*HEADER TRANSFERASE 08-SEP-09 2KO1 *TITLE SOLUTION NMR STRUCTURE OF THE ACT DOMAIN FROM GTP *TITLE 2 PYROPHOSPHOKINASE OF CHLOROBIUM TEPIDUM. NORTHEAST *TITLE 3 STRUCTURAL GENOMICS CONSORTIUM TARGET CTR148A *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: GTP PYROPHOSPHOKINASE; *COMPND 3 CHAIN: A, B; *COMPND 4 SYNONYM: CTR148A; *COMPND 5 EC: 2.7.6.5; *COMPND 6 ENGINEERED: YES; *COMPND 7 MUTATION: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: CHLOROBACULUM TEPIDUM; *SOURCE 3 ORGANISM_TAXID: 1097; *SOURCE 4 STRAIN: TLS; *SOURCE 5 GENE: CT1545, RELA; *SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; *SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+ MAGIC; *SOURCE 9 EXPRESSION_SYSTEM_VECTOR: PET 21-23C *KEYWDS HOMODIMER, ALPHA+BETA, KINASE, TRANSFERASE, STRUCTURAL *KEYWDS 2 GENOMICS, PSI-2, PROTEIN STRUCTURE INITIATIVE, NORTHEAST *KEYWDS 3 STRUCTURAL GENOMICS CONSORTIUM, NESG *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR A.ELETSKY, E.GARCIA, H.WANG, C.CICCOSANTI, M.JIANG, R.NAIR, *AUTHOR 2 B.ROST, T.B.ACTON, R.XIAO, J.K.EVERETT, H.LEE, *AUTHOR 3 J.H.PRESTEGARD, G.T.MONTELIONE, T.SZYPERSKI, NORTHEAST *AUTHOR 4 STRUCTURAL GENOMICS CONSORTIUM (NESG) *REVDAT 1 29-SEP-09 2KO1 0 # 2 THR PHI -221.8 32.2 # 2 THR PSI 97.5 170.4 4 PHE PHI -248.4 -27.3 4 PHE PSI 112.3 184.6 5 LEU PHI -136.1 -62.8 5 LEU PSI 103.2 150.1 6 ALA PHI -170.1 -94.1 6 ALA PSI 120.8 171.3 7 GLY PHI -186.7 -74.4 7 GLY PSI 97.7 194.2 8 ILE PHI -151.7 -109.8 8 ILE PSI 107.4 168.6 9 ARG PHI -157.9 -68.9 9 ARG PSI 119.2 139.2 10 ILE PHI -157.6 -89.8 10 ILE PSI 119.0 148.7 11 VAL PHI -142.8 -103.1 11 VAL PSI 97.7 170.5 # 12 GLY PHI 20.3 310.6 # 12 GLY PSI -218.9 -137.2 13 GLU PHI -148.8 -49.9 13 GLU PSI 105.2 165.8 14 ASP PHI -227.7 18.1 14 ASP PSI 48.2 192.8 15 LYS PHI -189.4 -57.3 15 LYS PSI 129.3 181.2 # 16 ASN PHI -152.1 40.1 # 16 ASN PSI 106.2 155.3 18 MET PHI -74.3 -54.3 18 MET PSI -49.7 -28.9 19 THR PHI -79.8 -44.9 19 THR PSI -57.4 -27.3 20 ASN PHI -76.0 -54.2 20 ASN PSI -48.0 -28.0 21 GLN PHI -73.6 -47.6 21 GLN PSI -57.9 -27.3 22 ILE PHI -76.5 -56.5 22 ILE PSI -51.9 -29.7 23 THR PHI -73.8 -53.8 23 THR PSI -49.9 -28.0 24 GLY PHI -78.8 -51.1 24 GLY PSI -51.9 -30.1 25 VAL PHI -75.0 -55.0 25 VAL PSI -53.9 -33.9 26 ILE PHI -72.3 -51.6 26 ILE PSI -56.0 -21.0 27 SER PHI -104.3 -36.9 27 SER PSI -51.1 -22.7 28 LYS PHI -120.2 -56.7 28 LYS PSI -56.2 34.3 # 29 PHE PHI -115.1 -53.8 # 29 PHE PSI 119.9 179.8 # 30 ASP PHI -130.8 -64.3 # 30 ASP PSI 69.1 163.1 # 31 THR PHI -177.8 -59.5 # 31 THR PSI 122.1 168.2 32 ASN PHI -135.8 -56.6 32 ASN PSI 112.6 156.5 33 ILE PHI -138.9 -52.1 33 ILE PSI 94.9 161.6 35 THR PHI -164.6 -109.9 35 THR PSI 132.7 175.9 36 ILE PHI -163.4 -108.4 36 ILE PSI 117.9 159.7 37 VAL PHI -145.5 -89.7 37 VAL PSI 105.5 147.6 38 LEU PHI -143.5 -94.1 38 LEU PSI 111.4 160.7 39 ASN PHI -151.7 -101.2 39 ASN PSI 108.0 164.8 40 ALA PHI -158.4 -85.9 40 ALA PSI 101.7 157.7 # 41 LYS PHI -161.1 -44.1 # 41 LYS PSI 100.0 173.5 44 ILE PHI -149.6 -86.5 44 ILE PSI 134.1 178.1 45 PHE PHI -172.6 -107.8 45 PHE PSI 135.1 179.0 46 THR PHI -141.8 -95.0 46 THR PSI 100.6 152.6 47 CYS PHI -154.3 -76.9 47 CYS PSI 95.7 131.4 48 ASN PHI -135.0 -83.5 48 ASN PSI 105.5 154.3 49 LEU PHI -150.5 -99.1 49 LEU PSI 108.9 171.0 50 MET PHI -160.1 -68.5 50 MET PSI 95.2 172.6 51 ILE PHI -151.1 -118.5 51 ILE PSI 148.5 180.1 52 PHE PHI -152.0 -75.2 52 PHE PSI 113.6 156.3 53 VAL PHI -185.4 -65.4 53 VAL PSI 142.1 171.6 54 LYS PHI -98.8 -49.1 54 LYS PSI -51.5 2.3 # 56 THR PHI -135.8 -19.1 # 56 THR PSI -64.8 -15.1 57 ASP PHI -78.2 -51.8 57 ASP PSI -51.3 -28.2 58 LYS PHI -78.3 -58.3 58 LYS PSI -57.8 -1.4 59 LEU PHI -76.8 -56.8 59 LEU PSI -47.2 -27.2 60 THR PHI -74.7 -54.7 60 THR PSI -48.5 -28.5 61 THR PHI -75.0 -50.8 61 THR PSI -51.0 -31.0 62 LEU PHI -76.1 -54.5 62 LEU PSI -53.9 -33.9 63 MET PHI -71.5 -51.5 63 MET PSI -53.6 -33.6 64 ASP PHI -72.3 -52.3 64 ASP PSI -53.3 -33.3 65 LYS PHI -76.8 -47.7 65 LYS PSI -57.0 -26.5 66 LEU PHI -89.7 -44.4 66 LEU PSI -55.0 -26.6 67 ARG PHI -84.0 -53.6 67 ARG PSI -53.6 -8.8 68 LYS PHI -121.0 -72.8 68 LYS PSI -36.8 30.5 69 VAL PHI -127.2 -48.5 69 VAL PSI 108.4 162.3 # 70 GLN PHI -99.3 -29.4 # 70 GLN PSI 122.3 142.3 # 72 VAL PHI -173.7 34.9 # 72 VAL PSI 104.0 162.1 # 73 PHE PHI -122.1 -74.6 # 73 PHE PSI 122.3 157.0 74 THR PHI -165.5 -113.1 74 THR PSI 119.1 174.4 75 VAL PHI -157.3 -81.1 75 VAL PSI 105.5 157.5 76 GLU PHI -151.1 -110.7 76 GLU PSI 133.8 177.7 77 ARG PHI -117.0 -68.5 77 ARG PSI 103.1 152.3 # 78 LEU PHI -156.3 -50.9 # 78 LEU PSI 101.3 177.5 # 79 SER PHI -133.8 -46.5 # 79 SER PSI 88.3 187.5 # 102 THR PHI -221.8 32.2 # 102 THR PSI 97.5 170.4 104 PHE PHI -248.4 -27.3 104 PHE PSI 112.3 184.6 105 LEU PHI -136.1 -62.8 105 LEU PSI 103.2 150.1 106 ALA PHI -170.1 -94.1 106 ALA PSI 120.8 171.3 107 GLY PHI -186.7 -74.4 107 GLY PSI 97.7 194.2 108 ILE PHI -151.7 -109.8 108 ILE PSI 107.4 168.6 109 ARG PHI -157.9 -68.9 109 ARG PSI 119.2 139.2 110 ILE PHI -157.6 -89.8 110 ILE PSI 119.0 148.7 111 VAL PHI -142.8 -103.1 111 VAL PSI 97.7 170.5 # 112 GLY PHI 20.3 310.6 # 112 GLY PSI -218.9 -137.2 113 GLU PHI -148.8 -49.9 113 GLU PSI 105.2 165.8 114 ASP PHI -227.7 18.1 114 ASP PSI 48.2 192.8 115 LYS PHI -189.4 -57.3 115 LYS PSI 129.3 181.2 # 116 ASN PHI -152.1 40.1 # 116 ASN PSI 106.2 155.3 118 MET PHI -74.3 -54.3 118 MET PSI -49.7 -28.9 119 THR PHI -79.8 -44.9 119 THR PSI -57.4 -27.3 120 ASN PHI -76.0 -54.2 120 ASN PSI -48.0 -28.0 121 GLN PHI -73.6 -47.6 121 GLN PSI -57.9 -27.3 122 ILE PHI -76.5 -56.5 122 ILE PSI -51.9 -29.7 123 THR PHI -73.8 -53.8 123 THR PSI -49.9 -28.0 124 GLY PHI -78.8 -51.1 124 GLY PSI -51.9 -30.1 125 VAL PHI -75.0 -55.0 125 VAL PSI -53.9 -33.9 126 ILE PHI -72.3 -51.6 126 ILE PSI -56.0 -21.0 127 SER PHI -104.3 -36.9 127 SER PSI -51.1 -22.7 128 LYS PHI -120.2 -56.7 128 LYS PSI -56.2 34.3 # 129 PHE PHI -115.1 -53.8 # 129 PHE PSI 119.9 179.8 # 130 ASP PHI -130.8 -64.3 # 130 ASP PSI 69.1 163.1 # 131 THR PHI -177.8 -59.5 # 131 THR PSI 122.1 168.2 132 ASN PHI -135.8 -56.6 132 ASN PSI 112.6 156.5 133 ILE PHI -138.9 -52.1 133 ILE PSI 94.9 161.6 135 THR PHI -164.6 -109.9 135 THR PSI 132.7 175.9 136 ILE PHI -163.4 -108.4 136 ILE PSI 117.9 159.7 137 VAL PHI -145.5 -89.7 137 VAL PSI 105.5 147.6 138 LEU PHI -143.5 -94.1 138 LEU PSI 111.4 160.7 139 ASN PHI -151.7 -101.2 139 ASN PSI 108.0 164.8 140 ALA PHI -158.4 -85.9 140 ALA PSI 101.7 157.7 # 141 LYS PHI -161.1 -44.1 # 141 LYS PSI 100.0 173.5 144 ILE PHI -149.6 -86.5 144 ILE PSI 134.1 178.1 145 PHE PHI -172.6 -107.8 145 PHE PSI 135.1 179.0 146 THR PHI -141.8 -95.0 146 THR PSI 100.6 152.6 147 CYS PHI -154.3 -76.9 147 CYS PSI 95.7 131.4 148 ASN PHI -135.0 -83.5 148 ASN PSI 105.5 154.3 149 LEU PHI -150.5 -99.1 149 LEU PSI 108.9 171.0 150 MET PHI -160.1 -68.5 150 MET PSI 95.2 172.6 151 ILE PHI -151.1 -118.5 151 ILE PSI 148.5 180.1 152 PHE PHI -152.0 -75.2 152 PHE PSI 113.6 156.3 153 VAL PHI -185.4 -65.4 153 VAL PSI 142.1 171.6 154 LYS PHI -98.8 -49.1 154 LYS PSI -51.5 2.3 # 156 THR PHI -135.8 -19.1 # 156 THR PSI -64.8 -15.1 157 ASP PHI -78.2 -51.8 157 ASP PSI -51.3 -28.2 158 LYS PHI -78.3 -58.3 158 LYS PSI -57.8 -1.4 159 LEU PHI -76.8 -56.8 159 LEU PSI -47.2 -27.2 160 THR PHI -74.7 -54.7 160 THR PSI -48.5 -28.5 161 THR PHI -75.0 -50.8 161 THR PSI -51.0 -31.0 162 LEU PHI -76.1 -54.5 162 LEU PSI -53.9 -33.9 163 MET PHI -71.5 -51.5 163 MET PSI -53.6 -33.6 164 ASP PHI -72.3 -52.3 164 ASP PSI -53.3 -33.3 165 LYS PHI -76.8 -47.7 165 LYS PSI -57.0 -26.5 166 LEU PHI -89.7 -44.4 166 LEU PSI -55.0 -26.6 167 ARG PHI -84.0 -53.6 167 ARG PSI -53.6 -8.8 168 LYS PHI -121.0 -72.8 168 LYS PSI -36.8 30.5 169 VAL PHI -127.2 -48.5 169 VAL PSI 108.4 162.3 # 170 GLN PHI -99.3 -29.4 # 170 GLN PSI 122.3 142.3 # 172 VAL PHI -173.7 34.9 # 172 VAL PSI 104.0 162.1 # 173 PHE PHI -122.1 -74.6 # 173 PHE PSI 122.3 157.0 174 THR PHI -165.5 -113.1 174 THR PSI 119.1 174.4 175 VAL PHI -157.3 -81.1 175 VAL PSI 105.5 157.5 176 GLU PHI -151.1 -110.7 176 GLU PSI 133.8 177.7 177 ARG PHI -117.0 -68.5 177 ARG PSI 103.1 152.3 # 178 LEU PHI -156.3 -50.9 # 178 LEU PSI 101.3 177.5 # 179 SER PHI -133.8 -46.5 # 179 SER PSI 88.3 187.5 #Orientation Magnitude Rhombicity ORI residue number 1 8.64 0.08 210 2 6.67 0.58 230 # First atom Second atom RDC Error Weight Orientation 3 ASP H 3 ASP N -6.651 2.690 1.000 1 #X24H-N 4 PHE H 4 PHE N -5.517 2.690 1.000 1 #X28H-N # 5 LEU H 5 LEU N -0.755 2.690 1.000 1 #X31H-N violation # 6 ALA H 6 ALA N 4.447 2.690 1.000 1 #X8H-N overlap w N48 7 GLY H 7 GLY N 6.924 2.690 1.000 1 #X26H-N 8 ILE H 8 ILE N 0.499 2.690 1.000 1 #X7H-N 9 ARG H 9 ARG N 6.923 2.690 1.000 1 #X6H-N 10 ILE H 10 ILE N -2.896 2.690 1.000 1 #X4H-N 11 VAL H 11 VAL N 5.191 2.690 1.000 1 #X30H-N ## 14 ASP H 14 ASP N 0.000 2.690 1.000 1 #X48H-N NO_RDC ## 15 LYS H 15 LYS N 0.000 2.690 1.000 1 #X64H-N NO_RDC # 16 ASN H 16 ASN N 6.488 2.690 1.000 1 #X12H-N violation 17 GLY H 17 GLY N 0.217 2.690 1.000 1 #X20H-N 18 MET H 18 MET N 3.711 2.690 1.000 1 #X52H-N 19 THR H 19 THR N 13.347 2.690 1.000 1 #X19H-N ## 20 ASN H 20 ASN N 0.000 2.690 1.000 1 #X54H-N NO_RDC ## 21 GLN H 21 GLN N 0.000 2.690 1.000 1 #X35H-N NO_RDC 22 ILE H 22 ILE N 8.085 2.690 1.000 1 #X22H-N ## 23 THR H 23 THR N 0.000 2.690 1.000 1 #X62H-N NO_RDC 24 GLY H 24 GLY N 5.248 2.690 1.000 1 #X50H-N 25 VAL H 25 VAL N 1.744 2.690 1.000 1 #X55H-N 26 ILE H 26 ILE N 10.999 2.690 1.000 1 #X60H-N # 28 LYS H 28 LYS N -6.582 2.690 1.000 1 #X69H-N violation 29 PHE H 29 PHE N 2.840 2.690 1.000 1 #X59H-N # 32 ASN H 32 ASN N 9.177 2.690 1.000 1 #X39H-N violation 33 ILE H 33 ILE N -3.180 2.690 1.000 1 #X38H-N 37 VAL H 37 VAL N 6.016 2.690 1.000 1 #X16H-N 38 LEU H 38 LEU N -2.377 2.690 1.000 1 #X71H-N 40 ALA H 40 ALA N 0.620 2.690 1.000 1 #X33H-N 41 LYS H 41 LYS N 5.723 2.690 1.000 1 #X17H-N 42 ASP H 42 ASP N 12.273 2.690 1.000 1 #X10H-N 43 GLY H 43 GLY N -4.411 2.690 1.000 1 #X9H-N ## 44 ILE H 44 ILE N 0.000 2.690 1.000 1 #X46H-N NO_RDC 45 PHE H 45 PHE N 0.528 2.690 1.000 1 #X15H-N 46 THR H 46 THR N 4.627 2.690 1.000 1 #X25H-N 49 LEU H 49 LEU N -1.392 2.690 1.000 1 #X5H-N 51 ILE H 51 ILE N 1.079 2.690 1.000 1 #X11H-N 53 VAL H 53 VAL N -2.795 2.690 1.000 1 #X18H-N ## 54 LYS H 54 LYS N 0.000 2.690 1.000 1 #X37H-N NO_RDC # 55 ASN H 55 ASN N 15.078 2.690 1.000 1 #X67H-N violation # 57 ASP H 57 ASP N 6.525 2.690 1.000 1 #X36H-N violation 59 LEU H 59 LEU N 17.044 2.690 1.000 1 #X66H-N 60 THR H 60 THR N 16.535 2.690 1.000 1 #X32H-N 61 THR H 61 THR N 5.248 2.690 1.000 1 #X51H-N 62 LEU H 62 LEU N 5.641 2.690 1.000 1 #X58H-N 63 MET H 63 MET N 14.749 2.690 1.000 1 #X44H-N 64 ASP H 64 ASP N 10.426 2.690 1.000 1 #X41H-N 67 ARG H 67 ARG N 16.367 2.690 1.000 1 #X49H-N 68 LYS H 68 LYS N -3.372 2.690 1.000 1 #X68H-N 69 VAL H 69 VAL N -2.636 2.690 1.000 1 #X65H-N 70 GLN H 70 GLN N -8.445 2.690 1.000 1 #X23H-N # 71 GLY H 71 GLY N 0.200 2.690 1.000 1 #X21H-N violation 72 VAL H 72 VAL N -5.511 2.690 1.000 1 #X56H-N 74 THR H 74 THR N 5.351 2.690 1.000 1 #X53H-N 75 VAL H 75 VAL N 0.855 2.690 1.000 1 #X29H-N 76 GLU H 76 GLU N 6.785 2.690 1.000 1 #X13H-N # 77 ARG H 77 ARG N 0.849 2.690 1.000 1 #X14H-N overlap w. M50 # 78 LEU H 78 LEU N -9.855 2.690 1.000 1 #X42H-N flexible # 79 SER H 79 SER N -2.046 2.690 1.000 1 #X27H-N flexible # 80 ASN H 80 ASN N 6.140 2.690 1.000 1 #X34H-N flexible ## 81 LEU H 81 LEU N 0.000 2.690 1.000 1 #X43H-N NO_RDC # First atom Second atom RDC Error Weight Orientation 103 ASP H 103 ASP N -6.651 2.690 1.000 1 #X24H-N 104 PHE H 104 PHE N -5.517 2.690 1.000 1 #X28H-N # 105 LEU H 105 LEU N -0.755 2.690 1.000 1 #X31H-N violation # 106 ALA H 106 ALA N 4.447 2.690 1.000 1 #X8H-N overlap w N48 107 GLY H 107 GLY N 6.924 2.690 1.000 1 #X26H-N 108 ILE H 108 ILE N 0.499 2.690 1.000 1 #X7H-N 109 ARG H 109 ARG N 6.923 2.690 1.000 1 #X6H-N 110 ILE H 110 ILE N -2.896 2.690 1.000 1 #X4H-N 111 VAL H 111 VAL N 5.191 2.690 1.000 1 #X30H-N ## 114 ASP H 114 ASP N 0.000 2.690 1.000 1 #X48H-N NO_RDC ## 115 LYS H 115 LYS N 0.000 2.690 1.000 1 #X64H-N NO_RDC # 116 ASN H 116 ASN N 6.488 2.690 1.000 1 #X12H-N violation 117 GLY H 117 GLY N 0.217 2.690 1.000 1 #X20H-N 118 MET H 118 MET N 3.711 2.690 1.000 1 #X52H-N 119 THR H 119 THR N 13.347 2.690 1.000 1 #X19H-N ## 120 ASN H 120 ASN N 0.000 2.690 1.000 1 #X54H-N NO_RDC ## 121 GLN H 121 GLN N 0.000 2.690 1.000 1 #X35H-N NO_RDC 122 ILE H 122 ILE N 8.085 2.690 1.000 1 #X22H-N ## 123 THR H 123 THR N 0.000 2.690 1.000 1 #X62H-N NO_RDC 124 GLY H 124 GLY N 5.248 2.690 1.000 1 #X50H-N 125 VAL H 125 VAL N 1.744 2.690 1.000 1 #X55H-N 126 ILE H 126 ILE N 10.999 2.690 1.000 1 #X60H-N # 128 LYS H 128 LYS N -6.582 2.690 1.000 1 #X69H-N violation 129 PHE H 129 PHE N 2.840 2.690 1.000 1 #X59H-N # 132 ASN H 132 ASN N 9.177 2.690 1.000 1 #X39H-N violation 133 ILE H 133 ILE N -3.180 2.690 1.000 1 #X38H-N 137 VAL H 137 VAL N 6.016 2.690 1.000 1 #X16H-N 138 LEU H 138 LEU N -2.377 2.690 1.000 1 #X71H-N 140 ALA H 140 ALA N 0.620 2.690 1.000 1 #X33H-N 141 LYS H 141 LYS N 5.723 2.690 1.000 1 #X17H-N 142 ASP H 142 ASP N 12.273 2.690 1.000 1 #X10H-N 143 GLY H 143 GLY N -4.411 2.690 1.000 1 #X9H-N ## 144 ILE H 144 ILE N 0.000 2.690 1.000 1 #X46H-N NO_RDC 145 PHE H 145 PHE N 0.528 2.690 1.000 1 #X15H-N 146 THR H 146 THR N 4.627 2.690 1.000 1 #X25H-N 149 LEU H 149 LEU N -1.392 2.690 1.000 1 #X5H-N 151 ILE H 151 ILE N 1.079 2.690 1.000 1 #X11H-N 153 VAL H 153 VAL N -2.795 2.690 1.000 1 #X18H-N ## 154 LYS H 154 LYS N 0.000 2.690 1.000 1 #X37H-N NO_RDC # 155 ASN H 155 ASN N 15.078 2.690 1.000 1 #X67H-N violation # 157 ASP H 157 ASP N 6.525 2.690 1.000 1 #X36H-N violation 159 LEU H 159 LEU N 17.044 2.690 1.000 1 #X66H-N 160 THR H 160 THR N 16.535 2.690 1.000 1 #X32H-N 161 THR H 161 THR N 5.248 2.690 1.000 1 #X51H-N 162 LEU H 162 LEU N 5.641 2.690 1.000 1 #X58H-N 163 MET H 163 MET N 14.749 2.690 1.000 1 #X44H-N 164 ASP H 164 ASP N 10.426 2.690 1.000 1 #X41H-N 167 ARG H 167 ARG N 16.367 2.690 1.000 1 #X49H-N 168 LYS H 168 LYS N -3.372 2.690 1.000 1 #X68H-N 169 VAL H 169 VAL N -2.636 2.690 1.000 1 #X65H-N 170 GLN H 170 GLN N -8.445 2.690 1.000 1 #X23H-N # 171 GLY H 171 GLY N 0.200 2.690 1.000 1 #X21H-N violation 172 VAL H 172 VAL N -5.511 2.690 1.000 1 #X56H-N 174 THR H 174 THR N 5.351 2.690 1.000 1 #X53H-N 175 VAL H 175 VAL N 0.855 2.690 1.000 1 #X29H-N 176 GLU H 176 GLU N 6.785 2.690 1.000 1 #X13H-N # 177 ARG H 177 ARG N 0.849 2.690 1.000 1 #X14H-N overlap w. M50 # 178 LEU H 178 LEU N -9.855 2.690 1.000 1 #X42H-N flexible # 179 SER H 179 SER N -2.046 2.690 1.000 1 #X27H-N flexible # 180 ASN H 180 ASN N 6.140 2.690 1.000 1 #X34H-N flexible ## 181 LEU H 181 LEU N 0.000 2.690 1.000 1 #X43H-N NO_RDC # First atom Second atom RDC Error Weight Orientation ## 3 ASP H 3 ASP N 0.000 2.330 1.000 2 #X24H-N NO_RDC 4 PHE H 4 PHE N -2.847 2.330 1.000 2 #X28H-N 5 LEU H 5 LEU N 1.865 2.330 1.000 2 #X31H-N # 6 ALA H 6 ALA N 2.898 2.330 1.000 2 #X8H-N overlap w. N48 7 GLY H 7 GLY N 3.051 2.330 1.000 2 #X26H-N 8 ILE H 8 ILE N -2.599 2.330 1.000 2 #X7H-N 9 ARG H 9 ARG N 5.307 2.330 1.000 2 #X6H-N 10 ILE H 10 ILE N -4.309 2.330 1.000 2 #X4H-N 11 VAL H 11 VAL N 4.383 2.330 1.000 2 #X30H-N 14 ASP H 14 ASP N -6.451 2.330 1.000 2 #X48H-N # 15 LYS H 15 LYS N 12.050 2.330 1.000 2 #X64H-N violation ## 16 ASN H 16 ASN N 0.000 2.330 1.000 2 #X12H-N NO_RDC # 17 GLY H 17 GLY N 3.370 2.330 1.000 2 #X20H-N violation 18 MET H 18 MET N -1.931 2.330 1.000 2 #X52H-N 19 THR H 19 THR N 12.562 2.330 1.000 2 #X19H-N # 20 ASN H 20 ASN N 6.537 2.330 1.000 2 #X54H-N violation 21 GLN H 21 GLN N 0.040 2.330 1.000 2 #X35H-N 22 ILE H 22 ILE N 5.970 2.330 1.000 2 #X22H-N ## 23 THR H 23 THR N 0.000 2.330 1.000 2 #X62H-N NO_RDC 24 GLY H 24 GLY N 0.455 2.330 1.000 2 #X50H-N 25 VAL H 25 VAL N -0.954 2.330 1.000 2 #X55H-N ## 26 ILE H 26 ILE N 0.000 2.330 1.000 2 #X60H-N NO_RDC # 28 LYS H 28 LYS N -9.659 2.330 1.000 2 #X69H-N violation 29 PHE H 29 PHE N 4.034 2.330 1.000 2 #X59H-N # 32 ASN H 32 ASN N 7.237 2.330 1.000 2 #X39H-N violation ## 33 ILE H 33 ILE N 0.000 2.330 1.000 2 #X38H-N NO_RDC 37 VAL H 37 VAL N 3.099 2.330 1.000 2 #X16H-N 38 LEU H 38 LEU N -9.580 2.330 1.000 2 #X71H-N 40 ALA H 40 ALA N -4.369 2.330 1.000 2 #X33H-N 41 LYS H 41 LYS N 3.468 2.330 1.000 2 #X17H-N 42 ASP H 42 ASP N 8.259 2.330 1.000 2 #X10H-N 43 GLY H 43 GLY N -8.227 2.330 1.000 2 #X9H-N 44 ILE H 44 ILE N -0.037 2.330 1.000 2 #X46H-N 45 PHE H 45 PHE N -1.278 2.330 1.000 2 #X15H-N 46 THR H 46 THR N 0.903 2.330 1.000 2 #X25H-N 49 LEU H 49 LEU N -6.054 2.330 1.000 2 #X5H-N 51 ILE H 51 ILE N -0.569 2.330 1.000 2 #X11H-N 53 VAL H 53 VAL N 1.744 2.330 1.000 2 #X18H-N ## 54 LYS H 54 LYS N 0.000 2.330 1.000 2 #X37H-N NO_RDC 55 ASN H 55 ASN N 10.537 2.330 1.000 2 #X67H-N 57 ASP H 57 ASP N 2.266 2.330 1.000 2 #X36H-N 59 LEU H 59 LEU N 13.645 2.330 1.000 2 #X66H-N 60 THR H 60 THR N 12.814 2.330 1.000 2 #X32H-N 61 THR H 61 THR N 0.970 2.330 1.000 2 #X51H-N 62 LEU H 62 LEU N 5.664 2.330 1.000 2 #X58H-N 63 MET H 63 MET N 7.941 2.330 1.000 2 #X44H-N 64 ASP H 64 ASP N 8.368 2.330 1.000 2 #X41H-N 67 ARG H 67 ARG N 11.696 2.330 1.000 2 #X49H-N 68 LYS H 68 LYS N -8.392 2.330 1.000 2 #X68H-N 69 VAL H 69 VAL N 1.479 2.330 1.000 2 #X65H-N 70 GLN H 70 GLN N -2.928 2.330 1.000 2 #X23H-N # 71 GLY H 71 GLY N -3.755 2.330 1.000 2 #X21H-N violation 72 VAL H 72 VAL N 1.147 2.330 1.000 2 #X56H-N 74 THR H 74 THR N 0.934 2.330 1.000 2 #X53H-N 75 VAL H 75 VAL N -3.870 2.330 1.000 2 #X29H-N 76 GLU H 76 GLU N 4.367 2.330 1.000 2 #X13H-N # 77 ARG H 77 ARG N -1.952 2.330 1.000 2 #X14H-N overlap w. M50 # 78 LEU H 78 LEU N -8.330 2.330 1.000 2 #X42H-N flexible # 79 SER H 79 SER N -1.346 2.330 1.000 2 #X27H-N flexible # 80 ASN H 80 ASN N 1.958 2.330 1.000 2 #X34H-N flexible # 81 LEU H 81 LEU N 2.186 2.330 1.000 2 #X43H-N flexible # First atom Second atom RDC Error Weight Orientation ## 103 ASP H 103 ASP N 0.000 2.330 1.000 2 #X24H-N NO_RDC 104 PHE H 104 PHE N -2.847 2.330 1.000 2 #X28H-N 105 LEU H 105 LEU N 1.865 2.330 1.000 2 #X31H-N # 106 ALA H 106 ALA N 2.898 2.330 1.000 2 #X8H-N overlap w. N48 107 GLY H 107 GLY N 3.051 2.330 1.000 2 #X26H-N 108 ILE H 108 ILE N -2.599 2.330 1.000 2 #X7H-N 109 ARG H 109 ARG N 5.307 2.330 1.000 2 #X6H-N 110 ILE H 110 ILE N -4.309 2.330 1.000 2 #X4H-N 111 VAL H 111 VAL N 4.383 2.330 1.000 2 #X30H-N 114 ASP H 114 ASP N -6.451 2.330 1.000 2 #X48H-N # 115 LYS H 115 LYS N 12.050 2.330 1.000 2 #X64H-N violation ## 116 ASN H 116 ASN N 0.000 2.330 1.000 2 #X12H-N NO_RDC # 117 GLY H 117 GLY N 3.370 2.330 1.000 2 #X20H-N violation 118 MET H 118 MET N -1.931 2.330 1.000 2 #X52H-N 119 THR H 119 THR N 12.562 2.330 1.000 2 #X19H-N # 120 ASN H 120 ASN N 6.537 2.330 1.000 2 #X54H-N violation 121 GLN H 121 GLN N 0.040 2.330 1.000 2 #X35H-N 122 ILE H 122 ILE N 5.970 2.330 1.000 2 #X22H-N ## 123 THR H 123 THR N 0.000 2.330 1.000 2 #X62H-N NO_RDC 124 GLY H 124 GLY N 0.455 2.330 1.000 2 #X50H-N 125 VAL H 125 VAL N -0.954 2.330 1.000 2 #X55H-N ## 126 ILE H 126 ILE N 0.000 2.330 1.000 2 #X60H-N NO_RDC # 128 LYS H 128 LYS N -9.659 2.330 1.000 2 #X69H-N violation 129 PHE H 129 PHE N 4.034 2.330 1.000 2 #X59H-N # 132 ASN H 132 ASN N 7.237 2.330 1.000 2 #X39H-N violation ## 133 ILE H 133 ILE N 0.000 2.330 1.000 2 #X38H-N NO_RDC 137 VAL H 137 VAL N 3.099 2.330 1.000 2 #X16H-N 138 LEU H 138 LEU N -9.580 2.330 1.000 2 #X71H-N 140 ALA H 140 ALA N -4.369 2.330 1.000 2 #X33H-N 141 LYS H 141 LYS N 3.468 2.330 1.000 2 #X17H-N 142 ASP H 142 ASP N 8.259 2.330 1.000 2 #X10H-N 143 GLY H 143 GLY N -8.227 2.330 1.000 2 #X9H-N 144 ILE H 144 ILE N -0.037 2.330 1.000 2 #X46H-N 145 PHE H 145 PHE N -1.278 2.330 1.000 2 #X15H-N 146 THR H 146 THR N 0.903 2.330 1.000 2 #X25H-N 149 LEU H 149 LEU N -6.054 2.330 1.000 2 #X5H-N 151 ILE H 151 ILE N -0.569 2.330 1.000 2 #X11H-N 153 VAL H 153 VAL N 1.744 2.330 1.000 2 #X18H-N ## 154 LYS H 154 LYS N 0.000 2.330 1.000 2 #X37H-N NO_RDC 155 ASN H 155 ASN N 10.537 2.330 1.000 2 #X67H-N 157 ASP H 157 ASP N 2.266 2.330 1.000 2 #X36H-N 159 LEU H 159 LEU N 13.645 2.330 1.000 2 #X66H-N 160 THR H 160 THR N 12.814 2.330 1.000 2 #X32H-N 161 THR H 161 THR N 0.970 2.330 1.000 2 #X51H-N 162 LEU H 162 LEU N 5.664 2.330 1.000 2 #X58H-N 163 MET H 163 MET N 7.941 2.330 1.000 2 #X44H-N 164 ASP H 164 ASP N 8.368 2.330 1.000 2 #X41H-N 167 ARG H 167 ARG N 11.696 2.330 1.000 2 #X49H-N 168 LYS H 168 LYS N -8.392 2.330 1.000 2 #X68H-N 169 VAL H 169 VAL N 1.479 2.330 1.000 2 #X65H-N 170 GLN H 170 GLN N -2.928 2.330 1.000 2 #X23H-N # 171 GLY H 171 GLY N -3.755 2.330 1.000 2 #X21H-N violation 172 VAL H 172 VAL N 1.147 2.330 1.000 2 #X56H-N 174 THR H 174 THR N 0.934 2.330 1.000 2 #X53H-N 175 VAL H 175 VAL N -3.870 2.330 1.000 2 #X29H-N 176 GLU H 176 GLU N 4.367 2.330 1.000 2 #X13H-N # 177 ARG H 177 ARG N -1.952 2.330 1.000 2 #X14H-N overlap w. M50 # 178 LEU H 178 LEU N -8.330 2.330 1.000 2 #X42H-N flexible # 179 SER H 179 SER N -1.346 2.330 1.000 2 #X27H-N flexible # 180 ASN H 180 ASN N 1.958 2.330 1.000 2 #X34H-N flexible # 181 LEU H 181 LEU N 2.186 2.330 1.000 2 #X43H-N flexible 4 PHE H 53 VAL HG2 4.46 #peak 2 #SUP 1.00 104 PHE H 153 VAL HG2 4.46 #peak 2 #SUP 1.00 2 THR HG2 4 PHE H 6.29 #peak 4 #SUP 1.00 #QF 0.29 102 THR HG2 104 PHE H 6.29 #peak 4 #SUP 1.00 #QF 0.29 4 PHE H 6 ALA HB 6.50 #peak 4 #SUP 1.00 #QF 0.29 104 PHE H 106 ALA HB 6.50 #peak 4 #SUP 1.00 #QF 0.29 4 PHE H 5 LEU HB3 6.50 #peak 5 #SUP 0.73 #QF 0.37 104 PHE H 105 LEU HB3 6.50 #peak 5 #SUP 0.73 #QF 0.37 4 PHE H 53 VAL HB 6.01 #peak 6 #SUP 1.00 104 PHE H 153 VAL HB 6.01 #peak 6 #SUP 1.00 4 PHE H 4 PHE HB 3.95 #peak 9 #SUP 1.00 104 PHE H 104 PHE HB 3.95 #peak 9 #SUP 1.00 4 PHE H 54 LYS HA 4.29 #peak 10 #SUP 0.99 #QF 0.99 104 PHE H 154 LYS HA 4.29 #peak 10 #SUP 0.99 #QF 0.99 3 ASP HA 4 PHE H 3.13 #peak 11 #SUP 0.91 #QF 0.91 103 ASP HA 104 PHE H 3.13 #peak 11 #SUP 0.91 #QF 0.91 4 PHE H 52 PHE HA 4.84 #peak 13 #SUP 0.99 #QF 0.99 104 PHE H 152 PHE HA 4.84 #peak 13 #SUP 0.99 #QF 0.99 4 PHE H 52 PHE HE 6.12 #peak 16 #SUP 0.97 #QF 0.97 104 PHE H 152 PHE HE 6.12 #peak 16 #SUP 0.97 #QF 0.97 4 PHE H 53 VAL H 3.69 #peak 17 #SUP 1.00 104 PHE H 153 VAL H 3.69 #peak 17 #SUP 1.00 5 LEU H 5 LEU HB2 3.60 #peak 20 #SUP 1.00 105 LEU H 105 LEU HB2 3.60 #peak 20 #SUP 1.00 5 LEU H 5 LEU HB3 3.75 #peak 21 #SUP 1.00 105 LEU H 105 LEU HB3 3.75 #peak 21 #SUP 1.00 4 PHE HB 5 LEU H 3.65 #peak 22 #SUP 0.99 #QF 0.99 104 PHE HB 105 LEU H 3.65 #peak 22 #SUP 0.99 #QF 0.99 5 LEU H 52 PHE HA 5.38 #peak 25 #SUP 0.99 #QF 0.99 105 LEU H 152 PHE HA 5.38 #peak 25 #SUP 0.99 #QF 0.99 5 LEU H 53 VAL H 5.47 #peak 29 #SUP 1.00 105 LEU H 153 VAL H 5.47 #peak 29 #SUP 1.00 5 LEU H 6 ALA H 4.88 #peak 30 #SUP 0.99 #QF 0.99 105 LEU H 106 ALA H 4.88 #peak 30 #SUP 0.99 #QF 0.99 6 ALA H 59 LEU HD1 5.50 #peak 33 #SUP 1.00 #QF 0.94 106 ALA H 159 LEU HD1 5.50 #peak 33 #SUP 1.00 #QF 0.94 5 LEU HA 6 ALA H 3.51 #peak 36 #SUP 1.00 105 LEU HA 106 ALA H 3.51 #peak 36 #SUP 1.00 4 PHE HA 6 ALA H 6.41 #peak 38 #SUP 0.99 #QF 0.86 104 PHE HA 106 ALA H 6.41 #peak 38 #SUP 0.99 #QF 0.86 6 ALA H 51 ILE HA 6.50 #peak 38 #SUP 0.99 #QF 0.86 106 ALA H 151 ILE HA 6.50 #peak 38 #SUP 0.99 #QF 0.86 6 ALA H 52 PHE HA 4.56 #peak 39 #SUP 1.00 106 ALA H 152 PHE HA 4.56 #peak 39 #SUP 1.00 7 GLY H 59 LEU HD1 4.37 #peak 42 #SUP 1.00 #QF 0.75 107 GLY H 159 LEU HD1 4.37 #peak 42 #SUP 1.00 #QF 0.75 7 GLY H 59 LEU HD2 5.60 #peak 44 #SUP 1.00 #QF 0.96 107 GLY H 159 LEU HD2 5.60 #peak 44 #SUP 1.00 #QF 0.96 6 ALA HA 7 GLY H 3.30 #peak 48 #SUP 0.93 #QF 0.93 106 ALA HA 107 GLY H 3.30 #peak 48 #SUP 0.93 #QF 0.93 7 GLY H 51 ILE H 5.49 #peak 51 #SUP 1.00 107 GLY H 151 ILE H 5.49 #peak 51 #SUP 1.00 6 ALA H 7 GLY H 5.09 #peak 52 #SUP 1.00 #QF 0.98 106 ALA H 107 GLY H 5.09 #peak 52 #SUP 1.00 #QF 0.98 8 ILE H 8 ILE HG13 4.46 #peak 55 #SUP 1.00 108 ILE H 108 ILE HG13 4.46 #peak 55 #SUP 1.00 8 ILE H 78 LEU HB2 4.58 #peak 56 #SUP 0.76 #QF 0.76 108 ILE H 178 LEU HB2 4.58 #peak 56 #SUP 0.76 #QF 0.76 8 ILE H 78 LEU HG 5.10 #peak 58 #SUP 1.00 108 ILE H 178 LEU HG 5.10 #peak 58 #SUP 1.00 8 ILE H 49 LEU HB3 4.76 #peak 59 #SUP 0.98 #QF 0.98 108 ILE H 149 LEU HB3 4.76 #peak 59 #SUP 0.98 #QF 0.98 7 GLY H 8 ILE H 5.11 #peak 63 #SUP 1.00 107 GLY H 108 ILE H 5.11 #peak 63 #SUP 1.00 8 ILE H 51 ILE H 5.35 #peak 64 #SUP 0.99 #QF 0.99 108 ILE H 151 ILE H 5.35 #peak 64 #SUP 0.99 #QF 0.99 8 ILE HD1 9 ARG H 5.36 #peak 65 #SUP 1.00 108 ILE HD1 109 ARG H 5.36 #peak 65 #SUP 1.00 9 ARG H 9 ARG HB 3.82 #peak 67 #SUP 0.99 #QF 0.99 109 ARG H 109 ARG HB 3.82 #peak 67 #SUP 0.99 #QF 0.99 9 ARG H 78 LEU HG 4.46 #peak 68 #SUP 0.99 #QF 0.62 109 ARG H 178 LEU HG 4.46 #peak 68 #SUP 0.99 #QF 0.62 9 ARG H 76 GLU HB2 5.10 #peak 70 #SUP 0.99 #QF 0.99 9 ARG H 63 MET HG2 6.46 #peak 71 #SUP 1.00 #QF 0.39 109 ARG H 163 MET HG2 6.46 #peak 71 #SUP 1.00 #QF 0.39 9 ARG H 9 ARG HD 5.23 #peak 73 #SUP 1.00 109 ARG H 109 ARG HD 5.23 #peak 73 #SUP 1.00 9 ARG H 77 ARG HA 4.74 #peak 74 #SUP 0.99 #QF 0.99 109 ARG H 177 ARG HA 4.74 #peak 74 #SUP 0.99 #QF 0.99 9 ARG H 78 LEU H 5.33 #peak 77 #SUP 0.99 #QF 0.99 109 ARG H 178 LEU H 5.33 #peak 77 #SUP 0.99 #QF 0.99 9 ARG HE 78 LEU HD2 5.65 #peak 79 #SUP 0.97 #QF 0.37 109 ARG HE 178 LEU HD2 5.65 #peak 79 #SUP 0.97 #QF 0.37 9 ARG HE 11 VAL HG2 4.72 #peak 80 #SUP 0.99 #QF 0.99 109 ARG HE 111 VAL HG2 4.72 #peak 80 #SUP 0.99 #QF 0.99 9 ARG HE 10 ILE H 5.76 #peak 85 #SUP 0.93 #QF 0.93 109 ARG HE 110 ILE H 5.76 #peak 85 #SUP 0.93 #QF 0.93 10 ILE H 22 ILE HG2 6.03 #peak 86 #SUP 0.98 #QF 0.98 110 ILE H 122 ILE HG2 6.03 #peak 86 #SUP 0.98 #QF 0.98 8 ILE HG2 10 ILE H 5.17 #peak 87 #SUP 0.98 #QF 0.94 108 ILE HG2 110 ILE H 5.17 #peak 87 #SUP 0.98 #QF 0.94 10 ILE H 78 LEU HD1 5.56 #peak 87 #SUP 0.98 #QF 0.94 110 ILE H 178 LEU HD1 5.56 #peak 87 #SUP 0.98 #QF 0.94 10 ILE H 11 VAL HG2 4.80 #peak 88 #SUP 1.00 #QF 0.94 110 ILE H 111 VAL HG2 4.80 #peak 88 #SUP 1.00 #QF 0.94 10 ILE H 10 ILE HG13 4.37 #peak 89 #SUP 1.00 110 ILE H 110 ILE HG13 4.37 #peak 89 #SUP 1.00 9 ARG HB 10 ILE H 4.49 #peak 91 #SUP 1.00 #QF 0.99 109 ARG HB 110 ILE H 4.49 #peak 91 #SUP 1.00 #QF 0.99 9 ARG HG2 10 ILE H 4.89 #peak 91 #SUP 1.00 #QF 0.99 109 ARG HG2 110 ILE H 4.89 #peak 91 #SUP 1.00 #QF 0.99 10 ILE H 47 CYS HB2 5.86 #peak 93 #SUP 0.97 #QF 0.97 110 ILE H 147 CYS HB2 5.86 #peak 93 #SUP 0.97 #QF 0.97 10 ILE H 47 CYS HB3 5.47 #peak 94 #SUP 1.00 110 ILE H 147 CYS HB3 5.47 #peak 94 #SUP 1.00 10 ILE HG2 11 VAL H 3.65 #peak 98 #SUP 1.00 110 ILE HG2 111 VAL H 3.65 #peak 98 #SUP 1.00 11 VAL H 11 VAL HG2 3.63 #peak 99 #SUP 0.93 #QF 0.93 111 VAL H 111 VAL HG2 3.63 #peak 99 #SUP 0.93 #QF 0.93 10 ILE HB 11 VAL H 5.28 #peak 101 #SUP 1.00 110 ILE HB 111 VAL H 5.28 #peak 101 #SUP 1.00 11 VAL H 11 VAL HB 4.03 #peak 102 #SUP 1.00 111 VAL H 111 VAL HB 4.03 #peak 102 #SUP 1.00 11 VAL H 74 THR HB 4.80 #peak 103 #SUP 1.00 111 VAL H 174 THR HB 4.80 #peak 103 #SUP 1.00 10 ILE HA 11 VAL H 3.38 #peak 105 #SUP 0.99 #QF 0.99 110 ILE HA 111 VAL H 3.38 #peak 105 #SUP 0.99 #QF 0.99 10 ILE H 11 VAL H 5.06 #peak 108 #SUP 1.00 #QF 0.97 110 ILE H 111 VAL H 5.06 #peak 108 #SUP 1.00 #QF 0.97 11 VAL H 73 PHE H 5.61 #peak 108 #SUP 1.00 #QF 0.97 111 VAL H 173 PHE H 5.61 #peak 108 #SUP 1.00 #QF 0.97 12 GLY H 44 ILE HG2 4.20 #peak 109 #SUP 0.97 #QF 0.87 112 GLY H 144 ILE HG2 4.20 #peak 109 #SUP 0.97 #QF 0.87 12 GLY H 46 THR HG2 6.32 #peak 110 #SUP 0.98 #QF 0.98 112 GLY H 146 THR HG2 6.32 #peak 110 #SUP 0.98 #QF 0.98 11 VAL HB 12 GLY H 5.40 #peak 111 #SUP 1.00 #QF 0.98 111 VAL HB 112 GLY H 5.40 #peak 111 #SUP 1.00 #QF 0.98 12 GLY H 18 MET HE 5.67 #peak 111 #SUP 1.00 #QF 0.98 112 GLY H 118 MET HE 5.67 #peak 111 #SUP 1.00 #QF 0.98 12 GLY H 72 VAL HA 5.33 #peak 114 #SUP 0.99 #QF 0.99 112 GLY H 172 VAL HA 5.33 #peak 114 #SUP 0.99 #QF 0.99 12 GLY H 46 THR HA 4.32 #peak 115 #SUP 0.97 #QF 0.97 112 GLY H 146 THR HA 4.32 #peak 115 #SUP 0.97 #QF 0.97 11 VAL H 12 GLY H 4.94 #peak 116 #SUP 1.00 111 VAL H 112 GLY H 4.94 #peak 116 #SUP 1.00 12 GLY H 73 PHE H 5.68 #peak 118 #SUP 0.99 #QF 0.99 112 GLY H 173 PHE H 5.68 #peak 118 #SUP 0.99 #QF 0.99 13 GLU H 72 VAL HG1 6.33 #peak 119 #SUP 0.97 #QF 0.95 113 GLU H 172 VAL HG1 6.33 #peak 119 #SUP 0.97 #QF 0.95 81 LEU HD2 83 HIS H 6.50 #peak 119 #SUP 0.97 #QF 0.95 181 LEU HD2 183 HIS H 6.50 #peak 119 #SUP 0.97 #QF 0.95 13 GLU H 44 ILE HG2 4.71 #peak 120 #SUP 0.98 #QF 0.89 113 GLU H 144 ILE HG2 4.71 #peak 120 #SUP 0.98 #QF 0.89 13 GLU H 13 GLU HB3 3.70 #peak 121 #SUP 1.00 #QF 0.99 113 GLU H 113 GLU HB3 3.70 #peak 121 #SUP 1.00 #QF 0.99 13 GLU H 13 GLU HB2 3.86 #peak 122 #SUP 1.00 113 GLU H 113 GLU HB2 3.86 #peak 122 #SUP 1.00 13 GLU H 13 GLU HG 3.63 #peak 123 #SUP 1.00 113 GLU H 113 GLU HG 3.63 #peak 123 #SUP 1.00 13 GLU H 71 GLY HA3 4.49 #peak 126 #SUP 0.89 #QF 0.23 113 GLU H 171 GLY HA3 4.49 #peak 126 #SUP 0.89 #QF 0.23 13 GLU H 72 VAL HA 4.70 #peak 126 #SUP 0.89 #QF 0.23 113 GLU H 172 VAL HA 4.70 #peak 126 #SUP 0.89 #QF 0.23 13 GLU H 44 ILE HA 5.58 #peak 129 #SUP 0.98 #QF 0.98 113 GLU H 144 ILE HA 5.58 #peak 129 #SUP 0.98 #QF 0.98 13 GLU H 45 PHE HD 5.72 #peak 130 #SUP 1.00 113 GLU H 145 PHE HD 5.72 #peak 130 #SUP 1.00 13 GLU H 45 PHE HZ 6.01 #peak 131 #SUP 0.99 #QF 0.99 113 GLU H 145 PHE HZ 6.01 #peak 131 #SUP 0.99 #QF 0.99 83 HIS H 83 HIS HD2 4.56 #peak 132 #SUP 0.98 #QF 0.97 183 HIS H 183 HIS HD2 4.56 #peak 132 #SUP 0.98 #QF 0.97 12 GLY H 13 GLU H 4.91 #peak 135 #SUP 1.00 112 GLY H 113 GLU H 4.91 #peak 135 #SUP 1.00 13 GLU H 73 PHE H 4.79 #peak 136 #SUP 1.00 113 GLU H 173 PHE H 4.79 #peak 136 #SUP 1.00 13 GLU HB2 14 ASP H 4.21 #peak 137 #SUP 0.99 #QF 0.72 113 GLU HB2 114 ASP H 4.21 #peak 137 #SUP 0.99 #QF 0.72 15 LYS H 15 LYS HG 3.81 #peak 145 #SUP 0.99 #QF 0.99 115 LYS H 115 LYS HG 3.81 #peak 145 #SUP 0.99 #QF 0.99 115 LYS H 115 LYS HB2 4.12 #peak 147 #SUP 1.00 15 LYS H 18 MET HE 4.77 #peak 148 #SUP 1.00 115 LYS H 118 MET HE 4.77 #peak 148 #SUP 1.00 15 LYS H 18 MET HB2 4.10 #peak 149 #SUP 0.93 #QF 0.93 115 LYS H 118 MET HB3 4.10 #peak 149 #SUP 0.93 #QF 0.93 13 GLU HG 15 LYS H 4.50 #peak 150 #SUP 0.98 #QF 0.96 113 GLU HG 115 LYS H 4.50 #peak 150 #SUP 0.98 #QF 0.96 15 LYS H 18 MET HB3 4.10 #peak 151 #SUP 0.99 #QF 0.98 115 LYS H 118 MET HB2 3.96 #peak 151 #SUP 0.99 #QF 0.98 15 LYS H 18 MET HG3 4.33 #peak 151 #SUP 0.99 #QF 0.98 115 LYS H 118 MET HG3 4.33 #peak 151 #SUP 0.99 #QF 0.98 15 LYS H 18 MET HG2 4.33 #peak 152 #SUP 0.99 #QF 0.99 115 LYS H 118 MET HG2 4.33 #peak 152 #SUP 0.99 #QF 0.99 15 LYS H 18 MET HA 5.84 #peak 153 #SUP 0.99 #QF 0.75 115 LYS H 118 MET HA 5.84 #peak 153 #SUP 0.99 #QF 0.75 14 ASP HA 15 LYS H 3.26 #peak 155 #SUP 0.91 #QF 0.91 114 ASP HA 115 LYS H 3.26 #peak 155 #SUP 0.91 #QF 0.91 15 LYS H 44 ILE HA 6.50 #peak 156 #SUP 0.89 #QF 0.89 115 LYS H 144 ILE HA 6.50 #peak 156 #SUP 0.89 #QF 0.89 15 LYS H 45 PHE HD 4.95 #peak 157 #SUP 1.00 115 LYS H 145 PHE HD 4.95 #peak 157 #SUP 1.00 15 LYS H 18 MET H 4.29 #peak 158 #SUP 1.00 115 LYS H 118 MET H 4.29 #peak 158 #SUP 1.00 14 ASP H 15 LYS H 4.66 #peak 159 #SUP 1.00 114 ASP H 115 LYS H 4.66 #peak 159 #SUP 1.00 15 LYS H 17 GLY H 5.24 #peak 160 #SUP 1.00 #QF 0.98 115 LYS H 117 GLY H 5.24 #peak 160 #SUP 1.00 #QF 0.98 15 LYS H 16 ASN H 5.83 #peak 161 #SUP 0.90 #QF 0.90 115 LYS H 116 ASN H 5.83 #peak 161 #SUP 0.90 #QF 0.90 15 LYS HB3 16 ASN H 5.51 #peak 163 #SUP 1.00 115 LYS HB3 116 ASN H 5.51 #peak 163 #SUP 1.00 16 ASN H 17 GLY H 5.76 #peak 169 #SUP 0.90 #QF 0.90 116 ASN H 117 GLY H 5.76 #peak 169 #SUP 0.90 #QF 0.90 16 ASN HA 16 ASN HD21 5.35 #peak 174 #SUP 1.00 #QF 0.76 116 ASN HA 116 ASN HD21 5.35 #peak 174 #SUP 1.00 #QF 0.76 15 LYS HE 16 ASN HD22 5.14 #peak 179 #SUP 0.82 #QF 0.55 115 LYS HE 116 ASN HD22 5.14 #peak 179 #SUP 0.82 #QF 0.55 16 ASN HA 16 ASN HD22 5.35 #peak 180 #SUP 1.00 116 ASN HA 116 ASN HD22 5.35 #peak 180 #SUP 1.00 17 GLY H 18 MET HB2 6.50 #peak 184 #SUP 0.98 #QF 0.98 117 GLY H 118 MET HB3 6.50 #peak 184 #SUP 0.98 #QF 0.98 17 GLY H 18 MET HB3 6.50 #peak 185 #SUP 0.99 #QF 0.96 117 GLY H 118 MET HB2 6.47 #peak 185 #SUP 0.99 #QF 0.96 17 GLY H 18 MET HG2 5.96 #peak 187 #SUP 1.00 117 GLY H 118 MET HG2 5.96 #peak 187 #SUP 1.00 16 ASN HA 17 GLY H 3.49 #peak 190 #SUP 0.97 #QF 0.97 116 ASN HA 117 GLY H 3.49 #peak 190 #SUP 0.97 #QF 0.97 15 LYS HG 18 MET H 5.56 #peak 195 #SUP 0.99 #QF 0.99 115 LYS HG 118 MET H 5.56 #peak 195 #SUP 0.99 #QF 0.99 115 LYS HB3 118 MET H 6.15 #peak 196 #SUP 1.00 18 MET H 18 MET HE 5.02 #peak 197 #SUP 1.00 118 MET H 118 MET HE 5.02 #peak 197 #SUP 1.00 18 MET H 18 MET HB2 3.68 #peak 198 #SUP 0.99 #QF 0.99 118 MET H 118 MET HB3 3.68 #peak 198 #SUP 0.99 #QF 0.99 18 MET H 18 MET HB3 3.68 #peak 199 #SUP 0.99 #QF 0.98 118 MET H 118 MET HB2 3.57 #peak 199 #SUP 0.99 #QF 0.98 18 MET H 18 MET HG3 4.00 #peak 199 #SUP 0.99 #QF 0.98 118 MET H 118 MET HG3 4.00 #peak 199 #SUP 0.99 #QF 0.98 18 MET H 18 MET HG2 4.00 #peak 200 #SUP 0.98 #QF 0.98 118 MET H 118 MET HG2 4.00 #peak 200 #SUP 0.98 #QF 0.98 14 ASP HA 18 MET H 5.83 #peak 205 #SUP 0.98 #QF 0.98 114 ASP HA 118 MET H 5.83 #peak 205 #SUP 0.98 #QF 0.98 18 MET H 21 GLN H 5.17 #peak 207 #SUP 0.99 #QF 0.99 118 MET H 121 GLN H 5.17 #peak 207 #SUP 0.99 #QF 0.99 17 GLY H 18 MET H 3.74 #peak 208 #SUP 0.99 #QF 0.93 117 GLY H 118 MET H 3.74 #peak 208 #SUP 0.99 #QF 0.93 18 MET H 21 GLN HE21 6.00 #peak 209 #SUP 1.00 118 MET H 121 GLN HE21 6.00 #peak 209 #SUP 1.00 19 THR H 38 LEU HD2 5.53 #peak 211 #SUP 0.98 #QF 0.98 119 THR H 138 LEU HD2 5.53 #peak 211 #SUP 0.98 #QF 0.98 19 THR H 38 LEU HD1 4.56 #peak 212 #SUP 1.00 119 THR H 138 LEU HD1 4.56 #peak 212 #SUP 1.00 19 THR H 19 THR HG2 3.39 #peak 213 #SUP 0.99 #QF 0.99 119 THR H 119 THR HG2 3.39 #peak 213 #SUP 0.99 #QF 0.99 15 LYS HG 19 THR H 6.50 #peak 214 #SUP 0.99 #QF 0.73 115 LYS HG 119 THR H 6.50 #peak 214 #SUP 0.99 #QF 0.73 19 THR H 40 ALA HB 6.50 #peak 214 #SUP 0.99 #QF 0.73 119 THR H 140 ALA HB 6.50 #peak 214 #SUP 0.99 #QF 0.73 18 MET HE 19 THR H 5.52 #peak 215 #SUP 0.99 #QF 0.99 118 MET HE 119 THR H 5.52 #peak 215 #SUP 0.99 #QF 0.99 18 MET HB2 19 THR H 4.08 #peak 216 #SUP 0.99 #QF 0.99 118 MET HB3 119 THR H 4.08 #peak 216 #SUP 0.99 #QF 0.99 18 MET HB3 19 THR H 4.08 #peak 217 #SUP 0.98 #QF 0.98 118 MET HB2 119 THR H 4.07 #peak 217 #SUP 0.98 #QF 0.98 19 THR H 19 THR HB 4.18 #peak 220 #SUP 1.00 119 THR H 119 THR HB 4.18 #peak 220 #SUP 1.00 19 THR H 19 THR HG1 4.29 #peak 224 #SUP 0.98 #QF 0.98 119 THR H 119 THR HG1 4.29 #peak 224 #SUP 0.98 #QF 0.98 15 LYS H 19 THR H 5.55 #peak 225 #SUP 1.00 115 LYS H 119 THR H 5.55 #peak 225 #SUP 1.00 18 MET H 19 THR H 3.79 #peak 226 #SUP 0.99 #QF 0.76 118 MET H 119 THR H 3.79 #peak 226 #SUP 0.99 #QF 0.76 19 THR H 21 GLN H 5.07 #peak 227 #SUP 0.99 #QF 0.99 119 THR H 121 GLN H 5.07 #peak 227 #SUP 0.99 #QF 0.99 33 ILE HD1 120 ASN H 4.90 #peak 228 #SUP 0.97 #QF 0.90 20 ASN H 133 ILE HD1 4.90 #peak 228 #SUP 0.97 #QF 0.90 20 ASN H 38 LEU HD1 5.33 #peak 228 #SUP 0.97 #QF 0.90 120 ASN H 138 LEU HD1 5.33 #peak 228 #SUP 0.97 #QF 0.90 19 THR HG2 20 ASN H 4.29 #peak 229 #SUP 1.00 119 THR HG2 120 ASN H 4.29 #peak 229 #SUP 1.00 33 ILE HB 120 ASN H 5.38 #peak 230 #SUP 0.99 #QF 0.99 20 ASN H 133 ILE HB 5.38 #peak 230 #SUP 0.99 #QF 0.99 20 ASN H 22 ILE HB 5.75 #peak 231 #SUP 1.00 120 ASN H 122 ILE HB 5.75 #peak 231 #SUP 1.00 118 MET HB3 120 ASN H 5.79 #peak 232 #SUP 0.99 #QF 0.99 20 ASN H 21 GLN HB3 5.26 #peak 233 #SUP 1.00 #QF 0.98 120 ASN H 121 GLN HB3 5.26 #peak 233 #SUP 1.00 #QF 0.98 20 ASN H 21 GLN HG2 5.62 #peak 233 #SUP 1.00 #QF 0.98 120 ASN H 121 GLN HG2 5.62 #peak 233 #SUP 1.00 #QF 0.98 20 ASN H 21 GLN HG3 6.12 #peak 234 #SUP 1.00 120 ASN H 121 GLN HG3 6.12 #peak 234 #SUP 1.00 20 ASN H 20 ASN HB3 4.05 #peak 236 #SUP 0.94 #QF 0.94 120 ASN H 120 ASN HB3 4.05 #peak 236 #SUP 0.94 #QF 0.94 20 ASN H 20 ASN HB2 4.05 #peak 237 #SUP 1.00 120 ASN H 120 ASN HB2 4.05 #peak 237 #SUP 1.00 19 THR HB 20 ASN H 4.43 #peak 239 #SUP 1.00 119 THR HB 120 ASN H 4.43 #peak 239 #SUP 1.00 18 MET HA 20 ASN H 5.25 #peak 242 #SUP 0.99 #QF 0.99 118 MET HA 120 ASN H 5.25 #peak 242 #SUP 0.99 #QF 0.99 19 THR HG1 20 ASN H 4.73 #peak 244 #SUP 0.73 #QF 0.73 119 THR HG1 120 ASN H 4.73 #peak 244 #SUP 0.73 #QF 0.73 20 ASN H 20 ASN HD22 5.58 #peak 245 #SUP 0.99 #QF 0.72 120 ASN H 120 ASN HD22 5.58 #peak 245 #SUP 0.99 #QF 0.72 20 ASN H 21 GLN HE21 6.04 #peak 245 #SUP 0.99 #QF 0.72 120 ASN H 121 GLN HE21 6.04 #peak 245 #SUP 0.99 #QF 0.72 20 ASN H 20 ASN HD21 5.16 #peak 246 #SUP 0.98 #QF 0.98 120 ASN H 120 ASN HD21 5.16 #peak 246 #SUP 0.98 #QF 0.98 20 ASN H 23 THR H 6.12 #peak 247 #SUP 0.99 #QF 0.98 120 ASN H 123 THR H 6.12 #peak 247 #SUP 0.99 #QF 0.98 20 ASN H 21 GLN H 3.55 #peak 248 #SUP 0.99 #QF 0.99 120 ASN H 121 GLN H 3.55 #peak 248 #SUP 0.99 #QF 0.99 19 THR H 20 ASN H 3.58 #peak 249 #SUP 0.94 #QF 0.94 119 THR H 120 ASN H 3.58 #peak 249 #SUP 0.94 #QF 0.94 33 ILE HG13 120 ASN HD21 5.44 #peak 250 #SUP 1.00 #QF 0.82 20 ASN HA 20 ASN HD21 5.05 #peak 254 #SUP 1.00 120 ASN HA 120 ASN HD21 5.05 #peak 254 #SUP 1.00 29 PHE H 120 ASN HD21 6.50 #peak 256 #SUP 0.97 #QF 0.81 20 ASN HD21 129 PHE H 6.50 #peak 256 #SUP 0.97 #QF 0.81 33 ILE HG13 120 ASN HD22 4.79 #peak 257 #SUP 1.00 #QF 0.88 20 ASN HD22 133 ILE HG13 5.23 #peak 257 #SUP 1.00 #QF 0.88 33 ILE HG12 120 ASN HD22 5.23 #peak 259 #SUP 0.95 #QF 0.95 20 ASN HD22 133 ILE HG12 5.23 #peak 259 #SUP 0.95 #QF 0.95 20 ASN HA 20 ASN HD22 5.33 #peak 263 #SUP 1.00 120 ASN HA 120 ASN HD22 5.33 #peak 263 #SUP 1.00 29 PHE H 120 ASN HD22 6.20 #peak 265 #SUP 0.84 #QF 0.58 20 ASN HD22 129 PHE H 6.20 #peak 265 #SUP 0.84 #QF 0.58 31 THR H 120 ASN HD22 6.50 #peak 265 #SUP 0.84 #QF 0.58 20 ASN HD22 131 THR H 6.50 #peak 265 #SUP 0.84 #QF 0.58 33 ILE HD1 121 GLN H 6.50 #peak 267 #SUP 1.00 21 GLN H 133 ILE HD1 6.50 #peak 267 #SUP 1.00 21 GLN H 38 LEU HD1 6.50 #peak 267 #SUP 1.00 121 GLN H 138 LEU HD1 6.50 #peak 267 #SUP 1.00 19 THR HG2 21 GLN H 5.95 #peak 268 #SUP 0.93 #QF 0.93 119 THR HG2 121 GLN H 5.95 #peak 268 #SUP 0.93 #QF 0.93 21 GLN H 22 ILE HB 5.54 #peak 269 #SUP 0.99 #QF 0.99 121 GLN H 122 ILE HB 5.54 #peak 269 #SUP 0.99 #QF 0.99 21 GLN H 21 GLN HB2 3.73 #peak 270 #SUP 1.00 121 GLN H 121 GLN HB2 3.73 #peak 270 #SUP 1.00 21 GLN H 21 GLN HB3 3.48 #peak 271 #SUP 1.00 #QF 0.99 121 GLN H 121 GLN HB3 3.48 #peak 271 #SUP 1.00 #QF 0.99 21 GLN H 21 GLN HG3 4.09 #peak 272 #SUP 1.00 121 GLN H 121 GLN HG3 4.09 #peak 272 #SUP 1.00 20 ASN HB3 21 GLN H 4.38 #peak 273 #SUP 0.96 #QF 0.96 120 ASN HB3 121 GLN H 4.38 #peak 273 #SUP 0.96 #QF 0.96 20 ASN HB2 21 GLN H 4.38 #peak 274 #SUP 1.00 120 ASN HB2 121 GLN H 4.38 #peak 274 #SUP 1.00 19 THR HA 21 GLN H 5.58 #peak 275 #SUP 0.99 #QF 0.99 119 THR HA 121 GLN H 5.58 #peak 275 #SUP 0.99 #QF 0.99 18 MET HA 21 GLN H 4.10 #peak 277 #SUP 0.99 #QF 0.99 118 MET HA 121 GLN H 4.10 #peak 277 #SUP 0.99 #QF 0.99 21 GLN H 21 GLN HE21 5.44 #peak 278 #SUP 0.98 #QF 0.98 121 GLN H 121 GLN HE21 5.44 #peak 278 #SUP 0.98 #QF 0.98 20 ASN HD21 21 GLN H 5.61 #peak 279 #SUP 0.97 #QF 0.97 120 ASN HD21 121 GLN H 5.61 #peak 279 #SUP 0.97 #QF 0.97 21 GLN H 23 THR H 5.55 #peak 280 #SUP 0.98 #QF 0.98 121 GLN H 123 THR H 5.55 #peak 280 #SUP 0.98 #QF 0.98 21 GLN H 22 ILE H 3.73 #peak 282 #SUP 1.00 121 GLN H 122 ILE H 3.73 #peak 282 #SUP 1.00 21 GLN H 22 ILE HA 5.30 #peak 283 #SUP 0.83 #QF 0.83 121 GLN H 122 ILE HA 5.30 #peak 283 #SUP 0.83 #QF 0.83 21 GLN HE21 22 ILE HD1 5.77 #peak 284 #SUP 0.88 #QF 0.88 121 GLN HE21 122 ILE HD1 5.77 #peak 284 #SUP 0.88 #QF 0.88 21 GLN HE21 69 VAL HG1 4.93 #peak 285 #SUP 1.00 121 GLN HE21 169 VAL HG1 4.93 #peak 285 #SUP 1.00 21 GLN HB3 21 GLN HE21 4.16 #peak 288 #SUP 1.00 #QF 0.97 121 GLN HB3 121 GLN HE21 4.16 #peak 288 #SUP 1.00 #QF 0.97 18 MET HA 21 GLN HE21 4.69 #peak 291 #SUP 0.98 #QF 0.98 118 MET HA 121 GLN HE21 4.69 #peak 291 #SUP 0.98 #QF 0.98 21 GLN HE22 69 VAL HG1 4.09 #peak 293 #SUP 0.99 #QF 0.99 121 GLN HE22 169 VAL HG1 4.09 #peak 293 #SUP 0.99 #QF 0.99 21 GLN HE22 22 ILE HD1 6.17 #peak 294 #SUP 0.87 #QF 0.87 121 GLN HE22 122 ILE HD1 6.17 #peak 294 #SUP 0.87 #QF 0.87 21 GLN HE22 69 VAL HG2 5.60 #peak 295 #SUP 0.92 #QF 0.92 121 GLN HE22 169 VAL HG2 5.60 #peak 295 #SUP 0.92 #QF 0.92 18 MET HE 21 GLN HE22 4.88 #peak 296 #SUP 0.98 #QF 0.98 118 MET HE 121 GLN HE22 4.88 #peak 296 #SUP 0.98 #QF 0.98 21 GLN HB3 21 GLN HE22 4.51 #peak 297 #SUP 1.00 #QF 0.98 121 GLN HB3 121 GLN HE22 4.51 #peak 297 #SUP 1.00 #QF 0.98 21 GLN HE22 69 VAL HA 6.50 #peak 299 #SUP 1.00 121 GLN HE22 169 VAL HA 6.50 #peak 299 #SUP 1.00 21 GLN HA 21 GLN HE22 6.33 #peak 301 #SUP 0.61 #QF 0.61 121 GLN HA 121 GLN HE22 6.33 #peak 301 #SUP 0.61 #QF 0.61 18 MET HA 21 GLN HE22 4.81 #peak 302 #SUP 0.99 #QF 0.99 118 MET HA 121 GLN HE22 4.81 #peak 302 #SUP 0.99 #QF 0.99 22 ILE H 22 ILE HG2 3.74 #peak 304 #SUP 1.00 122 ILE H 122 ILE HG2 3.74 #peak 304 #SUP 1.00 19 THR HG2 22 ILE H 5.79 #peak 306 #SUP 0.91 #QF 0.67 119 THR HG2 122 ILE H 5.79 #peak 306 #SUP 0.91 #QF 0.67 22 ILE H 69 VAL HG1 6.22 #peak 306 #SUP 0.91 #QF 0.67 122 ILE H 169 VAL HG1 6.22 #peak 306 #SUP 0.91 #QF 0.67 22 ILE H 25 VAL HG2 5.11 #peak 307 #SUP 0.99 #QF 0.99 122 ILE H 125 VAL HG2 5.11 #peak 307 #SUP 0.99 #QF 0.99 22 ILE H 22 ILE HG12 4.23 #peak 309 #SUP 1.00 122 ILE H 122 ILE HG12 4.23 #peak 309 #SUP 1.00 22 ILE H 22 ILE HB 3.58 #peak 310 #SUP 1.00 122 ILE H 122 ILE HB 3.58 #peak 310 #SUP 1.00 18 MET HE 22 ILE H 5.32 #peak 311 #SUP 0.97 #QF 0.97 118 MET HE 122 ILE H 5.32 #peak 311 #SUP 0.97 #QF 0.97 21 GLN HB2 22 ILE H 4.16 #peak 312 #SUP 1.00 121 GLN HB2 122 ILE H 4.16 #peak 312 #SUP 1.00 21 GLN HG2 22 ILE H 3.99 #peak 313 #SUP 1.00 #QF 0.97 121 GLN HG2 122 ILE H 3.99 #peak 313 #SUP 1.00 #QF 0.97 19 THR HA 22 ILE H 4.97 #peak 315 #SUP 0.99 #QF 0.99 119 THR HA 122 ILE H 4.97 #peak 315 #SUP 0.99 #QF 0.99 22 ILE H 23 THR HA 5.98 #peak 316 #SUP 0.99 #QF 0.99 122 ILE H 123 THR HA 5.98 #peak 316 #SUP 0.99 #QF 0.99 22 ILE H 23 THR HG1 5.18 #peak 319 #SUP 0.99 #QF 0.99 122 ILE H 123 THR HG1 5.18 #peak 319 #SUP 0.99 #QF 0.99 18 MET HA 22 ILE H 4.94 #peak 320 #SUP 1.00 118 MET HA 122 ILE H 4.94 #peak 320 #SUP 1.00 22 ILE H 23 THR H 4.05 #peak 321 #SUP 0.99 #QF 0.99 122 ILE H 123 THR H 4.05 #peak 321 #SUP 0.99 #QF 0.99 20 ASN H 22 ILE H 5.34 #peak 322 #SUP 1.00 #QF 0.96 120 ASN H 122 ILE H 5.34 #peak 322 #SUP 1.00 #QF 0.96 22 ILE H 24 GLY H 5.22 #peak 323 #SUP 1.00 122 ILE H 124 GLY H 5.22 #peak 323 #SUP 1.00 23 THR H 23 THR HG2 3.90 #peak 326 #SUP 0.99 #QF 0.99 123 THR H 123 THR HG2 3.90 #peak 326 #SUP 0.99 #QF 0.99 22 ILE HG12 23 THR H 5.85 #peak 328 #SUP 0.88 #QF 0.88 122 ILE HG12 123 THR H 5.85 #peak 328 #SUP 0.88 #QF 0.88 19 THR HA 23 THR H 5.71 #peak 330 #SUP 1.00 119 THR HA 123 THR H 5.71 #peak 330 #SUP 1.00 23 THR H 23 THR HB 3.94 #peak 332 #SUP 0.99 #QF 0.79 123 THR H 123 THR HB 3.94 #peak 332 #SUP 0.99 #QF 0.79 23 THR H 23 THR HG1 3.59 #peak 333 #SUP 0.96 #QF 0.96 123 THR H 123 THR HG1 3.59 #peak 333 #SUP 0.96 #QF 0.96 22 ILE HG2 24 GLY H 4.70 #peak 338 #SUP 1.00 122 ILE HG2 124 GLY H 4.70 #peak 338 #SUP 1.00 23 THR HG2 24 GLY H 4.37 #peak 339 #SUP 1.00 123 THR HG2 124 GLY H 4.37 #peak 339 #SUP 1.00 24 GLY H 25 VAL HG2 4.94 #peak 340 #SUP 0.97 #QF 0.97 124 GLY H 125 VAL HG2 4.94 #peak 340 #SUP 0.97 #QF 0.97 24 GLY H 26 ILE HB 6.50 #peak 341 #SUP 0.90 #QF 0.67 124 GLY H 126 ILE HB 6.50 #peak 341 #SUP 0.90 #QF 0.67 24 GLY H 25 VAL HB 5.29 #peak 342 #SUP 0.98 #QF 0.98 124 GLY H 125 VAL HB 5.29 #peak 342 #SUP 0.98 #QF 0.98 23 THR HB 24 GLY H 3.64 #peak 345 #SUP 1.00 #QF 0.82 123 THR HB 124 GLY H 3.64 #peak 345 #SUP 1.00 #QF 0.82 21 GLN HA 24 GLY H 3.93 #peak 346 #SUP 0.74 #QF 0.74 121 GLN HA 124 GLY H 3.93 #peak 346 #SUP 0.74 #QF 0.74 23 THR HG1 24 GLY H 4.61 #peak 347 #SUP 0.94 #QF 0.94 123 THR HG1 124 GLY H 4.61 #peak 347 #SUP 0.94 #QF 0.94 24 GLY H 27 SER HG 5.28 #peak 348 #SUP 0.92 #QF 0.92 124 GLY H 127 SER HG 5.28 #peak 348 #SUP 0.92 #QF 0.92 23 THR H 24 GLY H 4.01 #peak 349 #SUP 1.00 123 THR H 124 GLY H 4.01 #peak 349 #SUP 1.00 24 GLY H 26 ILE H 5.25 #peak 350 #SUP 1.00 124 GLY H 126 ILE H 5.25 #peak 350 #SUP 1.00 25 VAL H 25 VAL HG1 3.80 #peak 352 #SUP 1.00 125 VAL H 125 VAL HG1 3.80 #peak 352 #SUP 1.00 22 ILE HB 25 VAL H 6.42 #peak 355 #SUP 1.00 #QF 0.99 122 ILE HB 125 VAL H 6.42 #peak 355 #SUP 1.00 #QF 0.99 25 VAL H 25 VAL HB 3.54 #peak 356 #SUP 0.99 #QF 0.99 125 VAL H 125 VAL HB 3.54 #peak 356 #SUP 0.99 #QF 0.99 22 ILE HA 25 VAL H 4.23 #peak 359 #SUP 0.97 #QF 0.83 122 ILE HA 125 VAL H 4.23 #peak 359 #SUP 0.97 #QF 0.83 21 GLN HA 25 VAL H 4.86 #peak 360 #SUP 0.76 #QF 0.76 121 GLN HA 125 VAL H 4.86 #peak 360 #SUP 0.76 #QF 0.76 25 VAL H 27 SER HG 5.72 #peak 361 #SUP 0.86 #QF 0.86 125 VAL H 127 SER HG 5.72 #peak 361 #SUP 0.86 #QF 0.86 25 VAL H 28 LYS H 5.42 #peak 362 #SUP 0.98 #QF 0.98 125 VAL H 128 LYS H 5.42 #peak 362 #SUP 0.98 #QF 0.98 23 THR H 25 VAL H 5.29 #peak 363 #SUP 0.89 #QF 0.89 123 THR H 125 VAL H 5.29 #peak 363 #SUP 0.89 #QF 0.89 25 VAL H 26 ILE H 3.88 #peak 364 #SUP 0.98 #QF 0.98 125 VAL H 126 ILE H 3.88 #peak 364 #SUP 0.98 #QF 0.98 21 GLN H 25 VAL H 6.34 #peak 366 #SUP 0.89 #QF 0.89 121 GLN H 125 VAL H 6.34 #peak 366 #SUP 0.89 #QF 0.89 26 ILE H 26 ILE HG13 4.39 #peak 368 #SUP 0.99 #QF 0.99 126 ILE H 126 ILE HG13 4.39 #peak 368 #SUP 0.99 #QF 0.99 26 ILE H 26 ILE HB 4.11 #peak 370 #SUP 1.00 126 ILE H 126 ILE HB 4.11 #peak 370 #SUP 1.00 26 ILE H 26 ILE HG12 4.39 #peak 370 #SUP 1.00 126 ILE H 126 ILE HG12 4.39 #peak 370 #SUP 1.00 25 VAL HB 26 ILE H 4.13 #peak 371 #SUP 0.99 #QF 0.99 125 VAL HB 126 ILE H 4.13 #peak 371 #SUP 0.99 #QF 0.99 23 THR HA 26 ILE H 4.84 #peak 373 #SUP 0.99 #QF 0.95 123 THR HA 126 ILE H 4.84 #peak 373 #SUP 0.99 #QF 0.95 26 ILE H 28 LYS H 5.66 #peak 377 #SUP 1.00 126 ILE H 128 LYS H 5.66 #peak 377 #SUP 1.00 27 SER H 33 ILE HD1 5.06 #peak 378 #SUP 1.00 127 SER H 133 ILE HD1 5.06 #peak 378 #SUP 1.00 23 THR HG2 27 SER H 4.55 #peak 379 #SUP 0.98 #QF 0.98 123 THR HG2 127 SER H 4.55 #peak 379 #SUP 0.98 #QF 0.98 26 ILE HB 27 SER H 4.45 #peak 380 #SUP 1.00 #QF 0.98 126 ILE HB 127 SER H 4.45 #peak 380 #SUP 1.00 #QF 0.98 27 SER H 33 ILE HG12 6.38 #peak 381 #SUP 0.99 #QF 0.98 25 VAL HB 27 SER H 5.30 #peak 382 #SUP 0.68 #QF 0.68 125 VAL HB 127 SER H 5.30 #peak 382 #SUP 0.68 #QF 0.68 23 THR HA 27 SER H 5.06 #peak 384 #SUP 0.95 #QF 0.75 123 THR HA 127 SER H 5.06 #peak 384 #SUP 0.95 #QF 0.75 25 VAL HA 27 SER H 5.33 #peak 384 #SUP 0.95 #QF 0.75 125 VAL HA 127 SER H 5.33 #peak 384 #SUP 0.95 #QF 0.75 27 SER H 27 SER HB3 3.92 #peak 385 #SUP 0.98 #QF 0.98 127 SER H 127 SER HB3 3.92 #peak 385 #SUP 0.98 #QF 0.98 27 SER H 27 SER HB2 3.92 #peak 387 #SUP 0.99 #QF 0.99 127 SER H 127 SER HB2 3.92 #peak 387 #SUP 0.99 #QF 0.99 27 SER H 27 SER HG 3.86 #peak 388 #SUP 0.97 #QF 0.97 127 SER H 127 SER HG 3.86 #peak 388 #SUP 0.97 #QF 0.97 27 SER H 28 LYS H 3.99 #peak 389 #SUP 0.99 #QF 0.99 127 SER H 128 LYS H 3.99 #peak 389 #SUP 0.99 #QF 0.99 26 ILE H 27 SER H 3.59 #peak 390 #SUP 0.93 #QF 0.93 126 ILE H 127 SER H 3.59 #peak 390 #SUP 0.93 #QF 0.93 26 ILE HG2 28 LYS H 5.84 #peak 391 #SUP 1.00 #QF 0.97 126 ILE HG2 128 LYS H 5.84 #peak 391 #SUP 1.00 #QF 0.97 28 LYS H 33 ILE HD1 6.45 #peak 391 #SUP 1.00 #QF 0.97 128 LYS H 133 ILE HD1 6.45 #peak 391 #SUP 1.00 #QF 0.97 23 THR HG2 28 LYS H 6.50 #peak 392 #SUP 0.97 #QF 0.97 123 THR HG2 128 LYS H 6.50 #peak 392 #SUP 0.97 #QF 0.97 28 LYS H 28 LYS HG2 4.09 #peak 393 #SUP 1.00 128 LYS H 128 LYS HG2 4.09 #peak 393 #SUP 1.00 28 LYS H 28 LYS HG3 4.09 #peak 394 #SUP 1.00 128 LYS H 128 LYS HG3 4.09 #peak 394 #SUP 1.00 28 LYS H 28 LYS HB3 3.77 #peak 395 #SUP 1.00 128 LYS H 128 LYS HB3 3.77 #peak 395 #SUP 1.00 28 LYS H 28 LYS HB2 3.77 #peak 396 #SUP 1.00 128 LYS H 128 LYS HB2 3.77 #peak 396 #SUP 1.00 26 ILE HA 28 LYS H 5.57 #peak 397 #SUP 0.87 #QF 0.87 126 ILE HA 128 LYS H 5.57 #peak 397 #SUP 0.87 #QF 0.87 25 VAL HA 28 LYS H 4.60 #peak 399 #SUP 0.99 #QF 0.99 125 VAL HA 128 LYS H 4.60 #peak 399 #SUP 0.99 #QF 0.99 27 SER HB3 28 LYS H 4.84 #peak 400 #SUP 0.94 #QF 0.94 127 SER HB3 128 LYS H 4.84 #peak 400 #SUP 0.94 #QF 0.94 27 SER HB2 28 LYS H 4.84 #peak 402 #SUP 0.99 #QF 0.99 127 SER HB2 128 LYS H 4.84 #peak 402 #SUP 0.99 #QF 0.99 28 LYS H 29 PHE HA 5.69 #peak 404 #SUP 0.99 #QF 0.99 128 LYS H 129 PHE HA 5.69 #peak 404 #SUP 0.99 #QF 0.99 27 SER HG 28 LYS H 4.23 #peak 405 #SUP 0.96 #QF 0.96 127 SER HG 128 LYS H 4.23 #peak 405 #SUP 0.96 #QF 0.96 26 ILE HG2 29 PHE H 5.76 #peak 408 #SUP 0.99 #QF 0.97 126 ILE HG2 129 PHE H 5.76 #peak 408 #SUP 0.99 #QF 0.97 29 PHE H 33 ILE HD1 6.34 #peak 408 #SUP 0.99 #QF 0.97 129 PHE H 133 ILE HD1 6.34 #peak 408 #SUP 0.99 #QF 0.97 29 PHE H 31 THR HG2 5.58 #peak 409 #SUP 0.99 #QF 0.99 129 PHE H 131 THR HG2 5.58 #peak 409 #SUP 0.99 #QF 0.99 28 LYS HB3 29 PHE H 4.89 #peak 411 #SUP 0.96 #QF 0.96 128 LYS HB3 129 PHE H 4.89 #peak 411 #SUP 0.96 #QF 0.96 28 LYS HB2 29 PHE H 4.89 #peak 412 #SUP 1.00 128 LYS HB2 129 PHE H 4.89 #peak 412 #SUP 1.00 26 ILE HA 29 PHE H 5.05 #peak 413 #SUP 0.93 #QF 0.93 126 ILE HA 129 PHE H 5.05 #peak 413 #SUP 0.93 #QF 0.93 29 PHE H 29 PHE HB3 3.91 #peak 414 #SUP 1.00 129 PHE H 129 PHE HB3 3.91 #peak 414 #SUP 1.00 29 PHE H 29 PHE HB2 3.91 #peak 415 #SUP 1.00 129 PHE H 129 PHE HB2 3.91 #peak 415 #SUP 1.00 27 SER HA 29 PHE H 5.52 #peak 416 #SUP 0.95 #QF 0.95 127 SER HA 129 PHE H 5.52 #peak 416 #SUP 0.95 #QF 0.95 28 LYS H 29 PHE H 3.53 #peak 419 #SUP 0.99 #QF 0.99 128 LYS H 129 PHE H 3.53 #peak 419 #SUP 0.99 #QF 0.99 29 PHE H 30 ASP H 5.23 #peak 422 #SUP 0.94 #QF 0.94 129 PHE H 130 ASP H 5.23 #peak 422 #SUP 0.94 #QF 0.94 30 ASP H 62 LEU HD2 5.70 #peak 423 #SUP 1.00 130 ASP H 162 LEU HD2 5.70 #peak 423 #SUP 1.00 30 ASP H 31 THR HG2 5.79 #peak 424 #SUP 0.98 #QF 0.98 130 ASP H 131 THR HG2 5.79 #peak 424 #SUP 0.98 #QF 0.98 29 PHE HD 30 ASP H 4.86 #peak 429 #SUP 0.99 #QF 0.99 129 PHE HD 130 ASP H 4.86 #peak 429 #SUP 0.99 #QF 0.99 30 ASP H 31 THR H 4.65 #peak 430 #SUP 1.00 #QF 0.96 130 ASP H 131 THR H 4.65 #peak 430 #SUP 1.00 #QF 0.96 31 THR H 62 LEU HD1 5.59 #peak 432 #SUP 0.98 #QF 0.98 131 THR H 162 LEU HD1 5.59 #peak 432 #SUP 0.98 #QF 0.98 30 ASP HB 31 THR H 4.53 #peak 435 #SUP 1.00 130 ASP HB 131 THR H 4.53 #peak 435 #SUP 1.00 29 PHE HB3 31 THR H 4.75 #peak 436 #SUP 0.98 #QF 0.98 129 PHE HB3 131 THR H 4.75 #peak 436 #SUP 0.98 #QF 0.98 29 PHE HB2 31 THR H 4.75 #peak 437 #SUP 1.00 129 PHE HB2 131 THR H 4.75 #peak 437 #SUP 1.00 30 ASP HA 31 THR H 3.48 #peak 439 #SUP 0.94 #QF 0.94 130 ASP HA 131 THR H 3.48 #peak 439 #SUP 0.94 #QF 0.94 31 THR H 32 ASN HA 5.71 #peak 441 #SUP 0.87 #QF 0.87 131 THR H 132 ASN HA 5.71 #peak 441 #SUP 0.87 #QF 0.87 29 PHE HD 31 THR H 4.52 #peak 442 #SUP 0.73 #QF 0.73 129 PHE HD 131 THR H 4.52 #peak 442 #SUP 0.73 #QF 0.73 20 ASN HD21 131 THR H 6.33 #peak 443 #SUP 0.68 #QF 0.68 31 THR H 120 ASN HD21 6.33 #peak 443 #SUP 0.68 #QF 0.68 31 THR H 32 ASN H 4.98 #peak 444 #SUP 1.00 131 THR H 132 ASN H 4.98 #peak 444 #SUP 1.00 32 ASN H 51 ILE HD1 5.44 #peak 447 #SUP 1.00 132 ASN H 151 ILE HD1 5.44 #peak 447 #SUP 1.00 32 ASN H 51 ILE HG2 5.61 #peak 448 #SUP 0.99 #QF 0.99 132 ASN H 151 ILE HG2 5.61 #peak 448 #SUP 0.99 #QF 0.99 32 ASN H 51 ILE HB 5.36 #peak 450 #SUP 0.84 #QF 0.84 132 ASN H 151 ILE HB 5.36 #peak 450 #SUP 0.84 #QF 0.84 32 ASN H 32 ASN HB3 4.00 #peak 451 #SUP 1.00 132 ASN H 132 ASN HB3 4.00 #peak 451 #SUP 1.00 32 ASN H 32 ASN HB2 4.00 #peak 452 #SUP 1.00 132 ASN H 132 ASN HB2 4.00 #peak 452 #SUP 1.00 31 THR HB 32 ASN H 4.18 #peak 453 #SUP 0.99 #QF 0.99 131 THR HB 132 ASN H 4.18 #peak 453 #SUP 0.99 #QF 0.99 32 ASN HD21 33 ILE HB 5.93 #peak 457 #SUP 0.81 #QF 0.81 32 ASN HA 32 ASN HD21 5.16 #peak 461 #SUP 1.00 132 ASN HA 132 ASN HD21 5.44 #peak 461 #SUP 1.00 32 ASN HD21 33 ILE H 4.82 #peak 463 #SUP 0.91 #QF 0.38 32 ASN HD21 118 MET H 5.96 #peak 464 #SUP 0.78 #QF 0.58 20 ASN H 132 ASN HD21 6.50 #peak 464 #SUP 0.78 #QF 0.58 32 ASN HD21 120 ASN H 6.29 #peak 464 #SUP 0.78 #QF 0.58 32 ASN HD22 116 ASN HA 5.87 #peak 467 #SUP 0.55 #QF 0.55 132 ASN HA 132 ASN HD22 5.44 #peak 469 #SUP 1.00 32 ASN HD22 118 MET H 6.50 #peak 472 #SUP 0.89 #QF 0.75 20 ASN H 132 ASN HD22 6.50 #peak 472 #SUP 0.89 #QF 0.75 32 ASN HD22 120 ASN H 6.50 #peak 472 #SUP 0.89 #QF 0.75 32 ASN H 32 ASN HD22 6.13 #peak 473 #SUP 0.97 #QF 0.70 32 ASN HD22 33 ILE H 6.41 #peak 473 #SUP 0.97 #QF 0.70 32 ASN HD22 117 GLY H 5.72 #peak 474 #SUP 0.76 #QF 0.76 33 ILE H 33 ILE HG13 4.07 #peak 475 #SUP 1.00 #QF 0.86 133 ILE H 133 ILE HG13 4.39 #peak 475 #SUP 1.00 #QF 0.86 33 ILE H 33 ILE HB 4.15 #peak 477 #SUP 1.00 133 ILE H 133 ILE HB 4.15 #peak 477 #SUP 1.00 33 ILE H 33 ILE HG12 4.39 #peak 478 #SUP 0.97 #QF 0.97 133 ILE H 133 ILE HG12 4.39 #peak 478 #SUP 0.97 #QF 0.97 19 THR HB 133 ILE H 5.52 #peak 481 #SUP 0.88 #QF 0.88 33 ILE H 119 THR HB 5.52 #peak 481 #SUP 0.88 #QF 0.88 19 THR HG1 133 ILE H 5.30 #peak 484 #SUP 0.96 #QF 0.96 33 ILE H 119 THR HG1 5.30 #peak 484 #SUP 0.96 #QF 0.96 20 ASN HD22 133 ILE H 5.39 #peak 485 #SUP 0.99 #QF 0.99 33 ILE H 120 ASN HD22 5.39 #peak 485 #SUP 0.99 #QF 0.99 34 ARG H 35 THR HG2 6.50 #peak 493 #SUP 0.95 #QF 0.76 134 ARG H 135 THR HG2 6.50 #peak 493 #SUP 0.95 #QF 0.76 34 ARG H 51 ILE HG12 6.50 #peak 493 #SUP 0.95 #QF 0.76 134 ARG H 151 ILE HG12 6.50 #peak 493 #SUP 0.95 #QF 0.76 33 ILE H 34 ARG H 5.67 #peak 498 #SUP 1.00 #QF 0.99 133 ILE H 134 ARG H 5.67 #peak 498 #SUP 1.00 #QF 0.99 5 LEU HD1 35 THR H 5.43 #peak 499 #SUP 1.00 105 LEU HD1 135 THR H 5.43 #peak 499 #SUP 1.00 33 ILE HG2 35 THR H 3.98 #peak 500 #SUP 0.99 #QF 0.99 133 ILE HG2 135 THR H 3.98 #peak 500 #SUP 0.99 #QF 0.99 35 THR H 50 MET HB3 4.58 #peak 504 #SUP 0.99 #QF 0.76 135 THR H 150 MET HB3 4.58 #peak 504 #SUP 0.99 #QF 0.76 35 THR H 50 MET HB2 4.58 #peak 505 #SUP 1.00 135 THR H 150 MET HB2 4.58 #peak 505 #SUP 1.00 35 THR H 50 MET HG2 6.02 #peak 506 #SUP 1.00 135 THR H 150 MET HG2 6.02 #peak 506 #SUP 1.00 35 THR H 35 THR HB 4.09 #peak 507 #SUP 1.00 135 THR H 135 THR HB 4.09 #peak 507 #SUP 1.00 35 THR H 51 ILE HA 5.14 #peak 509 #SUP 0.98 #QF 0.98 135 THR H 151 ILE HA 5.14 #peak 509 #SUP 0.98 #QF 0.98 35 THR H 49 LEU HA 5.81 #peak 510 #SUP 1.00 135 THR H 149 LEU HA 5.81 #peak 510 #SUP 1.00 35 THR H 50 MET HA 5.30 #peak 512 #SUP 0.98 #QF 0.98 135 THR H 150 MET HA 5.30 #peak 512 #SUP 0.98 #QF 0.98 35 THR H 83 HIS HE1 5.12 #peak 513 #SUP 0.43 #QF 0.43 135 THR H 183 HIS HE1 5.12 #peak 513 #SUP 0.43 #QF 0.43 34 ARG H 35 THR H 3.77 #peak 514 #SUP 0.97 #QF 0.97 134 ARG H 135 THR H 3.77 #peak 514 #SUP 0.97 #QF 0.97 35 THR H 50 MET H 4.16 #peak 515 #SUP 0.99 #QF 0.99 135 THR H 150 MET H 4.16 #peak 515 #SUP 0.99 #QF 0.99 37 VAL HG1 136 ILE H 5.21 #peak 518 #SUP 0.81 #QF 0.81 36 ILE H 137 VAL HG1 5.21 #peak 518 #SUP 0.81 #QF 0.81 36 ILE H 36 ILE HB 4.05 #peak 520 #SUP 1.00 #QF 0.99 136 ILE H 136 ILE HB 4.05 #peak 520 #SUP 1.00 #QF 0.99 38 LEU HB 136 ILE H 4.46 #peak 520 #SUP 1.00 #QF 0.99 36 ILE H 138 LEU HB 4.46 #peak 520 #SUP 1.00 #QF 0.99 35 THR HB 36 ILE H 5.17 #peak 521 #SUP 1.00 135 THR HB 136 ILE H 5.17 #peak 521 #SUP 1.00 39 ASN HA 136 ILE H 5.72 #peak 524 #SUP 0.92 #QF 0.92 36 ILE H 139 ASN HA 5.72 #peak 524 #SUP 0.92 #QF 0.92 35 THR H 36 ILE H 5.08 #peak 526 #SUP 1.00 135 THR H 136 ILE H 5.08 #peak 526 #SUP 1.00 38 LEU H 136 ILE H 4.34 #peak 527 #SUP 0.98 #QF 0.98 36 ILE H 138 LEU H 4.34 #peak 527 #SUP 0.98 #QF 0.98 36 ILE HG2 37 VAL H 4.38 #peak 529 #SUP 1.00 136 ILE HG2 137 VAL H 4.38 #peak 529 #SUP 1.00 35 THR HG2 37 VAL H 4.85 #peak 531 #SUP 0.96 #QF 0.96 135 THR HG2 137 VAL H 4.85 #peak 531 #SUP 0.96 #QF 0.96 37 VAL H 48 ASN HB3 5.24 #peak 534 #SUP 1.00 137 VAL H 148 ASN HB3 5.24 #peak 534 #SUP 1.00 37 VAL H 48 ASN HB2 5.24 #peak 535 #SUP 0.94 #QF 0.94 137 VAL H 148 ASN HB2 5.24 #peak 535 #SUP 0.94 #QF 0.94 36 ILE HA 37 VAL H 3.50 #peak 536 #SUP 0.99 #QF 0.99 136 ILE HA 137 VAL H 3.50 #peak 536 #SUP 0.99 #QF 0.99 37 VAL H 49 LEU HA 4.67 #peak 538 #SUP 0.93 #QF 0.93 137 VAL H 149 LEU HA 4.67 #peak 538 #SUP 0.93 #QF 0.93 37 VAL H 38 LEU HA 5.34 #peak 539 #SUP 1.00 #QF 0.90 137 VAL H 138 LEU HA 5.34 #peak 539 #SUP 1.00 #QF 0.90 37 VAL H 48 ASN HA 5.67 #peak 539 #SUP 1.00 #QF 0.90 137 VAL H 148 ASN HA 5.67 #peak 539 #SUP 1.00 #QF 0.90 37 VAL H 48 ASN H 4.40 #peak 540 #SUP 1.00 137 VAL H 148 ASN H 4.40 #peak 540 #SUP 1.00 37 VAL H 38 LEU H 5.00 #peak 541 #SUP 1.00 137 VAL H 138 LEU H 5.00 #peak 541 #SUP 1.00 38 LEU H 38 LEU HB 3.97 #peak 546 #SUP 1.00 138 LEU H 138 LEU HB 3.97 #peak 546 #SUP 1.00 37 VAL HB 38 LEU H 5.43 #peak 547 #SUP 0.98 #QF 0.98 137 VAL HB 138 LEU H 5.43 #peak 547 #SUP 0.98 #QF 0.98 35 THR HA 138 LEU H 5.43 #peak 549 #SUP 0.64 #QF 0.64 38 LEU H 135 THR HA 5.43 #peak 549 #SUP 0.64 #QF 0.64 33 ILE HG2 50 MET H 4.28 #peak 554 #SUP 0.51 #QF 0.51 133 ILE HG2 150 MET H 4.28 #peak 554 #SUP 0.51 #QF 0.51 38 LEU HG 39 ASN H 3.83 #peak 555 #SUP 0.99 #QF 0.62 138 LEU HG 139 ASN H 3.83 #peak 555 #SUP 0.99 #QF 0.62 39 ASN H 39 ASN HB 3.80 #peak 556 #SUP 1.00 139 ASN H 139 ASN HB 3.80 #peak 556 #SUP 1.00 38 LEU HA 39 ASN H 3.41 #peak 558 #SUP 0.98 #QF 0.98 138 LEU HA 139 ASN H 3.41 #peak 558 #SUP 0.98 #QF 0.98 39 ASN H 48 ASN H 5.28 #peak 561 #SUP 0.94 #QF 0.94 139 ASN H 148 ASN H 5.28 #peak 561 #SUP 0.94 #QF 0.94 39 ASN HB 39 ASN HD22 3.75 #peak 568 #SUP 1.00 139 ASN HB 139 ASN HD22 3.75 #peak 568 #SUP 1.00 39 ASN HB 39 ASN HD21 3.75 #peak 570 #SUP 1.00 139 ASN HB 139 ASN HD21 3.75 #peak 570 #SUP 1.00 39 ASN HA 39 ASN HD22 5.52 #peak 571 #SUP 1.00 139 ASN HA 139 ASN HD22 5.52 #peak 571 #SUP 1.00 39 ASN HA 39 ASN HD21 5.52 #peak 573 #SUP 1.00 139 ASN HA 139 ASN HD21 5.52 #peak 573 #SUP 1.00 19 THR HG2 40 ALA H 5.78 #peak 575 #SUP 1.00 119 THR HG2 140 ALA H 5.78 #peak 575 #SUP 1.00 40 ALA H 40 ALA HB 3.50 #peak 576 #SUP 1.00 140 ALA H 140 ALA HB 3.50 #peak 576 #SUP 1.00 39 ASN HB 40 ALA H 3.95 #peak 577 #SUP 0.99 #QF 0.99 139 ASN HB 140 ALA H 3.95 #peak 577 #SUP 0.99 #QF 0.99 34 ARG HA 140 ALA H 5.73 #peak 578 #SUP 0.85 #QF 0.85 40 ALA H 134 ARG HA 5.73 #peak 578 #SUP 0.85 #QF 0.85 39 ASN HA 40 ALA H 3.30 #peak 581 #SUP 0.93 #QF 0.93 139 ASN HA 140 ALA H 3.30 #peak 581 #SUP 0.93 #QF 0.93 40 ALA H 45 PHE HA 5.28 #peak 582 #SUP 0.99 #QF 0.99 140 ALA H 145 PHE HA 5.28 #peak 582 #SUP 0.99 #QF 0.99 40 ALA H 41 LYS H 4.67 #peak 583 #SUP 0.95 #QF 0.95 140 ALA H 141 LYS H 4.67 #peak 583 #SUP 0.95 #QF 0.95 39 ASN H 40 ALA H 4.79 #peak 584 #SUP 0.98 #QF 0.98 139 ASN H 140 ALA H 4.79 #peak 584 #SUP 0.98 #QF 0.98 41 LYS H 44 ILE HG2 5.18 #peak 585 #SUP 1.00 141 LYS H 144 ILE HG2 5.18 #peak 585 #SUP 1.00 41 LYS H 41 LYS HG 4.04 #peak 586 #SUP 1.00 #QF 0.99 141 LYS H 141 LYS HG 4.04 #peak 586 #SUP 1.00 #QF 0.99 41 LYS H 41 LYS HB 3.88 #peak 587 #SUP 0.99 #QF 0.99 141 LYS H 141 LYS HB 3.88 #peak 587 #SUP 0.99 #QF 0.99 41 LYS H 44 ILE HB 5.26 #peak 588 #SUP 0.99 #QF 0.99 141 LYS H 144 ILE HB 5.26 #peak 588 #SUP 0.99 #QF 0.99 41 LYS H 45 PHE HB2 5.61 #peak 589 #SUP 0.99 #QF 0.99 141 LYS H 145 PHE HB2 5.61 #peak 589 #SUP 0.99 #QF 0.99 39 ASN HB 41 LYS H 6.02 #peak 590 #SUP 1.00 139 ASN HB 141 LYS H 6.02 #peak 590 #SUP 1.00 41 LYS H 45 PHE HB3 5.61 #peak 591 #SUP 1.00 141 LYS H 145 PHE HB3 5.61 #peak 591 #SUP 1.00 41 LYS H 41 LYS HE 6.13 #peak 592 #SUP 0.98 #QF 0.96 141 LYS H 141 LYS HE 6.13 #peak 592 #SUP 0.98 #QF 0.96 41 LYS H 44 ILE HA 5.91 #peak 594 #SUP 0.99 #QF 0.99 141 LYS H 144 ILE HA 5.91 #peak 594 #SUP 0.99 #QF 0.99 40 ALA HA 41 LYS H 3.20 #peak 595 #SUP 0.95 #QF 0.95 140 ALA HA 141 LYS H 3.20 #peak 595 #SUP 0.95 #QF 0.95 41 LYS H 45 PHE HA 3.96 #peak 596 #SUP 0.99 #QF 0.99 141 LYS H 145 PHE HA 3.96 #peak 596 #SUP 0.99 #QF 0.99 41 LYS H 45 PHE HD 5.93 #peak 598 #SUP 0.97 #QF 0.97 141 LYS H 145 PHE HD 5.93 #peak 598 #SUP 0.97 #QF 0.97 41 LYS H 46 THR H 4.65 #peak 601 #SUP 1.00 141 LYS H 146 THR H 4.65 #peak 601 #SUP 1.00 41 LYS H 42 ASP H 4.65 #peak 602 #SUP 1.00 141 LYS H 142 ASP H 4.65 #peak 602 #SUP 1.00 41 LYS H 43 GLY H 5.02 #peak 603 #SUP 0.94 #QF 0.94 141 LYS H 143 GLY H 5.02 #peak 603 #SUP 0.94 #QF 0.94 41 LYS HG 42 ASP H 3.93 #peak 604 #SUP 1.00 141 LYS HG 142 ASP H 3.93 #peak 604 #SUP 1.00 41 LYS HB 42 ASP H 4.01 #peak 605 #SUP 0.99 #QF 0.99 141 LYS HB 142 ASP H 4.01 #peak 605 #SUP 0.99 #QF 0.99 42 ASP H 44 ILE H 5.36 #peak 610 #SUP 0.94 #QF 0.94 142 ASP H 144 ILE H 5.36 #peak 610 #SUP 0.94 #QF 0.94 43 GLY H 44 ILE HG2 6.30 #peak 612 #SUP 0.99 #QF 0.99 143 GLY H 144 ILE HG2 6.30 #peak 612 #SUP 0.99 #QF 0.99 43 GLY H 44 ILE HG13 5.45 #peak 613 #SUP 0.98 #QF 0.98 143 GLY H 144 ILE HG13 5.45 #peak 613 #SUP 0.98 #QF 0.98 40 ALA HB 43 GLY H 5.34 #peak 614 #SUP 0.99 #QF 0.92 140 ALA HB 143 GLY H 5.34 #peak 614 #SUP 0.99 #QF 0.92 41 LYS HG 43 GLY H 5.96 #peak 614 #SUP 0.99 #QF 0.92 141 LYS HG 143 GLY H 5.96 #peak 614 #SUP 0.99 #QF 0.92 41 LYS HB 43 GLY H 5.66 #peak 615 #SUP 0.98 #QF 0.98 141 LYS HB 143 GLY H 5.66 #peak 615 #SUP 0.98 #QF 0.98 42 ASP HB2 43 GLY H 5.33 #peak 618 #SUP 0.99 #QF 0.99 142 ASP HB2 143 GLY H 5.33 #peak 618 #SUP 0.99 #QF 0.99 42 ASP HB3 43 GLY H 5.33 #peak 619 #SUP 1.00 142 ASP HB3 143 GLY H 5.33 #peak 619 #SUP 1.00 44 ILE H 44 ILE HG2 3.98 #peak 625 #SUP 1.00 144 ILE H 144 ILE HG2 3.98 #peak 625 #SUP 1.00 44 ILE H 44 ILE HG13 3.76 #peak 627 #SUP 1.00 144 ILE H 144 ILE HG13 3.76 #peak 627 #SUP 1.00 41 LYS HB 44 ILE H 6.50 #peak 630 #SUP 0.97 #QF 0.97 141 LYS HB 144 ILE H 6.50 #peak 630 #SUP 0.97 #QF 0.97 44 ILE H 44 ILE HB 3.50 #peak 631 #SUP 1.00 144 ILE H 144 ILE HB 3.50 #peak 631 #SUP 1.00 42 ASP HB2 44 ILE H 5.83 #peak 632 #SUP 0.98 #QF 0.98 142 ASP HB2 144 ILE H 5.83 #peak 632 #SUP 0.98 #QF 0.98 40 ALA HA 44 ILE H 5.28 #peak 636 #SUP 0.98 #QF 0.98 140 ALA HA 144 ILE H 5.28 #peak 636 #SUP 0.98 #QF 0.98 44 ILE H 45 PHE HA 5.67 #peak 637 #SUP 1.00 144 ILE H 145 PHE HA 5.67 #peak 637 #SUP 1.00 41 LYS H 44 ILE H 3.95 #peak 639 #SUP 1.00 141 LYS H 144 ILE H 3.95 #peak 639 #SUP 1.00 43 GLY H 44 ILE H 3.53 #peak 640 #SUP 0.99 #QF 0.99 143 GLY H 144 ILE H 3.53 #peak 640 #SUP 0.99 #QF 0.99 44 ILE H 45 PHE H 4.64 #peak 641 #SUP 1.00 144 ILE H 145 PHE H 4.64 #peak 641 #SUP 1.00 41 LYS HG 44 ILE H 6.31 #peak 642 #SUP 1.00 #QF 0.33 141 LYS HG 144 ILE H 6.31 #peak 642 #SUP 1.00 #QF 0.33 45 PHE H 46 THR HG2 5.97 #peak 644 #SUP 1.00 145 PHE H 146 THR HG2 5.97 #peak 644 #SUP 1.00 40 ALA HB 45 PHE H 5.54 #peak 645 #SUP 1.00 140 ALA HB 145 PHE H 5.54 #peak 645 #SUP 1.00 44 ILE HB 45 PHE H 3.79 #peak 647 #SUP 1.00 144 ILE HB 145 PHE H 3.79 #peak 647 #SUP 1.00 13 GLU HG 45 PHE H 6.50 #peak 648 #SUP 0.92 #QF 0.25 113 GLU HG 145 PHE H 6.50 #peak 648 #SUP 0.92 #QF 0.25 11 VAL HA 45 PHE H 5.19 #peak 652 #SUP 0.97 #QF 0.97 111 VAL HA 145 PHE H 5.19 #peak 652 #SUP 0.97 #QF 0.97 44 ILE HA 45 PHE H 3.43 #peak 653 #SUP 0.99 #QF 0.99 144 ILE HA 145 PHE H 3.43 #peak 653 #SUP 0.99 #QF 0.99 12 GLY H 45 PHE H 4.18 #peak 656 #SUP 0.99 #QF 0.99 112 GLY H 145 PHE H 4.18 #peak 656 #SUP 0.99 #QF 0.99 14 ASP H 45 PHE H 4.91 #peak 657 #SUP 0.98 #QF 0.48 114 ASP H 145 PHE H 4.91 #peak 657 #SUP 0.98 #QF 0.48 38 LEU HD2 46 THR H 5.44 #peak 658 #SUP 0.98 #QF 0.98 138 LEU HD2 146 THR H 5.44 #peak 658 #SUP 0.98 #QF 0.98 38 LEU HD1 46 THR H 5.97 #peak 659 #SUP 1.00 138 LEU HD1 146 THR H 5.97 #peak 659 #SUP 1.00 11 VAL HG2 46 THR H 4.59 #peak 660 #SUP 0.98 #QF 0.98 111 VAL HG2 146 THR H 4.59 #peak 660 #SUP 0.98 #QF 0.98 40 ALA HB 46 THR H 4.91 #peak 662 #SUP 1.00 140 ALA HB 146 THR H 4.91 #peak 662 #SUP 1.00 38 LEU HG 46 THR H 5.47 #peak 663 #SUP 1.00 138 LEU HG 146 THR H 5.47 #peak 663 #SUP 1.00 45 PHE HB2 46 THR H 4.45 #peak 664 #SUP 0.99 #QF 0.99 145 PHE HB2 146 THR H 4.45 #peak 664 #SUP 0.99 #QF 0.99 39 ASN HB 46 THR H 4.96 #peak 665 #SUP 0.99 #QF 0.99 139 ASN HB 146 THR H 4.96 #peak 665 #SUP 0.99 #QF 0.99 45 PHE HB3 46 THR H 4.45 #peak 666 #SUP 1.00 145 PHE HB3 146 THR H 4.45 #peak 666 #SUP 1.00 40 ALA HA 46 THR H 4.18 #peak 669 #SUP 0.98 #QF 0.98 140 ALA HA 146 THR H 4.18 #peak 669 #SUP 0.98 #QF 0.98 45 PHE HA 46 THR H 3.50 #peak 670 #SUP 0.99 #QF 0.99 145 PHE HA 146 THR H 3.50 #peak 670 #SUP 0.99 #QF 0.99 39 ASN H 46 THR H 3.97 #peak 672 #SUP 0.98 #QF 0.98 139 ASN H 146 THR H 3.97 #peak 672 #SUP 0.98 #QF 0.98 46 THR H 47 CYS H 5.12 #peak 673 #SUP 0.94 #QF 0.94 146 THR H 147 CYS H 5.12 #peak 673 #SUP 0.94 #QF 0.94 22 ILE HG2 47 CYS H 5.65 #peak 674 #SUP 1.00 #QF 0.95 122 ILE HG2 147 CYS H 5.65 #peak 674 #SUP 1.00 #QF 0.95 11 VAL HG2 47 CYS H 4.38 #peak 675 #SUP 0.99 #QF 0.99 111 VAL HG2 147 CYS H 4.38 #peak 675 #SUP 0.99 #QF 0.99 10 ILE HG2 47 CYS H 5.10 #peak 676 #SUP 1.00 110 ILE HG2 147 CYS H 5.10 #peak 676 #SUP 1.00 10 ILE HB 47 CYS H 4.79 #peak 678 #SUP 0.99 #QF 0.99 110 ILE HB 147 CYS H 4.79 #peak 678 #SUP 0.99 #QF 0.99 38 LEU HB 47 CYS H 6.21 #peak 679 #SUP 1.00 #QF 0.91 138 LEU HB 147 CYS H 6.21 #peak 679 #SUP 1.00 #QF 0.91 38 LEU HG 47 CYS H 6.44 #peak 679 #SUP 1.00 #QF 0.91 138 LEU HG 147 CYS H 6.44 #peak 679 #SUP 1.00 #QF 0.91 11 VAL HA 47 CYS H 4.77 #peak 683 #SUP 0.98 #QF 0.98 111 VAL HA 147 CYS H 4.77 #peak 683 #SUP 0.98 #QF 0.98 45 PHE HD 47 CYS H 5.24 #peak 686 #SUP 1.00 145 PHE HD 147 CYS H 5.24 #peak 686 #SUP 1.00 45 PHE HZ 47 CYS H 5.79 #peak 687 #SUP 0.99 #QF 0.99 145 PHE HZ 147 CYS H 5.79 #peak 687 #SUP 0.99 #QF 0.99 45 PHE HE 47 CYS H 5.59 #peak 688 #SUP 1.00 145 PHE HE 147 CYS H 5.59 #peak 688 #SUP 1.00 10 ILE H 47 CYS H 4.32 #peak 691 #SUP 0.99 #QF 0.99 110 ILE H 147 CYS H 4.32 #peak 691 #SUP 0.99 #QF 0.99 36 ILE HD1 48 ASN H 5.17 #peak 692 #SUP 0.88 #QF 0.88 136 ILE HD1 148 ASN H 5.17 #peak 692 #SUP 0.88 #QF 0.88 37 VAL HG1 48 ASN H 4.65 #peak 693 #SUP 1.00 137 VAL HG1 148 ASN H 4.65 #peak 693 #SUP 1.00 47 CYS HG 48 ASN H 4.79 #peak 694 #SUP 0.72 #QF 0.72 147 CYS HG 148 ASN H 4.79 #peak 694 #SUP 0.72 #QF 0.72 47 CYS HA 48 ASN H 3.56 #peak 698 #SUP 0.99 #QF 0.99 147 CYS HA 148 ASN H 3.56 #peak 698 #SUP 0.99 #QF 0.99 47 CYS H 48 ASN H 5.16 #peak 701 #SUP 1.00 147 CYS H 148 ASN H 5.16 #peak 701 #SUP 1.00 48 ASN HD21 78 LEU HD2 5.18 #peak 702 #SUP 1.00 148 ASN HD21 178 LEU HD2 5.18 #peak 702 #SUP 1.00 37 VAL HB 48 ASN HD21 5.62 #peak 705 #SUP 1.00 137 VAL HB 148 ASN HD21 5.62 #peak 705 #SUP 1.00 48 ASN HA 48 ASN HD21 6.05 #peak 709 #SUP 1.00 #QF 0.78 148 ASN HA 148 ASN HD21 6.05 #peak 709 #SUP 1.00 #QF 0.78 48 ASN HD22 78 LEU HD1 4.66 #peak 711 #SUP 1.00 148 ASN HD22 178 LEU HD1 4.66 #peak 711 #SUP 1.00 37 VAL HG1 48 ASN HD22 5.63 #peak 712 #SUP 0.99 #QF 0.99 137 VAL HG1 148 ASN HD22 5.63 #peak 712 #SUP 0.99 #QF 0.99 37 VAL HB 48 ASN HD22 5.62 #peak 714 #SUP 0.99 #QF 0.99 137 VAL HB 148 ASN HD22 5.62 #peak 714 #SUP 0.99 #QF 0.99 48 ASN HA 48 ASN HD22 6.05 #peak 718 #SUP 1.00 #QF 0.69 148 ASN HA 148 ASN HD22 6.05 #peak 718 #SUP 1.00 #QF 0.69 8 ILE HD1 49 LEU H 5.95 #peak 720 #SUP 0.89 #QF 0.70 108 ILE HD1 149 LEU H 5.95 #peak 720 #SUP 0.89 #QF 0.70 26 ILE HD1 49 LEU H 6.34 #peak 720 #SUP 0.89 #QF 0.70 126 ILE HD1 149 LEU H 6.34 #peak 720 #SUP 0.89 #QF 0.70 49 LEU H 78 LEU HD1 4.24 #peak 721 #SUP 0.83 #QF 0.23 149 LEU H 178 LEU HD1 4.24 #peak 721 #SUP 0.83 #QF 0.23 10 ILE HG13 49 LEU H 5.85 #peak 723 #SUP 0.93 #QF 0.87 110 ILE HG13 149 LEU H 5.85 #peak 723 #SUP 0.93 #QF 0.87 8 ILE HB 49 LEU H 4.63 #peak 725 #SUP 0.97 #QF 0.86 108 ILE HB 149 LEU H 4.63 #peak 725 #SUP 0.97 #QF 0.86 49 LEU H 49 LEU HG 5.24 #peak 725 #SUP 0.97 #QF 0.86 149 LEU H 149 LEU HG 5.24 #peak 725 #SUP 0.97 #QF 0.86 49 LEU H 49 LEU HB3 4.07 #peak 726 #SUP 1.00 149 LEU H 149 LEU HB3 4.07 #peak 726 #SUP 1.00 48 ASN HB3 49 LEU H 5.19 #peak 727 #SUP 1.00 148 ASN HB3 149 LEU H 5.19 #peak 727 #SUP 1.00 48 ASN HB2 49 LEU H 5.19 #peak 728 #SUP 0.96 #QF 0.96 148 ASN HB2 149 LEU H 5.19 #peak 728 #SUP 0.96 #QF 0.96 48 ASN HA 49 LEU H 3.36 #peak 730 #SUP 0.93 #QF 0.93 148 ASN HA 149 LEU H 3.36 #peak 730 #SUP 0.93 #QF 0.93 49 LEU HB2 50 MET H 4.37 #peak 733 #SUP 0.85 #QF 0.85 149 LEU HB2 150 MET H 4.37 #peak 733 #SUP 0.85 #QF 0.85 49 LEU H 50 MET H 4.88 #peak 739 #SUP 0.99 #QF 0.99 149 LEU H 150 MET H 4.88 #peak 739 #SUP 0.99 #QF 0.99 51 ILE H 51 ILE HG13 4.08 #peak 743 #SUP 0.98 #QF 0.98 151 ILE H 151 ILE HG13 4.08 #peak 743 #SUP 0.98 #QF 0.98 6 ALA HB 51 ILE H 4.40 #peak 744 #SUP 1.00 #QF 0.70 106 ALA HB 151 ILE H 4.40 #peak 744 #SUP 1.00 #QF 0.70 51 ILE H 51 ILE HG12 4.62 #peak 744 #SUP 1.00 #QF 0.70 151 ILE H 151 ILE HG12 4.62 #peak 744 #SUP 1.00 #QF 0.70 50 MET HB3 51 ILE H 5.30 #peak 746 #SUP 1.00 #QF 0.98 150 MET HB3 151 ILE H 5.30 #peak 746 #SUP 1.00 #QF 0.98 50 MET HB2 51 ILE H 5.30 #peak 747 #SUP 0.91 #QF 0.91 150 MET HB2 151 ILE H 5.30 #peak 747 #SUP 0.91 #QF 0.91 50 MET HG2 51 ILE H 5.44 #peak 748 #SUP 1.00 150 MET HG2 151 ILE H 5.44 #peak 748 #SUP 1.00 7 GLY HA3 51 ILE H 5.43 #peak 750 #SUP 0.96 #QF 0.96 107 GLY HA3 151 ILE H 5.43 #peak 750 #SUP 0.96 #QF 0.96 33 ILE HA 51 ILE H 6.12 #peak 751 #SUP 0.99 #QF 0.99 133 ILE HA 151 ILE H 6.12 #peak 751 #SUP 0.99 #QF 0.99 5 LEU HA 51 ILE H 5.47 #peak 752 #SUP 0.92 #QF 0.92 105 LEU HA 151 ILE H 5.47 #peak 752 #SUP 0.92 #QF 0.92 50 MET HA 51 ILE H 3.47 #peak 754 #SUP 0.98 #QF 0.98 150 MET HA 151 ILE H 3.47 #peak 754 #SUP 0.98 #QF 0.98 6 ALA H 51 ILE H 4.30 #peak 756 #SUP 0.99 #QF 0.99 106 ALA H 151 ILE H 4.30 #peak 756 #SUP 0.99 #QF 0.99 51 ILE HG12 52 PHE H 4.98 #peak 759 #SUP 0.99 #QF 0.99 151 ILE HG12 152 PHE H 4.98 #peak 759 #SUP 0.99 #QF 0.99 33 ILE HA 52 PHE H 5.80 #peak 764 #SUP 0.98 #QF 0.98 133 ILE HA 152 PHE H 5.80 #peak 764 #SUP 0.98 #QF 0.98 34 ARG H 52 PHE H 5.26 #peak 768 #SUP 0.99 #QF 0.22 134 ARG H 152 PHE H 5.26 #peak 768 #SUP 0.99 #QF 0.22 51 ILE H 52 PHE H 5.58 #peak 769 #SUP 1.00 151 ILE H 152 PHE H 5.58 #peak 769 #SUP 1.00 6 ALA HB 53 VAL H 4.87 #peak 772 #SUP 0.97 #QF 0.97 106 ALA HB 153 VAL H 4.87 #peak 772 #SUP 0.97 #QF 0.97 3 ASP HB3 53 VAL H 5.34 #peak 774 #SUP 1.00 103 ASP HB3 153 VAL H 5.34 #peak 774 #SUP 1.00 52 PHE HB2 53 VAL H 4.70 #peak 776 #SUP 1.00 152 PHE HB2 153 VAL H 4.70 #peak 776 #SUP 1.00 52 PHE HB3 53 VAL H 4.70 #peak 777 #SUP 1.00 152 PHE HB3 153 VAL H 4.70 #peak 777 #SUP 1.00 5 LEU HA 53 VAL H 4.55 #peak 778 #SUP 0.99 #QF 0.99 105 LEU HA 153 VAL H 4.55 #peak 778 #SUP 0.99 #QF 0.99 4 PHE HA 53 VAL H 5.60 #peak 781 #SUP 1.00 104 PHE HA 153 VAL H 5.60 #peak 781 #SUP 1.00 52 PHE HA 53 VAL H 3.36 #peak 782 #SUP 0.98 #QF 0.98 152 PHE HA 153 VAL H 3.36 #peak 782 #SUP 0.98 #QF 0.98 52 PHE H 53 VAL H 5.04 #peak 785 #SUP 1.00 152 PHE H 153 VAL H 5.04 #peak 785 #SUP 1.00 53 VAL H 54 LYS H 5.37 #peak 785 #SUP 1.00 153 VAL H 154 LYS H 5.37 #peak 785 #SUP 1.00 6 ALA H 53 VAL H 4.96 #peak 787 #SUP 0.99 #QF 0.99 106 ALA H 153 VAL H 4.96 #peak 787 #SUP 0.99 #QF 0.99 54 LYS H 54 LYS HG2 4.61 #peak 790 #SUP 0.88 #QF 0.74 154 LYS H 154 LYS HG2 4.61 #peak 790 #SUP 0.88 #QF 0.74 53 VAL HB 54 LYS H 3.51 #peak 791 #SUP 1.00 #QF 0.90 153 VAL HB 154 LYS H 3.51 #peak 791 #SUP 1.00 #QF 0.90 55 ASN H 56 THR HG2 6.05 #peak 797 #SUP 0.90 #QF 0.90 155 ASN H 156 THR HG2 6.05 #peak 797 #SUP 0.90 #QF 0.90 53 VAL HB 55 ASN H 4.02 #peak 799 #SUP 0.98 #QF 0.95 153 VAL HB 155 ASN H 4.02 #peak 799 #SUP 0.98 #QF 0.95 55 ASN H 58 LYS HB3 5.18 #peak 800 #SUP 0.88 #QF 0.50 155 ASN H 158 LYS HB3 5.18 #peak 800 #SUP 0.88 #QF 0.50 53 VAL HA 55 ASN H 5.03 #peak 804 #SUP 1.00 153 VAL HA 155 ASN H 5.03 #peak 804 #SUP 1.00 54 LYS H 55 ASN H 4.26 #peak 806 #SUP 1.00 154 LYS H 155 ASN H 4.26 #peak 806 #SUP 1.00 54 LYS HE 55 ASN HD22 4.81 #peak 816 #SUP 0.85 #QF 0.85 154 LYS HE 155 ASN HD22 4.81 #peak 816 #SUP 0.85 #QF 0.85 57 ASP H 58 LYS HG3 6.50 #peak 823 #SUP 0.99 #QF 0.99 157 ASP H 158 LYS HG3 6.50 #peak 823 #SUP 0.99 #QF 0.99 57 ASP H 58 LYS HB2 6.50 #peak 824 #SUP 0.94 #QF 0.80 157 ASP H 158 LYS HB2 6.50 #peak 824 #SUP 0.94 #QF 0.80 57 ASP H 58 LYS HB3 6.50 #peak 824 #SUP 0.94 #QF 0.80 157 ASP H 158 LYS HB3 6.50 #peak 824 #SUP 0.94 #QF 0.80 57 ASP H 57 ASP HB 3.34 #peak 825 #SUP 0.98 #QF 0.98 157 ASP H 157 ASP HB 3.34 #peak 825 #SUP 0.98 #QF 0.98 55 ASN HB3 57 ASP H 5.08 #peak 826 #SUP 0.84 #QF 0.84 155 ASN HB3 157 ASP H 5.08 #peak 826 #SUP 0.84 #QF 0.84 55 ASN HB2 57 ASP H 5.08 #peak 827 #SUP 0.87 #QF 0.87 155 ASN HB2 157 ASP H 5.08 #peak 827 #SUP 0.87 #QF 0.87 57 ASP H 59 LEU H 5.43 #peak 831 #SUP 0.98 #QF 0.60 157 ASP H 159 LEU H 5.43 #peak 831 #SUP 0.98 #QF 0.60 56 THR H 57 ASP H 5.01 #peak 832 #SUP 0.99 #QF 0.99 156 THR H 157 ASP H 5.01 #peak 832 #SUP 0.99 #QF 0.99 53 VAL HG2 58 LYS H 4.99 #peak 834 #SUP 0.99 #QF 0.99 153 VAL HG2 158 LYS H 4.99 #peak 834 #SUP 0.99 #QF 0.99 53 VAL HG1 58 LYS H 5.68 #peak 835 #SUP 0.98 #QF 0.98 153 VAL HG1 158 LYS H 5.68 #peak 835 #SUP 0.98 #QF 0.98 58 LYS H 58 LYS HG3 4.29 #peak 837 #SUP 0.99 #QF 0.99 158 LYS H 158 LYS HG3 4.29 #peak 837 #SUP 0.99 #QF 0.99 57 ASP HB 58 LYS H 3.66 #peak 838 #SUP 0.97 #QF 0.97 157 ASP HB 158 LYS H 3.66 #peak 838 #SUP 0.97 #QF 0.97 58 LYS H 59 LEU HA 5.61 #peak 839 #SUP 0.95 #QF 0.95 158 LYS H 159 LEU HA 5.61 #peak 839 #SUP 0.95 #QF 0.95 56 THR HA 58 LYS H 5.86 #peak 840 #SUP 1.00 156 THR HA 158 LYS H 5.86 #peak 840 #SUP 1.00 58 LYS H 59 LEU H 3.82 #peak 843 #SUP 0.99 #QF 0.99 158 LYS H 159 LEU H 3.82 #peak 843 #SUP 0.99 #QF 0.99 53 VAL HG2 59 LEU H 4.89 #peak 844 #SUP 1.00 153 VAL HG2 159 LEU H 4.89 #peak 844 #SUP 1.00 53 VAL HG1 59 LEU H 5.04 #peak 845 #SUP 1.00 153 VAL HG1 159 LEU H 5.04 #peak 845 #SUP 1.00 59 LEU H 60 THR HG2 5.45 #peak 848 #SUP 0.98 #QF 0.46 159 LEU H 160 THR HG2 5.45 #peak 848 #SUP 0.98 #QF 0.46 59 LEU H 59 LEU HB3 4.13 #peak 849 #SUP 1.00 159 LEU H 159 LEU HB3 4.13 #peak 849 #SUP 1.00 58 LYS HG3 59 LEU H 4.92 #peak 850 #SUP 1.00 #QF 0.77 158 LYS HG3 159 LEU H 4.92 #peak 850 #SUP 1.00 #QF 0.77 53 VAL HB 59 LEU H 5.58 #peak 851 #SUP 1.00 153 VAL HB 159 LEU H 5.58 #peak 851 #SUP 1.00 59 LEU H 59 LEU HB2 4.13 #peak 853 #SUP 1.00 159 LEU H 159 LEU HB2 4.13 #peak 853 #SUP 1.00 57 ASP HB 59 LEU H 5.72 #peak 854 #SUP 0.99 #QF 0.99 157 ASP HB 159 LEU H 5.72 #peak 854 #SUP 0.99 #QF 0.99 56 THR HB 59 LEU H 5.57 #peak 858 #SUP 0.67 #QF 0.67 156 THR HB 159 LEU H 5.57 #peak 858 #SUP 0.67 #QF 0.67 59 LEU HD1 60 THR H 5.00 #peak 861 #SUP 1.00 159 LEU HD1 160 THR H 5.00 #peak 861 #SUP 1.00 59 LEU HD2 60 THR H 4.62 #peak 862 #SUP 0.99 #QF 0.99 159 LEU HD2 160 THR H 4.62 #peak 862 #SUP 0.99 #QF 0.99 59 LEU HB3 60 THR H 4.29 #peak 864 #SUP 1.00 159 LEU HB3 160 THR H 4.29 #peak 864 #SUP 1.00 59 LEU HG 60 THR H 4.69 #peak 865 #SUP 1.00 159 LEU HG 160 THR H 4.69 #peak 865 #SUP 1.00 60 THR H 63 MET HE 5.54 #peak 866 #SUP 0.97 #QF 0.58 160 THR H 163 MET HE 5.54 #peak 866 #SUP 0.97 #QF 0.58 59 LEU HB2 60 THR H 4.29 #peak 867 #SUP 1.00 159 LEU HB2 160 THR H 4.29 #peak 867 #SUP 1.00 57 ASP HB 60 THR H 5.68 #peak 868 #SUP 1.00 157 ASP HB 160 THR H 5.68 #peak 868 #SUP 1.00 56 THR HA 60 THR H 4.92 #peak 870 #SUP 1.00 156 THR HA 160 THR H 4.92 #peak 870 #SUP 1.00 58 LYS HA 60 THR H 5.77 #peak 871 #SUP 1.00 158 LYS HA 160 THR H 5.77 #peak 871 #SUP 1.00 59 LEU H 60 THR H 3.85 #peak 873 #SUP 1.00 159 LEU H 160 THR H 3.85 #peak 873 #SUP 1.00 58 LYS H 60 THR H 4.56 #peak 876 #SUP 0.99 #QF 0.99 158 LYS H 160 THR H 4.56 #peak 876 #SUP 0.99 #QF 0.99 60 THR HG2 61 THR H 4.18 #peak 878 #SUP 0.98 #QF 0.46 160 THR HG2 161 THR H 4.18 #peak 878 #SUP 0.98 #QF 0.46 58 LYS HG3 61 THR H 6.50 #peak 879 #SUP 0.97 #QF 0.76 158 LYS HG3 161 THR H 6.50 #peak 879 #SUP 0.97 #QF 0.76 58 LYS HD 61 THR H 6.50 #peak 879 #SUP 0.97 #QF 0.76 158 LYS HD 161 THR H 6.50 #peak 879 #SUP 0.97 #QF 0.76 58 LYS HA 61 THR H 4.68 #peak 882 #SUP 0.99 #QF 0.99 158 LYS HA 161 THR H 4.68 #peak 882 #SUP 0.99 #QF 0.99 61 THR H 61 THR HB 3.58 #peak 883 #SUP 0.99 #QF 0.99 161 THR H 161 THR HB 3.58 #peak 883 #SUP 0.99 #QF 0.99 58 LYS HZ 61 THR H 5.87 #peak 886 #SUP 0.99 #QF 0.99 158 LYS HZ 161 THR H 5.87 #peak 886 #SUP 0.99 #QF 0.99 59 LEU H 61 THR H 5.43 #peak 887 #SUP 0.94 #QF 0.94 159 LEU H 161 THR H 5.43 #peak 887 #SUP 0.94 #QF 0.94 61 THR H 62 LEU H 3.83 #peak 888 #SUP 1.00 161 THR H 162 LEU H 3.83 #peak 888 #SUP 1.00 61 THR H 63 MET H 4.49 #peak 889 #SUP 0.94 #QF 0.94 161 THR H 163 MET H 4.49 #peak 889 #SUP 0.94 #QF 0.94 60 THR H 61 THR H 3.88 #peak 890 #SUP 1.00 160 THR H 161 THR H 3.88 #peak 890 #SUP 1.00 8 ILE HD1 62 LEU H 6.32 #peak 893 #SUP 0.98 #QF 0.92 108 ILE HD1 162 LEU H 6.32 #peak 893 #SUP 0.98 #QF 0.92 59 LEU HD1 62 LEU H 4.85 #peak 894 #SUP 0.99 #QF 0.99 159 LEU HD1 162 LEU H 4.85 #peak 894 #SUP 0.99 #QF 0.99 62 LEU H 62 LEU HB2 3.91 #peak 895 #SUP 1.00 162 LEU H 162 LEU HB2 3.91 #peak 895 #SUP 1.00 62 LEU H 62 LEU HG 3.37 #peak 896 #SUP 0.88 #QF 0.88 162 LEU H 162 LEU HG 3.37 #peak 896 #SUP 0.88 #QF 0.88 62 LEU H 63 MET HG2 6.50 #peak 897 #SUP 0.98 #QF 0.30 162 LEU H 163 MET HG2 6.50 #peak 897 #SUP 0.98 #QF 0.30 62 LEU H 63 MET HG3 5.77 #peak 898 #SUP 1.00 162 LEU H 163 MET HG3 5.77 #peak 898 #SUP 1.00 59 LEU HA 62 LEU H 4.57 #peak 900 #SUP 0.99 #QF 0.99 159 LEU HA 162 LEU H 4.57 #peak 900 #SUP 0.99 #QF 0.99 58 LYS HA 62 LEU H 5.50 #peak 902 #SUP 0.99 #QF 0.99 158 LYS HA 162 LEU H 5.50 #peak 902 #SUP 0.99 #QF 0.99 61 THR HB 62 LEU H 3.86 #peak 903 #SUP 1.00 161 THR HB 162 LEU H 3.86 #peak 903 #SUP 1.00 58 LYS HZ 62 LEU H 5.25 #peak 904 #SUP 0.97 #QF 0.97 158 LYS HZ 162 LEU H 5.25 #peak 904 #SUP 0.97 #QF 0.97 59 LEU H 62 LEU H 5.51 #peak 905 #SUP 0.69 #QF 0.69 159 LEU H 162 LEU H 5.51 #peak 905 #SUP 0.69 #QF 0.69 62 LEU H 63 MET H 3.70 #peak 907 #SUP 1.00 162 LEU H 163 MET H 3.70 #peak 907 #SUP 1.00 60 THR H 62 LEU H 5.18 #peak 908 #SUP 0.99 #QF 0.99 160 THR H 162 LEU H 5.18 #peak 908 #SUP 0.99 #QF 0.99 59 LEU HD1 63 MET H 5.30 #peak 912 #SUP 1.00 #QF 0.68 159 LEU HD1 163 MET H 5.30 #peak 912 #SUP 1.00 #QF 0.68 63 MET H 66 LEU HD1 5.38 #peak 912 #SUP 1.00 #QF 0.68 163 MET H 166 LEU HD1 5.38 #peak 912 #SUP 1.00 #QF 0.68 62 LEU HB2 63 MET H 4.34 #peak 913 #SUP 1.00 162 LEU HB2 163 MET H 4.34 #peak 913 #SUP 1.00 62 LEU HB3 63 MET H 4.04 #peak 914 #SUP 0.94 #QF 0.94 162 LEU HB3 163 MET H 4.04 #peak 914 #SUP 0.94 #QF 0.94 63 MET H 63 MET HB3 3.98 #peak 916 #SUP 0.99 #QF 0.96 163 MET H 163 MET HB3 3.98 #peak 916 #SUP 0.99 #QF 0.96 63 MET H 63 MET HG2 4.20 #peak 916 #SUP 0.99 #QF 0.96 163 MET H 163 MET HG2 4.20 #peak 916 #SUP 0.99 #QF 0.96 63 MET H 63 MET HB2 3.98 #peak 917 #SUP 0.99 #QF 0.99 163 MET H 163 MET HB2 3.98 #peak 917 #SUP 0.99 #QF 0.99 63 MET H 63 MET HG3 3.79 #peak 918 #SUP 0.98 #QF 0.98 163 MET H 163 MET HG3 3.79 #peak 918 #SUP 0.98 #QF 0.98 64 ASP H 75 VAL HG1 4.71 #peak 924 #SUP 0.91 #QF 0.91 164 ASP H 175 VAL HG1 4.71 #peak 924 #SUP 0.91 #QF 0.91 61 THR HG2 64 ASP H 5.06 #peak 925 #SUP 0.84 #QF 0.84 161 THR HG2 164 ASP H 5.06 #peak 925 #SUP 0.84 #QF 0.84 64 ASP H 65 LYS HG3 5.19 #peak 926 #SUP 0.98 #QF 0.98 63 MET HB3 64 ASP H 4.21 #peak 927 #SUP 0.91 #QF 0.91 163 MET HB3 164 ASP H 4.21 #peak 927 #SUP 0.91 #QF 0.91 63 MET HB2 64 ASP H 4.21 #peak 928 #SUP 0.98 #QF 0.98 163 MET HB2 164 ASP H 4.21 #peak 928 #SUP 0.98 #QF 0.98 64 ASP H 64 ASP HB2 3.28 #peak 930 #SUP 0.98 #QF 0.98 164 ASP H 164 ASP HB2 3.28 #peak 930 #SUP 0.98 #QF 0.98 62 LEU HA 64 ASP H 5.78 #peak 931 #SUP 0.97 #QF 0.97 162 LEU HA 164 ASP H 5.78 #peak 931 #SUP 0.97 #QF 0.97 60 THR HA 64 ASP H 5.07 #peak 933 #SUP 0.86 #QF 0.86 160 THR HA 164 ASP H 5.07 #peak 933 #SUP 0.86 #QF 0.86 61 THR HA 64 ASP H 4.29 #peak 934 #SUP 0.98 #QF 0.98 161 THR HA 164 ASP H 4.29 #peak 934 #SUP 0.98 #QF 0.98 65 LYS H 65 LYS HG3 3.58 #peak 938 #SUP 1.00 165 LYS H 165 LYS HG2 4.02 #peak 938 #SUP 1.00 65 LYS H 65 LYS HB3 3.86 #peak 939 #SUP 1.00 #QF 0.99 165 LYS H 165 LYS HB3 3.86 #peak 939 #SUP 1.00 #QF 0.99 65 LYS HB3 66 LEU H 4.14 #peak 939 #SUP 1.00 #QF 0.99 165 LYS HB3 166 LEU H 4.14 #peak 939 #SUP 1.00 #QF 0.99 65 LYS H 65 LYS HB2 3.32 #peak 940 #SUP 0.98 #QF 0.93 165 LYS H 165 LYS HB2 3.32 #peak 940 #SUP 0.98 #QF 0.93 64 ASP HB2 65 LYS H 3.87 #peak 942 #SUP 0.99 #QF 0.99 164 ASP HB2 165 LYS H 3.87 #peak 942 #SUP 0.99 #QF 0.99 65 LYS H 65 LYS HE 5.79 #peak 943 #SUP 0.84 #QF 0.78 165 LYS H 165 LYS HE 5.79 #peak 943 #SUP 0.84 #QF 0.78 65 LYS H 68 LYS HE 6.47 #peak 943 #SUP 0.84 #QF 0.78 165 LYS H 168 LYS HE 6.47 #peak 943 #SUP 0.84 #QF 0.78 62 LEU HA 65 LYS H 4.34 #peak 944 #SUP 0.99 #QF 0.98 162 LEU HA 165 LYS H 4.34 #peak 944 #SUP 0.99 #QF 0.98 64 ASP H 65 LYS H 3.50 #peak 947 #SUP 1.00 164 ASP H 165 LYS H 3.50 #peak 947 #SUP 1.00 62 LEU HD2 65 LYS H 6.21 #peak 948 #SUP 1.00 #QF 0.97 162 LEU HD2 165 LYS H 6.21 #peak 948 #SUP 1.00 #QF 0.97 62 LEU HD2 66 LEU H 6.50 #peak 948 #SUP 1.00 #QF 0.97 162 LEU HD2 166 LEU H 6.50 #peak 948 #SUP 1.00 #QF 0.97 62 LEU HD1 65 LYS H 6.50 #peak 949 #SUP 0.96 #QF 0.86 162 LEU HD1 165 LYS H 6.50 #peak 949 #SUP 0.96 #QF 0.86 62 LEU HD1 66 LEU H 6.50 #peak 949 #SUP 0.96 #QF 0.86 162 LEU HD1 166 LEU H 6.50 #peak 949 #SUP 0.96 #QF 0.86 66 LEU H 66 LEU HD1 3.96 #peak 950 #SUP 1.00 166 LEU H 166 LEU HD1 3.96 #peak 950 #SUP 1.00 62 LEU HB2 65 LYS H 5.95 #peak 951 #SUP 0.98 #QF 0.68 162 LEU HB2 165 LYS H 5.95 #peak 951 #SUP 0.98 #QF 0.68 66 LEU H 69 VAL HG2 6.32 #peak 951 #SUP 0.98 #QF 0.68 166 LEU H 169 VAL HG2 6.32 #peak 951 #SUP 0.98 #QF 0.68 66 LEU H 66 LEU HB3 3.97 #peak 952 #SUP 1.00 166 LEU H 166 LEU HB3 3.97 #peak 952 #SUP 1.00 66 LEU H 66 LEU HB2 3.97 #peak 953 #SUP 0.98 #QF 0.98 166 LEU H 166 LEU HB2 3.97 #peak 953 #SUP 0.98 #QF 0.98 63 MET HA 66 LEU H 4.62 #peak 954 #SUP 0.96 #QF 0.49 163 MET HA 166 LEU H 4.62 #peak 954 #SUP 0.96 #QF 0.49 67 ARG H 75 VAL HG1 3.83 #peak 962 #SUP 0.98 #QF 0.70 167 ARG H 175 VAL HG1 3.83 #peak 962 #SUP 0.98 #QF 0.70 67 ARG H 75 VAL HG2 4.11 #peak 962 #SUP 0.98 #QF 0.70 167 ARG H 175 VAL HG2 4.11 #peak 962 #SUP 0.98 #QF 0.70 67 ARG H 69 VAL HG2 5.27 #peak 963 #SUP 0.96 #QF 0.96 167 ARG H 169 VAL HG2 5.27 #peak 963 #SUP 0.96 #QF 0.96 66 LEU HB3 67 ARG H 4.35 #peak 964 #SUP 0.99 #QF 0.99 166 LEU HB3 167 ARG H 4.35 #peak 964 #SUP 0.99 #QF 0.99 67 ARG H 67 ARG HG2 4.71 #peak 965 #SUP 0.97 #QF 0.97 167 ARG H 167 ARG HG2 4.71 #peak 965 #SUP 0.97 #QF 0.97 67 ARG H 67 ARG HB 3.22 #peak 966 #SUP 0.99 #QF 0.99 167 ARG H 167 ARG HB 3.22 #peak 966 #SUP 0.99 #QF 0.99 66 LEU HB2 67 ARG H 4.35 #peak 967 #SUP 0.99 #QF 0.99 166 LEU HB2 167 ARG H 4.35 #peak 967 #SUP 0.99 #QF 0.99 67 ARG H 67 ARG HD 4.79 #peak 969 #SUP 1.00 167 ARG H 167 ARG HD 4.79 #peak 969 #SUP 1.00 67 ARG H 68 LYS HA 5.42 #peak 972 #SUP 0.98 #QF 0.98 167 ARG H 168 LYS HA 5.42 #peak 972 #SUP 0.98 #QF 0.98 64 ASP HA 67 ARG H 4.25 #peak 973 #SUP 1.00 164 ASP HA 167 ARG H 4.25 #peak 973 #SUP 1.00 67 ARG H 67 ARG HE 5.76 #peak 976 #SUP 0.76 #QF 0.76 167 ARG H 167 ARG HE 5.76 #peak 976 #SUP 0.76 #QF 0.76 66 LEU H 67 ARG H 3.62 #peak 977 #SUP 0.99 #QF 0.99 166 LEU H 167 ARG H 3.62 #peak 977 #SUP 0.99 #QF 0.99 64 ASP H 67 ARG H 4.84 #peak 978 #SUP 0.92 #QF 0.92 164 ASP H 167 ARG H 4.84 #peak 978 #SUP 0.92 #QF 0.92 67 ARG HE 75 VAL HG2 5.28 #peak 980 #SUP 1.00 #QF 0.86 167 ARG HE 175 VAL HG2 5.28 #peak 980 #SUP 1.00 #QF 0.86 67 ARG HB 67 ARG HE 4.66 #peak 982 #SUP 1.00 #QF 0.98 167 ARG HB 167 ARG HE 4.66 #peak 982 #SUP 1.00 #QF 0.98 67 ARG HE 75 VAL HB 4.87 #peak 982 #SUP 1.00 #QF 0.98 167 ARG HE 175 VAL HB 4.87 #peak 982 #SUP 1.00 #QF 0.98 67 ARG HA 67 ARG HE 5.42 #peak 984 #SUP 0.89 #QF 0.89 167 ARG HA 167 ARG HE 5.42 #peak 984 #SUP 0.89 #QF 0.89 64 ASP HA 67 ARG HE 5.78 #peak 985 #SUP 0.97 #QF 0.97 164 ASP HA 167 ARG HE 5.78 #peak 985 #SUP 0.97 #QF 0.97 67 ARG HE 75 VAL H 5.05 #peak 988 #SUP 0.96 #QF 0.96 167 ARG HE 175 VAL H 5.05 #peak 988 #SUP 0.96 #QF 0.96 68 LYS H 75 VAL HG2 4.99 #peak 989 #SUP 0.93 #QF 0.93 168 LYS H 175 VAL HG2 4.99 #peak 989 #SUP 0.93 #QF 0.93 68 LYS H 69 VAL HG2 4.13 #peak 990 #SUP 1.00 168 LYS H 169 VAL HG2 4.13 #peak 990 #SUP 1.00 68 LYS H 68 LYS HG3 4.18 #peak 991 #SUP 0.87 #QF 0.87 168 LYS H 168 LYS HG3 4.18 #peak 991 #SUP 0.87 #QF 0.87 68 LYS H 68 LYS HB2 3.26 #peak 993 #SUP 0.99 #QF 0.99 168 LYS H 168 LYS HB2 3.26 #peak 993 #SUP 0.99 #QF 0.99 67 ARG HB 68 LYS H 3.77 #peak 994 #SUP 0.96 #QF 0.96 167 ARG HB 168 LYS H 3.77 #peak 994 #SUP 0.96 #QF 0.96 68 LYS H 68 LYS HB3 3.70 #peak 995 #SUP 1.00 168 LYS H 168 LYS HB3 3.70 #peak 995 #SUP 1.00 68 LYS H 69 VAL HB 5.65 #peak 996 #SUP 0.99 #QF 0.56 168 LYS H 169 VAL HB 5.65 #peak 996 #SUP 0.99 #QF 0.56 65 LYS HA 68 LYS H 4.24 #peak 999 #SUP 0.98 #QF 0.98 165 LYS HA 168 LYS H 4.24 #peak 999 #SUP 0.98 #QF 0.98 64 ASP HA 68 LYS H 5.20 #peak 1001 #SUP 0.99 #QF 0.99 164 ASP HA 168 LYS H 5.20 #peak 1001 #SUP 0.99 #QF 0.99 68 LYS H 69 VAL H 3.28 #peak 1002 #SUP 0.99 #QF 0.99 168 LYS H 169 VAL H 3.28 #peak 1002 #SUP 0.99 #QF 0.99 66 LEU H 68 LYS H 4.58 #peak 1003 #SUP 1.00 166 LEU H 168 LYS H 4.58 #peak 1003 #SUP 1.00 67 ARG H 68 LYS H 3.54 #peak 1004 #SUP 0.99 #QF 0.99 167 ARG H 168 LYS H 3.54 #peak 1004 #SUP 0.99 #QF 0.99 69 VAL H 69 VAL HG2 3.19 #peak 1007 #SUP 1.00 169 VAL H 169 VAL HG2 3.19 #peak 1007 #SUP 1.00 68 LYS HG3 69 VAL H 5.75 #peak 1009 #SUP 0.95 #QF 0.95 168 LYS HG3 169 VAL H 5.75 #peak 1009 #SUP 0.95 #QF 0.95 68 LYS HB2 69 VAL H 4.53 #peak 1011 #SUP 1.00 168 LYS HB2 169 VAL H 4.53 #peak 1011 #SUP 1.00 67 ARG HB 69 VAL H 4.98 #peak 1012 #SUP 0.89 #QF 0.89 167 ARG HB 169 VAL H 4.98 #peak 1012 #SUP 0.89 #QF 0.89 68 LYS HB3 69 VAL H 4.44 #peak 1013 #SUP 0.99 #QF 0.99 168 LYS HB3 169 VAL H 4.44 #peak 1013 #SUP 0.99 #QF 0.99 69 VAL H 69 VAL HB 3.27 #peak 1014 #SUP 0.98 #QF 0.98 169 VAL H 169 VAL HB 3.27 #peak 1014 #SUP 0.98 #QF 0.98 66 LEU HA 69 VAL H 4.57 #peak 1016 #SUP 1.00 166 LEU HA 169 VAL H 4.57 #peak 1016 #SUP 1.00 69 VAL H 72 VAL H 4.80 #peak 1019 #SUP 1.00 169 VAL H 172 VAL H 4.80 #peak 1019 #SUP 1.00 67 ARG H 69 VAL H 5.00 #peak 1020 #SUP 0.99 #QF 0.99 167 ARG H 169 VAL H 5.00 #peak 1020 #SUP 0.99 #QF 0.99 69 VAL H 70 GLN H 4.47 #peak 1021 #SUP 1.00 169 VAL H 170 GLN H 4.47 #peak 1021 #SUP 1.00 69 VAL HG1 70 GLN H 3.52 #peak 1022 #SUP 1.00 169 VAL HG1 170 GLN H 3.52 #peak 1022 #SUP 1.00 70 GLN H 70 GLN HB 3.04 #peak 1024 #SUP 0.98 #QF 0.98 170 GLN H 170 GLN HB 3.04 #peak 1024 #SUP 0.98 #QF 0.98 69 VAL HB 70 GLN H 4.89 #peak 1025 #SUP 0.98 #QF 0.98 169 VAL HB 170 GLN H 4.89 #peak 1025 #SUP 0.98 #QF 0.98 69 VAL HA 70 GLN H 2.95 #peak 1027 #SUP 0.95 #QF 0.95 169 VAL HA 170 GLN H 2.95 #peak 1027 #SUP 0.95 #QF 0.95 70 GLN H 72 VAL H 5.63 #peak 1030 #SUP 1.00 170 GLN H 172 VAL H 5.63 #peak 1030 #SUP 1.00 70 GLN HG 70 GLN HE21 3.92 #peak 1032 #SUP 1.00 170 GLN HG 170 GLN HE21 3.92 #peak 1032 #SUP 1.00 70 GLN HG 70 GLN HE22 3.92 #peak 1037 #SUP 1.00 170 GLN HG 170 GLN HE22 3.92 #peak 1037 #SUP 1.00 69 VAL HG1 71 GLY H 4.42 #peak 1038 #SUP 0.98 #QF 0.90 169 VAL HG1 171 GLY H 4.42 #peak 1038 #SUP 0.98 #QF 0.90 70 GLN HB 71 GLY H 3.82 #peak 1040 #SUP 0.99 #QF 0.99 170 GLN HB 171 GLY H 3.82 #peak 1040 #SUP 0.99 #QF 0.99 13 GLU HG 71 GLY H 5.54 #peak 1041 #SUP 1.00 #QF 0.99 113 GLU HG 171 GLY H 5.54 #peak 1041 #SUP 1.00 #QF 0.99 70 GLN HG 71 GLY H 3.95 #peak 1042 #SUP 0.95 #QF 0.95 170 GLN HG 171 GLY H 3.95 #peak 1042 #SUP 0.95 #QF 0.95 69 VAL HG1 72 VAL H 3.50 #peak 1047 #SUP 0.99 #QF 0.52 169 VAL HG1 172 VAL H 3.50 #peak 1047 #SUP 0.99 #QF 0.52 72 VAL H 72 VAL HG1 3.93 #peak 1048 #SUP 1.00 172 VAL H 172 VAL HG1 3.93 #peak 1048 #SUP 1.00 69 VAL HG2 72 VAL H 4.76 #peak 1049 #SUP 0.85 #QF 0.85 169 VAL HG2 172 VAL H 4.76 #peak 1049 #SUP 0.85 #QF 0.85 72 VAL H 72 VAL HB 3.19 #peak 1051 #SUP 0.95 #QF 0.95 172 VAL H 172 VAL HB 3.19 #peak 1051 #SUP 0.95 #QF 0.95 70 GLN HA 72 VAL H 4.29 #peak 1053 #SUP 0.98 #QF 0.98 170 GLN HA 172 VAL H 4.29 #peak 1053 #SUP 0.98 #QF 0.98 13 GLU H 72 VAL H 5.38 #peak 1056 #SUP 0.99 #QF 0.99 113 GLU H 172 VAL H 5.38 #peak 1056 #SUP 0.99 #QF 0.99 71 GLY H 72 VAL H 3.34 #peak 1058 #SUP 0.99 #QF 0.99 171 GLY H 172 VAL H 3.34 #peak 1058 #SUP 0.99 #QF 0.99 72 VAL H 73 PHE H 5.07 #peak 1059 #SUP 0.99 #QF 0.99 172 VAL H 173 PHE H 5.07 #peak 1059 #SUP 0.99 #QF 0.99 72 VAL HG2 73 PHE H 4.39 #peak 1061 #SUP 1.00 172 VAL HG2 173 PHE H 4.39 #peak 1061 #SUP 1.00 11 VAL HB 73 PHE H 5.69 #peak 1062 #SUP 1.00 #QF 0.95 111 VAL HB 173 PHE H 5.69 #peak 1062 #SUP 1.00 #QF 0.95 72 VAL HB 73 PHE H 5.21 #peak 1063 #SUP 0.96 #QF 0.96 172 VAL HB 173 PHE H 5.21 #peak 1063 #SUP 0.96 #QF 0.96 12 GLY HA3 73 PHE H 4.40 #peak 1066 #SUP 1.00 112 GLY HA3 173 PHE H 4.40 #peak 1066 #SUP 1.00 12 GLY HA2 73 PHE H 4.35 #peak 1067 #SUP 1.00 112 GLY HA2 173 PHE H 4.35 #peak 1067 #SUP 1.00 72 VAL HG1 74 THR H 3.72 #peak 1074 #SUP 1.00 172 VAL HG1 174 THR H 3.72 #peak 1074 #SUP 1.00 74 THR H 75 VAL HG2 3.90 #peak 1075 #SUP 0.90 #QF 0.90 174 THR H 175 VAL HG2 3.90 #peak 1075 #SUP 0.90 #QF 0.90 11 VAL HB 74 THR H 4.77 #peak 1077 #SUP 1.00 111 VAL HB 174 THR H 4.77 #peak 1077 #SUP 1.00 72 VAL HB 74 THR H 5.75 #peak 1078 #SUP 0.93 #QF 0.93 172 VAL HB 174 THR H 5.75 #peak 1078 #SUP 0.93 #QF 0.93 73 PHE HB2 74 THR H 4.18 #peak 1080 #SUP 1.00 173 PHE HB2 174 THR H 4.18 #peak 1080 #SUP 1.00 12 GLY HA2 74 THR H 4.75 #peak 1081 #SUP 0.99 #QF 0.99 112 GLY HA2 174 THR H 4.75 #peak 1081 #SUP 0.99 #QF 0.99 12 GLY HA3 74 THR H 5.42 #peak 1082 #SUP 0.99 #QF 0.99 112 GLY HA3 174 THR H 5.42 #peak 1082 #SUP 0.99 #QF 0.99 72 VAL HA 74 THR H 4.33 #peak 1083 #SUP 1.00 172 VAL HA 174 THR H 4.33 #peak 1083 #SUP 1.00 11 VAL H 74 THR H 3.83 #peak 1088 #SUP 0.99 #QF 0.99 111 VAL H 174 THR H 3.83 #peak 1088 #SUP 0.99 #QF 0.99 73 PHE H 74 THR H 3.55 #peak 1089 #SUP 0.99 #QF 0.99 173 PHE H 174 THR H 3.55 #peak 1089 #SUP 0.99 #QF 0.99 75 VAL H 75 VAL HG2 3.71 #peak 1090 #SUP 1.00 175 VAL H 175 VAL HG2 3.71 #peak 1090 #SUP 1.00 72 VAL HG1 75 VAL H 4.96 #peak 1091 #SUP 0.97 #QF 0.97 172 VAL HG1 175 VAL H 4.96 #peak 1091 #SUP 0.97 #QF 0.97 74 THR HG2 75 VAL H 4.36 #peak 1092 #SUP 0.99 #QF 0.99 174 THR HG2 175 VAL H 4.36 #peak 1092 #SUP 0.99 #QF 0.99 75 VAL H 75 VAL HB 3.82 #peak 1093 #SUP 0.98 #QF 0.98 175 VAL H 175 VAL HB 3.82 #peak 1093 #SUP 0.98 #QF 0.98 75 VAL H 76 GLU HG 5.02 #peak 1094 #SUP 0.96 #QF 0.96 175 VAL H 176 GLU HG 5.02 #peak 1094 #SUP 0.96 #QF 0.96 67 ARG HD 75 VAL H 6.18 #peak 1095 #SUP 0.93 #QF 0.93 167 ARG HD 175 VAL H 6.18 #peak 1095 #SUP 0.93 #QF 0.93 67 ARG HA 75 VAL H 6.43 #peak 1096 #SUP 0.92 #QF 0.92 167 ARG HA 175 VAL H 6.43 #peak 1096 #SUP 0.92 #QF 0.92 74 THR H 75 VAL H 4.86 #peak 1100 #SUP 1.00 174 THR H 175 VAL H 4.86 #peak 1100 #SUP 1.00 75 VAL HG1 76 GLU H 3.54 #peak 1103 #SUP 0.95 #QF 0.95 175 VAL HG1 176 GLU H 3.54 #peak 1103 #SUP 0.95 #QF 0.95 10 ILE HG2 76 GLU H 6.16 #peak 1104 #SUP 0.99 #QF 0.91 110 ILE HG2 176 GLU H 6.16 #peak 1104 #SUP 0.99 #QF 0.91 10 ILE HG13 76 GLU H 6.50 #peak 1104 #SUP 0.99 #QF 0.91 110 ILE HG13 176 GLU H 6.50 #peak 1104 #SUP 0.99 #QF 0.91 9 ARG HB 76 GLU H 4.51 #peak 1105 #SUP 0.98 #QF 0.96 109 ARG HB 176 GLU H 4.51 #peak 1105 #SUP 0.98 #QF 0.96 76 GLU H 76 GLU HB2 3.97 #peak 1106 #SUP 0.99 #QF 0.99 176 GLU H 176 GLU HB2 4.17 #peak 1106 #SUP 0.99 #QF 0.99 76 GLU H 76 GLU HB3 4.17 #peak 1107 #SUP 0.96 #QF 0.96 176 GLU H 176 GLU HB3 4.17 #peak 1107 #SUP 0.96 #QF 0.96 76 GLU H 76 GLU HG 4.11 #peak 1108 #SUP 0.99 #QF 0.99 176 GLU H 176 GLU HG 4.11 #peak 1108 #SUP 0.99 #QF 0.99 75 VAL HA 76 GLU H 3.26 #peak 1110 #SUP 1.00 #QF 0.96 175 VAL HA 176 GLU H 3.26 #peak 1110 #SUP 1.00 #QF 0.96 10 ILE HA 76 GLU H 4.57 #peak 1111 #SUP 0.98 #QF 0.98 110 ILE HA 176 GLU H 4.57 #peak 1111 #SUP 0.98 #QF 0.98 9 ARG HA 76 GLU H 5.78 #peak 1112 #SUP 1.00 109 ARG HA 176 GLU H 5.78 #peak 1112 #SUP 1.00 75 VAL H 76 GLU H 4.62 #peak 1113 #SUP 1.00 175 VAL H 176 GLU H 4.62 #peak 1113 #SUP 1.00 9 ARG H 76 GLU H 4.00 #peak 1114 #SUP 0.99 #QF 0.99 109 ARG H 176 GLU H 4.00 #peak 1114 #SUP 0.99 #QF 0.99 10 ILE H 76 GLU H 6.00 #peak 1115 #SUP 0.83 #QF 0.83 110 ILE H 176 GLU H 6.00 #peak 1115 #SUP 0.83 #QF 0.83 77 ARG H 77 ARG HB2 3.62 #peak 1116 #SUP 0.98 #QF 0.98 177 ARG H 177 ARG HB2 3.62 #peak 1116 #SUP 0.98 #QF 0.98 76 GLU HB2 77 ARG H 3.75 #peak 1117 #SUP 0.98 #QF 0.32 176 GLU HB2 177 ARG H 4.03 #peak 1117 #SUP 0.98 #QF 0.32 77 ARG H 77 ARG HB3 3.62 #peak 1117 #SUP 0.98 #QF 0.32 177 ARG H 177 ARG HB3 3.62 #peak 1117 #SUP 0.98 #QF 0.32 76 GLU HB3 77 ARG H 4.03 #peak 1118 #SUP 1.00 176 GLU HB3 177 ARG H 4.03 #peak 1118 #SUP 1.00 76 GLU HG 77 ARG H 4.57 #peak 1119 #SUP 0.89 #QF 0.89 176 GLU HG 177 ARG H 4.57 #peak 1119 #SUP 0.89 #QF 0.89 77 ARG H 77 ARG HD 4.95 #peak 1120 #SUP 1.00 177 ARG H 177 ARG HD 4.95 #peak 1120 #SUP 1.00 77 ARG H 78 LEU H 4.87 #peak 1123 #SUP 0.98 #QF 0.98 177 ARG H 178 LEU H 4.87 #peak 1123 #SUP 0.98 #QF 0.98 78 LEU H 78 LEU HD1 4.10 #peak 1127 #SUP 1.00 #QF 0.99 178 LEU H 178 LEU HD1 4.10 #peak 1127 #SUP 1.00 #QF 0.99 78 LEU H 78 LEU HB2 3.78 #peak 1128 #SUP 0.98 #QF 0.80 178 LEU H 178 LEU HB2 3.78 #peak 1128 #SUP 0.98 #QF 0.80 77 ARG HG2 78 LEU H 4.61 #peak 1130 #SUP 0.98 #QF 0.68 177 ARG HG2 178 LEU H 4.61 #peak 1130 #SUP 0.98 #QF 0.68 7 GLY HA3 78 LEU H 5.31 #peak 1132 #SUP 0.97 #QF 0.97 107 GLY HA3 178 LEU H 5.31 #peak 1132 #SUP 0.97 #QF 0.97 8 ILE HA 78 LEU H 4.16 #peak 1135 #SUP 0.99 #QF 0.99 108 ILE HA 178 LEU H 4.16 #peak 1135 #SUP 0.99 #QF 0.99 7 GLY HA2 78 LEU H 5.59 #peak 1136 #SUP 0.99 #QF 0.99 107 GLY HA2 178 LEU H 5.59 #peak 1136 #SUP 0.99 #QF 0.99 7 GLY H 78 LEU H 5.08 #peak 1137 #SUP 1.00 #QF 0.99 107 GLY H 178 LEU H 5.08 #peak 1137 #SUP 1.00 #QF 0.99 78 LEU H 79 SER H 5.70 #peak 1137 #SUP 1.00 #QF 0.99 178 LEU H 179 SER H 5.70 #peak 1137 #SUP 1.00 #QF 0.99 8 ILE H 78 LEU H 5.16 #peak 1139 #SUP 1.00 108 ILE H 178 LEU H 5.16 #peak 1139 #SUP 1.00 78 LEU HD2 79 SER H 4.56 #peak 1140 #SUP 0.95 #QF 0.95 178 LEU HD2 179 SER H 4.56 #peak 1140 #SUP 0.95 #QF 0.95 78 LEU HB2 79 SER H 5.58 #peak 1141 #SUP 0.98 #QF 0.86 178 LEU HB2 179 SER H 5.58 #peak 1141 #SUP 0.98 #QF 0.86 78 LEU HG 79 SER H 6.24 #peak 1141 #SUP 0.98 #QF 0.86 178 LEU HG 179 SER H 6.24 #peak 1141 #SUP 0.98 #QF 0.86 78 LEU HB3 79 SER H 5.25 #peak 1142 #SUP 1.00 178 LEU HB3 179 SER H 5.25 #peak 1142 #SUP 1.00 79 SER HB 80 ASN H 5.00 #peak 1147 #SUP 0.99 #QF 0.99 179 SER HB 180 ASN H 5.00 #peak 1147 #SUP 0.99 #QF 0.99 78 LEU HA 80 ASN H 5.10 #peak 1148 #SUP 1.00 #QF 0.40 178 LEU HA 180 ASN H 5.10 #peak 1148 #SUP 1.00 #QF 0.40 81 LEU H 81 LEU HD1 4.36 #peak 1160 #SUP 0.99 #QF 0.99 181 LEU H 181 LEU HD1 4.36 #peak 1160 #SUP 0.99 #QF 0.99 81 LEU H 81 LEU HB2 3.30 #peak 1161 #SUP 0.97 #QF 0.78 181 LEU H 181 LEU HB2 3.30 #peak 1161 #SUP 0.97 #QF 0.78 81 LEU H 81 LEU HG 3.53 #peak 1161 #SUP 0.97 #QF 0.78 181 LEU H 181 LEU HG 3.53 #peak 1161 #SUP 0.97 #QF 0.78 50 MET HE 81 LEU H 6.48 #peak 1162 #SUP 1.00 #QF 0.97 150 MET HE 181 LEU H 6.48 #peak 1162 #SUP 1.00 #QF 0.97 81 LEU H 82 GLU HB 6.50 #peak 1162 #SUP 1.00 #QF 0.97 181 LEU H 182 GLU HB 6.50 #peak 1162 #SUP 1.00 #QF 0.97 81 LEU HD2 82 GLU H 4.62 #peak 1167 #SUP 0.97 #QF 0.97 181 LEU HD2 182 GLU H 4.62 #peak 1167 #SUP 0.97 #QF 0.97 81 LEU HB3 82 GLU H 3.91 #peak 1168 #SUP 0.97 #QF 0.82 181 LEU HB3 182 GLU H 3.91 #peak 1168 #SUP 0.97 #QF 0.82 82 GLU H 82 GLU HB 3.47 #peak 1169 #SUP 0.97 #QF 0.60 182 GLU H 182 GLU HB 3.47 #peak 1169 #SUP 0.97 #QF 0.60 82 GLU H 82 GLU HG2 4.29 #peak 1170 #SUP 0.96 #QF 0.89 182 GLU H 182 GLU HG2 4.29 #peak 1170 #SUP 0.96 #QF 0.89 81 LEU HA 82 GLU H 3.38 #peak 1172 #SUP 0.94 #QF 0.94 181 LEU HA 182 GLU H 3.38 #peak 1172 #SUP 0.94 #QF 0.94 82 GLU H 83 HIS HD2 5.76 #peak 1173 #SUP 0.97 #QF 0.32 182 GLU H 183 HIS HD2 5.76 #peak 1173 #SUP 0.97 #QF 0.32 5 LEU H 81 LEU HD1 6.33 #peak 1177 #SUP 0.80 #QF 0.80 105 LEU H 181 LEU HD1 6.33 #peak 1177 #SUP 0.80 #QF 0.80 8 ILE H 77 ARG HA 5.78 #peak 1181 #SUP 0.91 #QF 0.91 108 ILE H 177 ARG HA 5.78 #peak 1181 #SUP 0.91 #QF 0.91 11 VAL H 75 VAL HA 4.84 #peak 1183 #SUP 0.99 #QF 0.99 111 VAL H 175 VAL HA 4.84 #peak 1183 #SUP 0.99 #QF 0.99 15 LYS H 45 PHE HE 5.54 #peak 1184 #SUP 1.00 115 LYS H 145 PHE HE 5.54 #peak 1184 #SUP 1.00 21 GLN HA 21 GLN HE21 5.51 #peak 1186 #SUP 0.99 #QF 0.99 121 GLN HA 121 GLN HE21 5.51 #peak 1186 #SUP 0.99 #QF 0.99 25 VAL HG1 28 LYS H 5.57 #peak 1188 #SUP 1.00 125 VAL HG1 128 LYS H 5.57 #peak 1188 #SUP 1.00 37 VAL H 49 LEU H 5.62 #peak 1193 #SUP 0.95 #QF 0.95 137 VAL H 149 LEU H 5.62 #peak 1193 #SUP 0.95 #QF 0.95 38 LEU HG 40 ALA H 6.41 #peak 1195 #SUP 0.98 #QF 0.43 138 LEU HG 140 ALA H 6.41 #peak 1195 #SUP 0.98 #QF 0.43 40 ALA H 41 LYS HD 6.15 #peak 1195 #SUP 0.98 #QF 0.43 140 ALA H 141 LYS HD 6.15 #peak 1195 #SUP 0.98 #QF 0.43 41 LYS HD 42 ASP H 5.59 #peak 1197 #SUP 1.00 141 LYS HD 142 ASP H 5.59 #peak 1197 #SUP 1.00 42 ASP HB3 44 ILE H 5.83 #peak 1198 #SUP 0.95 #QF 0.60 142 ASP HB3 144 ILE H 5.83 #peak 1198 #SUP 0.95 #QF 0.60 14 ASP H 44 ILE HA 4.01 #peak 1199 #SUP 0.94 #QF 0.80 114 ASP H 144 ILE HA 4.01 #peak 1199 #SUP 0.94 #QF 0.80 14 ASP HA 45 PHE H 6.24 #peak 1200 #SUP 0.98 #QF 0.98 114 ASP HA 145 PHE H 6.24 #peak 1200 #SUP 0.98 #QF 0.98 45 PHE H 45 PHE HE 5.86 #peak 1201 #SUP 1.00 145 PHE H 145 PHE HE 5.86 #peak 1201 #SUP 1.00 10 ILE HG12 47 CYS H 6.50 #peak 1202 #SUP 0.86 #QF 0.34 110 ILE HG12 147 CYS H 6.50 #peak 1202 #SUP 0.86 #QF 0.34 38 LEU HB 48 ASN H 5.72 #peak 1203 #SUP 1.00 #QF 0.97 138 LEU HB 148 ASN H 5.72 #peak 1203 #SUP 1.00 #QF 0.97 47 CYS HB2 48 ASN H 5.87 #peak 1204 #SUP 1.00 147 CYS HB2 148 ASN H 5.87 #peak 1204 #SUP 1.00 3 ASP HA 53 VAL H 5.10 #peak 1205 #SUP 0.98 #QF 0.98 103 ASP HA 153 VAL H 5.10 #peak 1205 #SUP 0.98 #QF 0.98 56 THR HG2 58 LYS H 6.03 #peak 1206 #SUP 0.98 #QF 0.95 156 THR HG2 158 LYS H 6.03 #peak 1206 #SUP 0.98 #QF 0.95 58 LYS HB2 60 THR H 6.50 #peak 1207 #SUP 0.75 #QF 0.36 158 LYS HB2 160 THR H 6.50 #peak 1207 #SUP 0.75 #QF 0.36 58 LYS HB3 60 THR H 6.50 #peak 1207 #SUP 0.75 #QF 0.36 158 LYS HB3 160 THR H 6.50 #peak 1207 #SUP 0.75 #QF 0.36 62 LEU H 63 MET HA 5.91 #peak 1208 #SUP 1.00 162 LEU H 163 MET HA 5.91 #peak 1208 #SUP 1.00 12 GLY HA3 72 VAL H 5.66 #peak 1209 #SUP 1.00 112 GLY HA3 172 VAL H 5.66 #peak 1209 #SUP 1.00 10 ILE HA 75 VAL H 6.21 #peak 1211 #SUP 0.96 #QF 0.94 110 ILE HA 175 VAL H 6.21 #peak 1211 #SUP 0.96 #QF 0.94 73 PHE HA 75 VAL H 6.50 #peak 1211 #SUP 0.96 #QF 0.94 173 PHE HA 175 VAL H 6.50 #peak 1211 #SUP 0.96 #QF 0.94 2 THR HA 2 THR HG2 3.32 #peak 1 #SUP 1.00 102 THR HA 102 THR HG2 3.32 #peak 1 #SUP 1.00 3 ASP HB2 53 VAL H 5.34 #peak 15 #SUP 1.00 103 ASP HB2 153 VAL H 5.34 #peak 15 #SUP 1.00 3 ASP HB3 54 LYS HA 5.60 #peak 16 #SUP 1.00 103 ASP HB3 154 LYS HA 5.60 #peak 16 #SUP 1.00 4 PHE HB 52 PHE HD 6.34 #peak 22 #SUP 0.98 #QF 0.94 104 PHE HB 152 PHE HD 6.34 #peak 22 #SUP 0.98 #QF 0.94 5 LEU HB3 50 MET HE 5.13 #peak 29 #SUP 0.96 #QF 0.96 105 LEU HB3 150 MET HE 5.13 #peak 29 #SUP 0.96 #QF 0.96 5 LEU HB3 52 PHE HZ 6.02 #peak 33 #SUP 1.00 105 LEU HB3 152 PHE HZ 6.02 #peak 33 #SUP 1.00 5 LEU HB3 6 ALA H 4.97 #peak 35 #SUP 1.00 105 LEU HB3 106 ALA H 4.97 #peak 35 #SUP 1.00 5 LEU HB2 6 ALA H 5.13 #peak 43 #SUP 1.00 105 LEU HB2 106 ALA H 5.13 #peak 43 #SUP 1.00 5 LEU HG 51 ILE HA 6.50 #peak 49 #SUP 0.94 #QF 0.94 105 LEU HG 151 ILE HA 6.50 #peak 49 #SUP 0.94 #QF 0.94 4 PHE HD 5 LEU HG 5.99 #peak 50 #SUP 1.00 104 PHE HD 105 LEU HG 5.99 #peak 50 #SUP 1.00 5 LEU HG 52 PHE HE 5.41 #peak 51 #SUP 0.99 #QF 0.99 105 LEU HG 152 PHE HE 5.41 #peak 51 #SUP 0.99 #QF 0.99 5 LEU H 5 LEU HG 4.70 #peak 52 #SUP 1.00 105 LEU H 105 LEU HG 4.70 #peak 52 #SUP 1.00 5 LEU HG 6 ALA H 4.77 #peak 53 #SUP 1.00 105 LEU HG 106 ALA H 4.77 #peak 53 #SUP 1.00 5 LEU HB2 5 LEU HD1 3.45 #peak 55 #SUP 1.00 #QF 0.99 105 LEU HB2 105 LEU HD1 3.45 #peak 55 #SUP 1.00 #QF 0.99 5 LEU HB3 5 LEU HD1 3.82 #peak 57 #SUP 1.00 105 LEU HB3 105 LEU HD1 3.82 #peak 57 #SUP 1.00 5 LEU HD1 50 MET HE 3.56 #peak 58 #SUP 0.95 #QF 0.95 105 LEU HD1 150 MET HE 3.56 #peak 58 #SUP 0.95 #QF 0.95 5 LEU HD1 50 MET HG2 5.20 #peak 60 #SUP 1.00 105 LEU HD1 150 MET HG2 5.20 #peak 60 #SUP 1.00 5 LEU HD1 50 MET HG3 5.45 #peak 61 #SUP 0.99 #QF 0.99 105 LEU HD1 150 MET HG3 5.45 #peak 61 #SUP 0.99 #QF 0.99 5 LEU HD1 34 ARG HD3 5.98 #peak 62 #SUP 0.86 #QF 0.86 105 LEU HD1 134 ARG HD3 5.98 #peak 62 #SUP 0.86 #QF 0.86 5 LEU HD1 34 ARG HD2 5.98 #peak 63 #SUP 1.00 #QF 0.57 105 LEU HD1 134 ARG HD2 5.98 #peak 63 #SUP 1.00 #QF 0.57 5 LEU HA 5 LEU HD1 3.44 #peak 65 #SUP 1.00 105 LEU HA 105 LEU HD1 3.44 #peak 65 #SUP 1.00 5 LEU HD1 51 ILE HA 4.71 #peak 67 #SUP 0.98 #QF 0.98 105 LEU HD1 151 ILE HA 4.71 #peak 67 #SUP 0.98 #QF 0.98 5 LEU HD1 52 PHE HA 4.38 #peak 68 #SUP 0.99 #QF 0.99 105 LEU HD1 152 PHE HA 4.38 #peak 68 #SUP 0.99 #QF 0.99 5 LEU HD1 50 MET HA 4.62 #peak 69 #SUP 1.00 #QF 0.71 105 LEU HD1 150 MET HA 4.62 #peak 69 #SUP 1.00 #QF 0.71 5 LEU HD1 52 PHE H 5.45 #peak 73 #SUP 1.00 105 LEU HD1 152 PHE H 5.45 #peak 73 #SUP 1.00 5 LEU H 5 LEU HD1 4.55 #peak 74 #SUP 1.00 105 LEU H 105 LEU HD1 4.55 #peak 74 #SUP 1.00 5 LEU HD1 34 ARG H 5.56 #peak 75 #SUP 1.00 #QF 0.96 105 LEU HD1 134 ARG H 5.56 #peak 75 #SUP 1.00 #QF 0.96 5 LEU HD1 53 VAL H 5.96 #peak 75 #SUP 1.00 #QF 0.96 105 LEU HD1 153 VAL H 5.96 #peak 75 #SUP 1.00 #QF 0.96 5 LEU HD1 51 ILE H 4.31 #peak 76 #SUP 0.98 #QF 0.98 105 LEU HD1 151 ILE H 4.31 #peak 76 #SUP 0.98 #QF 0.98 5 LEU HD1 6 ALA H 3.70 #peak 77 #SUP 0.99 #QF 0.99 105 LEU HD1 106 ALA H 3.70 #peak 77 #SUP 0.99 #QF 0.99 5 LEU HB2 5 LEU HD2 3.47 #peak 79 #SUP 1.00 105 LEU HB2 105 LEU HD2 3.47 #peak 79 #SUP 1.00 5 LEU HB3 5 LEU HD2 3.48 #peak 80 #SUP 1.00 105 LEU HB3 105 LEU HD2 3.48 #peak 80 #SUP 1.00 5 LEU HD2 50 MET HG2 6.01 #peak 82 #SUP 0.97 #QF 0.97 105 LEU HD2 150 MET HG2 6.01 #peak 82 #SUP 0.97 #QF 0.97 5 LEU HD2 83 HIS HB3 4.95 #peak 84 #SUP 0.92 #QF 0.92 105 LEU HD2 183 HIS HB3 4.95 #peak 84 #SUP 0.92 #QF 0.92 5 LEU HA 5 LEU HD2 4.23 #peak 85 #SUP 1.00 105 LEU HA 105 LEU HD2 4.23 #peak 85 #SUP 1.00 5 LEU HD2 6 ALA HA 5.94 #peak 86 #SUP 1.00 105 LEU HD2 106 ALA HA 5.94 #peak 86 #SUP 1.00 5 LEU HD2 51 ILE HA 5.72 #peak 87 #SUP 1.00 105 LEU HD2 151 ILE HA 5.72 #peak 87 #SUP 1.00 5 LEU HD2 52 PHE HA 5.58 #peak 88 #SUP 1.00 105 LEU HD2 152 PHE HA 5.58 #peak 88 #SUP 1.00 5 LEU H 5 LEU HD2 4.55 #peak 91 #SUP 1.00 105 LEU H 105 LEU HD2 4.55 #peak 91 #SUP 1.00 5 LEU HD2 6 ALA H 5.13 #peak 92 #SUP 1.00 105 LEU HD2 106 ALA H 5.13 #peak 92 #SUP 1.00 6 ALA HB 51 ILE HD1 3.88 #peak 94 #SUP 1.00 #QF 0.73 106 ALA HB 151 ILE HD1 3.88 #peak 94 #SUP 1.00 #QF 0.73 6 ALA HB 7 GLY HA3 5.60 #peak 99 #SUP 1.00 106 ALA HB 107 GLY HA3 5.60 #peak 99 #SUP 1.00 6 ALA HB 59 LEU HA 5.61 #peak 100 #SUP 1.00 106 ALA HB 159 LEU HA 5.61 #peak 100 #SUP 1.00 6 ALA HB 52 PHE HA 5.26 #peak 102 #SUP 0.98 #QF 0.71 106 ALA HB 152 PHE HA 5.26 #peak 102 #SUP 0.98 #QF 0.71 6 ALA HB 7 GLY HA2 4.69 #peak 103 #SUP 1.00 106 ALA HB 107 GLY HA2 4.69 #peak 103 #SUP 1.00 6 ALA HB 78 LEU H 6.14 #peak 106 #SUP 0.99 #QF 0.99 106 ALA HB 178 LEU H 6.14 #peak 106 #SUP 0.99 #QF 0.99 5 LEU H 6 ALA HB 6.26 #peak 107 #SUP 1.00 105 LEU H 106 ALA HB 6.26 #peak 107 #SUP 1.00 6 ALA HB 60 THR H 6.50 #peak 107 #SUP 1.00 106 ALA HB 160 THR H 6.50 #peak 107 #SUP 1.00 6 ALA HB 7 GLY H 3.57 #peak 108 #SUP 1.00 106 ALA HB 107 GLY H 3.57 #peak 108 #SUP 1.00 6 ALA H 6 ALA HB 3.54 #peak 109 #SUP 1.00 106 ALA H 106 ALA HB 3.54 #peak 109 #SUP 1.00 7 GLY HA3 78 LEU HB2 4.89 #peak 117 #SUP 1.00 #QF 0.97 107 GLY HA3 178 LEU HB2 4.89 #peak 117 #SUP 1.00 #QF 0.97 7 GLY HA2 8 ILE HB 5.30 #peak 127 #SUP 0.96 #QF 0.96 107 GLY HA2 108 ILE HB 5.30 #peak 127 #SUP 0.96 #QF 0.96 8 ILE H 8 ILE HB 3.93 #peak 128 #SUP 0.99 #QF 0.99 108 ILE H 108 ILE HB 3.93 #peak 128 #SUP 0.99 #QF 0.99 8 ILE HG12 77 ARG HA 5.50 #peak 132 #SUP 0.99 #QF 0.99 108 ILE HG12 177 ARG HA 5.50 #peak 132 #SUP 0.99 #QF 0.99 8 ILE H 8 ILE HG12 4.46 #peak 135 #SUP 1.00 108 ILE H 108 ILE HG12 4.46 #peak 135 #SUP 1.00 8 ILE HG13 77 ARG HA 5.50 #peak 140 #SUP 0.99 #QF 0.99 108 ILE HG13 177 ARG HA 5.50 #peak 140 #SUP 0.99 #QF 0.99 8 ILE HG2 10 ILE HG12 3.35 #peak 146 #SUP 0.78 #QF 0.78 108 ILE HG2 110 ILE HG12 3.35 #peak 146 #SUP 0.78 #QF 0.78 8 ILE HG2 63 MET HG2 4.50 #peak 147 #SUP 0.99 #QF 0.23 108 ILE HG2 163 MET HG2 4.50 #peak 147 #SUP 0.99 #QF 0.23 8 ILE HG2 63 MET HG3 4.28 #peak 149 #SUP 0.96 #QF 0.96 108 ILE HG2 163 MET HG3 4.28 #peak 149 #SUP 0.96 #QF 0.96 8 ILE HG2 77 ARG HD 6.18 #peak 150 #SUP 0.99 #QF 0.99 108 ILE HG2 177 ARG HD 6.18 #peak 150 #SUP 0.99 #QF 0.99 8 ILE HG2 77 ARG HA 4.12 #peak 151 #SUP 0.99 #QF 0.99 108 ILE HG2 177 ARG HA 4.12 #peak 151 #SUP 0.99 #QF 0.99 8 ILE HG2 9 ARG HA 4.45 #peak 153 #SUP 0.99 #QF 0.99 108 ILE HG2 109 ARG HA 4.45 #peak 153 #SUP 0.99 #QF 0.99 8 ILE HG2 63 MET H 5.11 #peak 154 #SUP 1.00 #QF 0.89 108 ILE HG2 163 MET H 5.11 #peak 154 #SUP 1.00 #QF 0.89 8 ILE HG2 78 LEU H 5.59 #peak 154 #SUP 1.00 #QF 0.89 108 ILE HG2 178 LEU H 5.59 #peak 154 #SUP 1.00 #QF 0.89 7 GLY H 8 ILE HG2 6.50 #peak 155 #SUP 0.99 #QF 0.62 107 GLY H 108 ILE HG2 6.50 #peak 155 #SUP 0.99 #QF 0.62 8 ILE HG2 11 VAL H 6.50 #peak 155 #SUP 0.99 #QF 0.62 108 ILE HG2 111 VAL H 6.50 #peak 155 #SUP 0.99 #QF 0.62 8 ILE HG2 75 VAL H 6.50 #peak 155 #SUP 0.99 #QF 0.62 108 ILE HG2 175 VAL H 6.50 #peak 155 #SUP 0.99 #QF 0.62 8 ILE HG2 9 ARG H 3.35 #peak 156 #SUP 0.97 #QF 0.97 108 ILE HG2 109 ARG H 3.35 #peak 156 #SUP 0.97 #QF 0.97 8 ILE HD1 62 LEU HD2 3.99 #peak 157 #SUP 0.96 #QF 0.96 108 ILE HD1 162 LEU HD2 3.99 #peak 157 #SUP 0.96 #QF 0.96 8 ILE HD1 62 LEU HD1 3.64 #peak 158 #SUP 0.90 #QF 0.90 108 ILE HD1 162 LEU HD1 3.64 #peak 158 #SUP 0.90 #QF 0.90 26 ILE HD1 49 LEU HB2 3.53 #peak 159 #SUP 0.71 #QF 0.59 126 ILE HD1 149 LEU HB2 3.53 #peak 159 #SUP 0.71 #QF 0.59 8 ILE HB 8 ILE HD1 3.23 #peak 160 #SUP 1.00 #QF 0.80 108 ILE HB 108 ILE HD1 3.23 #peak 160 #SUP 1.00 #QF 0.80 33 ILE HB 33 ILE HD1 3.47 #peak 161 #SUP 1.00 #QF 0.99 133 ILE HB 133 ILE HD1 3.47 #peak 161 #SUP 1.00 #QF 0.99 8 ILE HD1 63 MET HG2 4.70 #peak 162 #SUP 0.99 #QF 0.85 108 ILE HD1 163 MET HG2 4.70 #peak 162 #SUP 0.99 #QF 0.85 8 ILE HD1 63 MET HG3 4.10 #peak 164 #SUP 0.99 #QF 0.53 108 ILE HD1 163 MET HG3 4.10 #peak 164 #SUP 0.99 #QF 0.53 23 THR HA 26 ILE HD1 3.74 #peak 165 #SUP 0.91 #QF 0.91 123 THR HA 126 ILE HD1 3.74 #peak 165 #SUP 0.91 #QF 0.91 8 ILE HD1 77 ARG HA 5.04 #peak 166 #SUP 0.93 #QF 0.93 108 ILE HD1 177 ARG HA 5.04 #peak 166 #SUP 0.93 #QF 0.93 8 ILE HA 8 ILE HD1 4.36 #peak 167 #SUP 0.98 #QF 0.98 108 ILE HA 108 ILE HD1 4.36 #peak 167 #SUP 0.98 #QF 0.98 26 ILE HD1 27 SER H 4.92 #peak 168 #SUP 0.94 #QF 0.49 126 ILE HD1 127 SER H 4.92 #peak 168 #SUP 0.94 #QF 0.49 24 GLY H 26 ILE HD1 5.90 #peak 169 #SUP 0.97 #QF 0.94 124 GLY H 126 ILE HD1 5.90 #peak 169 #SUP 0.97 #QF 0.94 24 GLY H 133 ILE HD1 6.39 #peak 169 #SUP 0.97 #QF 0.94 33 ILE HD1 124 GLY H 6.39 #peak 169 #SUP 0.97 #QF 0.94 8 ILE HD1 63 MET H 4.62 #peak 170 #SUP 0.98 #QF 0.98 108 ILE HD1 163 MET H 4.62 #peak 170 #SUP 0.98 #QF 0.98 8 ILE H 8 ILE HD1 4.32 #peak 171 #SUP 1.00 108 ILE H 108 ILE HD1 4.32 #peak 171 #SUP 1.00 9 ARG HA 10 ILE HD1 5.31 #peak 173 #SUP 0.99 #QF 0.77 109 ARG HA 110 ILE HD1 5.31 #peak 173 #SUP 0.99 #QF 0.77 9 ARG HA 11 VAL HG2 5.76 #peak 173 #SUP 0.99 #QF 0.77 109 ARG HA 111 VAL HG2 5.76 #peak 173 #SUP 0.99 #QF 0.77 9 ARG HA 47 CYS H 5.55 #peak 179 #SUP 0.90 #QF 0.90 109 ARG HA 147 CYS H 5.55 #peak 179 #SUP 0.90 #QF 0.90 9 ARG HG3 10 ILE H 4.89 #peak 195 #SUP 0.98 #QF 0.98 109 ARG HG3 110 ILE H 4.89 #peak 195 #SUP 0.98 #QF 0.98 9 ARG HB 9 ARG HD 3.50 #peak 199 #SUP 1.00 #QF 0.98 109 ARG HB 109 ARG HD 3.50 #peak 199 #SUP 1.00 #QF 0.98 9 ARG HD 76 GLU HB2 6.18 #peak 200 #SUP 0.89 #QF 0.89 9 ARG HD 11 VAL HB 5.62 #peak 201 #SUP 0.75 #QF 0.75 109 ARG HD 111 VAL HB 5.62 #peak 201 #SUP 0.75 #QF 0.75 9 ARG HD 76 GLU HG 6.39 #peak 202 #SUP 0.90 #QF 0.90 109 ARG HD 176 GLU HG 6.39 #peak 202 #SUP 0.90 #QF 0.90 9 ARG HA 9 ARG HD 4.91 #peak 203 #SUP 1.00 109 ARG HA 109 ARG HD 4.91 #peak 203 #SUP 1.00 9 ARG HD 46 THR HG1 5.27 #peak 203 #SUP 1.00 109 ARG HD 146 THR HG1 5.27 #peak 203 #SUP 1.00 9 ARG HD 10 ILE H 5.35 #peak 207 #SUP 0.96 #QF 0.96 109 ARG HD 110 ILE H 5.35 #peak 207 #SUP 0.96 #QF 0.96 10 ILE HB 22 ILE HG2 5.28 #peak 208 #SUP 0.99 #QF 0.98 110 ILE HB 122 ILE HG2 5.28 #peak 208 #SUP 0.99 #QF 0.98 9 ARG HA 10 ILE HB 5.57 #peak 213 #SUP 1.00 #QF 0.99 109 ARG HA 110 ILE HB 5.57 #peak 213 #SUP 1.00 #QF 0.99 10 ILE HB 48 ASN HA 6.10 #peak 213 #SUP 1.00 #QF 0.99 110 ILE HB 148 ASN HA 6.10 #peak 213 #SUP 1.00 #QF 0.99 9 ARG HA 10 ILE HG12 6.07 #peak 220 #SUP 1.00 109 ARG HA 110 ILE HG12 6.07 #peak 220 #SUP 1.00 10 ILE HG12 11 VAL H 4.98 #peak 221 #SUP 0.99 #QF 0.99 110 ILE HG12 111 VAL H 4.98 #peak 221 #SUP 0.99 #QF 0.99 9 ARG H 10 ILE HG12 5.89 #peak 222 #SUP 0.97 #QF 0.97 109 ARG H 110 ILE HG12 5.89 #peak 222 #SUP 0.97 #QF 0.97 10 ILE H 10 ILE HG12 4.73 #peak 223 #SUP 1.00 110 ILE H 110 ILE HG12 4.73 #peak 223 #SUP 1.00 10 ILE HG13 47 CYS HB2 5.86 #peak 227 #SUP 0.93 #QF 0.93 110 ILE HG13 147 CYS HB2 5.86 #peak 227 #SUP 0.93 #QF 0.93 10 ILE HG13 47 CYS HB3 5.57 #peak 228 #SUP 0.92 #QF 0.92 110 ILE HG13 147 CYS HB3 5.57 #peak 228 #SUP 0.92 #QF 0.92 10 ILE HG13 75 VAL HA 5.71 #peak 229 #SUP 1.00 110 ILE HG13 175 VAL HA 5.71 #peak 229 #SUP 1.00 9 ARG HA 10 ILE HG13 5.83 #peak 231 #SUP 1.00 #QF 0.99 109 ARG HA 110 ILE HG13 5.83 #peak 231 #SUP 1.00 #QF 0.99 10 ILE HG13 45 PHE HE 6.50 #peak 232 #SUP 0.98 #QF 0.98 110 ILE HG13 145 PHE HE 6.50 #peak 232 #SUP 0.98 #QF 0.98 10 ILE HG13 11 VAL H 5.54 #peak 233 #SUP 0.97 #QF 0.97 110 ILE HG13 111 VAL H 5.54 #peak 233 #SUP 0.97 #QF 0.97 10 ILE HG12 75 VAL HA 5.09 #peak 235 #SUP 0.96 #QF 0.96 110 ILE HG12 175 VAL HA 5.09 #peak 235 #SUP 0.96 #QF 0.96 10 ILE HG2 18 MET HE 4.49 #peak 238 #SUP 0.97 #QF 0.97 110 ILE HG2 118 MET HE 4.49 #peak 238 #SUP 0.97 #QF 0.97 10 ILE HG2 72 VAL HB 5.03 #peak 240 #SUP 0.97 #QF 0.97 110 ILE HG2 172 VAL HB 5.03 #peak 240 #SUP 0.97 #QF 0.97 10 ILE HG2 47 CYS HB2 5.42 #peak 241 #SUP 1.00 110 ILE HG2 147 CYS HB2 5.42 #peak 241 #SUP 1.00 10 ILE HG2 47 CYS HB3 4.61 #peak 242 #SUP 0.87 #QF 0.87 110 ILE HG2 147 CYS HB3 4.61 #peak 242 #SUP 0.87 #QF 0.87 10 ILE HG2 72 VAL HA 4.79 #peak 243 #SUP 1.00 110 ILE HG2 172 VAL HA 4.79 #peak 243 #SUP 1.00 10 ILE HG2 22 ILE HA 5.67 #peak 244 #SUP 0.98 #QF 0.94 110 ILE HG2 122 ILE HA 5.67 #peak 244 #SUP 0.98 #QF 0.94 10 ILE HG2 67 ARG HA 6.21 #peak 244 #SUP 0.98 #QF 0.94 110 ILE HG2 167 ARG HA 6.21 #peak 244 #SUP 0.98 #QF 0.94 10 ILE HG2 75 VAL HA 4.48 #peak 245 #SUP 0.98 #QF 0.98 110 ILE HG2 175 VAL HA 4.48 #peak 245 #SUP 0.98 #QF 0.98 9 ARG HA 10 ILE HG2 5.50 #peak 247 #SUP 1.00 109 ARG HA 110 ILE HG2 5.50 #peak 247 #SUP 1.00 10 ILE HG2 72 VAL H 5.62 #peak 250 #SUP 0.84 #QF 0.84 110 ILE HG2 172 VAL H 5.62 #peak 250 #SUP 0.84 #QF 0.84 10 ILE HG2 74 THR H 4.86 #peak 251 #SUP 0.98 #QF 0.98 110 ILE HG2 174 THR H 4.86 #peak 251 #SUP 0.98 #QF 0.98 10 ILE H 10 ILE HG2 4.31 #peak 253 #SUP 1.00 110 ILE H 110 ILE HG2 4.31 #peak 253 #SUP 1.00 10 ILE HD1 22 ILE HG2 2.93 #peak 255 #SUP 0.71 #QF 0.71 110 ILE HD1 122 ILE HG2 2.93 #peak 255 #SUP 0.71 #QF 0.71 8 ILE HB 10 ILE HD1 4.08 #peak 256 #SUP 0.92 #QF 0.92 108 ILE HB 110 ILE HD1 4.08 #peak 256 #SUP 0.92 #QF 0.92 10 ILE HB 10 ILE HD1 3.46 #peak 258 #SUP 1.00 110 ILE HB 110 ILE HD1 3.46 #peak 258 #SUP 1.00 10 ILE HD1 47 CYS HB2 4.82 #peak 260 #SUP 1.00 110 ILE HD1 147 CYS HB2 4.82 #peak 260 #SUP 1.00 10 ILE HD1 47 CYS HB3 3.93 #peak 261 #SUP 0.99 #QF 0.99 110 ILE HD1 147 CYS HB3 3.93 #peak 261 #SUP 0.99 #QF 0.99 10 ILE HD1 22 ILE HA 5.93 #peak 262 #SUP 0.93 #QF 0.86 110 ILE HD1 122 ILE HA 5.93 #peak 262 #SUP 0.93 #QF 0.86 10 ILE HD1 63 MET HA 6.50 #peak 262 #SUP 0.93 #QF 0.86 110 ILE HD1 163 MET HA 6.50 #peak 262 #SUP 0.93 #QF 0.86 10 ILE HD1 66 LEU HA 5.55 #peak 263 #SUP 0.93 #QF 0.93 110 ILE HD1 166 LEU HA 5.55 #peak 263 #SUP 0.93 #QF 0.93 10 ILE HD1 75 VAL HA 5.48 #peak 264 #SUP 0.98 #QF 0.98 110 ILE HD1 175 VAL HA 5.48 #peak 264 #SUP 0.98 #QF 0.98 10 ILE HA 10 ILE HD1 4.37 #peak 265 #SUP 1.00 110 ILE HA 110 ILE HD1 4.37 #peak 265 #SUP 1.00 10 ILE HD1 45 PHE HZ 5.90 #peak 267 #SUP 1.00 110 ILE HD1 145 PHE HZ 5.90 #peak 267 #SUP 1.00 10 ILE HD1 45 PHE HE 4.94 #peak 268 #SUP 1.00 110 ILE HD1 145 PHE HE 4.94 #peak 268 #SUP 1.00 10 ILE HD1 29 PHE HZ 5.78 #peak 269 #SUP 0.70 #QF 0.70 110 ILE HD1 129 PHE HZ 5.78 #peak 269 #SUP 0.70 #QF 0.70 10 ILE HD1 66 LEU H 6.05 #peak 270 #SUP 0.92 #QF 0.92 110 ILE HD1 166 LEU H 6.05 #peak 270 #SUP 0.92 #QF 0.92 10 ILE HD1 11 VAL H 5.46 #peak 271 #SUP 0.98 #QF 0.98 110 ILE HD1 111 VAL H 5.46 #peak 271 #SUP 0.98 #QF 0.98 8 ILE H 10 ILE HD1 6.38 #peak 272 #SUP 0.97 #QF 0.41 108 ILE H 110 ILE HD1 6.38 #peak 272 #SUP 0.97 #QF 0.41 9 ARG H 10 ILE HD1 6.50 #peak 272 #SUP 0.97 #QF 0.41 109 ARG H 110 ILE HD1 6.50 #peak 272 #SUP 0.97 #QF 0.41 10 ILE HD1 48 ASN H 6.50 #peak 272 #SUP 0.97 #QF 0.41 110 ILE HD1 148 ASN H 6.50 #peak 272 #SUP 0.97 #QF 0.41 10 ILE H 10 ILE HD1 4.38 #peak 273 #SUP 0.99 #QF 0.98 110 ILE H 110 ILE HD1 4.38 #peak 273 #SUP 0.99 #QF 0.98 10 ILE HD1 49 LEU H 4.72 #peak 273 #SUP 0.99 #QF 0.98 110 ILE HD1 149 LEU H 4.72 #peak 273 #SUP 0.99 #QF 0.98 10 ILE HD1 47 CYS H 4.96 #peak 274 #SUP 0.99 #QF 0.99 110 ILE HD1 147 CYS H 4.96 #peak 274 #SUP 0.99 #QF 0.99 10 ILE HA 11 VAL HB 5.40 #peak 279 #SUP 1.00 #QF 0.97 110 ILE HA 111 VAL HB 5.40 #peak 279 #SUP 1.00 #QF 0.97 11 VAL HB 46 THR HA 5.92 #peak 279 #SUP 1.00 #QF 0.97 111 VAL HB 146 THR HA 5.92 #peak 279 #SUP 1.00 #QF 0.97 11 VAL HB 73 PHE HD 5.81 #peak 280 #SUP 0.95 #QF 0.95 111 VAL HB 173 PHE HD 5.81 #peak 280 #SUP 0.95 #QF 0.95 11 VAL HG2 46 THR HG2 3.45 #peak 284 #SUP 0.99 #QF 0.99 111 VAL HG2 146 THR HG2 3.45 #peak 284 #SUP 0.99 #QF 0.99 9 ARG HD 11 VAL HG2 4.11 #peak 288 #SUP 0.99 #QF 0.99 109 ARG HD 111 VAL HG2 4.11 #peak 288 #SUP 0.99 #QF 0.99 11 VAL HG2 46 THR HB 3.93 #peak 289 #SUP 0.80 #QF 0.80 111 VAL HG2 146 THR HB 3.93 #peak 289 #SUP 0.80 #QF 0.80 11 VAL HA 11 VAL HG2 3.38 #peak 290 #SUP 1.00 111 VAL HA 111 VAL HG2 3.38 #peak 290 #SUP 1.00 11 VAL HG2 40 ALA HA 6.50 #peak 292 #SUP 0.96 #QF 0.96 111 VAL HG2 140 ALA HA 6.50 #peak 292 #SUP 0.96 #QF 0.96 11 VAL HG2 46 THR HG1 5.25 #peak 293 #SUP 1.00 111 VAL HG2 146 THR HG1 5.25 #peak 293 #SUP 1.00 11 VAL HG2 45 PHE HE 5.98 #peak 294 #SUP 0.95 #QF 0.95 111 VAL HG2 145 PHE HE 5.98 #peak 294 #SUP 0.95 #QF 0.95 11 VAL HG2 73 PHE HD 6.20 #peak 295 #SUP 1.00 111 VAL HG2 173 PHE HD 6.20 #peak 295 #SUP 1.00 11 VAL HG2 12 GLY H 4.40 #peak 297 #SUP 1.00 111 VAL HG2 112 GLY H 4.40 #peak 297 #SUP 1.00 11 VAL HG2 74 THR H 5.99 #peak 298 #SUP 0.99 #QF 0.99 111 VAL HG2 174 THR H 5.99 #peak 298 #SUP 0.99 #QF 0.99 11 VAL HG1 41 LYS HE 5.08 #peak 304 #SUP 0.66 #QF 0.66 111 VAL HG1 141 LYS HE 5.08 #peak 304 #SUP 0.66 #QF 0.66 11 VAL HG1 73 PHE HB2 5.47 #peak 305 #SUP 1.00 111 VAL HG1 173 PHE HB2 5.47 #peak 305 #SUP 1.00 11 VAL HG1 12 GLY HA3 6.42 #peak 306 #SUP 1.00 111 VAL HG1 112 GLY HA3 6.42 #peak 306 #SUP 1.00 11 VAL HG1 12 GLY HA2 6.00 #peak 307 #SUP 1.00 111 VAL HG1 112 GLY HA2 6.00 #peak 307 #SUP 1.00 11 VAL HG1 46 THR HB 5.81 #peak 308 #SUP 1.00 #QF 0.93 111 VAL HG1 146 THR HB 5.81 #peak 308 #SUP 1.00 #QF 0.93 11 VAL HG1 74 THR HB 6.50 #peak 308 #SUP 1.00 #QF 0.93 111 VAL HG1 174 THR HB 6.50 #peak 308 #SUP 1.00 #QF 0.93 11 VAL HA 11 VAL HG1 3.44 #peak 309 #SUP 1.00 111 VAL HA 111 VAL HG1 3.44 #peak 309 #SUP 1.00 11 VAL HG1 46 THR HA 4.02 #peak 310 #SUP 0.99 #QF 0.99 111 VAL HG1 146 THR HA 4.02 #peak 310 #SUP 0.99 #QF 0.99 11 VAL HG1 73 PHE HD 3.81 #peak 311 #SUP 0.92 #QF 0.92 111 VAL HG1 173 PHE HD 3.81 #peak 311 #SUP 0.92 #QF 0.92 11 VAL HG1 73 PHE HE 4.24 #peak 312 #SUP 0.99 #QF 0.94 111 VAL HG1 173 PHE HE 4.24 #peak 312 #SUP 0.99 #QF 0.94 11 VAL HG1 12 GLY H 3.59 #peak 313 #SUP 0.86 #QF 0.86 111 VAL HG1 112 GLY H 3.59 #peak 313 #SUP 0.86 #QF 0.86 11 VAL HG1 74 THR H 4.93 #peak 314 #SUP 0.99 #QF 0.99 111 VAL HG1 174 THR H 4.93 #peak 314 #SUP 0.99 #QF 0.99 11 VAL HG1 44 ILE H 6.01 #peak 315 #SUP 0.29 #QF 0.29 111 VAL HG1 144 ILE H 6.01 #peak 315 #SUP 0.29 #QF 0.29 11 VAL H 11 VAL HG1 4.60 #peak 316 #SUP 1.00 111 VAL H 111 VAL HG1 4.60 #peak 316 #SUP 1.00 12 GLY HA3 69 VAL HG1 5.27 #peak 317 #SUP 0.92 #QF 0.92 112 GLY HA3 169 VAL HG1 5.27 #peak 317 #SUP 0.92 #QF 0.92 12 GLY HA2 72 VAL HG1 5.53 #peak 323 #SUP 1.00 112 GLY HA2 172 VAL HG1 5.53 #peak 323 #SUP 1.00 12 GLY HA2 72 VAL HA 4.82 #peak 325 #SUP 1.00 112 GLY HA2 172 VAL HA 4.82 #peak 325 #SUP 1.00 13 GLU HB3 44 ILE HD1 5.94 #peak 329 #SUP 0.94 #QF 0.94 113 GLU HB3 144 ILE HD1 5.94 #peak 329 #SUP 0.94 #QF 0.94 13 GLU HB3 15 LYS HG 5.16 #peak 330 #SUP 1.00 113 GLU HB3 115 LYS HG 5.16 #peak 330 #SUP 1.00 13 GLU HB3 15 LYS HD 5.53 #peak 331 #SUP 0.99 #QF 0.99 113 GLU HB3 115 LYS HD 5.53 #peak 331 #SUP 0.99 #QF 0.99 13 GLU HB3 71 GLY HA3 5.86 #peak 333 #SUP 1.00 113 GLU HB3 171 GLY HA3 5.86 #peak 333 #SUP 1.00 13 GLU HB3 71 GLY HA2 5.51 #peak 335 #SUP 0.99 #QF 0.99 113 GLU HB3 171 GLY HA2 5.51 #peak 335 #SUP 0.99 #QF 0.99 13 GLU HB3 44 ILE HA 5.80 #peak 336 #SUP 0.99 #QF 0.99 113 GLU HB3 144 ILE HA 5.80 #peak 336 #SUP 0.99 #QF 0.99 13 GLU HB2 15 LYS HD 4.76 #peak 340 #SUP 1.00 113 GLU HB2 115 LYS HD 4.76 #peak 340 #SUP 1.00 12 GLY HA2 13 GLU HB2 6.24 #peak 342 #SUP 0.99 #QF 0.99 112 GLY HA2 113 GLU HB2 6.24 #peak 342 #SUP 0.99 #QF 0.99 13 GLU HB2 71 GLY HA3 6.50 #peak 343 #SUP 1.00 113 GLU HB2 171 GLY HA3 6.50 #peak 343 #SUP 1.00 13 GLU HB2 15 LYS HA 6.35 #peak 345 #SUP 0.98 #QF 0.43 113 GLU HB2 115 LYS HA 6.35 #peak 345 #SUP 0.98 #QF 0.43 13 GLU HB2 71 GLY HA2 6.50 #peak 345 #SUP 0.98 #QF 0.43 113 GLU HB2 171 GLY HA2 6.50 #peak 345 #SUP 0.98 #QF 0.43 13 GLU HB2 44 ILE HA 5.37 #peak 346 #SUP 1.00 113 GLU HB2 144 ILE HA 5.37 #peak 346 #SUP 1.00 13 GLU HB2 73 PHE HE 4.24 #peak 347 #SUP 1.00 113 GLU HB2 173 PHE HE 4.24 #peak 347 #SUP 1.00 13 GLU HG 44 ILE HG2 5.29 #peak 349 #SUP 1.00 #QF 0.97 113 GLU HG 144 ILE HG2 5.29 #peak 349 #SUP 1.00 #QF 0.97 13 GLU HG 72 VAL HG2 5.86 #peak 349 #SUP 1.00 #QF 0.97 113 GLU HG 172 VAL HG2 5.86 #peak 349 #SUP 1.00 #QF 0.97 13 GLU HG 69 VAL HG1 5.18 #peak 350 #SUP 0.63 #QF 0.63 113 GLU HG 169 VAL HG1 5.18 #peak 350 #SUP 0.63 #QF 0.63 13 GLU HG 15 LYS HD 4.13 #peak 352 #SUP 1.00 113 GLU HG 115 LYS HD 4.13 #peak 352 #SUP 1.00 13 GLU HG 15 LYS HE 5.35 #peak 356 #SUP 0.99 #QF 0.99 113 GLU HG 115 LYS HE 5.35 #peak 356 #SUP 0.99 #QF 0.99 12 GLY HA3 13 GLU HG 5.61 #peak 357 #SUP 1.00 112 GLY HA3 113 GLU HG 5.61 #peak 357 #SUP 1.00 13 GLU HG 71 GLY HA3 4.36 #peak 358 #SUP 0.99 #QF 0.99 113 GLU HG 171 GLY HA3 4.36 #peak 358 #SUP 0.99 #QF 0.99 13 GLU HG 71 GLY HA2 4.38 #peak 360 #SUP 0.97 #QF 0.97 113 GLU HG 171 GLY HA2 4.38 #peak 360 #SUP 0.97 #QF 0.97 13 GLU HG 14 ASP HA 6.01 #peak 361 #SUP 1.00 113 GLU HG 114 ASP HA 6.01 #peak 361 #SUP 1.00 13 GLU HG 44 ILE HA 5.94 #peak 362 #SUP 1.00 113 GLU HG 144 ILE HA 5.94 #peak 362 #SUP 1.00 13 GLU HG 45 PHE HE 5.75 #peak 363 #SUP 0.98 #QF 0.98 113 GLU HG 145 PHE HE 5.75 #peak 363 #SUP 0.98 #QF 0.98 13 GLU HG 73 PHE HD 5.73 #peak 364 #SUP 0.98 #QF 0.98 113 GLU HG 173 PHE HD 5.73 #peak 364 #SUP 0.98 #QF 0.98 14 ASP HB2 44 ILE HA 5.81 #peak 373 #SUP 0.98 #QF 0.98 114 ASP HB2 144 ILE HA 5.81 #peak 373 #SUP 0.98 #QF 0.98 14 ASP HB3 43 GLY HA2 5.69 #peak 379 #SUP 1.00 114 ASP HB3 143 GLY HA2 5.69 #peak 379 #SUP 1.00 14 ASP HB3 44 ILE HA 5.81 #peak 381 #SUP 0.98 #QF 0.98 114 ASP HB3 144 ILE HA 5.81 #peak 381 #SUP 0.98 #QF 0.98 13 GLU HG 15 LYS HB2 5.03 #peak 386 #SUP 1.00 113 GLU HG 115 LYS HB2 4.63 #peak 386 #SUP 1.00 115 LYS HB2 118 MET HB2 6.07 #peak 387 #SUP 0.84 #QF 0.52 15 LYS HB2 16 ASN H 5.51 #peak 390 #SUP 1.00 115 LYS HB2 116 ASN H 5.44 #peak 390 #SUP 1.00 13 GLU HG 15 LYS HB3 5.03 #peak 395 #SUP 1.00 113 GLU HG 115 LYS HB3 5.03 #peak 395 #SUP 1.00 115 LYS HB3 116 ASN HB2 5.60 #peak 397 #SUP 1.00 115 LYS HB3 115 LYS HE 4.79 #peak 398 #SUP 0.99 #QF 0.99 114 ASP HA 115 LYS HB3 5.96 #peak 400 #SUP 1.00 15 LYS HG 18 MET HE 5.61 #peak 404 #SUP 0.96 #QF 0.67 115 LYS HG 118 MET HE 5.61 #peak 404 #SUP 0.96 #QF 0.67 13 GLU HB2 15 LYS HG 4.20 #peak 405 #SUP 1.00 113 GLU HB2 115 LYS HG 4.20 #peak 405 #SUP 1.00 13 GLU HG 15 LYS HG 4.07 #peak 406 #SUP 1.00 113 GLU HG 115 LYS HG 4.07 #peak 406 #SUP 1.00 14 ASP H 15 LYS HG 5.47 #peak 412 #SUP 1.00 114 ASP H 115 LYS HG 5.47 #peak 412 #SUP 1.00 15 LYS HG 15 LYS HD 2.81 #peak 413 #SUP 0.92 #QF 0.92 115 LYS HG 115 LYS HD 2.81 #peak 413 #SUP 0.92 #QF 0.92 15 LYS HA 15 LYS HD 4.92 #peak 415 #SUP 1.00 115 LYS HA 115 LYS HD 4.92 #peak 415 #SUP 1.00 15 LYS HD 71 GLY HA2 5.46 #peak 415 #SUP 1.00 115 LYS HD 171 GLY HA2 5.46 #peak 415 #SUP 1.00 11 VAL HG2 41 LYS HE 4.73 #peak 417 #SUP 0.62 #QF 0.38 111 VAL HG2 141 LYS HE 4.73 #peak 417 #SUP 0.62 #QF 0.38 41 LYS HE 44 ILE HD1 5.26 #peak 417 #SUP 0.62 #QF 0.38 141 LYS HE 144 ILE HD1 5.26 #peak 417 #SUP 0.62 #QF 0.38 25 VAL HG2 65 LYS HE 6.50 #peak 418 #SUP 0.76 #QF 0.50 125 VAL HG2 165 LYS HE 6.50 #peak 418 #SUP 0.76 #QF 0.50 68 LYS HE 69 VAL HG2 6.50 #peak 418 #SUP 0.76 #QF 0.50 168 LYS HE 169 VAL HG2 6.50 #peak 418 #SUP 0.76 #QF 0.50 15 LYS HG 15 LYS HE 2.86 #peak 419 #SUP 1.00 #QF 0.84 115 LYS HG 115 LYS HE 2.86 #peak 419 #SUP 1.00 #QF 0.84 41 LYS HG 41 LYS HE 3.02 #peak 419 #SUP 1.00 #QF 0.84 141 LYS HG 141 LYS HE 3.02 #peak 419 #SUP 1.00 #QF 0.84 41 LYS HA 41 LYS HE 6.12 #peak 420 #SUP 0.97 #QF 0.24 141 LYS HA 141 LYS HE 6.12 #peak 420 #SUP 0.97 #QF 0.24 64 ASP HA 68 LYS HE 6.24 #peak 420 #SUP 0.97 #QF 0.24 164 ASP HA 168 LYS HE 6.24 #peak 420 #SUP 0.97 #QF 0.24 15 LYS HA 15 LYS HE 4.98 #peak 421 #SUP 0.91 #QF 0.88 115 LYS HA 115 LYS HE 4.98 #peak 421 #SUP 0.91 #QF 0.88 29 PHE HA 65 LYS HE 5.58 #peak 421 #SUP 0.91 #QF 0.88 129 PHE HA 165 LYS HE 5.58 #peak 421 #SUP 0.91 #QF 0.88 16 ASN HB2 17 GLY H 4.55 #peak 434 #SUP 0.97 #QF 0.97 116 ASN HB2 117 GLY H 4.55 #peak 434 #SUP 0.97 #QF 0.97 115 LYS HB3 116 ASN HB3 5.60 #peak 437 #SUP 0.98 #QF 0.98 16 ASN HB3 17 GLY H 4.55 #peak 441 #SUP 0.97 #QF 0.97 116 ASN HB3 117 GLY H 4.55 #peak 441 #SUP 0.97 #QF 0.97 16 ASN HA 17 GLY HA2 5.26 #peak 444 #SUP 1.00 #QF 0.95 116 ASN HA 117 GLY HA2 5.26 #peak 444 #SUP 1.00 #QF 0.95 17 GLY HA2 18 MET HA 5.64 #peak 444 #SUP 1.00 #QF 0.95 117 GLY HA2 118 MET HA 5.64 #peak 444 #SUP 1.00 #QF 0.95 16 ASN HA 17 GLY HA3 5.26 #peak 448 #SUP 1.00 #QF 0.86 116 ASN HA 117 GLY HA3 5.26 #peak 448 #SUP 1.00 #QF 0.86 17 GLY HA3 18 MET HA 5.64 #peak 448 #SUP 1.00 #QF 0.86 117 GLY HA3 118 MET HA 5.64 #peak 448 #SUP 1.00 #QF 0.86 18 MET HA 21 GLN HG2 3.96 #peak 453 #SUP 0.99 #QF 0.91 118 MET HA 121 GLN HG2 3.96 #peak 453 #SUP 0.99 #QF 0.91 18 MET HA 21 GLN HA 5.46 #peak 456 #SUP 1.00 118 MET HA 121 GLN HA 5.46 #peak 456 #SUP 1.00 114 ASP HA 118 MET HB3 5.54 #peak 463 #SUP 0.89 #QF 0.89 118 MET HB2 145 PHE HD 5.79 #peak 470 #SUP 0.92 #QF 0.92 17 GLY H 18 MET HG3 5.96 #peak 489 #SUP 1.00 #QF 0.48 117 GLY H 118 MET HG3 5.96 #peak 489 #SUP 1.00 #QF 0.48 18 MET HE 69 VAL HG2 4.92 #peak 496 #SUP 1.00 #QF 0.88 118 MET HE 169 VAL HG2 4.92 #peak 496 #SUP 1.00 #QF 0.88 18 MET HE 22 ILE HG12 3.90 #peak 497 #SUP 0.84 #QF 0.84 118 MET HE 122 ILE HG12 3.90 #peak 497 #SUP 0.84 #QF 0.84 118 MET HB2 118 MET HE 3.62 #peak 498 #SUP 0.99 #QF 0.90 18 MET HG3 18 MET HE 3.91 #peak 498 #SUP 0.99 #QF 0.90 118 MET HG3 118 MET HE 3.91 #peak 498 #SUP 0.99 #QF 0.90 18 MET HG2 18 MET HE 3.91 #peak 499 #SUP 1.00 118 MET HG2 118 MET HE 3.91 #peak 499 #SUP 1.00 12 GLY HA3 18 MET HE 4.63 #peak 500 #SUP 1.00 112 GLY HA3 118 MET HE 4.63 #peak 500 #SUP 1.00 18 MET HE 71 GLY HA3 3.50 #peak 501 #SUP 0.99 #QF 0.96 118 MET HE 171 GLY HA3 3.50 #peak 501 #SUP 0.99 #QF 0.96 18 MET HA 18 MET HE 4.05 #peak 503 #SUP 0.99 #QF 0.99 118 MET HA 118 MET HE 4.05 #peak 503 #SUP 0.99 #QF 0.99 18 MET HE 71 GLY HA2 3.60 #peak 504 #SUP 0.98 #QF 0.98 118 MET HE 171 GLY HA2 3.60 #peak 504 #SUP 0.98 #QF 0.98 18 MET HE 45 PHE HZ 3.68 #peak 506 #SUP 0.99 #QF 0.99 118 MET HE 145 PHE HZ 3.68 #peak 506 #SUP 0.99 #QF 0.99 18 MET HE 45 PHE HE 3.32 #peak 507 #SUP 0.99 #QF 0.99 118 MET HE 145 PHE HE 3.32 #peak 507 #SUP 0.99 #QF 0.99 18 MET HE 72 VAL H 3.79 #peak 510 #SUP 0.99 #QF 0.99 118 MET HE 172 VAL H 3.79 #peak 510 #SUP 0.99 #QF 0.99 13 GLU H 18 MET HE 4.20 #peak 512 #SUP 0.99 #QF 0.99 113 GLU H 118 MET HE 4.20 #peak 512 #SUP 0.99 #QF 0.99 18 MET HE 21 GLN H 6.50 #peak 513 #SUP 1.00 118 MET HE 121 GLN H 6.50 #peak 513 #SUP 1.00 18 MET HE 70 GLN H 5.55 #peak 514 #SUP 1.00 118 MET HE 170 GLN H 5.55 #peak 514 #SUP 1.00 18 MET HE 71 GLY H 3.76 #peak 515 #SUP 0.97 #QF 0.97 118 MET HE 171 GLY H 3.76 #peak 515 #SUP 0.97 #QF 0.97 18 MET HE 73 PHE H 5.58 #peak 516 #SUP 1.00 118 MET HE 173 PHE H 5.58 #peak 516 #SUP 1.00 19 THR HA 38 LEU HD1 3.85 #peak 517 #SUP 1.00 #QF 0.76 119 THR HA 138 LEU HD1 3.85 #peak 517 #SUP 1.00 #QF 0.76 19 THR HB 38 LEU HD1 4.16 #peak 523 #SUP 1.00 #QF 0.93 119 THR HB 138 LEU HD1 4.16 #peak 523 #SUP 1.00 #QF 0.93 33 ILE HB 119 THR HB 4.61 #peak 526 #SUP 0.99 #QF 0.99 19 THR HB 133 ILE HB 4.61 #peak 526 #SUP 0.99 #QF 0.99 33 ILE HB 119 THR HG2 4.98 #peak 529 #SUP 0.99 #QF 0.99 19 THR HG2 133 ILE HB 4.98 #peak 529 #SUP 0.99 #QF 0.99 19 THR HG2 45 PHE HB2 4.37 #peak 530 #SUP 0.99 #QF 0.54 119 THR HG2 145 PHE HB2 4.37 #peak 530 #SUP 0.99 #QF 0.54 19 THR HG2 45 PHE HB3 4.37 #peak 531 #SUP 1.00 119 THR HG2 145 PHE HB3 4.37 #peak 531 #SUP 1.00 19 THR HA 19 THR HG2 3.45 #peak 532 #SUP 1.00 119 THR HA 119 THR HG2 3.45 #peak 532 #SUP 1.00 72 VAL HA 72 VAL HG2 3.68 #peak 533 #SUP 0.99 #QF 0.96 172 VAL HA 172 VAL HG2 3.68 #peak 533 #SUP 0.99 #QF 0.96 19 THR HG2 19 THR HG1 3.68 #peak 534 #SUP 1.00 119 THR HG2 119 THR HG1 3.68 #peak 534 #SUP 1.00 18 MET H 19 THR HG2 4.98 #peak 536 #SUP 1.00 #QF 0.57 118 MET H 119 THR HG2 4.98 #peak 536 #SUP 1.00 #QF 0.57 72 VAL HG2 74 THR H 5.75 #peak 536 #SUP 1.00 #QF 0.57 172 VAL HG2 174 THR H 5.75 #peak 536 #SUP 1.00 #QF 0.57 20 ASN HA 23 THR H 5.47 #peak 541 #SUP 0.92 #QF 0.92 120 ASN HA 123 THR H 5.47 #peak 541 #SUP 0.92 #QF 0.92 33 ILE HD1 120 ASN HB3 5.60 #peak 551 #SUP 1.00 #QF 0.79 20 ASN HB3 133 ILE HD1 5.60 #peak 551 #SUP 1.00 #QF 0.79 27 SER HA 120 ASN HB3 5.61 #peak 553 #SUP 0.99 #QF 0.99 20 ASN HB3 127 SER HA 5.61 #peak 553 #SUP 0.99 #QF 0.99 21 GLN HB3 69 VAL HG1 5.87 #peak 566 #SUP 0.98 #QF 0.98 121 GLN HB3 169 VAL HG1 5.87 #peak 566 #SUP 0.98 #QF 0.98 21 GLN HB3 22 ILE H 4.35 #peak 574 #SUP 1.00 121 GLN HB3 122 ILE H 4.35 #peak 574 #SUP 1.00 21 GLN HB2 69 VAL HG1 5.54 #peak 575 #SUP 0.99 #QF 0.99 121 GLN HB2 169 VAL HG1 5.54 #peak 575 #SUP 0.99 #QF 0.99 21 GLN HB2 22 ILE HD1 5.62 #peak 576 #SUP 0.59 #QF 0.59 121 GLN HB2 122 ILE HD1 5.62 #peak 576 #SUP 0.59 #QF 0.59 21 GLN HB2 25 VAL HG2 5.34 #peak 577 #SUP 1.00 121 GLN HB2 125 VAL HG2 5.34 #peak 577 #SUP 1.00 20 ASN H 21 GLN HB2 6.03 #peak 580 #SUP 0.95 #QF 0.95 120 ASN H 121 GLN HB2 6.03 #peak 580 #SUP 0.95 #QF 0.95 21 GLN HG2 69 VAL HG1 4.39 #peak 583 #SUP 0.99 #QF 0.99 121 GLN HG2 169 VAL HG1 4.39 #peak 583 #SUP 0.99 #QF 0.99 21 GLN HG2 25 VAL HG2 5.24 #peak 584 #SUP 1.00 #QF 0.97 121 GLN HG2 125 VAL HG2 5.24 #peak 584 #SUP 1.00 #QF 0.97 21 GLN HG2 69 VAL HG2 5.64 #peak 584 #SUP 1.00 #QF 0.97 121 GLN HG2 169 VAL HG2 5.64 #peak 584 #SUP 1.00 #QF 0.97 21 GLN HG2 22 ILE HA 5.11 #peak 586 #SUP 0.99 #QF 0.99 121 GLN HG2 122 ILE HA 5.11 #peak 586 #SUP 0.99 #QF 0.99 21 GLN HA 21 GLN HG2 3.99 #peak 587 #SUP 1.00 121 GLN HA 121 GLN HG2 3.99 #peak 587 #SUP 1.00 18 MET H 21 GLN HG2 5.80 #peak 591 #SUP 1.00 #QF 0.75 118 MET H 121 GLN HG2 5.80 #peak 591 #SUP 1.00 #QF 0.75 21 GLN H 21 GLN HG2 3.77 #peak 592 #SUP 0.99 #QF 0.99 121 GLN H 121 GLN HG2 3.77 #peak 592 #SUP 0.99 #QF 0.99 21 GLN HG3 25 VAL HG2 4.36 #peak 594 #SUP 1.00 121 GLN HG3 125 VAL HG2 4.36 #peak 594 #SUP 1.00 21 GLN HG3 69 VAL HG2 4.86 #peak 594 #SUP 1.00 121 GLN HG3 169 VAL HG2 4.86 #peak 594 #SUP 1.00 18 MET HA 21 GLN HG3 4.29 #peak 596 #SUP 1.00 118 MET HA 121 GLN HG3 4.29 #peak 596 #SUP 1.00 21 GLN HG3 25 VAL H 5.14 #peak 598 #SUP 0.78 #QF 0.78 121 GLN HG3 125 VAL H 5.14 #peak 598 #SUP 0.78 #QF 0.78 22 ILE HA 69 VAL HG2 4.98 #peak 602 #SUP 1.00 122 ILE HA 169 VAL HG2 4.98 #peak 602 #SUP 1.00 22 ILE HA 25 VAL HB 4.29 #peak 606 #SUP 1.00 122 ILE HA 125 VAL HB 4.29 #peak 606 #SUP 1.00 22 ILE HA 23 THR HA 5.10 #peak 608 #SUP 0.98 #QF 0.98 122 ILE HA 123 THR HA 5.10 #peak 608 #SUP 0.98 #QF 0.98 21 GLN HE21 22 ILE HA 6.50 #peak 609 #SUP 0.84 #QF 0.84 121 GLN HE21 122 ILE HA 6.50 #peak 609 #SUP 0.84 #QF 0.84 22 ILE HA 26 ILE H 5.14 #peak 610 #SUP 1.00 122 ILE HA 126 ILE H 5.14 #peak 610 #SUP 1.00 19 THR HG2 22 ILE HB 4.84 #peak 615 #SUP 0.59 #QF 0.59 119 THR HG2 122 ILE HB 4.84 #peak 615 #SUP 0.59 #QF 0.59 10 ILE HG2 22 ILE HB 6.01 #peak 616 #SUP 0.94 #QF 0.85 110 ILE HG2 122 ILE HB 6.01 #peak 616 #SUP 0.94 #QF 0.85 22 ILE HB 47 CYS HG 6.50 #peak 616 #SUP 0.94 #QF 0.85 122 ILE HB 147 CYS HG 6.50 #peak 616 #SUP 0.94 #QF 0.85 118 MET HB3 122 ILE HB 5.44 #peak 619 #SUP 0.96 #QF 0.96 21 GLN HG2 22 ILE HB 5.10 #peak 620 #SUP 1.00 121 GLN HG2 122 ILE HB 5.10 #peak 620 #SUP 1.00 19 THR HA 22 ILE HB 4.73 #peak 622 #SUP 1.00 119 THR HA 122 ILE HB 4.73 #peak 622 #SUP 1.00 22 ILE HB 45 PHE HZ 5.42 #peak 624 #SUP 1.00 122 ILE HB 145 PHE HZ 5.42 #peak 624 #SUP 1.00 22 ILE HB 45 PHE HE 5.38 #peak 625 #SUP 0.95 #QF 0.95 122 ILE HB 145 PHE HE 5.38 #peak 625 #SUP 0.95 #QF 0.95 22 ILE HB 23 THR H 4.45 #peak 626 #SUP 1.00 122 ILE HB 123 THR H 4.45 #peak 626 #SUP 1.00 21 GLN HG2 22 ILE HG12 5.70 #peak 634 #SUP 1.00 #QF 0.77 121 GLN HG2 122 ILE HG12 5.70 #peak 634 #SUP 1.00 #QF 0.77 118 MET HB3 122 ILE HG12 5.48 #peak 635 #SUP 0.93 #QF 0.88 21 GLN HB2 22 ILE HG12 6.26 #peak 635 #SUP 0.93 #QF 0.88 121 GLN HB2 122 ILE HG12 6.26 #peak 635 #SUP 0.93 #QF 0.88 22 ILE HG12 45 PHE HZ 5.04 #peak 637 #SUP 1.00 122 ILE HG12 145 PHE HZ 5.04 #peak 637 #SUP 1.00 22 ILE HG12 45 PHE HE 4.97 #peak 638 #SUP 1.00 122 ILE HG12 145 PHE HE 4.97 #peak 638 #SUP 1.00 18 MET HE 22 ILE HG13 5.28 #peak 644 #SUP 0.98 #QF 0.98 118 MET HE 122 ILE HG13 5.28 #peak 644 #SUP 0.98 #QF 0.98 21 GLN HG2 22 ILE HG13 6.20 #peak 645 #SUP 1.00 #QF 0.22 121 GLN HG2 122 ILE HG13 6.20 #peak 645 #SUP 1.00 #QF 0.22 19 THR HA 22 ILE HG13 5.54 #peak 646 #SUP 0.99 #QF 0.99 119 THR HA 122 ILE HG13 5.54 #peak 646 #SUP 0.99 #QF 0.99 22 ILE HG13 23 THR H 5.48 #peak 650 #SUP 1.00 122 ILE HG13 123 THR H 5.48 #peak 650 #SUP 1.00 20 ASN H 22 ILE HG13 6.50 #peak 651 #SUP 1.00 120 ASN H 122 ILE HG13 6.50 #peak 651 #SUP 1.00 22 ILE H 22 ILE HG13 4.52 #peak 652 #SUP 1.00 122 ILE H 122 ILE HG13 4.52 #peak 652 #SUP 1.00 22 ILE HG2 22 ILE HG13 3.57 #peak 653 #SUP 1.00 122 ILE HG2 122 ILE HG13 3.57 #peak 653 #SUP 1.00 22 ILE HG2 22 ILE HG12 3.77 #peak 654 #SUP 1.00 122 ILE HG2 122 ILE HG12 3.77 #peak 654 #SUP 1.00 26 ILE HG2 49 LEU HB2 4.13 #peak 654 #SUP 1.00 126 ILE HG2 149 LEU HB2 4.13 #peak 654 #SUP 1.00 18 MET HE 22 ILE HG2 5.38 #peak 656 #SUP 0.95 #QF 0.87 118 MET HE 122 ILE HG2 5.38 #peak 656 #SUP 0.95 #QF 0.87 22 ILE HG2 25 VAL HB 5.71 #peak 656 #SUP 0.95 #QF 0.87 122 ILE HG2 125 VAL HB 5.71 #peak 656 #SUP 0.95 #QF 0.87 21 GLN HG2 22 ILE HG2 5.40 #peak 657 #SUP 0.98 #QF 0.98 121 GLN HG2 122 ILE HG2 5.40 #peak 657 #SUP 0.98 #QF 0.98 118 MET HB3 122 ILE HG2 5.90 #peak 658 #SUP 0.95 #QF 0.95 19 THR HA 22 ILE HG2 3.97 #peak 659 #SUP 0.90 #QF 0.90 119 THR HA 122 ILE HG2 3.97 #peak 659 #SUP 0.90 #QF 0.90 22 ILE HA 22 ILE HG2 3.53 #peak 660 #SUP 0.99 #QF 0.99 122 ILE HA 122 ILE HG2 3.53 #peak 660 #SUP 0.99 #QF 0.99 22 ILE HG2 23 THR HG1 4.13 #peak 661 #SUP 0.90 #QF 0.90 122 ILE HG2 123 THR HG1 4.13 #peak 661 #SUP 0.90 #QF 0.90 26 ILE HG2 49 LEU HA 6.34 #peak 662 #SUP 0.98 #QF 0.88 126 ILE HG2 149 LEU HA 6.34 #peak 662 #SUP 0.98 #QF 0.88 22 ILE HG2 45 PHE HD 4.69 #peak 663 #SUP 1.00 122 ILE HG2 145 PHE HD 4.69 #peak 663 #SUP 1.00 22 ILE HG2 23 THR H 3.71 #peak 666 #SUP 0.99 #QF 0.99 122 ILE HG2 123 THR H 3.71 #peak 666 #SUP 0.99 #QF 0.99 22 ILE HG2 25 VAL H 5.49 #peak 667 #SUP 0.99 #QF 0.99 122 ILE HG2 125 VAL H 5.49 #peak 667 #SUP 0.99 #QF 0.99 25 VAL H 26 ILE HG2 6.03 #peak 667 #SUP 0.99 #QF 0.99 125 VAL H 126 ILE HG2 6.03 #peak 667 #SUP 0.99 #QF 0.99 21 GLN H 22 ILE HG2 6.08 #peak 669 #SUP 1.00 121 GLN H 122 ILE HG2 6.08 #peak 669 #SUP 1.00 10 ILE HG2 22 ILE HD1 3.15 #peak 672 #SUP 0.97 #QF 0.87 110 ILE HG2 122 ILE HD1 3.15 #peak 672 #SUP 0.97 #QF 0.87 22 ILE HD1 69 VAL HG2 3.57 #peak 672 #SUP 0.97 #QF 0.87 122 ILE HD1 169 VAL HG2 3.57 #peak 672 #SUP 0.97 #QF 0.87 22 ILE HB 22 ILE HD1 3.65 #peak 675 #SUP 1.00 122 ILE HB 122 ILE HD1 3.65 #peak 675 #SUP 1.00 18 MET HE 22 ILE HD1 3.69 #peak 676 #SUP 0.99 #QF 0.99 118 MET HE 122 ILE HD1 3.69 #peak 676 #SUP 0.99 #QF 0.99 21 GLN HG2 22 ILE HD1 4.37 #peak 677 #SUP 0.94 #QF 0.67 121 GLN HG2 122 ILE HD1 4.37 #peak 677 #SUP 0.94 #QF 0.67 22 ILE HD1 69 VAL HB 4.56 #peak 677 #SUP 0.94 #QF 0.67 122 ILE HD1 169 VAL HB 4.56 #peak 677 #SUP 0.94 #QF 0.67 22 ILE HD1 23 THR HA 5.37 #peak 678 #SUP 0.97 #QF 0.97 122 ILE HD1 123 THR HA 5.37 #peak 678 #SUP 0.97 #QF 0.97 22 ILE HA 22 ILE HD1 3.24 #peak 679 #SUP 0.98 #QF 0.98 122 ILE HA 122 ILE HD1 3.24 #peak 679 #SUP 0.98 #QF 0.98 22 ILE HD1 66 LEU HA 4.74 #peak 680 #SUP 0.67 #QF 0.67 122 ILE HD1 166 LEU HA 4.74 #peak 680 #SUP 0.67 #QF 0.67 22 ILE HD1 69 VAL H 5.30 #peak 683 #SUP 0.94 #QF 0.94 122 ILE HD1 169 VAL H 5.30 #peak 683 #SUP 0.94 #QF 0.94 22 ILE HD1 23 THR H 5.14 #peak 684 #SUP 1.00 122 ILE HD1 123 THR H 5.14 #peak 684 #SUP 1.00 22 ILE HD1 26 ILE H 5.63 #peak 685 #SUP 0.97 #QF 0.97 122 ILE HD1 126 ILE H 5.63 #peak 685 #SUP 0.97 #QF 0.97 22 ILE HD1 72 VAL H 5.09 #peak 686 #SUP 0.92 #QF 0.92 122 ILE HD1 172 VAL H 5.09 #peak 686 #SUP 0.92 #QF 0.92 22 ILE HD1 25 VAL H 5.43 #peak 687 #SUP 0.98 #QF 0.98 122 ILE HD1 125 VAL H 5.43 #peak 687 #SUP 0.98 #QF 0.98 22 ILE HD1 24 GLY H 5.92 #peak 688 #SUP 0.95 #QF 0.95 122 ILE HD1 124 GLY H 5.92 #peak 688 #SUP 0.95 #QF 0.95 22 ILE H 22 ILE HD1 4.23 #peak 689 #SUP 1.00 122 ILE H 122 ILE HD1 4.23 #peak 689 #SUP 1.00 33 ILE HD1 123 THR HB 5.10 #peak 699 #SUP 1.00 #QF 0.99 23 THR HB 133 ILE HD1 5.10 #peak 699 #SUP 1.00 #QF 0.99 23 THR HB 26 ILE HB 6.50 #peak 701 #SUP 0.98 #QF 0.65 123 THR HB 126 ILE HB 6.50 #peak 701 #SUP 0.98 #QF 0.65 23 THR HG2 26 ILE HB 4.91 #peak 706 #SUP 0.98 #QF 0.65 123 THR HG2 126 ILE HB 4.91 #peak 706 #SUP 0.98 #QF 0.65 23 THR HA 23 THR HG2 3.42 #peak 707 #SUP 1.00 123 THR HA 123 THR HG2 3.42 #peak 707 #SUP 1.00 23 THR HG2 23 THR HG1 3.51 #peak 709 #SUP 1.00 123 THR HG2 123 THR HG1 3.51 #peak 709 #SUP 1.00 23 THR HG2 27 SER HG 5.68 #peak 710 #SUP 0.99 #QF 0.99 123 THR HG2 127 SER HG 5.68 #peak 710 #SUP 0.99 #QF 0.99 27 SER HG 123 THR HG2 6.45 #peak 710 #SUP 0.99 #QF 0.99 23 THR HG2 127 SER HG 6.45 #peak 710 #SUP 0.99 #QF 0.99 67 ARG HE 75 VAL HG1 4.44 #peak 711 #SUP 1.00 #QF 0.99 167 ARG HE 175 VAL HG1 4.44 #peak 711 #SUP 1.00 #QF 0.99 24 GLY HA2 27 SER HG 5.19 #peak 715 #SUP 0.98 #QF 0.96 124 GLY HA2 127 SER HG 5.19 #peak 715 #SUP 0.98 #QF 0.96 24 GLY HA3 27 SER HG 5.19 #peak 720 #SUP 0.93 #QF 0.89 124 GLY HA3 127 SER HG 5.19 #peak 720 #SUP 0.93 #QF 0.89 25 VAL HA 28 LYS HB3 5.22 #peak 726 #SUP 1.00 125 VAL HA 128 LYS HB3 5.22 #peak 726 #SUP 1.00 25 VAL HB 66 LEU HD2 4.53 #peak 734 #SUP 0.58 #QF 0.41 125 VAL HB 166 LEU HD2 4.53 #peak 734 #SUP 0.58 #QF 0.41 65 LYS HB2 66 LEU HD2 5.14 #peak 734 #SUP 0.58 #QF 0.41 165 LYS HB2 166 LEU HD2 5.14 #peak 734 #SUP 0.58 #QF 0.41 25 VAL HG1 62 LEU HD2 5.75 #peak 740 #SUP 0.38 #QF 0.38 125 VAL HG1 162 LEU HD2 5.75 #peak 740 #SUP 0.38 #QF 0.38 25 VAL HG1 28 LYS HD2 5.23 #peak 743 #SUP 0.92 #QF 0.62 125 VAL HG1 128 LYS HD2 5.23 #peak 743 #SUP 0.92 #QF 0.62 25 VAL HG1 28 LYS HD3 5.23 #peak 743 #SUP 0.92 #QF 0.62 125 VAL HG1 128 LYS HD3 5.23 #peak 743 #SUP 0.92 #QF 0.62 25 VAL HG1 65 LYS HB3 4.12 #peak 744 #SUP 0.88 #QF 0.88 125 VAL HG1 165 LYS HB3 4.12 #peak 744 #SUP 0.88 #QF 0.88 25 VAL HG1 26 ILE HA 4.88 #peak 746 #SUP 0.98 #QF 0.98 125 VAL HG1 126 ILE HA 4.88 #peak 746 #SUP 0.98 #QF 0.98 25 VAL HG1 65 LYS HE 4.90 #peak 747 #SUP 0.86 #QF 0.86 125 VAL HG1 165 LYS HE 4.90 #peak 747 #SUP 0.86 #QF 0.86 25 VAL HA 25 VAL HG1 3.36 #peak 748 #SUP 1.00 125 VAL HA 125 VAL HG1 3.36 #peak 748 #SUP 1.00 22 ILE HA 25 VAL HG1 4.85 #peak 749 #SUP 0.99 #QF 0.99 122 ILE HA 125 VAL HG1 4.85 #peak 749 #SUP 0.99 #QF 0.99 25 VAL HG1 66 LEU HA 4.48 #peak 750 #SUP 0.55 #QF 0.55 125 VAL HG1 166 LEU HA 4.48 #peak 750 #SUP 0.55 #QF 0.55 25 VAL HG1 29 PHE HE 3.84 #peak 751 #SUP 0.95 #QF 0.79 125 VAL HG1 129 PHE HE 3.84 #peak 751 #SUP 0.95 #QF 0.79 25 VAL HG1 69 VAL H 6.46 #peak 752 #SUP 0.87 #QF 0.87 125 VAL HG1 169 VAL H 6.46 #peak 752 #SUP 0.87 #QF 0.87 25 VAL HG1 26 ILE H 4.04 #peak 753 #SUP 1.00 125 VAL HG1 126 ILE H 4.04 #peak 753 #SUP 1.00 25 VAL HG1 27 SER H 5.05 #peak 754 #SUP 0.97 #QF 0.97 125 VAL HG1 127 SER H 5.05 #peak 754 #SUP 0.97 #QF 0.97 21 GLN HB3 25 VAL HG2 5.18 #peak 759 #SUP 0.98 #QF 0.65 121 GLN HB3 125 VAL HG2 5.18 #peak 759 #SUP 0.98 #QF 0.65 25 VAL HG2 28 LYS HE 5.18 #peak 761 #SUP 0.92 #QF 0.92 125 VAL HG2 128 LYS HE 5.18 #peak 761 #SUP 0.92 #QF 0.92 25 VAL HA 25 VAL HG2 3.05 #peak 762 #SUP 0.98 #QF 0.98 125 VAL HA 125 VAL HG2 3.05 #peak 762 #SUP 0.98 #QF 0.98 22 ILE HA 25 VAL HG2 3.62 #peak 763 #SUP 0.97 #QF 0.97 122 ILE HA 125 VAL HG2 3.62 #peak 763 #SUP 0.97 #QF 0.97 21 GLN HA 25 VAL HG2 4.28 #peak 764 #SUP 0.99 #QF 0.99 121 GLN HA 125 VAL HG2 4.28 #peak 764 #SUP 0.99 #QF 0.99 21 GLN HE21 25 VAL HG2 6.50 #peak 765 #SUP 0.87 #QF 0.79 121 GLN HE21 125 VAL HG2 6.50 #peak 765 #SUP 0.87 #QF 0.79 25 VAL HG2 29 PHE HD 6.50 #peak 765 #SUP 0.87 #QF 0.79 125 VAL HG2 129 PHE HD 6.50 #peak 765 #SUP 0.87 #QF 0.79 25 VAL HG2 28 LYS H 5.77 #peak 766 #SUP 0.94 #QF 0.86 125 VAL HG2 128 LYS H 5.77 #peak 766 #SUP 0.94 #QF 0.86 25 VAL HG2 29 PHE HE 6.18 #peak 766 #SUP 0.94 #QF 0.86 125 VAL HG2 129 PHE HE 6.18 #peak 766 #SUP 0.94 #QF 0.86 21 GLN HE22 25 VAL HG2 6.33 #peak 767 #SUP 1.00 121 GLN HE22 125 VAL HG2 6.33 #peak 767 #SUP 1.00 23 THR H 25 VAL HG2 5.52 #peak 768 #SUP 1.00 123 THR H 125 VAL HG2 5.52 #peak 768 #SUP 1.00 25 VAL HG2 26 ILE H 4.13 #peak 769 #SUP 1.00 125 VAL HG2 126 ILE H 4.13 #peak 769 #SUP 1.00 25 VAL H 25 VAL HG2 3.14 #peak 770 #SUP 0.99 #QF 0.99 125 VAL H 125 VAL HG2 3.14 #peak 770 #SUP 0.99 #QF 0.99 21 GLN H 25 VAL HG2 5.85 #peak 771 #SUP 1.00 121 GLN H 125 VAL HG2 5.85 #peak 771 #SUP 1.00 26 ILE HA 49 LEU HD2 5.35 #peak 775 #SUP 1.00 126 ILE HA 149 LEU HD2 5.35 #peak 775 #SUP 1.00 26 ILE HA 29 PHE HE 5.37 #peak 777 #SUP 1.00 #QF 0.81 126 ILE HA 129 PHE HE 5.37 #peak 777 #SUP 1.00 #QF 0.81 26 ILE HB 49 LEU HD2 5.19 #peak 782 #SUP 1.00 126 ILE HB 149 LEU HD2 5.19 #peak 782 #SUP 1.00 23 THR HA 26 ILE HB 4.74 #peak 784 #SUP 0.98 #QF 0.98 123 THR HA 126 ILE HB 4.74 #peak 784 #SUP 0.98 #QF 0.98 26 ILE HB 27 SER HA 5.86 #peak 785 #SUP 0.96 #QF 0.67 126 ILE HB 127 SER HA 5.86 #peak 785 #SUP 0.96 #QF 0.67 26 ILE HA 26 ILE HG2 3.83 #peak 794 #SUP 0.99 #QF 0.99 126 ILE HA 126 ILE HG2 3.83 #peak 794 #SUP 0.99 #QF 0.99 22 ILE HG2 23 THR HA 4.18 #peak 795 #SUP 0.99 #QF 0.96 122 ILE HG2 123 THR HA 4.18 #peak 795 #SUP 0.99 #QF 0.96 26 ILE H 26 ILE HG2 3.81 #peak 797 #SUP 0.99 #QF 0.99 126 ILE H 126 ILE HG2 3.81 #peak 797 #SUP 0.99 #QF 0.99 26 ILE HG2 27 SER H 4.33 #peak 798 #SUP 0.98 #QF 0.98 126 ILE HG2 127 SER H 4.33 #peak 798 #SUP 0.98 #QF 0.98 26 ILE HA 26 ILE HD1 4.39 #peak 799 #SUP 1.00 126 ILE HA 126 ILE HD1 4.39 #peak 799 #SUP 1.00 26 ILE H 26 ILE HD1 3.86 #peak 800 #SUP 0.99 #QF 0.99 126 ILE H 126 ILE HD1 3.86 #peak 800 #SUP 0.99 #QF 0.99 25 VAL H 26 ILE HD1 5.69 #peak 801 #SUP 0.96 #QF 0.93 125 VAL H 126 ILE HD1 5.69 #peak 801 #SUP 0.96 #QF 0.93 23 THR HG2 27 SER HA 5.73 #peak 803 #SUP 0.94 #QF 0.94 123 THR HG2 127 SER HA 5.73 #peak 803 #SUP 0.94 #QF 0.94 20 ASN HB2 127 SER HA 5.61 #peak 804 #SUP 1.00 27 SER HA 120 ASN HB2 5.61 #peak 804 #SUP 1.00 20 ASN HD22 127 SER HA 5.33 #peak 807 #SUP 0.96 #QF 0.96 27 SER HA 120 ASN HD22 5.33 #peak 807 #SUP 0.96 #QF 0.96 20 ASN HD21 127 SER HA 5.04 #peak 808 #SUP 0.99 #QF 0.99 27 SER HA 120 ASN HD21 5.04 #peak 808 #SUP 0.99 #QF 0.99 23 THR HG2 27 SER HB2 6.04 #peak 811 #SUP 0.93 #QF 0.86 123 THR HG2 127 SER HB2 6.04 #peak 811 #SUP 0.93 #QF 0.86 23 THR HG2 127 SER HB2 6.50 #peak 811 #SUP 0.93 #QF 0.86 27 SER HB2 123 THR HG2 6.50 #peak 811 #SUP 0.93 #QF 0.86 23 THR HG2 27 SER HB3 6.04 #peak 816 #SUP 0.98 #QF 0.97 123 THR HG2 127 SER HB3 6.04 #peak 816 #SUP 0.98 #QF 0.97 23 THR HG2 127 SER HB3 6.50 #peak 816 #SUP 0.98 #QF 0.97 27 SER HB3 123 THR HG2 6.50 #peak 816 #SUP 0.98 #QF 0.97 25 VAL HA 28 LYS HB2 5.22 #peak 831 #SUP 1.00 125 VAL HA 128 LYS HB2 5.22 #peak 831 #SUP 1.00 66 LEU HD2 68 LYS HB2 6.50 #peak 835 #SUP 0.96 #QF 0.28 166 LEU HD2 168 LYS HB2 6.50 #peak 835 #SUP 0.96 #QF 0.28 68 LYS HB2 69 VAL HG1 6.50 #peak 835 #SUP 0.96 #QF 0.28 168 LYS HB2 169 VAL HG1 6.50 #peak 835 #SUP 0.96 #QF 0.28 28 LYS HA 28 LYS HG2 3.93 #peak 843 #SUP 1.00 128 LYS HA 128 LYS HG2 3.93 #peak 843 #SUP 1.00 27 SER HG 28 LYS HG2 5.42 #peak 845 #SUP 0.99 #QF 0.99 127 SER HG 128 LYS HG2 5.42 #peak 845 #SUP 0.99 #QF 0.99 28 LYS HA 28 LYS HG3 3.93 #peak 850 #SUP 1.00 128 LYS HA 128 LYS HG3 3.93 #peak 850 #SUP 1.00 27 SER HG 28 LYS HG3 5.42 #peak 851 #SUP 1.00 127 SER HG 128 LYS HG3 5.42 #peak 851 #SUP 1.00 25 VAL HA 28 LYS HD2 5.44 #peak 857 #SUP 0.98 #QF 0.53 125 VAL HA 128 LYS HD2 5.44 #peak 857 #SUP 0.98 #QF 0.53 25 VAL HA 28 LYS HD3 5.44 #peak 861 #SUP 1.00 125 VAL HA 128 LYS HD3 5.44 #peak 861 #SUP 1.00 68 LYS HA 68 LYS HD2 3.80 #peak 862 #SUP 0.98 #QF 0.98 168 LYS HA 168 LYS HD2 3.80 #peak 862 #SUP 0.98 #QF 0.98 25 VAL HA 28 LYS HE 4.43 #peak 868 #SUP 1.00 125 VAL HA 128 LYS HE 4.43 #peak 868 #SUP 1.00 28 LYS HA 28 LYS HE 5.20 #peak 869 #SUP 0.89 #QF 0.83 128 LYS HA 128 LYS HE 5.20 #peak 869 #SUP 0.89 #QF 0.83 31 THR HB 51 ILE HB 4.39 #peak 893 #SUP 0.99 #QF 0.99 131 THR HB 151 ILE HB 4.39 #peak 893 #SUP 0.99 #QF 0.99 29 PHE HD 31 THR HB 5.73 #peak 895 #SUP 0.97 #QF 0.97 129 PHE HD 131 THR HB 5.73 #peak 895 #SUP 0.97 #QF 0.97 31 THR HG2 62 LEU HD2 3.79 #peak 898 #SUP 1.00 131 THR HG2 162 LEU HD2 3.79 #peak 898 #SUP 1.00 31 THR HG2 62 LEU HD1 3.42 #peak 899 #SUP 0.99 #QF 0.99 131 THR HG2 162 LEU HD1 3.42 #peak 899 #SUP 0.99 #QF 0.99 31 THR HG2 51 ILE HD1 3.10 #peak 900 #SUP 0.99 #QF 0.99 131 THR HG2 151 ILE HD1 3.10 #peak 900 #SUP 0.99 #QF 0.99 31 THR HG2 51 ILE HB 3.68 #peak 901 #SUP 0.72 #QF 0.72 131 THR HG2 151 ILE HB 3.68 #peak 901 #SUP 0.72 #QF 0.72 30 ASP HB 31 THR HG2 5.85 #peak 902 #SUP 0.97 #QF 0.97 130 ASP HB 131 THR HG2 5.85 #peak 902 #SUP 0.97 #QF 0.97 29 PHE HB3 31 THR HG2 4.31 #peak 904 #SUP 0.99 #QF 0.99 129 PHE HB3 131 THR HG2 4.31 #peak 904 #SUP 0.99 #QF 0.99 29 PHE HB2 31 THR HG2 4.31 #peak 905 #SUP 1.00 129 PHE HB2 131 THR HG2 4.31 #peak 905 #SUP 1.00 31 THR H 31 THR HG2 3.67 #peak 909 #SUP 1.00 131 THR H 131 THR HG2 3.67 #peak 909 #SUP 1.00 31 THR HG2 32 ASN H 4.00 #peak 910 #SUP 1.00 #QF 0.99 131 THR HG2 132 ASN H 4.00 #peak 910 #SUP 1.00 #QF 0.99 31 THR HG2 52 PHE H 4.54 #peak 910 #SUP 1.00 #QF 0.99 131 THR HG2 152 PHE H 4.54 #peak 910 #SUP 1.00 #QF 0.99 31 THR HG2 34 ARG H 6.17 #peak 911 #SUP 0.43 #QF 0.43 131 THR HG2 134 ARG H 6.17 #peak 911 #SUP 0.43 #QF 0.43 33 ILE HB 49 LEU HD1 5.73 #peak 928 #SUP 0.95 #QF 0.94 133 ILE HB 149 LEU HD1 5.73 #peak 928 #SUP 0.95 #QF 0.94 19 THR HG1 133 ILE HB 5.00 #peak 933 #SUP 1.00 33 ILE HB 119 THR HG1 5.00 #peak 933 #SUP 1.00 33 ILE HG12 51 ILE HG2 4.65 #peak 936 #SUP 0.94 #QF 0.94 33 ILE HG2 33 ILE HG12 4.05 #peak 942 #SUP 1.00 33 ILE HA 33 ILE HG2 3.78 #peak 943 #SUP 0.99 #QF 0.99 133 ILE HA 133 ILE HG2 3.78 #peak 943 #SUP 0.99 #QF 0.99 20 ASN HA 133 ILE HG2 5.38 #peak 944 #SUP 0.70 #QF 0.70 33 ILE HG2 120 ASN HA 5.38 #peak 944 #SUP 0.70 #QF 0.70 33 ILE HG2 34 ARG HA 5.24 #peak 945 #SUP 0.96 #QF 0.96 133 ILE HG2 134 ARG HA 5.24 #peak 945 #SUP 0.96 #QF 0.96 32 ASN HA 33 ILE HG2 5.73 #peak 946 #SUP 0.98 #QF 0.98 132 ASN HA 133 ILE HG2 5.73 #peak 946 #SUP 0.98 #QF 0.98 33 ILE HG2 51 ILE HA 5.48 #peak 947 #SUP 0.99 #QF 0.99 133 ILE HG2 151 ILE HA 5.48 #peak 947 #SUP 0.99 #QF 0.99 33 ILE HG2 49 LEU HA 5.81 #peak 948 #SUP 0.95 #QF 0.95 133 ILE HG2 149 LEU HA 5.81 #peak 948 #SUP 0.95 #QF 0.95 33 ILE HG2 35 THR HA 5.58 #peak 949 #SUP 0.97 #QF 0.97 133 ILE HG2 135 THR HA 5.58 #peak 949 #SUP 0.97 #QF 0.97 19 THR HG1 133 ILE HG2 4.69 #peak 950 #SUP 0.99 #QF 0.99 33 ILE HG2 119 THR HG1 4.69 #peak 950 #SUP 0.99 #QF 0.99 33 ILE H 33 ILE HG2 4.48 #peak 952 #SUP 1.00 133 ILE H 133 ILE HG2 4.48 #peak 952 #SUP 1.00 33 ILE HG2 34 ARG H 4.10 #peak 953 #SUP 0.98 #QF 0.98 133 ILE HG2 134 ARG H 4.10 #peak 953 #SUP 0.98 #QF 0.98 20 ASN HB2 133 ILE HD1 5.60 #peak 955 #SUP 1.00 33 ILE HD1 120 ASN HB2 5.60 #peak 955 #SUP 1.00 27 SER HA 33 ILE HD1 3.47 #peak 956 #SUP 0.76 #QF 0.76 127 SER HA 133 ILE HD1 3.47 #peak 956 #SUP 0.76 #QF 0.76 8 ILE HD1 63 MET HA 4.51 #peak 957 #SUP 0.96 #QF 0.73 108 ILE HD1 163 MET HA 4.51 #peak 957 #SUP 0.96 #QF 0.73 20 ASN HA 133 ILE HD1 3.53 #peak 958 #SUP 0.89 #QF 0.89 33 ILE HD1 120 ASN HA 3.53 #peak 958 #SUP 0.89 #QF 0.89 7 GLY HA2 8 ILE HD1 5.16 #peak 959 #SUP 0.75 #QF 0.75 107 GLY HA2 108 ILE HD1 5.16 #peak 959 #SUP 0.75 #QF 0.75 20 ASN HD22 133 ILE HD1 4.15 #peak 960 #SUP 0.96 #QF 0.91 33 ILE HD1 120 ASN HD22 4.15 #peak 960 #SUP 0.96 #QF 0.91 20 ASN HD21 133 ILE HD1 4.84 #peak 961 #SUP 1.00 33 ILE HD1 120 ASN HD21 4.84 #peak 961 #SUP 1.00 33 ILE H 33 ILE HD1 4.26 #peak 962 #SUP 0.98 #QF 0.98 133 ILE H 133 ILE HD1 4.26 #peak 962 #SUP 0.98 #QF 0.98 33 ILE HD1 34 ARG H 5.50 #peak 963 #SUP 0.94 #QF 0.94 133 ILE HD1 134 ARG H 5.50 #peak 963 #SUP 0.94 #QF 0.94 38 LEU HB 135 THR HA 5.04 #peak 972 #SUP 1.00 #QF 0.30 35 THR HA 138 LEU HB 5.04 #peak 972 #SUP 1.00 #QF 0.30 5 LEU HD2 35 THR HB 5.81 #peak 976 #SUP 0.98 #QF 0.36 105 LEU HD2 135 THR HB 5.81 #peak 976 #SUP 0.98 #QF 0.36 33 ILE HG2 35 THR HB 6.15 #peak 976 #SUP 0.98 #QF 0.36 133 ILE HG2 135 THR HB 6.15 #peak 976 #SUP 0.98 #QF 0.36 35 THR HB 50 MET HB3 4.27 #peak 979 #SUP 0.99 #QF 0.99 135 THR HB 150 MET HB3 4.27 #peak 979 #SUP 0.99 #QF 0.99 35 THR HB 50 MET HB2 4.27 #peak 980 #SUP 1.00 135 THR HB 150 MET HB2 4.27 #peak 980 #SUP 1.00 35 THR HB 36 ILE HA 4.92 #peak 983 #SUP 0.95 #QF 0.95 135 THR HB 136 ILE HA 4.92 #peak 983 #SUP 0.95 #QF 0.95 35 THR HB 49 LEU HA 6.08 #peak 984 #SUP 1.00 135 THR HB 149 LEU HA 6.08 #peak 984 #SUP 1.00 35 THR HB 50 MET H 4.77 #peak 987 #SUP 0.99 #QF 0.99 135 THR HB 150 MET H 4.77 #peak 987 #SUP 0.99 #QF 0.99 39 ASN HB 135 THR HG2 4.03 #peak 993 #SUP 0.97 #QF 0.97 35 THR HG2 139 ASN HB 4.03 #peak 993 #SUP 0.97 #QF 0.97 35 THR HA 35 THR HG2 3.50 #peak 995 #SUP 1.00 135 THR HA 135 THR HG2 3.50 #peak 995 #SUP 1.00 39 ASN HA 135 THR HG2 4.15 #peak 996 #SUP 0.89 #QF 0.89 35 THR HG2 139 ASN HA 4.15 #peak 996 #SUP 0.89 #QF 0.89 35 THR H 35 THR HG2 4.33 #peak 998 #SUP 1.00 135 THR H 135 THR HG2 4.33 #peak 998 #SUP 1.00 35 THR HG2 36 ILE H 3.50 #peak 999 #SUP 0.91 #QF 0.87 135 THR HG2 136 ILE H 3.50 #peak 999 #SUP 0.91 #QF 0.87 56 THR H 56 THR HG2 3.98 #peak 999 #SUP 0.91 #QF 0.87 156 THR H 156 THR HG2 3.98 #peak 999 #SUP 0.91 #QF 0.87 38 LEU H 135 THR HG2 4.93 #peak 1000 #SUP 0.92 #QF 0.92 35 THR HG2 138 LEU H 4.93 #peak 1000 #SUP 0.92 #QF 0.92 38 LEU H 136 ILE HB 5.91 #peak 1004 #SUP 0.97 #QF 0.97 36 ILE HB 138 LEU H 5.91 #peak 1004 #SUP 0.97 #QF 0.97 36 ILE HG2 37 VAL HB 5.72 #peak 1015 #SUP 0.97 #QF 0.97 136 ILE HG2 137 VAL HB 5.72 #peak 1015 #SUP 0.97 #QF 0.97 39 ASN HB 136 ILE HG2 6.50 #peak 1016 #SUP 0.77 #QF 0.54 36 ILE HG2 139 ASN HB 6.50 #peak 1016 #SUP 0.77 #QF 0.54 23 THR HB 36 ILE HG2 5.44 #peak 1018 #SUP 0.80 #QF 0.80 123 THR HB 136 ILE HG2 5.44 #peak 1018 #SUP 0.80 #QF 0.80 35 THR HB 36 ILE HG2 5.82 #peak 1019 #SUP 0.98 #QF 0.98 135 THR HB 136 ILE HG2 5.82 #peak 1019 #SUP 0.98 #QF 0.98 36 ILE HA 36 ILE HG2 3.63 #peak 1020 #SUP 1.00 136 ILE HA 136 ILE HG2 3.63 #peak 1020 #SUP 1.00 36 ILE HG2 37 VAL HA 4.36 #peak 1021 #SUP 0.97 #QF 0.95 136 ILE HG2 137 VAL HA 4.36 #peak 1021 #SUP 0.97 #QF 0.95 37 VAL HA 136 ILE HG2 4.74 #peak 1021 #SUP 0.97 #QF 0.95 36 ILE HG2 137 VAL HA 4.74 #peak 1021 #SUP 0.97 #QF 0.95 36 ILE HG2 49 LEU HA 5.33 #peak 1022 #SUP 1.00 136 ILE HG2 149 LEU HA 5.33 #peak 1022 #SUP 1.00 35 THR HA 36 ILE HG2 4.98 #peak 1023 #SUP 0.97 #QF 0.97 135 THR HA 136 ILE HG2 4.98 #peak 1023 #SUP 0.97 #QF 0.97 38 LEU HA 136 ILE HG2 5.24 #peak 1024 #SUP 0.84 #QF 0.84 36 ILE HG2 138 LEU HA 5.24 #peak 1024 #SUP 0.84 #QF 0.84 36 ILE H 36 ILE HG2 3.50 #peak 1025 #SUP 0.87 #QF 0.87 136 ILE H 136 ILE HG2 3.50 #peak 1025 #SUP 0.87 #QF 0.87 36 ILE HG2 48 ASN H 5.90 #peak 1026 #SUP 0.99 #QF 0.99 136 ILE HG2 148 ASN H 5.90 #peak 1026 #SUP 0.99 #QF 0.99 38 LEU H 136 ILE HG2 4.05 #peak 1028 #SUP 0.96 #QF 0.65 36 ILE HG2 138 LEU H 4.05 #peak 1028 #SUP 0.96 #QF 0.65 36 ILE HB 36 ILE HD1 3.29 #peak 1029 #SUP 0.97 #QF 0.67 136 ILE HB 136 ILE HD1 3.29 #peak 1029 #SUP 0.97 #QF 0.67 23 THR HA 36 ILE HD1 5.11 #peak 1030 #SUP 0.95 #QF 0.95 123 THR HA 136 ILE HD1 5.11 #peak 1030 #SUP 0.95 #QF 0.95 35 THR HB 36 ILE HD1 6.50 #peak 1031 #SUP 0.95 #QF 0.95 135 THR HB 136 ILE HD1 6.50 #peak 1031 #SUP 0.95 #QF 0.95 23 THR HB 36 ILE HD1 5.81 #peak 1032 #SUP 0.97 #QF 0.97 123 THR HB 136 ILE HD1 5.81 #peak 1032 #SUP 0.97 #QF 0.97 23 THR HG1 36 ILE HD1 4.73 #peak 1033 #SUP 0.90 #QF 0.90 123 THR HG1 136 ILE HD1 4.73 #peak 1033 #SUP 0.90 #QF 0.90 36 ILE HA 36 ILE HD1 4.47 #peak 1034 #SUP 1.00 136 ILE HA 136 ILE HD1 4.47 #peak 1034 #SUP 1.00 36 ILE HD1 37 VAL HA 5.79 #peak 1035 #SUP 0.98 #QF 0.98 136 ILE HD1 137 VAL HA 5.79 #peak 1035 #SUP 0.98 #QF 0.98 36 ILE HD1 38 LEU HA 6.50 #peak 1037 #SUP 0.99 #QF 0.89 136 ILE HD1 138 LEU HA 6.50 #peak 1037 #SUP 0.99 #QF 0.89 36 ILE HD1 48 ASN HA 6.50 #peak 1037 #SUP 0.99 #QF 0.89 136 ILE HD1 148 ASN HA 6.50 #peak 1037 #SUP 0.99 #QF 0.89 23 THR H 36 ILE HD1 6.03 #peak 1038 #SUP 0.99 #QF 0.99 123 THR H 136 ILE HD1 6.03 #peak 1038 #SUP 0.99 #QF 0.99 36 ILE HD1 37 VAL H 4.64 #peak 1039 #SUP 0.98 #QF 0.59 136 ILE HD1 137 VAL H 4.64 #peak 1039 #SUP 0.98 #QF 0.59 36 ILE HD1 38 LEU H 5.68 #peak 1040 #SUP 0.88 #QF 0.88 136 ILE HD1 138 LEU H 5.68 #peak 1040 #SUP 0.88 #QF 0.88 35 THR HG2 37 VAL HB 5.32 #peak 1042 #SUP 0.99 #QF 0.99 135 THR HG2 137 VAL HB 5.32 #peak 1042 #SUP 0.99 #QF 0.99 37 VAL HB 48 ASN HB2 4.61 #peak 1043 #SUP 0.99 #QF 0.99 137 VAL HB 148 ASN HB2 4.61 #peak 1043 #SUP 0.99 #QF 0.99 37 VAL HB 38 LEU HA 5.78 #peak 1044 #SUP 0.97 #QF 0.64 137 VAL HB 138 LEU HA 5.78 #peak 1044 #SUP 0.97 #QF 0.64 37 VAL HB 47 CYS HA 6.43 #peak 1044 #SUP 0.97 #QF 0.64 137 VAL HB 147 CYS HA 6.43 #peak 1044 #SUP 0.97 #QF 0.64 37 VAL HB 48 ASN HA 6.50 #peak 1044 #SUP 0.97 #QF 0.64 137 VAL HB 148 ASN HA 6.50 #peak 1044 #SUP 0.97 #QF 0.64 37 VAL HB 48 ASN H 4.98 #peak 1045 #SUP 1.00 137 VAL HB 148 ASN H 4.98 #peak 1045 #SUP 1.00 37 VAL HG1 38 LEU HB 4.72 #peak 1047 #SUP 0.97 #QF 0.97 137 VAL HG1 138 LEU HB 4.72 #peak 1047 #SUP 0.97 #QF 0.97 37 VAL HG1 48 ASN HB3 5.43 #peak 1049 #SUP 1.00 137 VAL HG1 148 ASN HB3 5.43 #peak 1049 #SUP 1.00 37 VAL HG1 39 ASN HB 4.41 #peak 1050 #SUP 0.98 #QF 0.85 137 VAL HG1 139 ASN HB 4.41 #peak 1050 #SUP 0.98 #QF 0.85 37 VAL HG1 48 ASN HB2 5.43 #peak 1050 #SUP 0.98 #QF 0.85 137 VAL HG1 148 ASN HB2 5.43 #peak 1050 #SUP 0.98 #QF 0.85 37 VAL HA 37 VAL HG1 3.31 #peak 1051 #SUP 0.99 #QF 0.99 137 VAL HA 137 VAL HG1 3.31 #peak 1051 #SUP 0.99 #QF 0.99 37 VAL HG1 38 LEU HA 4.62 #peak 1052 #SUP 0.99 #QF 0.99 137 VAL HG1 138 LEU HA 4.62 #peak 1052 #SUP 0.99 #QF 0.99 37 VAL HG1 48 ASN HD21 5.63 #peak 1054 #SUP 1.00 137 VAL HG1 148 ASN HD21 5.63 #peak 1054 #SUP 1.00 37 VAL H 37 VAL HG1 4.20 #peak 1055 #SUP 1.00 137 VAL H 137 VAL HG1 4.20 #peak 1055 #SUP 1.00 37 VAL HG1 39 ASN H 4.61 #peak 1055 #SUP 1.00 137 VAL HG1 139 ASN H 4.61 #peak 1055 #SUP 1.00 37 VAL HG1 38 LEU H 3.76 #peak 1057 #SUP 0.97 #QF 0.97 137 VAL HG1 138 LEU H 3.76 #peak 1057 #SUP 0.97 #QF 0.97 35 THR HG2 37 VAL HG2 3.08 #peak 1058 #SUP 0.99 #QF 0.99 135 THR HG2 137 VAL HG2 3.08 #peak 1058 #SUP 0.99 #QF 0.99 37 VAL HG2 48 ASN HB3 4.71 #peak 1061 #SUP 1.00 137 VAL HG2 148 ASN HB3 4.71 #peak 1061 #SUP 1.00 37 VAL HG2 48 ASN HB2 4.71 #peak 1062 #SUP 0.94 #QF 0.94 137 VAL HG2 148 ASN HB2 4.71 #peak 1062 #SUP 0.94 #QF 0.94 35 THR HB 37 VAL HG2 5.39 #peak 1064 #SUP 1.00 135 THR HB 137 VAL HG2 5.39 #peak 1064 #SUP 1.00 37 VAL HA 37 VAL HG2 3.37 #peak 1066 #SUP 1.00 137 VAL HA 137 VAL HG2 3.37 #peak 1066 #SUP 1.00 35 THR HA 37 VAL HG2 5.49 #peak 1067 #SUP 1.00 135 THR HA 137 VAL HG2 5.49 #peak 1067 #SUP 1.00 37 VAL HG2 38 LEU HA 6.11 #peak 1068 #SUP 0.97 #QF 0.94 137 VAL HG2 138 LEU HA 6.11 #peak 1068 #SUP 0.97 #QF 0.94 37 VAL HG2 48 ASN HA 6.50 #peak 1068 #SUP 0.97 #QF 0.94 137 VAL HG2 148 ASN HA 6.50 #peak 1068 #SUP 0.97 #QF 0.94 37 VAL HG2 48 ASN HD22 5.82 #peak 1069 #SUP 0.79 #QF 0.79 137 VAL HG2 148 ASN HD22 5.82 #peak 1069 #SUP 0.79 #QF 0.79 37 VAL HG2 48 ASN HD21 5.82 #peak 1071 #SUP 1.00 137 VAL HG2 148 ASN HD21 5.82 #peak 1071 #SUP 1.00 37 VAL H 37 VAL HG2 3.78 #peak 1072 #SUP 0.99 #QF 0.61 137 VAL H 137 VAL HG2 3.78 #peak 1072 #SUP 0.99 #QF 0.61 37 VAL HG2 48 ASN H 5.06 #peak 1073 #SUP 1.00 137 VAL HG2 148 ASN H 5.06 #peak 1073 #SUP 1.00 37 VAL HG2 38 LEU H 4.23 #peak 1074 #SUP 0.99 #QF 0.99 137 VAL HG2 138 LEU H 4.23 #peak 1074 #SUP 0.99 #QF 0.99 38 LEU HA 48 ASN H 4.83 #peak 1079 #SUP 0.79 #QF 0.79 138 LEU HA 148 ASN H 4.83 #peak 1079 #SUP 0.79 #QF 0.79 38 LEU HG 47 CYS HB2 4.78 #peak 1087 #SUP 0.99 #QF 0.99 138 LEU HG 147 CYS HB2 4.78 #peak 1087 #SUP 0.99 #QF 0.99 38 LEU HA 38 LEU HG 4.12 #peak 1088 #SUP 0.95 #QF 0.95 138 LEU HA 138 LEU HG 4.12 #peak 1088 #SUP 0.95 #QF 0.95 38 LEU H 38 LEU HG 5.33 #peak 1091 #SUP 0.98 #QF 0.98 138 LEU H 138 LEU HG 5.33 #peak 1091 #SUP 0.98 #QF 0.98 19 THR HG2 38 LEU HD1 3.17 #peak 1092 #SUP 0.99 #QF 0.99 119 THR HG2 138 LEU HD1 3.17 #peak 1092 #SUP 0.99 #QF 0.99 38 LEU HD1 47 CYS HG 4.09 #peak 1093 #SUP 0.93 #QF 0.93 138 LEU HD1 147 CYS HG 4.09 #peak 1093 #SUP 0.93 #QF 0.93 38 LEU HB 38 LEU HD1 3.29 #peak 1094 #SUP 1.00 138 LEU HB 138 LEU HD1 3.29 #peak 1094 #SUP 1.00 38 LEU HD1 47 CYS HB2 4.05 #peak 1095 #SUP 1.00 138 LEU HD1 147 CYS HB2 4.05 #peak 1095 #SUP 1.00 38 LEU HD1 47 CYS HB3 4.43 #peak 1096 #SUP 0.94 #QF 0.94 138 LEU HD1 147 CYS HB3 4.43 #peak 1096 #SUP 0.94 #QF 0.94 23 THR HB 38 LEU HD1 5.51 #peak 1100 #SUP 0.94 #QF 0.21 123 THR HB 138 LEU HD1 5.51 #peak 1100 #SUP 0.94 #QF 0.21 23 THR HG1 38 LEU HD1 4.52 #peak 1101 #SUP 0.92 #QF 0.92 123 THR HG1 138 LEU HD1 4.52 #peak 1101 #SUP 0.92 #QF 0.92 38 LEU HA 38 LEU HD1 4.43 #peak 1102 #SUP 0.97 #QF 0.92 138 LEU HA 138 LEU HD1 4.43 #peak 1102 #SUP 0.97 #QF 0.92 38 LEU HD1 47 CYS HA 4.79 #peak 1102 #SUP 0.97 #QF 0.92 138 LEU HD1 147 CYS HA 4.79 #peak 1102 #SUP 0.97 #QF 0.92 19 THR HG1 38 LEU HD1 5.68 #peak 1103 #SUP 0.98 #QF 0.98 119 THR HG1 138 LEU HD1 5.68 #peak 1103 #SUP 0.98 #QF 0.98 38 LEU HD1 45 PHE HZ 4.96 #peak 1105 #SUP 1.00 138 LEU HD1 145 PHE HZ 4.96 #peak 1105 #SUP 1.00 23 THR H 38 LEU HD1 5.67 #peak 1107 #SUP 0.99 #QF 0.99 123 THR H 138 LEU HD1 5.67 #peak 1107 #SUP 0.99 #QF 0.99 22 ILE H 38 LEU HD1 6.01 #peak 1108 #SUP 1.00 122 ILE H 138 LEU HD1 6.01 #peak 1108 #SUP 1.00 38 LEU HD1 39 ASN H 4.82 #peak 1109 #SUP 0.99 #QF 0.99 138 LEU HD1 139 ASN H 4.82 #peak 1109 #SUP 0.99 #QF 0.99 38 LEU HD1 47 CYS H 5.62 #peak 1110 #SUP 1.00 138 LEU HD1 147 CYS H 5.62 #peak 1110 #SUP 1.00 38 LEU H 38 LEU HD1 5.03 #peak 1111 #SUP 1.00 138 LEU H 138 LEU HD1 5.03 #peak 1111 #SUP 1.00 19 THR HG2 38 LEU HD2 3.10 #peak 1112 #SUP 0.99 #QF 0.99 119 THR HG2 138 LEU HD2 3.10 #peak 1112 #SUP 0.99 #QF 0.99 35 THR HG2 138 LEU HD2 4.19 #peak 1113 #SUP 0.99 #QF 0.37 38 LEU HD2 135 THR HG2 4.19 #peak 1113 #SUP 0.99 #QF 0.37 38 LEU HB 38 LEU HD2 3.15 #peak 1114 #SUP 1.00 138 LEU HB 138 LEU HD2 3.15 #peak 1114 #SUP 1.00 38 LEU HD2 45 PHE HB2 4.77 #peak 1115 #SUP 1.00 138 LEU HD2 145 PHE HB2 4.77 #peak 1115 #SUP 1.00 38 LEU HD2 39 ASN HB 4.82 #peak 1116 #SUP 0.98 #QF 0.91 138 LEU HD2 139 ASN HB 4.82 #peak 1116 #SUP 0.98 #QF 0.91 38 LEU HD2 47 CYS HB2 5.13 #peak 1116 #SUP 0.98 #QF 0.91 138 LEU HD2 147 CYS HB2 5.13 #peak 1116 #SUP 0.98 #QF 0.91 38 LEU HD2 45 PHE HB3 4.77 #peak 1117 #SUP 1.00 138 LEU HD2 145 PHE HB3 4.77 #peak 1117 #SUP 1.00 19 THR HA 38 LEU HD2 4.52 #peak 1118 #SUP 1.00 119 THR HA 138 LEU HD2 4.52 #peak 1118 #SUP 1.00 19 THR HB 38 LEU HD2 3.81 #peak 1119 #SUP 1.00 119 THR HB 138 LEU HD2 3.81 #peak 1119 #SUP 1.00 23 THR HG1 38 LEU HD2 5.23 #peak 1120 #SUP 0.95 #QF 0.95 123 THR HG1 138 LEU HD2 5.23 #peak 1120 #SUP 0.95 #QF 0.95 37 VAL HA 38 LEU HD2 5.91 #peak 1122 #SUP 0.77 #QF 0.77 137 VAL HA 138 LEU HD2 5.91 #peak 1122 #SUP 0.77 #QF 0.77 35 THR HA 138 LEU HD2 3.81 #peak 1123 #SUP 0.90 #QF 0.90 38 LEU HD2 135 THR HA 3.81 #peak 1123 #SUP 0.90 #QF 0.90 38 LEU HD2 39 ASN HA 3.92 #peak 1124 #SUP 0.99 #QF 0.99 138 LEU HD2 139 ASN HA 3.92 #peak 1124 #SUP 0.99 #QF 0.99 38 LEU HA 38 LEU HD2 4.11 #peak 1125 #SUP 0.94 #QF 0.94 138 LEU HA 138 LEU HD2 4.11 #peak 1125 #SUP 0.94 #QF 0.94 19 THR HG1 38 LEU HD2 4.77 #peak 1126 #SUP 1.00 119 THR HG1 138 LEU HD2 4.77 #peak 1126 #SUP 1.00 38 LEU HD2 45 PHE HD 4.50 #peak 1127 #SUP 1.00 138 LEU HD2 145 PHE HD 4.50 #peak 1127 #SUP 1.00 38 LEU HD2 45 PHE HZ 6.50 #peak 1128 #SUP 0.99 #QF 0.82 138 LEU HD2 145 PHE HZ 6.50 #peak 1128 #SUP 0.99 #QF 0.82 38 LEU HD2 45 PHE HE 5.22 #peak 1129 #SUP 1.00 138 LEU HD2 145 PHE HE 5.22 #peak 1129 #SUP 1.00 35 THR H 138 LEU HD2 4.97 #peak 1130 #SUP 0.96 #QF 0.96 38 LEU HD2 135 THR H 4.97 #peak 1130 #SUP 0.96 #QF 0.96 38 LEU HD2 40 ALA H 4.47 #peak 1131 #SUP 0.99 #QF 0.99 138 LEU HD2 140 ALA H 4.47 #peak 1131 #SUP 0.99 #QF 0.99 36 ILE H 138 LEU HD2 4.10 #peak 1133 #SUP 0.93 #QF 0.22 38 LEU HD2 136 ILE H 4.10 #peak 1133 #SUP 0.93 #QF 0.22 38 LEU HD2 39 ASN H 4.25 #peak 1133 #SUP 0.93 #QF 0.22 138 LEU HD2 139 ASN H 4.25 #peak 1133 #SUP 0.93 #QF 0.22 38 LEU HD2 48 ASN H 6.50 #peak 1134 #SUP 0.98 #QF 0.98 138 LEU HD2 148 ASN H 6.50 #peak 1134 #SUP 0.98 #QF 0.98 38 LEU H 38 LEU HD2 4.72 #peak 1135 #SUP 0.99 #QF 0.99 138 LEU H 138 LEU HD2 4.72 #peak 1135 #SUP 0.99 #QF 0.99 39 ASN HA 40 ALA HB 5.38 #peak 1137 #SUP 0.99 #QF 0.89 139 ASN HA 140 ALA HB 5.38 #peak 1137 #SUP 0.99 #QF 0.89 39 ASN HB 41 LYS HD 5.45 #peak 1144 #SUP 0.96 #QF 0.73 139 ASN HB 141 LYS HD 5.45 #peak 1144 #SUP 0.96 #QF 0.73 39 ASN HB 41 LYS HB 5.60 #peak 1145 #SUP 0.84 #QF 0.84 139 ASN HB 141 LYS HB 5.60 #peak 1145 #SUP 0.84 #QF 0.84 38 LEU HA 39 ASN HB 5.03 #peak 1147 #SUP 0.93 #QF 0.93 138 LEU HA 139 ASN HB 5.03 #peak 1147 #SUP 0.93 #QF 0.93 40 ALA HA 45 PHE HA 4.22 #peak 1156 #SUP 1.00 140 ALA HA 145 PHE HA 4.22 #peak 1156 #SUP 1.00 38 LEU HD2 40 ALA HB 4.04 #peak 1160 #SUP 0.99 #QF 0.99 138 LEU HD2 140 ALA HB 4.04 #peak 1160 #SUP 0.99 #QF 0.99 19 THR HG2 40 ALA HB 3.53 #peak 1161 #SUP 0.88 #QF 0.88 119 THR HG2 140 ALA HB 3.53 #peak 1161 #SUP 0.88 #QF 0.88 40 ALA HB 45 PHE HB2 3.97 #peak 1163 #SUP 0.98 #QF 0.98 140 ALA HB 145 PHE HB2 3.97 #peak 1163 #SUP 0.98 #QF 0.98 40 ALA HB 45 PHE HB3 3.97 #peak 1164 #SUP 1.00 140 ALA HB 145 PHE HB3 3.97 #peak 1164 #SUP 1.00 40 ALA HB 41 LYS HA 5.34 #peak 1165 #SUP 1.00 140 ALA HB 141 LYS HA 5.34 #peak 1165 #SUP 1.00 34 ARG HA 140 ALA HB 4.42 #peak 1166 #SUP 0.44 #QF 0.44 40 ALA HB 134 ARG HA 4.42 #peak 1166 #SUP 0.44 #QF 0.44 40 ALA HB 45 PHE HA 3.97 #peak 1168 #SUP 1.00 140 ALA HB 145 PHE HA 3.97 #peak 1168 #SUP 1.00 15 LYS H 40 ALA HB 6.49 #peak 1170 #SUP 0.92 #QF 0.92 115 LYS H 140 ALA HB 6.49 #peak 1170 #SUP 0.92 #QF 0.92 14 ASP H 40 ALA HB 5.87 #peak 1171 #SUP 1.00 #QF 0.67 114 ASP H 140 ALA HB 5.87 #peak 1171 #SUP 1.00 #QF 0.67 40 ALA HB 44 ILE H 6.16 #peak 1171 #SUP 1.00 #QF 0.67 140 ALA HB 144 ILE H 6.16 #peak 1171 #SUP 1.00 #QF 0.67 40 ALA HB 41 LYS H 3.65 #peak 1173 #SUP 1.00 140 ALA HB 141 LYS H 3.65 #peak 1173 #SUP 1.00 2 THR HG2 3 ASP H 4.49 #peak 1174 #SUP 0.68 #QF 0.68 102 THR HG2 103 ASP H 4.49 #peak 1174 #SUP 0.68 #QF 0.68 41 LYS HB 41 LYS HE 4.41 #peak 1176 #SUP 1.00 141 LYS HB 141 LYS HE 4.41 #peak 1176 #SUP 1.00 40 ALA HA 41 LYS HB 5.34 #peak 1178 #SUP 0.98 #QF 0.98 140 ALA HA 141 LYS HB 5.34 #peak 1178 #SUP 0.98 #QF 0.98 41 LYS HG 42 ASP HB2 4.99 #peak 1188 #SUP 0.97 #QF 0.97 141 LYS HG 142 ASP HB2 4.99 #peak 1188 #SUP 0.97 #QF 0.97 41 LYS HG 42 ASP HB3 4.99 #peak 1192 #SUP 0.97 #QF 0.97 141 LYS HG 142 ASP HB3 4.99 #peak 1192 #SUP 0.97 #QF 0.97 14 ASP HB2 43 GLY HA2 5.69 #peak 1196 #SUP 0.99 #QF 0.99 114 ASP HB2 143 GLY HA2 5.69 #peak 1196 #SUP 0.99 #QF 0.99 14 ASP HB2 43 GLY HA3 5.69 #peak 1200 #SUP 0.94 #QF 0.94 114 ASP HB2 143 GLY HA3 5.69 #peak 1200 #SUP 0.94 #QF 0.94 14 ASP HB3 43 GLY HA3 5.69 #peak 1202 #SUP 1.00 114 ASP HB3 143 GLY HA3 5.69 #peak 1202 #SUP 1.00 13 GLU HA 44 ILE HB 5.21 #peak 1214 #SUP 0.99 #QF 0.99 113 GLU HA 144 ILE HB 5.21 #peak 1214 #SUP 0.99 #QF 0.99 12 GLY H 44 ILE HB 5.74 #peak 1216 #SUP 0.99 #QF 0.99 112 GLY H 144 ILE HB 5.74 #peak 1216 #SUP 0.99 #QF 0.99 43 GLY H 44 ILE HB 6.03 #peak 1219 #SUP 0.98 #QF 0.98 143 GLY H 144 ILE HB 6.03 #peak 1219 #SUP 0.98 #QF 0.98 13 GLU HA 44 ILE HG12 5.03 #peak 1224 #SUP 0.96 #QF 0.94 113 GLU HA 144 ILE HG12 5.03 #peak 1224 #SUP 0.96 #QF 0.94 44 ILE HG12 73 PHE HZ 5.85 #peak 1226 #SUP 1.00 #QF 0.99 144 ILE HG12 173 PHE HZ 5.85 #peak 1226 #SUP 1.00 #QF 0.99 44 ILE H 44 ILE HG12 3.87 #peak 1227 #SUP 1.00 144 ILE H 144 ILE HG12 3.87 #peak 1227 #SUP 1.00 44 ILE HG12 45 PHE H 4.71 #peak 1228 #SUP 0.98 #QF 0.98 144 ILE HG12 145 PHE H 4.71 #peak 1228 #SUP 0.98 #QF 0.98 42 ASP HB2 44 ILE HG13 5.91 #peak 1233 #SUP 0.96 #QF 0.96 142 ASP HB2 144 ILE HG13 5.91 #peak 1233 #SUP 0.96 #QF 0.96 42 ASP HB3 44 ILE HG13 5.91 #peak 1234 #SUP 1.00 #QF 0.75 142 ASP HB3 144 ILE HG13 5.91 #peak 1234 #SUP 1.00 #QF 0.75 13 GLU HA 44 ILE HG13 5.75 #peak 1235 #SUP 0.98 #QF 0.60 113 GLU HA 144 ILE HG13 5.75 #peak 1235 #SUP 0.98 #QF 0.60 42 ASP HA 44 ILE HG13 6.39 #peak 1235 #SUP 0.98 #QF 0.60 142 ASP HA 144 ILE HG13 6.39 #peak 1235 #SUP 0.98 #QF 0.60 40 ALA HA 44 ILE HG13 6.50 #peak 1237 #SUP 0.86 #QF 0.86 140 ALA HA 144 ILE HG13 6.50 #peak 1237 #SUP 0.86 #QF 0.86 44 ILE HG13 73 PHE HZ 5.42 #peak 1238 #SUP 0.98 #QF 0.98 144 ILE HG13 173 PHE HZ 5.42 #peak 1238 #SUP 0.98 #QF 0.98 44 ILE HG13 45 PHE H 5.08 #peak 1240 #SUP 0.99 #QF 0.99 144 ILE HG13 145 PHE H 5.08 #peak 1240 #SUP 0.99 #QF 0.99 44 ILE HG2 44 ILE HG13 3.25 #peak 1241 #SUP 1.00 144 ILE HG2 144 ILE HG13 3.25 #peak 1241 #SUP 1.00 44 ILE HG2 44 ILE HG12 3.45 #peak 1242 #SUP 1.00 144 ILE HG2 144 ILE HG12 3.45 #peak 1242 #SUP 1.00 44 ILE HG2 46 THR HB 6.09 #peak 1246 #SUP 0.94 #QF 0.94 144 ILE HG2 146 THR HB 6.09 #peak 1246 #SUP 0.94 #QF 0.94 13 GLU HA 44 ILE HG2 3.89 #peak 1247 #SUP 1.00 113 GLU HA 144 ILE HG2 3.89 #peak 1247 #SUP 1.00 44 ILE HA 44 ILE HG2 3.33 #peak 1249 #SUP 1.00 144 ILE HA 144 ILE HG2 3.33 #peak 1249 #SUP 1.00 40 ALA HA 44 ILE HG2 5.64 #peak 1250 #SUP 0.98 #QF 0.98 140 ALA HA 144 ILE HG2 5.64 #peak 1250 #SUP 0.98 #QF 0.98 44 ILE HG2 45 PHE HA 4.86 #peak 1251 #SUP 1.00 144 ILE HG2 145 PHE HA 4.86 #peak 1251 #SUP 1.00 44 ILE HG2 45 PHE HD 5.52 #peak 1252 #SUP 1.00 144 ILE HG2 145 PHE HD 5.52 #peak 1252 #SUP 1.00 44 ILE HG2 73 PHE HD 4.55 #peak 1253 #SUP 1.00 144 ILE HG2 173 PHE HD 4.55 #peak 1253 #SUP 1.00 14 ASP H 44 ILE HG2 4.18 #peak 1256 #SUP 1.00 #QF 0.72 114 ASP H 144 ILE HG2 4.18 #peak 1256 #SUP 1.00 #QF 0.72 44 ILE HG2 46 THR H 5.49 #peak 1257 #SUP 0.99 #QF 0.99 144 ILE HG2 146 THR H 5.49 #peak 1257 #SUP 0.99 #QF 0.99 44 ILE HG2 45 PHE H 3.46 #peak 1258 #SUP 0.99 #QF 0.99 144 ILE HG2 145 PHE H 3.46 #peak 1258 #SUP 0.99 #QF 0.99 44 ILE HB 44 ILE HD1 3.28 #peak 1262 #SUP 1.00 144 ILE HB 144 ILE HD1 3.28 #peak 1262 #SUP 1.00 42 ASP HB2 44 ILE HD1 5.82 #peak 1264 #SUP 0.97 #QF 0.97 142 ASP HB2 144 ILE HD1 5.82 #peak 1264 #SUP 0.97 #QF 0.97 42 ASP HB3 44 ILE HD1 5.82 #peak 1265 #SUP 0.97 #QF 0.62 142 ASP HB3 144 ILE HD1 5.82 #peak 1265 #SUP 0.97 #QF 0.62 44 ILE HD1 46 THR HB 6.50 #peak 1267 #SUP 0.98 #QF 0.98 144 ILE HD1 146 THR HB 6.50 #peak 1267 #SUP 0.98 #QF 0.98 13 GLU HA 44 ILE HD1 4.63 #peak 1268 #SUP 1.00 113 GLU HA 144 ILE HD1 4.63 #peak 1268 #SUP 1.00 44 ILE HA 44 ILE HD1 3.96 #peak 1269 #SUP 0.99 #QF 0.99 144 ILE HA 144 ILE HD1 3.96 #peak 1269 #SUP 0.99 #QF 0.99 44 ILE HD1 73 PHE HD 5.04 #peak 1270 #SUP 1.00 144 ILE HD1 173 PHE HD 5.04 #peak 1270 #SUP 1.00 44 ILE HD1 73 PHE HZ 4.08 #peak 1271 #SUP 1.00 #QF 0.99 144 ILE HD1 173 PHE HZ 4.08 #peak 1271 #SUP 1.00 #QF 0.99 12 GLY H 44 ILE HD1 5.95 #peak 1272 #SUP 1.00 112 GLY H 144 ILE HD1 5.95 #peak 1272 #SUP 1.00 44 ILE H 44 ILE HD1 4.12 #peak 1273 #SUP 1.00 144 ILE H 144 ILE HD1 4.12 #peak 1273 #SUP 1.00 44 ILE HD1 45 PHE H 4.62 #peak 1275 #SUP 0.99 #QF 0.99 144 ILE HD1 145 PHE H 4.62 #peak 1275 #SUP 0.99 #QF 0.99 43 GLY H 44 ILE HD1 6.03 #peak 1276 #SUP 1.00 143 GLY H 144 ILE HD1 6.03 #peak 1276 #SUP 1.00 40 ALA HA 45 PHE HB2 5.25 #peak 1290 #SUP 1.00 140 ALA HA 145 PHE HB2 5.25 #peak 1290 #SUP 1.00 40 ALA HA 45 PHE HB3 5.25 #peak 1299 #SUP 0.99 #QF 0.99 140 ALA HA 145 PHE HB3 5.25 #peak 1299 #SUP 0.99 #QF 0.99 11 VAL HA 46 THR HB 4.19 #peak 1306 #SUP 0.95 #QF 0.95 111 VAL HA 146 THR HB 4.19 #peak 1306 #SUP 0.95 #QF 0.95 46 THR HB 47 CYS H 4.48 #peak 1311 #SUP 1.00 146 THR HB 147 CYS H 4.48 #peak 1311 #SUP 1.00 41 LYS HD 46 THR HG2 4.05 #peak 1313 #SUP 0.50 #QF 0.50 141 LYS HD 146 THR HG2 4.05 #peak 1313 #SUP 0.50 #QF 0.50 44 ILE HB 46 THR HG2 5.47 #peak 1314 #SUP 0.83 #QF 0.83 144 ILE HB 146 THR HG2 5.47 #peak 1314 #SUP 0.83 #QF 0.83 39 ASN HB 46 THR HG2 4.96 #peak 1315 #SUP 1.00 139 ASN HB 146 THR HG2 4.96 #peak 1315 #SUP 1.00 41 LYS HE 46 THR HG2 5.50 #peak 1316 #SUP 1.00 141 LYS HE 146 THR HG2 5.50 #peak 1316 #SUP 1.00 9 ARG HD 46 THR HG2 5.18 #peak 1317 #SUP 0.99 #QF 0.99 109 ARG HD 146 THR HG2 5.18 #peak 1317 #SUP 0.99 #QF 0.99 46 THR HA 46 THR HG2 3.29 #peak 1319 #SUP 1.00 146 THR HA 146 THR HG2 3.29 #peak 1319 #SUP 1.00 40 ALA HA 46 THR HG2 5.87 #peak 1320 #SUP 0.97 #QF 0.97 140 ALA HA 146 THR HG2 5.87 #peak 1320 #SUP 0.97 #QF 0.97 45 PHE HA 46 THR HG2 4.90 #peak 1322 #SUP 0.97 #QF 0.97 145 PHE HA 146 THR HG2 4.90 #peak 1322 #SUP 0.97 #QF 0.97 45 PHE HD 46 THR HG2 5.38 #peak 1323 #SUP 0.99 #QF 0.99 145 PHE HD 146 THR HG2 5.38 #peak 1323 #SUP 0.99 #QF 0.99 39 ASN HD22 46 THR HG2 4.99 #peak 1324 #SUP 0.64 #QF 0.64 139 ASN HD22 146 THR HG2 4.99 #peak 1324 #SUP 0.64 #QF 0.64 9 ARG HE 46 THR HG2 5.36 #peak 1327 #SUP 0.75 #QF 0.75 109 ARG HE 146 THR HG2 5.36 #peak 1327 #SUP 0.75 #QF 0.75 39 ASN HD21 46 THR HG2 4.99 #peak 1328 #SUP 0.95 #QF 0.95 139 ASN HD21 146 THR HG2 4.99 #peak 1328 #SUP 0.95 #QF 0.95 46 THR H 46 THR HG2 4.02 #peak 1329 #SUP 1.00 146 THR H 146 THR HG2 4.02 #peak 1329 #SUP 1.00 39 ASN H 46 THR HG2 4.65 #peak 1330 #SUP 0.97 #QF 0.97 139 ASN H 146 THR HG2 4.65 #peak 1330 #SUP 0.97 #QF 0.97 10 ILE H 46 THR HG2 5.97 #peak 1331 #SUP 0.99 #QF 0.99 110 ILE H 146 THR HG2 5.97 #peak 1331 #SUP 0.99 #QF 0.99 46 THR HG2 47 CYS H 4.29 #peak 1332 #SUP 1.00 146 THR HG2 147 CYS H 4.29 #peak 1332 #SUP 1.00 37 VAL HG1 47 CYS HA 6.20 #peak 1334 #SUP 1.00 137 VAL HG1 147 CYS HA 6.20 #peak 1334 #SUP 1.00 38 LEU HB 47 CYS HA 5.49 #peak 1336 #SUP 1.00 #QF 0.98 138 LEU HB 147 CYS HA 5.49 #peak 1336 #SUP 1.00 #QF 0.98 38 LEU HG 47 CYS HA 6.23 #peak 1336 #SUP 1.00 #QF 0.98 138 LEU HG 147 CYS HA 6.23 #peak 1336 #SUP 1.00 #QF 0.98 37 VAL H 47 CYS HA 5.77 #peak 1339 #SUP 0.96 #QF 0.74 137 VAL H 147 CYS HA 5.77 #peak 1339 #SUP 0.96 #QF 0.74 39 ASN H 47 CYS HA 5.98 #peak 1339 #SUP 0.96 #QF 0.74 139 ASN H 147 CYS HA 5.98 #peak 1339 #SUP 0.96 #QF 0.74 22 ILE HD1 47 CYS HB2 6.23 #peak 1343 #SUP 0.97 #QF 0.94 122 ILE HD1 147 CYS HB2 6.23 #peak 1343 #SUP 0.97 #QF 0.94 36 ILE HD1 47 CYS HB2 6.50 #peak 1343 #SUP 0.97 #QF 0.94 136 ILE HD1 147 CYS HB2 6.50 #peak 1343 #SUP 0.97 #QF 0.94 19 THR HG2 47 CYS HB2 5.67 #peak 1344 #SUP 1.00 #QF 0.98 119 THR HG2 147 CYS HB2 5.67 #peak 1344 #SUP 1.00 #QF 0.98 38 LEU HB 47 CYS HB2 5.71 #peak 1346 #SUP 1.00 138 LEU HB 147 CYS HB2 5.71 #peak 1346 #SUP 1.00 10 ILE HB 47 CYS HB2 4.70 #peak 1347 #SUP 0.99 #QF 0.99 110 ILE HB 147 CYS HB2 4.70 #peak 1347 #SUP 0.99 #QF 0.99 22 ILE HG2 47 CYS HB3 5.22 #peak 1354 #SUP 1.00 #QF 0.94 122 ILE HG2 147 CYS HB3 5.22 #peak 1354 #SUP 1.00 #QF 0.94 22 ILE HD1 47 CYS HB3 6.19 #peak 1355 #SUP 0.98 #QF 0.93 122 ILE HD1 147 CYS HB3 6.19 #peak 1355 #SUP 0.98 #QF 0.93 36 ILE HD1 47 CYS HB3 6.50 #peak 1355 #SUP 0.98 #QF 0.93 136 ILE HD1 147 CYS HB3 6.50 #peak 1355 #SUP 0.98 #QF 0.93 23 THR HG1 47 CYS HB3 5.64 #peak 1359 #SUP 0.28 #QF 0.28 123 THR HG1 147 CYS HB3 5.64 #peak 1359 #SUP 0.28 #QF 0.28 45 PHE HD 47 CYS HB3 5.72 #peak 1361 #SUP 0.94 #QF 0.94 145 PHE HD 147 CYS HB3 5.72 #peak 1361 #SUP 0.94 #QF 0.94 45 PHE HE 47 CYS HB3 5.66 #peak 1362 #SUP 1.00 145 PHE HE 147 CYS HB3 5.66 #peak 1362 #SUP 1.00 10 ILE HD1 48 ASN HA 5.49 #peak 1365 #SUP 0.57 #QF 0.57 110 ILE HD1 148 ASN HA 5.49 #peak 1365 #SUP 0.57 #QF 0.57 9 ARG HG3 48 ASN HA 6.08 #peak 1366 #SUP 1.00 #QF 0.52 109 ARG HG3 148 ASN HA 6.08 #peak 1366 #SUP 1.00 #QF 0.52 9 ARG HB 48 ASN HA 5.37 #peak 1367 #SUP 0.90 #QF 0.87 109 ARG HB 148 ASN HA 5.37 #peak 1367 #SUP 0.90 #QF 0.87 9 ARG HG2 48 ASN HA 6.08 #peak 1367 #SUP 0.90 #QF 0.87 109 ARG HG2 148 ASN HA 6.08 #peak 1367 #SUP 0.90 #QF 0.87 37 VAL HB 48 ASN HB3 4.61 #peak 1384 #SUP 1.00 137 VAL HB 148 ASN HB3 4.61 #peak 1384 #SUP 1.00 36 ILE HD1 49 LEU HA 4.99 #peak 1392 #SUP 1.00 #QF 0.93 136 ILE HD1 149 LEU HA 4.99 #peak 1392 #SUP 1.00 #QF 0.93 36 ILE HB 49 LEU HA 5.39 #peak 1395 #SUP 1.00 #QF 0.98 136 ILE HB 149 LEU HA 5.39 #peak 1395 #SUP 1.00 #QF 0.98 36 ILE HA 49 LEU HA 4.36 #peak 1397 #SUP 0.87 #QF 0.87 136 ILE HA 149 LEU HA 4.36 #peak 1397 #SUP 0.87 #QF 0.87 49 LEU HA 50 MET HA 4.66 #peak 1398 #SUP 0.82 #QF 0.82 149 LEU HA 150 MET HA 4.66 #peak 1398 #SUP 0.82 #QF 0.82 8 ILE HD1 49 LEU HB3 4.88 #peak 1401 #SUP 1.00 #QF 0.95 108 ILE HD1 149 LEU HB3 4.88 #peak 1401 #SUP 1.00 #QF 0.95 26 ILE HD1 49 LEU HB3 5.49 #peak 1401 #SUP 1.00 #QF 0.95 126 ILE HD1 149 LEU HB3 5.49 #peak 1401 #SUP 1.00 #QF 0.95 10 ILE HG13 49 LEU HB3 5.46 #peak 1403 #SUP 0.82 #QF 0.82 110 ILE HG13 149 LEU HB3 5.46 #peak 1403 #SUP 0.82 #QF 0.82 8 ILE HB 49 LEU HB3 4.19 #peak 1405 #SUP 1.00 #QF 0.94 108 ILE HB 149 LEU HB3 4.19 #peak 1405 #SUP 1.00 #QF 0.94 9 ARG HA 49 LEU HB3 6.18 #peak 1407 #SUP 1.00 #QF 0.70 109 ARG HA 149 LEU HB3 6.18 #peak 1407 #SUP 1.00 #QF 0.70 48 ASN HA 49 LEU HB3 6.41 #peak 1407 #SUP 1.00 #QF 0.70 148 ASN HA 149 LEU HB3 6.41 #peak 1407 #SUP 1.00 #QF 0.70 49 LEU HB3 50 MET H 5.12 #peak 1408 #SUP 1.00 149 LEU HB3 150 MET H 5.12 #peak 1408 #SUP 1.00 48 ASN HA 49 LEU HB2 5.80 #peak 1416 #SUP 0.99 #QF 0.99 148 ASN HA 149 LEU HB2 5.80 #peak 1416 #SUP 0.99 #QF 0.99 49 LEU HB2 50 MET HA 5.89 #peak 1417 #SUP 1.00 149 LEU HB2 150 MET HA 5.89 #peak 1417 #SUP 1.00 8 ILE H 49 LEU HG 5.64 #peak 1423 #SUP 1.00 108 ILE H 149 LEU HG 5.64 #peak 1423 #SUP 1.00 49 LEU HD1 62 LEU HD2 5.97 #peak 1424 #SUP 0.96 #QF 0.96 149 LEU HD1 162 LEU HD2 5.97 #peak 1424 #SUP 0.96 #QF 0.96 26 ILE HG2 49 LEU HD1 3.54 #peak 1425 #SUP 0.95 #QF 0.66 126 ILE HG2 149 LEU HD1 3.54 #peak 1425 #SUP 0.95 #QF 0.66 26 ILE HD1 49 LEU HD1 3.98 #peak 1425 #SUP 0.95 #QF 0.66 126 ILE HD1 149 LEU HD1 3.98 #peak 1425 #SUP 0.95 #QF 0.66 33 ILE HG12 49 LEU HD1 4.00 #peak 1427 #SUP 0.99 #QF 0.42 26 ILE HA 49 LEU HD1 5.79 #peak 1428 #SUP 0.59 #QF 0.59 126 ILE HA 149 LEU HD1 5.79 #peak 1428 #SUP 0.59 #QF 0.59 49 LEU HD1 50 MET HG2 6.36 #peak 1429 #SUP 0.96 #QF 0.96 149 LEU HD1 150 MET HG2 6.36 #peak 1429 #SUP 0.96 #QF 0.96 33 ILE HA 49 LEU HD1 4.56 #peak 1430 #SUP 0.71 #QF 0.71 133 ILE HA 149 LEU HD1 4.56 #peak 1430 #SUP 0.71 #QF 0.71 35 THR HB 49 LEU HD1 6.08 #peak 1431 #SUP 0.95 #QF 0.95 135 THR HB 149 LEU HD1 6.08 #peak 1431 #SUP 0.95 #QF 0.95 36 ILE HA 49 LEU HD1 4.48 #peak 1433 #SUP 0.68 #QF 0.68 136 ILE HA 149 LEU HD1 4.48 #peak 1433 #SUP 0.68 #QF 0.68 49 LEU HA 49 LEU HD1 3.55 #peak 1434 #SUP 0.95 #QF 0.95 149 LEU HA 149 LEU HD1 3.55 #peak 1434 #SUP 0.95 #QF 0.95 48 ASN HA 49 LEU HD1 6.18 #peak 1435 #SUP 0.97 #QF 0.97 148 ASN HA 149 LEU HD1 6.18 #peak 1435 #SUP 0.97 #QF 0.97 49 LEU HD1 50 MET HA 5.54 #peak 1436 #SUP 1.00 #QF 0.63 149 LEU HD1 150 MET HA 5.54 #peak 1436 #SUP 1.00 #QF 0.63 29 PHE HE 49 LEU HD1 5.31 #peak 1437 #SUP 0.96 #QF 0.96 129 PHE HE 149 LEU HD1 5.31 #peak 1437 #SUP 0.96 #QF 0.96 35 THR H 49 LEU HD1 4.82 #peak 1438 #SUP 0.95 #QF 0.95 135 THR H 149 LEU HD1 4.82 #peak 1438 #SUP 0.95 #QF 0.95 33 ILE H 49 LEU HD1 5.65 #peak 1439 #SUP 0.94 #QF 0.94 133 ILE H 149 LEU HD1 5.65 #peak 1439 #SUP 0.94 #QF 0.94 49 LEU HD1 50 MET H 3.72 #peak 1440 #SUP 1.00 149 LEU HD1 150 MET H 3.72 #peak 1440 #SUP 1.00 49 LEU H 49 LEU HD1 4.81 #peak 1441 #SUP 1.00 149 LEU H 149 LEU HD1 4.81 #peak 1441 #SUP 1.00 8 ILE H 49 LEU HD1 5.51 #peak 1442 #SUP 0.97 #QF 0.97 108 ILE H 149 LEU HD1 5.51 #peak 1442 #SUP 0.97 #QF 0.97 49 LEU HD2 62 LEU HB3 4.02 #peak 1445 #SUP 0.48 #QF 0.30 149 LEU HD2 162 LEU HB3 4.02 #peak 1445 #SUP 0.48 #QF 0.30 62 LEU HB3 66 LEU HD1 4.22 #peak 1445 #SUP 0.48 #QF 0.30 162 LEU HB3 166 LEU HD1 4.22 #peak 1445 #SUP 0.48 #QF 0.30 49 LEU HB2 49 LEU HD2 3.54 #peak 1447 #SUP 1.00 149 LEU HB2 149 LEU HD2 3.54 #peak 1447 #SUP 1.00 49 LEU HB3 49 LEU HD2 3.64 #peak 1448 #SUP 1.00 149 LEU HB3 149 LEU HD2 3.64 #peak 1448 #SUP 1.00 49 LEU HA 49 LEU HD2 4.50 #peak 1451 #SUP 0.98 #QF 0.98 149 LEU HA 149 LEU HD2 4.50 #peak 1451 #SUP 0.98 #QF 0.98 7 GLY HA2 49 LEU HD2 6.03 #peak 1452 #SUP 0.81 #QF 0.32 107 GLY HA2 149 LEU HD2 6.03 #peak 1452 #SUP 0.81 #QF 0.32 49 LEU HD2 50 MET HA 6.34 #peak 1452 #SUP 0.81 #QF 0.32 149 LEU HD2 150 MET HA 6.34 #peak 1452 #SUP 0.81 #QF 0.32 49 LEU HD2 50 MET H 4.84 #peak 1455 #SUP 0.97 #QF 0.97 149 LEU HD2 150 MET H 4.84 #peak 1455 #SUP 0.97 #QF 0.97 8 ILE H 49 LEU HD2 5.35 #peak 1456 #SUP 0.97 #QF 0.97 108 ILE H 149 LEU HD2 5.35 #peak 1456 #SUP 0.97 #QF 0.97 49 LEU H 49 LEU HD2 4.92 #peak 1457 #SUP 1.00 149 LEU H 149 LEU HD2 4.92 #peak 1457 #SUP 1.00 6 ALA HB 50 MET HA 6.36 #peak 1460 #SUP 1.00 #QF 0.84 106 ALA HB 150 MET HA 6.36 #peak 1460 #SUP 1.00 #QF 0.84 49 LEU HG 50 MET HA 5.34 #peak 1461 #SUP 1.00 149 LEU HG 150 MET HA 5.34 #peak 1461 #SUP 1.00 8 ILE H 50 MET HA 4.89 #peak 1465 #SUP 0.97 #QF 0.97 108 ILE H 150 MET HA 4.89 #peak 1465 #SUP 0.97 #QF 0.97 50 MET HG3 78 LEU HD1 5.16 #peak 1477 #SUP 0.99 #QF 0.69 150 MET HG3 178 LEU HD1 5.16 #peak 1477 #SUP 0.99 #QF 0.69 5 LEU HD2 50 MET HG3 4.67 #peak 1478 #SUP 1.00 105 LEU HD2 150 MET HG3 4.67 #peak 1478 #SUP 1.00 35 THR HG2 50 MET HG3 4.40 #peak 1479 #SUP 1.00 135 THR HG2 150 MET HG3 4.40 #peak 1479 #SUP 1.00 50 MET HG3 81 LEU HB3 6.50 #peak 1480 #SUP 0.84 #QF 0.41 150 MET HG3 181 LEU HB3 6.50 #peak 1480 #SUP 0.84 #QF 0.41 115 LYS HB3 118 MET HB2 6.50 #peak 1481 #SUP 0.69 #QF 0.35 118 MET HB2 122 ILE HB 6.50 #peak 1481 #SUP 0.69 #QF 0.35 35 THR HB 50 MET HG3 4.28 #peak 1484 #SUP 1.00 135 THR HB 150 MET HG3 4.28 #peak 1484 #SUP 1.00 50 MET HA 50 MET HG3 4.24 #peak 1485 #SUP 1.00 150 MET HA 150 MET HG3 4.24 #peak 1485 #SUP 1.00 35 THR H 50 MET HG3 5.75 #peak 1486 #SUP 1.00 135 THR H 150 MET HG3 5.75 #peak 1486 #SUP 1.00 50 MET H 50 MET HG3 5.01 #peak 1487 #SUP 1.00 150 MET H 150 MET HG3 5.01 #peak 1487 #SUP 1.00 50 MET HG3 51 ILE H 5.57 #peak 1488 #SUP 1.00 150 MET HG3 151 ILE H 5.57 #peak 1488 #SUP 1.00 8 ILE H 50 MET HG3 6.08 #peak 1489 #SUP 0.98 #QF 0.98 108 ILE H 150 MET HG3 6.08 #peak 1489 #SUP 0.98 #QF 0.98 35 THR HG2 50 MET HG2 4.58 #peak 1491 #SUP 1.00 135 THR HG2 150 MET HG2 4.58 #peak 1491 #SUP 1.00 49 LEU HG 50 MET HG2 6.50 #peak 1492 #SUP 0.86 #QF 0.41 149 LEU HG 150 MET HG2 6.50 #peak 1492 #SUP 0.86 #QF 0.41 35 THR HB 50 MET HG2 4.13 #peak 1496 #SUP 0.96 #QF 0.96 135 THR HB 150 MET HG2 4.13 #peak 1496 #SUP 0.96 #QF 0.96 7 GLY HA3 50 MET HG2 5.81 #peak 1497 #SUP 0.90 #QF 0.90 107 GLY HA3 150 MET HG2 5.81 #peak 1497 #SUP 0.90 #QF 0.90 49 LEU HA 50 MET HG2 5.78 #peak 1498 #SUP 0.94 #QF 0.94 149 LEU HA 150 MET HG2 5.78 #peak 1498 #SUP 0.94 #QF 0.94 50 MET HA 50 MET HG2 4.17 #peak 1499 #SUP 0.99 #QF 0.99 150 MET HA 150 MET HG2 4.17 #peak 1499 #SUP 0.99 #QF 0.99 50 MET H 50 MET HG2 4.69 #peak 1500 #SUP 0.96 #QF 0.96 150 MET H 150 MET HG2 4.69 #peak 1500 #SUP 0.96 #QF 0.96 8 ILE H 50 MET HG2 5.23 #peak 1501 #SUP 0.99 #QF 0.99 108 ILE H 150 MET HG2 5.23 #peak 1501 #SUP 0.99 #QF 0.99 50 MET HE 81 LEU HD1 3.20 #peak 1503 #SUP 0.86 #QF 0.61 150 MET HE 181 LEU HD1 3.20 #peak 1503 #SUP 0.86 #QF 0.61 50 MET HE 81 LEU HD2 3.46 #peak 1503 #SUP 0.86 #QF 0.61 150 MET HE 181 LEU HD2 3.46 #peak 1503 #SUP 0.86 #QF 0.61 5 LEU HD2 50 MET HE 3.17 #peak 1504 #SUP 0.99 #QF 0.99 105 LEU HD2 150 MET HE 3.17 #peak 1504 #SUP 0.99 #QF 0.99 50 MET HE 51 ILE HG13 5.00 #peak 1505 #SUP 0.75 #QF 0.75 150 MET HE 151 ILE HG13 5.00 #peak 1505 #SUP 0.75 #QF 0.75 5 LEU HG 50 MET HE 3.12 #peak 1506 #SUP 0.97 #QF 0.97 105 LEU HG 150 MET HE 3.12 #peak 1506 #SUP 0.97 #QF 0.97 50 MET HG2 50 MET HE 3.78 #peak 1507 #SUP 1.00 150 MET HG2 150 MET HE 3.78 #peak 1507 #SUP 1.00 50 MET HG3 50 MET HE 3.56 #peak 1508 #SUP 0.96 #QF 0.96 150 MET HG3 150 MET HE 3.56 #peak 1508 #SUP 0.96 #QF 0.96 50 MET HE 83 HIS HB2 5.22 #peak 1510 #SUP 0.83 #QF 0.83 150 MET HE 183 HIS HB2 5.22 #peak 1510 #SUP 0.83 #QF 0.83 7 GLY HA3 50 MET HE 4.23 #peak 1511 #SUP 0.99 #QF 0.99 107 GLY HA3 150 MET HE 4.23 #peak 1511 #SUP 0.99 #QF 0.99 35 THR HB 50 MET HE 5.09 #peak 1512 #SUP 1.00 135 THR HB 150 MET HE 5.09 #peak 1512 #SUP 1.00 50 MET HE 81 LEU HA 4.85 #peak 1513 #SUP 1.00 150 MET HE 181 LEU HA 4.85 #peak 1513 #SUP 1.00 5 LEU HA 50 MET HE 4.76 #peak 1514 #SUP 1.00 105 LEU HA 150 MET HE 4.76 #peak 1514 #SUP 1.00 6 ALA HA 50 MET HE 4.21 #peak 1516 #SUP 0.89 #QF 0.89 106 ALA HA 150 MET HE 4.21 #peak 1516 #SUP 0.89 #QF 0.89 49 LEU HA 50 MET HE 6.05 #peak 1517 #SUP 0.99 #QF 0.99 149 LEU HA 150 MET HE 6.05 #peak 1517 #SUP 0.99 #QF 0.99 50 MET HE 52 PHE HA 6.22 #peak 1518 #SUP 0.72 #QF 0.72 150 MET HE 152 PHE HA 6.22 #peak 1518 #SUP 0.72 #QF 0.72 7 GLY HA2 50 MET HE 4.12 #peak 1519 #SUP 1.00 #QF 0.97 107 GLY HA2 150 MET HE 4.12 #peak 1519 #SUP 1.00 #QF 0.97 50 MET HA 50 MET HE 4.33 #peak 1519 #SUP 1.00 #QF 0.97 150 MET HA 150 MET HE 4.33 #peak 1519 #SUP 1.00 #QF 0.97 4 PHE HD 50 MET HE 6.35 #peak 1522 #SUP 0.99 #QF 0.99 104 PHE HD 150 MET HE 6.35 #peak 1522 #SUP 0.99 #QF 0.99 35 THR H 50 MET HE 5.99 #peak 1523 #SUP 0.98 #QF 0.98 135 THR H 150 MET HE 5.99 #peak 1523 #SUP 0.98 #QF 0.98 50 MET HE 78 LEU H 6.07 #peak 1525 #SUP 0.99 #QF 0.85 150 MET HE 178 LEU H 6.07 #peak 1525 #SUP 0.99 #QF 0.85 50 MET HE 82 GLU H 6.50 #peak 1525 #SUP 0.99 #QF 0.85 150 MET HE 182 GLU H 6.50 #peak 1525 #SUP 0.99 #QF 0.85 7 GLY H 50 MET HE 4.56 #peak 1526 #SUP 1.00 107 GLY H 150 MET HE 4.56 #peak 1526 #SUP 1.00 50 MET HE 51 ILE H 4.53 #peak 1527 #SUP 0.95 #QF 0.95 150 MET HE 151 ILE H 4.53 #peak 1527 #SUP 0.95 #QF 0.95 50 MET H 50 MET HE 4.94 #peak 1528 #SUP 0.87 #QF 0.87 150 MET H 150 MET HE 4.94 #peak 1528 #SUP 0.87 #QF 0.87 6 ALA H 50 MET HE 4.78 #peak 1529 #SUP 1.00 #QF 0.99 106 ALA H 150 MET HE 4.78 #peak 1529 #SUP 1.00 #QF 0.99 8 ILE H 50 MET HE 5.14 #peak 1529 #SUP 1.00 #QF 0.99 108 ILE H 150 MET HE 5.14 #peak 1529 #SUP 1.00 #QF 0.99 33 ILE HA 51 ILE HB 5.86 #peak 1535 #SUP 0.96 #QF 0.96 133 ILE HA 151 ILE HB 5.86 #peak 1535 #SUP 0.96 #QF 0.96 31 THR HA 51 ILE HB 5.93 #peak 1537 #SUP 0.98 #QF 0.98 131 THR HA 151 ILE HB 5.93 #peak 1537 #SUP 0.98 #QF 0.98 51 ILE HB 52 PHE H 4.39 #peak 1539 #SUP 1.00 #QF 0.83 151 ILE HB 152 PHE H 4.39 #peak 1539 #SUP 1.00 #QF 0.83 34 ARG H 51 ILE HB 6.07 #peak 1540 #SUP 1.00 #QF 0.99 134 ARG H 151 ILE HB 6.07 #peak 1540 #SUP 1.00 #QF 0.99 31 THR HB 51 ILE HG12 5.98 #peak 1545 #SUP 1.00 131 THR HB 151 ILE HG12 5.98 #peak 1545 #SUP 1.00 50 MET HA 51 ILE HG12 5.34 #peak 1548 #SUP 0.99 #QF 0.99 150 MET HA 151 ILE HG12 5.34 #peak 1548 #SUP 0.99 #QF 0.99 15 LYS HG 16 ASN H 4.65 #peak 1549 #SUP 1.00 #QF 0.66 115 LYS HG 116 ASN H 4.65 #peak 1549 #SUP 1.00 #QF 0.66 51 ILE HG13 62 LEU HD1 5.14 #peak 1550 #SUP 1.00 151 ILE HG13 162 LEU HD1 5.14 #peak 1550 #SUP 1.00 50 MET HA 51 ILE HG13 5.32 #peak 1555 #SUP 0.99 #QF 0.64 150 MET HA 151 ILE HG13 5.32 #peak 1555 #SUP 0.99 #QF 0.64 51 ILE HG13 52 PHE H 5.78 #peak 1556 #SUP 1.00 151 ILE HG13 152 PHE H 5.78 #peak 1556 #SUP 1.00 6 ALA H 51 ILE HG13 5.69 #peak 1558 #SUP 0.99 #QF 0.99 106 ALA H 151 ILE HG13 5.69 #peak 1558 #SUP 0.99 #QF 0.99 8 ILE HG2 62 LEU HD1 4.98 #peak 1560 #SUP 1.00 #QF 0.47 108 ILE HG2 162 LEU HD1 4.98 #peak 1560 #SUP 1.00 #QF 0.47 51 ILE HG2 62 LEU HD1 5.23 #peak 1560 #SUP 1.00 #QF 0.47 151 ILE HG2 162 LEU HD1 5.23 #peak 1560 #SUP 1.00 #QF 0.47 51 ILE HG2 51 ILE HG12 3.46 #peak 1561 #SUP 0.99 #QF 0.99 151 ILE HG2 151 ILE HG12 3.46 #peak 1561 #SUP 0.99 #QF 0.99 33 ILE HA 51 ILE HG2 3.48 #peak 1564 #SUP 0.94 #QF 0.94 133 ILE HA 151 ILE HG2 3.48 #peak 1564 #SUP 0.94 #QF 0.94 31 THR HB 51 ILE HG2 4.50 #peak 1565 #SUP 1.00 131 THR HB 151 ILE HG2 4.50 #peak 1565 #SUP 1.00 31 THR HA 51 ILE HG2 5.65 #peak 1566 #SUP 1.00 131 THR HA 151 ILE HG2 5.65 #peak 1566 #SUP 1.00 34 ARG HA 51 ILE HG2 5.96 #peak 1566 #SUP 1.00 134 ARG HA 151 ILE HG2 5.96 #peak 1566 #SUP 1.00 51 ILE HA 51 ILE HG2 3.49 #peak 1567 #SUP 1.00 151 ILE HA 151 ILE HG2 3.49 #peak 1567 #SUP 1.00 51 ILE HG2 52 PHE HA 5.77 #peak 1568 #SUP 0.98 #QF 0.98 151 ILE HG2 152 PHE HA 5.77 #peak 1568 #SUP 0.98 #QF 0.98 50 MET HA 51 ILE HG2 4.56 #peak 1569 #SUP 0.95 #QF 0.95 150 MET HA 151 ILE HG2 4.56 #peak 1569 #SUP 0.95 #QF 0.95 20 ASN HD22 151 ILE HG2 5.39 #peak 1570 #SUP 0.95 #QF 0.27 51 ILE HG2 120 ASN HD22 5.39 #peak 1570 #SUP 0.95 #QF 0.27 29 PHE HD 51 ILE HG2 5.55 #peak 1570 #SUP 0.95 #QF 0.27 129 PHE HD 151 ILE HG2 5.55 #peak 1570 #SUP 0.95 #QF 0.27 8 ILE HG2 29 PHE HE 6.08 #peak 1571 #SUP 0.94 #QF 0.23 108 ILE HG2 129 PHE HE 6.08 #peak 1571 #SUP 0.94 #QF 0.23 29 PHE HE 51 ILE HG2 6.50 #peak 1571 #SUP 0.94 #QF 0.23 129 PHE HE 151 ILE HG2 6.50 #peak 1571 #SUP 0.94 #QF 0.23 51 ILE HG2 52 PHE HD 6.50 #peak 1571 #SUP 0.94 #QF 0.23 151 ILE HG2 152 PHE HD 6.50 #peak 1571 #SUP 0.94 #QF 0.23 35 THR H 51 ILE HG2 4.86 #peak 1572 #SUP 0.97 #QF 0.25 135 THR H 151 ILE HG2 4.86 #peak 1572 #SUP 0.97 #QF 0.25 33 ILE H 51 ILE HG2 4.59 #peak 1573 #SUP 1.00 #QF 0.40 133 ILE H 151 ILE HG2 4.59 #peak 1573 #SUP 1.00 #QF 0.40 51 ILE HG2 52 PHE H 4.30 #peak 1573 #SUP 1.00 #QF 0.40 151 ILE HG2 152 PHE H 4.30 #peak 1573 #SUP 1.00 #QF 0.40 34 ARG H 51 ILE HG2 4.15 #peak 1574 #SUP 0.99 #QF 0.99 134 ARG H 151 ILE HG2 4.15 #peak 1574 #SUP 0.99 #QF 0.99 51 ILE H 51 ILE HG2 4.02 #peak 1575 #SUP 0.95 #QF 0.88 151 ILE H 151 ILE HG2 4.02 #peak 1575 #SUP 0.95 #QF 0.88 8 ILE HG2 76 GLU H 4.33 #peak 1575 #SUP 0.95 #QF 0.88 108 ILE HG2 176 GLU H 4.33 #peak 1575 #SUP 0.95 #QF 0.88 51 ILE HD1 62 LEU HD2 4.23 #peak 1576 #SUP 1.00 151 ILE HD1 162 LEU HD2 4.23 #peak 1576 #SUP 1.00 51 ILE HG2 51 ILE HD1 3.35 #peak 1578 #SUP 1.00 151 ILE HG2 151 ILE HD1 3.35 #peak 1578 #SUP 1.00 51 ILE HD1 59 LEU HD1 3.78 #peak 1578 #SUP 1.00 151 ILE HD1 159 LEU HD1 3.78 #peak 1578 #SUP 1.00 51 ILE HB 51 ILE HD1 3.35 #peak 1582 #SUP 0.98 #QF 0.98 151 ILE HB 151 ILE HD1 3.35 #peak 1582 #SUP 0.98 #QF 0.98 7 GLY HA3 51 ILE HD1 6.50 #peak 1585 #SUP 0.75 #QF 0.44 107 GLY HA3 151 ILE HD1 6.50 #peak 1585 #SUP 0.75 #QF 0.44 51 ILE HD1 62 LEU HA 6.50 #peak 1585 #SUP 0.75 #QF 0.44 151 ILE HD1 162 LEU HA 6.50 #peak 1585 #SUP 0.75 #QF 0.44 51 ILE HD1 59 LEU HA 4.67 #peak 1586 #SUP 0.89 #QF 0.89 151 ILE HD1 159 LEU HA 4.67 #peak 1586 #SUP 0.89 #QF 0.89 31 THR HB 51 ILE HD1 4.15 #peak 1588 #SUP 1.00 131 THR HB 151 ILE HD1 4.15 #peak 1588 #SUP 1.00 5 LEU HA 51 ILE HD1 5.57 #peak 1589 #SUP 0.99 #QF 0.73 105 LEU HA 151 ILE HD1 5.57 #peak 1589 #SUP 0.99 #QF 0.73 31 THR HA 51 ILE HD1 5.92 #peak 1589 #SUP 0.99 #QF 0.73 131 THR HA 151 ILE HD1 5.92 #peak 1589 #SUP 0.99 #QF 0.73 7 GLY HA2 51 ILE HD1 5.81 #peak 1591 #SUP 0.99 #QF 0.27 107 GLY HA2 151 ILE HD1 5.81 #peak 1591 #SUP 0.99 #QF 0.27 50 MET HA 51 ILE HD1 6.10 #peak 1591 #SUP 0.99 #QF 0.27 150 MET HA 151 ILE HD1 6.10 #peak 1591 #SUP 0.99 #QF 0.27 29 PHE HD 51 ILE HD1 4.70 #peak 1592 #SUP 0.99 #QF 0.99 129 PHE HD 151 ILE HD1 4.70 #peak 1592 #SUP 0.99 #QF 0.99 51 ILE HD1 58 LYS HZ 4.78 #peak 1593 #SUP 0.84 #QF 0.84 151 ILE HD1 158 LYS HZ 4.78 #peak 1593 #SUP 0.84 #QF 0.84 31 THR H 51 ILE HD1 5.49 #peak 1594 #SUP 0.96 #QF 0.96 131 THR H 151 ILE HD1 5.49 #peak 1594 #SUP 0.96 #QF 0.96 51 ILE HD1 52 PHE H 4.43 #peak 1595 #SUP 0.99 #QF 0.99 151 ILE HD1 152 PHE H 4.43 #peak 1595 #SUP 0.99 #QF 0.99 51 ILE HD1 53 VAL H 5.26 #peak 1596 #SUP 0.98 #QF 0.98 151 ILE HD1 153 VAL H 5.26 #peak 1596 #SUP 0.98 #QF 0.98 51 ILE H 51 ILE HD1 4.12 #peak 1597 #SUP 1.00 151 ILE H 151 ILE HD1 4.12 #peak 1597 #SUP 1.00 6 ALA H 51 ILE HD1 5.01 #peak 1598 #SUP 0.96 #QF 0.96 106 ALA H 151 ILE HD1 5.01 #peak 1598 #SUP 0.96 #QF 0.96 5 LEU HA 52 PHE HA 4.43 #peak 1602 #SUP 1.00 105 LEU HA 152 PHE HA 4.43 #peak 1602 #SUP 1.00 51 ILE HA 52 PHE HA 5.10 #peak 1603 #SUP 0.91 #QF 0.91 151 ILE HA 152 PHE HA 5.10 #peak 1603 #SUP 0.91 #QF 0.91 53 VAL HB 59 LEU HD1 5.75 #peak 1619 #SUP 0.98 #QF 0.98 153 VAL HB 159 LEU HD1 5.75 #peak 1619 #SUP 0.98 #QF 0.98 53 VAL HB 59 LEU HD2 6.10 #peak 1620 #SUP 1.00 153 VAL HB 159 LEU HD2 6.10 #peak 1620 #SUP 1.00 31 THR HG2 53 VAL HB 6.48 #peak 1621 #SUP 1.00 131 THR HG2 153 VAL HB 6.48 #peak 1621 #SUP 1.00 4 PHE HZ 53 VAL HB 5.46 #peak 1623 #SUP 0.87 #QF 0.87 104 PHE HZ 153 VAL HB 5.46 #peak 1623 #SUP 0.87 #QF 0.87 53 VAL HG1 62 LEU HD2 4.99 #peak 1626 #SUP 0.97 #QF 0.97 153 VAL HG1 162 LEU HD2 4.99 #peak 1626 #SUP 0.97 #QF 0.97 53 VAL HG1 59 LEU HD1 3.44 #peak 1627 #SUP 0.99 #QF 0.99 153 VAL HG1 159 LEU HD1 3.44 #peak 1627 #SUP 0.99 #QF 0.99 51 ILE HG13 53 VAL HG1 4.41 #peak 1628 #SUP 0.95 #QF 0.67 151 ILE HG13 153 VAL HG1 4.41 #peak 1628 #SUP 0.95 #QF 0.67 53 VAL HG1 59 LEU HD2 4.84 #peak 1628 #SUP 0.95 #QF 0.67 153 VAL HG1 159 LEU HD2 4.84 #peak 1628 #SUP 0.95 #QF 0.67 31 THR HG2 53 VAL HG1 4.04 #peak 1629 #SUP 0.92 #QF 0.92 131 THR HG2 153 VAL HG1 4.04 #peak 1629 #SUP 0.92 #QF 0.92 6 ALA HB 53 VAL HG1 3.33 #peak 1630 #SUP 0.99 #QF 0.99 106 ALA HB 153 VAL HG1 3.33 #peak 1630 #SUP 0.99 #QF 0.99 53 VAL HG1 58 LYS HG2 4.25 #peak 1631 #SUP 0.96 #QF 0.91 153 VAL HG1 158 LYS HG2 4.25 #peak 1631 #SUP 0.96 #QF 0.91 53 VAL HG1 59 LEU HB3 4.51 #peak 1631 #SUP 0.96 #QF 0.91 153 VAL HG1 159 LEU HB3 4.51 #peak 1631 #SUP 0.96 #QF 0.91 53 VAL HG1 59 LEU HB2 4.51 #peak 1633 #SUP 1.00 153 VAL HG1 159 LEU HB2 4.51 #peak 1633 #SUP 1.00 4 PHE HB 53 VAL HG1 5.97 #peak 1635 #SUP 0.95 #QF 0.95 104 PHE HB 153 VAL HG1 5.97 #peak 1635 #SUP 0.95 #QF 0.95 53 VAL HG1 59 LEU HA 4.11 #peak 1636 #SUP 1.00 153 VAL HG1 159 LEU HA 4.11 #peak 1636 #SUP 1.00 31 THR HB 53 VAL HG1 4.44 #peak 1637 #SUP 0.92 #QF 0.92 131 THR HB 153 VAL HG1 4.44 #peak 1637 #SUP 0.92 #QF 0.92 53 VAL HG1 54 LYS HA 5.85 #peak 1638 #SUP 1.00 153 VAL HG1 154 LYS HA 5.85 #peak 1638 #SUP 1.00 53 VAL HA 53 VAL HG1 3.61 #peak 1639 #SUP 1.00 153 VAL HA 153 VAL HG1 3.61 #peak 1639 #SUP 1.00 51 ILE HA 53 VAL HG1 5.70 #peak 1640 #SUP 0.94 #QF 0.94 151 ILE HA 153 VAL HG1 5.70 #peak 1640 #SUP 0.94 #QF 0.94 52 PHE HA 53 VAL HG1 4.58 #peak 1641 #SUP 0.98 #QF 0.98 152 PHE HA 153 VAL HG1 4.58 #peak 1641 #SUP 0.98 #QF 0.98 53 VAL HG1 58 LYS HZ 5.15 #peak 1642 #SUP 0.99 #QF 0.99 153 VAL HG1 158 LYS HZ 5.15 #peak 1642 #SUP 0.99 #QF 0.99 53 VAL HG1 55 ASN H 4.56 #peak 1643 #SUP 1.00 153 VAL HG1 155 ASN H 4.56 #peak 1643 #SUP 1.00 52 PHE H 53 VAL HG1 4.48 #peak 1644 #SUP 1.00 #QF 0.93 152 PHE H 153 VAL HG1 4.48 #peak 1644 #SUP 1.00 #QF 0.93 53 VAL HG1 54 LYS H 4.74 #peak 1644 #SUP 1.00 #QF 0.93 153 VAL HG1 154 LYS H 4.74 #peak 1644 #SUP 1.00 #QF 0.93 53 VAL HG1 60 THR H 6.07 #peak 1645 #SUP 0.90 #QF 0.90 153 VAL HG1 160 THR H 6.07 #peak 1645 #SUP 0.90 #QF 0.90 4 PHE H 53 VAL HG1 4.97 #peak 1646 #SUP 1.00 104 PHE H 153 VAL HG1 4.97 #peak 1646 #SUP 1.00 53 VAL H 53 VAL HG1 3.85 #peak 1647 #SUP 1.00 153 VAL H 153 VAL HG1 3.85 #peak 1647 #SUP 1.00 51 ILE H 53 VAL HG1 5.67 #peak 1648 #SUP 0.99 #QF 0.99 151 ILE H 153 VAL HG1 5.67 #peak 1648 #SUP 0.99 #QF 0.99 6 ALA H 53 VAL HG1 5.14 #peak 1649 #SUP 1.00 106 ALA H 153 VAL HG1 5.14 #peak 1649 #SUP 1.00 53 VAL HG2 59 LEU HD1 4.26 #peak 1650 #SUP 0.98 #QF 0.98 153 VAL HG2 159 LEU HD1 4.26 #peak 1650 #SUP 0.98 #QF 0.98 53 VAL HG2 59 LEU HD2 3.99 #peak 1651 #SUP 1.00 153 VAL HG2 159 LEU HD2 3.99 #peak 1651 #SUP 1.00 6 ALA HB 53 VAL HG2 3.45 #peak 1653 #SUP 1.00 106 ALA HB 153 VAL HG2 3.45 #peak 1653 #SUP 1.00 53 VAL HG2 59 LEU HB3 4.56 #peak 1654 #SUP 0.89 #QF 0.29 153 VAL HG2 159 LEU HB3 4.56 #peak 1654 #SUP 0.89 #QF 0.29 53 VAL HG2 59 LEU HB2 4.56 #peak 1656 #SUP 1.00 #QF 0.77 153 VAL HG2 159 LEU HB2 4.56 #peak 1656 #SUP 1.00 #QF 0.77 4 PHE HB 53 VAL HG2 4.80 #peak 1657 #SUP 0.96 #QF 0.96 104 PHE HB 153 VAL HG2 4.80 #peak 1657 #SUP 0.96 #QF 0.96 53 VAL HG2 59 LEU HA 4.39 #peak 1658 #SUP 1.00 153 VAL HG2 159 LEU HA 4.39 #peak 1658 #SUP 1.00 53 VAL HG2 56 THR HA 4.46 #peak 1659 #SUP 1.00 153 VAL HG2 156 THR HA 4.46 #peak 1659 #SUP 1.00 53 VAL HG2 58 LYS HA 6.07 #peak 1660 #SUP 0.96 #QF 0.96 153 VAL HG2 158 LYS HA 6.07 #peak 1660 #SUP 0.96 #QF 0.96 53 VAL HG2 54 LYS HA 4.95 #peak 1661 #SUP 1.00 153 VAL HG2 154 LYS HA 4.95 #peak 1661 #SUP 1.00 5 LEU HA 53 VAL HG2 5.06 #peak 1662 #SUP 0.99 #QF 0.99 105 LEU HA 153 VAL HG2 5.06 #peak 1662 #SUP 0.99 #QF 0.99 4 PHE HA 53 VAL HG2 5.47 #peak 1664 #SUP 0.99 #QF 0.99 104 PHE HA 153 VAL HG2 5.47 #peak 1664 #SUP 0.99 #QF 0.99 52 PHE HA 53 VAL HG2 4.54 #peak 1665 #SUP 0.99 #QF 0.99 152 PHE HA 153 VAL HG2 4.54 #peak 1665 #SUP 0.99 #QF 0.99 53 VAL HG2 55 ASN H 3.88 #peak 1668 #SUP 1.00 #QF 0.64 153 VAL HG2 155 ASN H 3.88 #peak 1668 #SUP 1.00 #QF 0.64 53 VAL HG2 54 LYS H 4.05 #peak 1669 #SUP 1.00 153 VAL HG2 154 LYS H 4.05 #peak 1669 #SUP 1.00 5 LEU H 53 VAL HG2 5.97 #peak 1670 #SUP 1.00 #QF 0.99 105 LEU H 153 VAL HG2 5.97 #peak 1670 #SUP 1.00 #QF 0.99 53 VAL HG2 60 THR H 6.50 #peak 1670 #SUP 1.00 #QF 0.99 153 VAL HG2 160 THR H 6.50 #peak 1670 #SUP 1.00 #QF 0.99 6 ALA H 53 VAL HG2 5.02 #peak 1672 #SUP 1.00 106 ALA H 153 VAL HG2 5.02 #peak 1672 #SUP 1.00 53 VAL H 53 VAL HG2 3.66 #peak 1673 #SUP 1.00 153 VAL H 153 VAL HG2 3.66 #peak 1673 #SUP 1.00 3 ASP HA 54 LYS HA 3.84 #peak 1677 #SUP 0.88 #QF 0.88 103 ASP HA 154 LYS HA 3.84 #peak 1677 #SUP 0.88 #QF 0.88 3 ASP H 54 LYS HA 5.39 #peak 1679 #SUP 1.00 #QF 0.28 103 ASP H 154 LYS HA 5.39 #peak 1679 #SUP 1.00 #QF 0.28 54 LYS HB2 54 LYS HE 5.00 #peak 1683 #SUP 1.00 154 LYS HB2 154 LYS HE 5.00 #peak 1683 #SUP 1.00 3 ASP HA 54 LYS HB2 5.52 #peak 1686 #SUP 0.88 #QF 0.88 103 ASP HA 154 LYS HB2 5.52 #peak 1686 #SUP 0.88 #QF 0.88 54 LYS HB2 55 ASN H 4.69 #peak 1688 #SUP 1.00 154 LYS HB2 155 ASN H 4.69 #peak 1688 #SUP 1.00 54 LYS H 54 LYS HB2 3.89 #peak 1689 #SUP 1.00 154 LYS H 154 LYS HB2 3.89 #peak 1689 #SUP 1.00 54 LYS HB3 54 LYS HE 5.00 #peak 1691 #SUP 0.98 #QF 0.98 154 LYS HB3 154 LYS HE 5.00 #peak 1691 #SUP 0.98 #QF 0.98 3 ASP HA 54 LYS HB3 5.52 #peak 1694 #SUP 0.99 #QF 0.99 103 ASP HA 154 LYS HB3 5.52 #peak 1694 #SUP 0.99 #QF 0.99 54 LYS HB3 55 ASN H 4.69 #peak 1695 #SUP 1.00 154 LYS HB3 155 ASN H 4.69 #peak 1695 #SUP 1.00 54 LYS H 54 LYS HB3 3.89 #peak 1697 #SUP 1.00 154 LYS H 154 LYS HB3 3.89 #peak 1697 #SUP 1.00 54 LYS HG2 54 LYS HE 4.04 #peak 1698 #SUP 1.00 154 LYS HG2 154 LYS HE 4.04 #peak 1698 #SUP 1.00 54 LYS HG3 54 LYS HE 4.04 #peak 1701 #SUP 1.00 154 LYS HG3 154 LYS HE 4.04 #peak 1701 #SUP 1.00 53 VAL HA 58 LYS HG2 5.67 #peak 1704 #SUP 0.66 #QF 0.42 153 VAL HA 158 LYS HG2 5.67 #peak 1704 #SUP 0.66 #QF 0.42 54 LYS H 54 LYS HG3 4.61 #peak 1707 #SUP 0.92 #QF 0.87 154 LYS H 154 LYS HG3 4.61 #peak 1707 #SUP 0.92 #QF 0.87 54 LYS H 58 LYS HG2 5.21 #peak 1707 #SUP 0.92 #QF 0.87 154 LYS H 158 LYS HG2 5.21 #peak 1707 #SUP 0.92 #QF 0.87 15 LYS HD 15 LYS HE 2.95 #peak 1708 #SUP 1.00 #QF 0.90 115 LYS HD 115 LYS HE 2.95 #peak 1708 #SUP 1.00 #QF 0.90 54 LYS HA 54 LYS HD 4.46 #peak 1709 #SUP 1.00 154 LYS HA 154 LYS HD 4.46 #peak 1709 #SUP 1.00 15 LYS HD 16 ASN HD22 5.47 #peak 1710 #SUP 0.90 #QF 0.34 115 LYS HD 116 ASN HD22 5.47 #peak 1710 #SUP 0.90 #QF 0.34 15 LYS H 15 LYS HD 4.94 #peak 1711 #SUP 0.92 #QF 0.92 115 LYS H 115 LYS HD 4.94 #peak 1711 #SUP 0.92 #QF 0.92 15 LYS HD 16 ASN HD21 5.47 #peak 1712 #SUP 1.00 #QF 0.28 115 LYS HD 116 ASN HD21 5.47 #peak 1712 #SUP 1.00 #QF 0.28 54 LYS H 54 LYS HD 4.79 #peak 1713 #SUP 1.00 154 LYS H 154 LYS HD 4.79 #peak 1713 #SUP 1.00 54 LYS HA 54 LYS HE 4.83 #peak 1714 #SUP 0.96 #QF 0.96 154 LYS HA 154 LYS HE 4.83 #peak 1714 #SUP 0.96 #QF 0.96 54 LYS HE 55 ASN HD21 4.81 #peak 1715 #SUP 1.00 154 LYS HE 155 ASN HD21 4.81 #peak 1715 #SUP 1.00 54 LYS H 54 LYS HE 4.86 #peak 1717 #SUP 0.98 #QF 0.98 154 LYS H 154 LYS HE 4.86 #peak 1717 #SUP 0.98 #QF 0.98 53 VAL HG1 56 THR HA 5.74 #peak 1725 #SUP 0.86 #QF 0.86 153 VAL HG1 156 THR HA 5.74 #peak 1725 #SUP 0.86 #QF 0.86 56 THR HA 59 LEU HD1 6.13 #peak 1726 #SUP 1.00 156 THR HA 159 LEU HD1 6.13 #peak 1726 #SUP 1.00 56 THR HA 59 LEU HB3 4.43 #peak 1728 #SUP 0.98 #QF 0.98 156 THR HA 159 LEU HB3 4.43 #peak 1728 #SUP 0.98 #QF 0.98 56 THR HA 59 LEU HG 5.36 #peak 1729 #SUP 0.97 #QF 0.97 156 THR HA 159 LEU HG 5.36 #peak 1729 #SUP 0.97 #QF 0.97 56 THR HA 59 LEU HB2 4.43 #peak 1730 #SUP 1.00 156 THR HA 159 LEU HB2 4.43 #peak 1730 #SUP 1.00 55 ASN HA 56 THR HA 5.24 #peak 1731 #SUP 0.92 #QF 0.92 155 ASN HA 156 THR HA 5.24 #peak 1731 #SUP 0.92 #QF 0.92 56 THR HA 59 LEU H 4.42 #peak 1734 #SUP 1.00 156 THR HA 159 LEU H 4.42 #peak 1734 #SUP 1.00 59 LEU H 61 THR HB 6.19 #peak 1740 #SUP 0.99 #QF 0.97 159 LEU H 161 THR HB 6.19 #peak 1740 #SUP 0.99 #QF 0.97 56 THR HB 57 ASP H 4.20 #peak 1741 #SUP 0.93 #QF 0.93 156 THR HB 157 ASP H 4.20 #peak 1741 #SUP 0.93 #QF 0.93 53 VAL HG2 56 THR HG2 4.48 #peak 1743 #SUP 0.99 #QF 0.99 153 VAL HG2 156 THR HG2 4.48 #peak 1743 #SUP 0.99 #QF 0.99 56 THR HA 56 THR HG2 3.35 #peak 1745 #SUP 1.00 156 THR HA 156 THR HG2 3.35 #peak 1745 #SUP 1.00 4 PHE HD 56 THR HG2 4.61 #peak 1748 #SUP 0.99 #QF 0.99 104 PHE HD 156 THR HG2 4.61 #peak 1748 #SUP 0.99 #QF 0.99 56 THR HG2 59 LEU H 5.33 #peak 1749 #SUP 0.99 #QF 0.99 156 THR HG2 159 LEU H 5.33 #peak 1749 #SUP 0.99 #QF 0.99 56 THR HG2 57 ASP H 4.54 #peak 1750 #SUP 1.00 156 THR HG2 157 ASP H 4.54 #peak 1750 #SUP 1.00 56 THR HG2 57 ASP HB 5.88 #peak 1751 #SUP 0.95 #QF 0.44 156 THR HG2 157 ASP HB 5.88 #peak 1751 #SUP 0.95 #QF 0.44 57 ASP HB 60 THR HG2 6.15 #peak 1751 #SUP 0.95 #QF 0.44 157 ASP HB 160 THR HG2 6.15 #peak 1751 #SUP 0.95 #QF 0.44 57 ASP HB 58 LYS HG3 6.50 #peak 1752 #SUP 0.78 #QF 0.46 157 ASP HB 158 LYS HG3 6.50 #peak 1752 #SUP 0.78 #QF 0.46 57 ASP HB 58 LYS HD 6.50 #peak 1752 #SUP 0.78 #QF 0.46 157 ASP HB 158 LYS HD 6.50 #peak 1752 #SUP 0.78 #QF 0.46 58 LYS HA 61 THR HG2 4.60 #peak 1759 #SUP 0.83 #QF 0.83 158 LYS HA 161 THR HG2 4.60 #peak 1759 #SUP 0.83 #QF 0.83 57 ASP HB 58 LYS HA 5.21 #peak 1763 #SUP 0.97 #QF 0.97 157 ASP HB 158 LYS HA 5.21 #peak 1763 #SUP 0.97 #QF 0.97 53 VAL HG2 58 LYS HB2 5.67 #peak 1767 #SUP 0.99 #QF 0.99 153 VAL HG2 158 LYS HB2 5.67 #peak 1767 #SUP 0.99 #QF 0.99 55 ASN H 58 LYS HB2 5.18 #peak 1770 #SUP 0.93 #QF 0.63 155 ASN H 158 LYS HB2 5.18 #peak 1770 #SUP 0.93 #QF 0.63 53 VAL HG2 58 LYS HB3 5.67 #peak 1772 #SUP 1.00 153 VAL HG2 158 LYS HB3 5.67 #peak 1772 #SUP 1.00 53 VAL HG2 58 LYS HG3 5.34 #peak 1779 #SUP 1.00 153 VAL HG2 158 LYS HG3 5.34 #peak 1779 #SUP 1.00 53 VAL HG1 58 LYS HG3 5.39 #peak 1780 #SUP 0.99 #QF 0.94 153 VAL HG1 158 LYS HG3 5.39 #peak 1780 #SUP 0.99 #QF 0.94 31 THR HG2 58 LYS HG3 5.34 #peak 1781 #SUP 0.84 #QF 0.84 131 THR HG2 158 LYS HG3 5.34 #peak 1781 #SUP 0.84 #QF 0.84 58 LYS HG3 61 THR HB 5.70 #peak 1786 #SUP 0.99 #QF 0.99 158 LYS HG3 161 THR HB 5.70 #peak 1786 #SUP 0.99 #QF 0.99 4 PHE HZ 58 LYS HG3 6.50 #peak 1787 #SUP 0.56 #QF 0.22 104 PHE HZ 158 LYS HG3 6.50 #peak 1787 #SUP 0.56 #QF 0.22 58 LYS HG3 58 LYS HZ 6.05 #peak 1788 #SUP 0.98 #QF 0.98 158 LYS HG3 158 LYS HZ 6.05 #peak 1788 #SUP 0.98 #QF 0.98 55 ASN H 58 LYS HG3 5.36 #peak 1789 #SUP 0.95 #QF 0.95 155 ASN H 158 LYS HG3 5.36 #peak 1789 #SUP 0.95 #QF 0.95 54 LYS H 58 LYS HG3 5.57 #peak 1791 #SUP 0.88 #QF 0.88 154 LYS H 158 LYS HG3 5.57 #peak 1791 #SUP 0.88 #QF 0.88 58 LYS HG2 62 LEU HD1 5.25 #peak 1792 #SUP 1.00 158 LYS HG2 162 LEU HD1 5.25 #peak 1792 #SUP 1.00 53 VAL HG2 58 LYS HG2 5.65 #peak 1793 #SUP 0.98 #QF 0.21 153 VAL HG2 158 LYS HG2 5.65 #peak 1793 #SUP 0.98 #QF 0.21 58 LYS H 58 LYS HG2 4.61 #peak 1798 #SUP 1.00 158 LYS H 158 LYS HG2 4.61 #peak 1798 #SUP 1.00 58 LYS HD 62 LEU HD1 5.12 #peak 1799 #SUP 1.00 158 LYS HD 162 LEU HD1 5.12 #peak 1799 #SUP 1.00 53 VAL HG2 58 LYS HD 5.99 #peak 1800 #SUP 1.00 153 VAL HG2 158 LYS HD 5.99 #peak 1800 #SUP 1.00 31 THR HG2 58 LYS HD 5.75 #peak 1801 #SUP 1.00 131 THR HG2 158 LYS HD 5.75 #peak 1801 #SUP 1.00 58 LYS HD 62 LEU HB2 6.42 #peak 1801 #SUP 1.00 158 LYS HD 162 LEU HB2 6.42 #peak 1801 #SUP 1.00 30 ASP HB 58 LYS HD 5.66 #peak 1803 #SUP 0.67 #QF 0.27 130 ASP HB 158 LYS HD 5.66 #peak 1803 #SUP 0.67 #QF 0.27 58 LYS HA 58 LYS HD 3.54 #peak 1805 #SUP 0.93 #QF 0.93 158 LYS HA 158 LYS HD 3.54 #peak 1805 #SUP 0.93 #QF 0.93 58 LYS HD 61 THR HB 4.83 #peak 1806 #SUP 1.00 158 LYS HD 161 THR HB 4.83 #peak 1806 #SUP 1.00 58 LYS HD 59 LEU H 5.33 #peak 1808 #SUP 0.83 #QF 0.83 158 LYS HD 159 LEU H 5.33 #peak 1808 #SUP 0.83 #QF 0.83 58 LYS HD 62 LEU H 5.33 #peak 1809 #SUP 0.95 #QF 0.95 158 LYS HD 162 LEU H 5.33 #peak 1809 #SUP 0.95 #QF 0.95 58 LYS H 58 LYS HD 4.48 #peak 1810 #SUP 0.97 #QF 0.97 158 LYS H 158 LYS HD 4.48 #peak 1810 #SUP 0.97 #QF 0.97 58 LYS HE3 62 LEU HD1 4.93 #peak 1818 #SUP 1.00 158 LYS HE3 162 LEU HD1 4.93 #peak 1818 #SUP 1.00 59 LEU HA 62 LEU HG 4.55 #peak 1825 #SUP 0.99 #QF 0.92 159 LEU HA 162 LEU HG 4.55 #peak 1825 #SUP 0.99 #QF 0.92 58 LYS HG3 59 LEU HA 5.14 #peak 1827 #SUP 1.00 #QF 0.59 158 LYS HG3 159 LEU HA 5.14 #peak 1827 #SUP 1.00 #QF 0.59 59 LEU HA 63 MET H 6.41 #peak 1830 #SUP 1.00 #QF 0.93 159 LEU HA 163 MET H 6.41 #peak 1830 #SUP 1.00 #QF 0.93 53 VAL HG2 59 LEU HG 5.63 #peak 1854 #SUP 1.00 153 VAL HG2 159 LEU HG 5.63 #peak 1854 #SUP 1.00 59 LEU HG 63 MET HG3 5.86 #peak 1858 #SUP 0.95 #QF 0.95 159 LEU HG 163 MET HG3 5.86 #peak 1858 #SUP 0.95 #QF 0.95 59 LEU HG 60 THR HA 5.20 #peak 1859 #SUP 0.99 #QF 0.98 159 LEU HG 160 THR HA 5.20 #peak 1859 #SUP 0.99 #QF 0.98 59 LEU H 59 LEU HG 4.97 #peak 1861 #SUP 1.00 159 LEU H 159 LEU HG 4.97 #peak 1861 #SUP 1.00 59 LEU HG 63 MET H 5.91 #peak 1862 #SUP 0.97 #QF 0.97 159 LEU HG 163 MET H 5.91 #peak 1862 #SUP 0.97 #QF 0.97 59 LEU HD1 62 LEU HD2 5.56 #peak 1864 #SUP 1.00 159 LEU HD1 162 LEU HD2 5.56 #peak 1864 #SUP 1.00 62 LEU HD2 66 LEU HD2 5.95 #peak 1864 #SUP 1.00 162 LEU HD2 166 LEU HD2 5.95 #peak 1864 #SUP 1.00 59 LEU HD1 62 LEU HD1 3.76 #peak 1865 #SUP 0.90 #QF 0.90 159 LEU HD1 162 LEU HD1 3.76 #peak 1865 #SUP 0.90 #QF 0.90 6 ALA HB 59 LEU HD1 2.95 #peak 1866 #SUP 0.98 #QF 0.98 106 ALA HB 159 LEU HD1 2.95 #peak 1866 #SUP 0.98 #QF 0.98 59 LEU HB3 59 LEU HD1 4.04 #peak 1867 #SUP 0.92 #QF 0.25 159 LEU HB3 159 LEU HD1 4.04 #peak 1867 #SUP 0.92 #QF 0.25 59 LEU HB2 59 LEU HD1 4.04 #peak 1869 #SUP 1.00 159 LEU HB2 159 LEU HD1 4.04 #peak 1869 #SUP 1.00 59 LEU HD1 63 MET HG3 4.25 #peak 1870 #SUP 0.88 #QF 0.88 159 LEU HD1 163 MET HG3 4.25 #peak 1870 #SUP 0.88 #QF 0.88 59 LEU HA 59 LEU HD1 3.22 #peak 1871 #SUP 0.98 #QF 0.98 159 LEU HA 159 LEU HD1 3.22 #peak 1871 #SUP 0.98 #QF 0.98 59 LEU H 59 LEU HD1 4.44 #peak 1872 #SUP 1.00 159 LEU H 159 LEU HD1 4.44 #peak 1872 #SUP 1.00 6 ALA HB 59 LEU HD2 3.09 #peak 1876 #SUP 1.00 106 ALA HB 159 LEU HD2 3.09 #peak 1876 #SUP 1.00 59 LEU HB3 59 LEU HD2 3.66 #peak 1877 #SUP 1.00 159 LEU HB3 159 LEU HD2 3.66 #peak 1877 #SUP 1.00 59 LEU HD2 77 ARG HG2 4.60 #peak 1879 #SUP 1.00 159 LEU HD2 177 ARG HG2 4.60 #peak 1879 #SUP 1.00 59 LEU HD2 63 MET HE 4.28 #peak 1880 #SUP 0.92 #QF 0.92 159 LEU HD2 163 MET HE 4.28 #peak 1880 #SUP 0.92 #QF 0.92 59 LEU HB2 59 LEU HD2 3.66 #peak 1881 #SUP 1.00 159 LEU HB2 159 LEU HD2 3.66 #peak 1881 #SUP 1.00 59 LEU HD2 63 MET HG3 6.09 #peak 1882 #SUP 1.00 159 LEU HD2 163 MET HG3 6.09 #peak 1882 #SUP 1.00 59 LEU HA 59 LEU HD2 4.25 #peak 1884 #SUP 1.00 159 LEU HA 159 LEU HD2 4.25 #peak 1884 #SUP 1.00 56 THR HA 59 LEU HD2 4.31 #peak 1885 #SUP 1.00 156 THR HA 159 LEU HD2 4.31 #peak 1885 #SUP 1.00 56 THR HB 59 LEU HD2 5.16 #peak 1887 #SUP 1.00 156 THR HB 159 LEU HD2 5.16 #peak 1887 #SUP 1.00 59 LEU H 59 LEU HD2 4.65 #peak 1891 #SUP 1.00 159 LEU H 159 LEU HD2 4.65 #peak 1891 #SUP 1.00 59 LEU HD2 77 ARG HE 6.23 #peak 1892 #SUP 1.00 #QF 0.65 159 LEU HD2 177 ARG HE 6.23 #peak 1892 #SUP 1.00 #QF 0.65 59 LEU HD2 78 LEU H 5.58 #peak 1893 #SUP 0.99 #QF 0.99 159 LEU HD2 178 LEU H 5.58 #peak 1893 #SUP 0.99 #QF 0.99 6 ALA H 59 LEU HD2 5.47 #peak 1896 #SUP 0.99 #QF 0.99 106 ALA H 159 LEU HD2 5.47 #peak 1896 #SUP 0.99 #QF 0.99 60 THR HA 63 MET HG3 4.94 #peak 1900 #SUP 1.00 160 THR HA 163 MET HG3 4.94 #peak 1900 #SUP 1.00 60 THR HA 63 MET H 4.26 #peak 1903 #SUP 1.00 160 THR HA 163 MET H 4.26 #peak 1903 #SUP 1.00 60 THR HA 62 LEU H 5.33 #peak 1905 #SUP 1.00 160 THR HA 162 LEU H 5.33 #peak 1905 #SUP 1.00 60 THR HG2 63 MET HG3 4.96 #peak 1908 #SUP 0.84 #QF 0.84 160 THR HG2 163 MET HG3 4.96 #peak 1908 #SUP 0.84 #QF 0.84 60 THR HA 60 THR HG2 3.15 #peak 1909 #SUP 0.99 #QF 0.99 160 THR HA 160 THR HG2 3.15 #peak 1909 #SUP 0.99 #QF 0.99 58 LYS H 60 THR HG2 5.98 #peak 1912 #SUP 0.97 #QF 0.51 158 LYS H 160 THR HG2 5.98 #peak 1912 #SUP 0.97 #QF 0.51 60 THR HG2 63 MET H 6.29 #peak 1912 #SUP 0.97 #QF 0.51 160 THR HG2 163 MET H 6.29 #peak 1912 #SUP 0.97 #QF 0.51 60 THR H 60 THR HG2 3.70 #peak 1913 #SUP 1.00 160 THR H 160 THR HG2 3.70 #peak 1913 #SUP 1.00 61 THR HA 64 ASP HB2 3.93 #peak 1916 #SUP 0.99 #QF 0.99 161 THR HA 164 ASP HB2 3.93 #peak 1916 #SUP 0.99 #QF 0.99 61 THR HA 63 MET H 4.97 #peak 1920 #SUP 0.99 #QF 0.33 161 THR HA 163 MET H 4.97 #peak 1920 #SUP 0.99 #QF 0.33 60 THR H 61 THR HA 5.45 #peak 1921 #SUP 0.99 #QF 0.99 160 THR H 161 THR HA 5.45 #peak 1921 #SUP 0.99 #QF 0.99 58 LYS HZ 61 THR HB 4.71 #peak 1923 #SUP 0.94 #QF 0.22 158 LYS HZ 161 THR HB 4.71 #peak 1923 #SUP 0.94 #QF 0.22 58 LYS H 61 THR HB 5.98 #peak 1926 #SUP 0.99 #QF 0.22 158 LYS H 161 THR HB 5.98 #peak 1926 #SUP 0.99 #QF 0.22 61 THR HB 63 MET H 6.29 #peak 1926 #SUP 0.99 #QF 0.22 161 THR HB 163 MET H 6.29 #peak 1926 #SUP 0.99 #QF 0.22 56 THR HB 60 THR H 5.69 #peak 1927 #SUP 0.98 #QF 0.55 156 THR HB 160 THR H 5.69 #peak 1927 #SUP 0.98 #QF 0.55 60 THR H 61 THR HB 6.07 #peak 1927 #SUP 0.98 #QF 0.55 160 THR H 161 THR HB 6.07 #peak 1927 #SUP 0.98 #QF 0.55 61 THR HG2 62 LEU HD2 4.29 #peak 1928 #SUP 0.99 #QF 0.99 161 THR HG2 162 LEU HD2 4.29 #peak 1928 #SUP 0.99 #QF 0.99 61 THR HG2 62 LEU HD1 5.44 #peak 1929 #SUP 1.00 161 THR HG2 162 LEU HD1 5.44 #peak 1929 #SUP 1.00 61 THR HG2 64 ASP HB3 4.64 #peak 1930 #SUP 1.00 161 THR HG2 164 ASP HB3 4.64 #peak 1930 #SUP 1.00 61 THR HG2 65 LYS HE 4.52 #peak 1932 #SUP 0.41 #QF 0.41 161 THR HG2 165 LYS HE 4.52 #peak 1932 #SUP 0.41 #QF 0.41 61 THR HG2 62 LEU HA 4.36 #peak 1933 #SUP 0.99 #QF 0.99 161 THR HG2 162 LEU HA 4.36 #peak 1933 #SUP 0.99 #QF 0.99 61 THR HA 61 THR HG2 3.19 #peak 1934 #SUP 1.00 161 THR HA 161 THR HG2 3.19 #peak 1934 #SUP 1.00 58 LYS HZ 61 THR HG2 4.47 #peak 1936 #SUP 0.97 #QF 0.97 158 LYS HZ 161 THR HG2 4.47 #peak 1936 #SUP 0.97 #QF 0.97 61 THR HG2 62 LEU H 3.79 #peak 1937 #SUP 1.00 161 THR HG2 162 LEU H 3.79 #peak 1937 #SUP 1.00 61 THR H 61 THR HG2 3.81 #peak 1938 #SUP 1.00 161 THR H 161 THR HG2 3.81 #peak 1938 #SUP 1.00 61 THR HG2 63 MET H 5.64 #peak 1939 #SUP 1.00 #QF 0.84 161 THR HG2 163 MET H 5.64 #peak 1939 #SUP 1.00 #QF 0.84 8 ILE HG2 62 LEU HA 6.50 #peak 1942 #SUP 0.94 #QF 0.82 108 ILE HG2 162 LEU HA 6.50 #peak 1942 #SUP 0.94 #QF 0.82 49 LEU HD2 62 LEU HA 6.50 #peak 1942 #SUP 0.94 #QF 0.82 149 LEU HD2 162 LEU HA 6.50 #peak 1942 #SUP 0.94 #QF 0.82 59 LEU HD1 62 LEU HA 6.50 #peak 1942 #SUP 0.94 #QF 0.82 159 LEU HD1 162 LEU HA 6.50 #peak 1942 #SUP 0.94 #QF 0.82 62 LEU HA 65 LYS HG3 4.63 #peak 1946 #SUP 1.00 61 THR HB 62 LEU HA 5.33 #peak 1949 #SUP 1.00 161 THR HB 162 LEU HA 5.33 #peak 1949 #SUP 1.00 29 PHE HZ 62 LEU HA 6.11 #peak 1950 #SUP 1.00 #QF 0.99 129 PHE HZ 162 LEU HA 6.11 #peak 1950 #SUP 1.00 #QF 0.99 61 THR H 62 LEU HA 5.80 #peak 1952 #SUP 1.00 161 THR H 162 LEU HA 5.80 #peak 1952 #SUP 1.00 59 LEU HA 62 LEU HB3 5.56 #peak 1958 #SUP 1.00 159 LEU HA 162 LEU HB3 5.56 #peak 1958 #SUP 1.00 8 ILE HD1 62 LEU HB2 5.49 #peak 1963 #SUP 0.99 #QF 0.91 108 ILE HD1 162 LEU HB2 5.49 #peak 1963 #SUP 0.99 #QF 0.91 59 LEU HA 62 LEU HB2 5.60 #peak 1966 #SUP 0.97 #QF 0.94 159 LEU HA 162 LEU HB2 5.60 #peak 1966 #SUP 0.97 #QF 0.94 29 PHE HE 62 LEU HB2 6.05 #peak 1967 #SUP 1.00 #QF 0.65 129 PHE HE 162 LEU HB2 6.05 #peak 1967 #SUP 1.00 #QF 0.65 29 PHE HD 62 LEU HB2 6.18 #peak 1968 #SUP 0.93 #QF 0.93 129 PHE HD 162 LEU HB2 6.18 #peak 1968 #SUP 0.93 #QF 0.93 62 LEU HG 63 MET H 5.46 #peak 1976 #SUP 1.00 162 LEU HG 163 MET H 5.46 #peak 1976 #SUP 1.00 51 ILE HD1 62 LEU HD1 3.24 #peak 1978 #SUP 1.00 151 ILE HD1 162 LEU HD1 3.24 #peak 1978 #SUP 1.00 49 LEU HD2 62 LEU HD1 3.59 #peak 1979 #SUP 0.99 #QF 0.84 149 LEU HD2 162 LEU HD1 3.59 #peak 1979 #SUP 0.99 #QF 0.84 62 LEU HB2 62 LEU HD1 3.92 #peak 1980 #SUP 1.00 #QF 0.97 162 LEU HB2 162 LEU HD1 3.92 #peak 1980 #SUP 1.00 #QF 0.97 62 LEU HB3 62 LEU HD1 3.62 #peak 1981 #SUP 0.99 #QF 0.68 162 LEU HB3 162 LEU HD1 3.62 #peak 1981 #SUP 0.99 #QF 0.68 58 LYS HG3 62 LEU HD1 4.26 #peak 1982 #SUP 0.84 #QF 0.84 158 LYS HG3 162 LEU HD1 4.26 #peak 1982 #SUP 0.84 #QF 0.84 62 LEU HD1 66 LEU HG 5.42 #peak 1983 #SUP 0.87 #QF 0.87 162 LEU HD1 166 LEU HG 5.42 #peak 1983 #SUP 0.87 #QF 0.87 26 ILE HA 62 LEU HD1 5.82 #peak 1984 #SUP 0.99 #QF 0.99 126 ILE HA 162 LEU HD1 5.82 #peak 1984 #SUP 0.99 #QF 0.99 58 LYS HE2 62 LEU HD1 4.93 #peak 1985 #SUP 0.99 #QF 0.87 158 LYS HE2 162 LEU HD1 4.93 #peak 1985 #SUP 0.99 #QF 0.87 29 PHE HB3 62 LEU HD1 5.04 #peak 1986 #SUP 0.99 #QF 0.99 129 PHE HB3 162 LEU HD1 5.04 #peak 1986 #SUP 0.99 #QF 0.99 29 PHE HB2 62 LEU HD1 5.04 #peak 1987 #SUP 1.00 129 PHE HB2 162 LEU HD1 5.04 #peak 1987 #SUP 1.00 62 LEU HA 62 LEU HD1 3.96 #peak 1988 #SUP 0.99 #QF 0.99 162 LEU HA 162 LEU HD1 3.96 #peak 1988 #SUP 0.99 #QF 0.99 62 LEU HD1 63 MET HA 5.90 #peak 1989 #SUP 1.00 162 LEU HD1 163 MET HA 5.90 #peak 1989 #SUP 1.00 59 LEU HA 62 LEU HD1 4.20 #peak 1990 #SUP 1.00 159 LEU HA 162 LEU HD1 4.20 #peak 1990 #SUP 1.00 31 THR HB 62 LEU HD1 4.84 #peak 1991 #SUP 1.00 131 THR HB 162 LEU HD1 4.84 #peak 1991 #SUP 1.00 61 THR HB 62 LEU HD1 5.91 #peak 1992 #SUP 1.00 161 THR HB 162 LEU HD1 5.91 #peak 1992 #SUP 1.00 29 PHE HA 62 LEU HD1 5.92 #peak 1993 #SUP 0.91 #QF 0.91 129 PHE HA 162 LEU HD1 5.92 #peak 1993 #SUP 0.91 #QF 0.91 29 PHE HE 62 LEU HD1 4.60 #peak 1995 #SUP 1.00 #QF 0.94 129 PHE HE 162 LEU HD1 4.60 #peak 1995 #SUP 1.00 #QF 0.94 58 LYS HZ 62 LEU HD1 5.18 #peak 1995 #SUP 1.00 #QF 0.94 158 LYS HZ 162 LEU HD1 5.18 #peak 1995 #SUP 1.00 #QF 0.94 62 LEU H 62 LEU HD1 4.06 #peak 1997 #SUP 1.00 162 LEU H 162 LEU HD1 4.06 #peak 1997 #SUP 1.00 62 LEU HD1 63 MET H 4.85 #peak 1998 #SUP 1.00 162 LEU HD1 163 MET H 4.85 #peak 1998 #SUP 1.00 30 ASP H 62 LEU HD1 5.75 #peak 1999 #SUP 0.76 #QF 0.76 130 ASP H 162 LEU HD1 5.75 #peak 1999 #SUP 0.76 #QF 0.76 62 LEU HB2 62 LEU HD2 4.11 #peak 2003 #SUP 1.00 #QF 0.72 162 LEU HB2 162 LEU HD2 4.11 #peak 2003 #SUP 1.00 #QF 0.72 62 LEU HB3 62 LEU HD2 3.71 #peak 2004 #SUP 1.00 #QF 0.80 162 LEU HB3 162 LEU HD2 3.71 #peak 2004 #SUP 1.00 #QF 0.80 62 LEU HD2 65 LYS HD3 4.87 #peak 2005 #SUP 1.00 #QF 0.99 162 LEU HD2 165 LYS HD3 4.87 #peak 2005 #SUP 1.00 #QF 0.99 58 LYS HD 62 LEU HD2 5.09 #peak 2006 #SUP 1.00 #QF 0.55 158 LYS HD 162 LEU HD2 5.09 #peak 2006 #SUP 1.00 #QF 0.55 62 LEU HD2 65 LYS HD2 4.87 #peak 2006 #SUP 1.00 #QF 0.55 162 LEU HD2 165 LYS HD2 4.87 #peak 2006 #SUP 1.00 #QF 0.55 62 LEU HD2 65 LYS HB2 5.19 #peak 2007 #SUP 0.90 #QF 0.67 162 LEU HD2 165 LYS HB2 5.19 #peak 2007 #SUP 0.90 #QF 0.67 29 PHE HB3 62 LEU HD2 5.46 #peak 2009 #SUP 0.99 #QF 0.99 129 PHE HB3 162 LEU HD2 5.46 #peak 2009 #SUP 0.99 #QF 0.99 29 PHE HB2 62 LEU HD2 5.46 #peak 2010 #SUP 0.97 #QF 0.97 129 PHE HB2 162 LEU HD2 5.46 #peak 2010 #SUP 0.97 #QF 0.97 62 LEU HA 62 LEU HD2 3.56 #peak 2011 #SUP 0.99 #QF 0.99 162 LEU HA 162 LEU HD2 3.56 #peak 2011 #SUP 0.99 #QF 0.99 59 LEU HA 62 LEU HD2 5.00 #peak 2012 #SUP 0.98 #QF 0.98 159 LEU HA 162 LEU HD2 5.00 #peak 2012 #SUP 0.98 #QF 0.98 31 THR HB 62 LEU HD2 5.61 #peak 2013 #SUP 0.99 #QF 0.89 131 THR HB 162 LEU HD2 5.61 #peak 2013 #SUP 0.99 #QF 0.89 61 THR HA 62 LEU HD2 6.04 #peak 2013 #SUP 0.99 #QF 0.89 161 THR HA 162 LEU HD2 6.04 #peak 2013 #SUP 0.99 #QF 0.89 61 THR HB 62 LEU HD2 5.88 #peak 2014 #SUP 1.00 161 THR HB 162 LEU HD2 5.88 #peak 2014 #SUP 1.00 58 LYS HZ 62 LEU HD2 4.53 #peak 2017 #SUP 1.00 #QF 0.96 158 LYS HZ 162 LEU HD2 4.53 #peak 2017 #SUP 1.00 #QF 0.96 62 LEU H 62 LEU HD2 4.13 #peak 2019 #SUP 1.00 162 LEU H 162 LEU HD2 4.13 #peak 2019 #SUP 1.00 61 THR H 62 LEU HD2 5.96 #peak 2020 #SUP 1.00 161 THR H 162 LEU HD2 5.96 #peak 2020 #SUP 1.00 62 LEU HD2 63 MET H 4.88 #peak 2021 #SUP 1.00 162 LEU HD2 163 MET H 4.88 #peak 2021 #SUP 1.00 8 ILE HD1 63 MET HE 4.24 #peak 2046 #SUP 0.99 #QF 0.99 108 ILE HD1 163 MET HE 4.24 #peak 2046 #SUP 0.99 #QF 0.99 60 THR HG2 63 MET HE 3.60 #peak 2048 #SUP 0.98 #QF 0.98 160 THR HG2 163 MET HE 3.60 #peak 2048 #SUP 0.98 #QF 0.98 63 MET HG3 63 MET HE 3.58 #peak 2050 #SUP 1.00 163 MET HG3 163 MET HE 3.58 #peak 2050 #SUP 1.00 63 MET HE 77 ARG HD 3.77 #peak 2051 #SUP 0.94 #QF 0.94 163 MET HE 177 ARG HD 3.77 #peak 2051 #SUP 0.94 #QF 0.94 60 THR HA 63 MET HE 3.36 #peak 2052 #SUP 0.93 #QF 0.93 160 THR HA 163 MET HE 3.36 #peak 2052 #SUP 0.93 #QF 0.93 56 THR HA 63 MET HE 6.50 #peak 2053 #SUP 0.79 #QF 0.71 156 THR HA 163 MET HE 6.50 #peak 2053 #SUP 0.79 #QF 0.71 61 THR HA 63 MET HE 6.50 #peak 2053 #SUP 0.79 #QF 0.71 161 THR HA 163 MET HE 6.50 #peak 2053 #SUP 0.79 #QF 0.71 60 THR HB 63 MET HE 4.68 #peak 2054 #SUP 1.00 160 THR HB 163 MET HE 4.68 #peak 2054 #SUP 1.00 63 MET HE 77 ARG HA 3.61 #peak 2055 #SUP 0.89 #QF 0.89 163 MET HE 177 ARG HA 3.61 #peak 2055 #SUP 0.89 #QF 0.89 63 MET HE 76 GLU HA 3.86 #peak 2056 #SUP 0.78 #QF 0.78 163 MET HE 176 GLU HA 3.86 #peak 2056 #SUP 0.78 #QF 0.78 62 LEU H 63 MET HE 6.10 #peak 2058 #SUP 0.99 #QF 0.84 162 LEU H 163 MET HE 6.10 #peak 2058 #SUP 0.99 #QF 0.84 63 MET HE 77 ARG HE 6.36 #peak 2058 #SUP 0.99 #QF 0.84 163 MET HE 177 ARG HE 6.36 #peak 2058 #SUP 0.99 #QF 0.84 63 MET H 63 MET HE 4.39 #peak 2059 #SUP 0.99 #QF 0.99 163 MET H 163 MET HE 4.39 #peak 2059 #SUP 0.99 #QF 0.99 63 MET HE 77 ARG H 3.33 #peak 2060 #SUP 0.95 #QF 0.95 163 MET HE 177 ARG H 3.33 #peak 2060 #SUP 0.95 #QF 0.95 9 ARG H 63 MET HE 5.71 #peak 2061 #SUP 0.97 #QF 0.97 109 ARG H 163 MET HE 5.71 #peak 2061 #SUP 0.97 #QF 0.97 61 THR HG2 64 ASP HB2 5.00 #peak 2064 #SUP 0.91 #QF 0.91 161 THR HG2 164 ASP HB2 5.00 #peak 2064 #SUP 0.91 #QF 0.91 64 ASP HB2 65 LYS HG3 5.57 #peak 2065 #SUP 1.00 64 ASP HB2 67 ARG HB 5.13 #peak 2066 #SUP 0.98 #QF 0.98 164 ASP HB2 167 ARG HB 5.13 #peak 2066 #SUP 0.98 #QF 0.98 64 ASP HB2 65 LYS HB2 6.22 #peak 2067 #SUP 1.00 164 ASP HB2 165 LYS HB2 6.22 #peak 2067 #SUP 1.00 64 ASP HB2 67 ARG H 5.82 #peak 2072 #SUP 1.00 164 ASP HB2 167 ARG H 5.82 #peak 2072 #SUP 1.00 64 ASP HB3 65 LYS HG3 4.92 #peak 2075 #SUP 1.00 64 ASP HB3 67 ARG HB 5.03 #peak 2076 #SUP 0.91 #QF 0.91 164 ASP HB3 167 ARG HB 5.03 #peak 2076 #SUP 0.91 #QF 0.91 64 ASP HB3 65 LYS HB2 5.37 #peak 2077 #SUP 0.99 #QF 0.99 164 ASP HB3 165 LYS HB2 5.37 #peak 2077 #SUP 0.99 #QF 0.99 61 THR HA 64 ASP HB3 4.00 #peak 2079 #SUP 0.99 #QF 0.99 161 THR HA 164 ASP HB3 4.00 #peak 2079 #SUP 0.99 #QF 0.99 64 ASP HB3 65 LYS H 3.88 #peak 2081 #SUP 1.00 164 ASP HB3 165 LYS H 3.88 #peak 2081 #SUP 1.00 64 ASP HB3 67 ARG H 5.62 #peak 2082 #SUP 1.00 164 ASP HB3 167 ARG H 5.62 #peak 2082 #SUP 1.00 64 ASP H 64 ASP HB3 3.55 #peak 2083 #SUP 1.00 164 ASP H 164 ASP HB3 3.55 #peak 2083 #SUP 1.00 65 LYS HA 65 LYS HG3 3.87 #peak 2085 #SUP 1.00 165 LYS HA 165 LYS HG2 3.87 #peak 2085 #SUP 1.00 64 ASP H 65 LYS HA 5.53 #peak 2091 #SUP 0.99 #QF 0.99 164 ASP H 165 LYS HA 5.53 #peak 2091 #SUP 0.99 #QF 0.99 62 LEU HD1 65 LYS HB2 5.57 #peak 2093 #SUP 1.00 162 LEU HD1 165 LYS HB2 5.57 #peak 2093 #SUP 1.00 61 THR HG2 65 LYS HB2 5.43 #peak 2094 #SUP 0.99 #QF 0.83 161 THR HG2 165 LYS HB2 5.43 #peak 2094 #SUP 0.99 #QF 0.83 62 LEU HB3 65 LYS HB2 5.80 #peak 2094 #SUP 0.99 #QF 0.83 162 LEU HB3 165 LYS HB2 5.80 #peak 2094 #SUP 0.99 #QF 0.83 62 LEU HA 65 LYS HB2 4.39 #peak 2095 #SUP 1.00 162 LEU HA 165 LYS HB2 4.39 #peak 2095 #SUP 1.00 29 PHE HZ 65 LYS HB2 4.92 #peak 2097 #SUP 0.94 #QF 0.94 129 PHE HZ 165 LYS HB2 4.92 #peak 2097 #SUP 0.94 #QF 0.94 63 MET H 65 LYS HB2 5.82 #peak 2099 #SUP 1.00 #QF 0.86 163 MET H 165 LYS HB2 5.82 #peak 2099 #SUP 1.00 #QF 0.86 64 ASP H 65 LYS HB2 6.15 #peak 2099 #SUP 1.00 #QF 0.86 164 ASP H 165 LYS HB2 6.15 #peak 2099 #SUP 1.00 #QF 0.86 62 LEU HD1 65 LYS HB3 6.50 #peak 2100 #SUP 1.00 162 LEU HD1 165 LYS HB3 6.50 #peak 2100 #SUP 1.00 65 LYS HB3 66 LEU HD2 5.26 #peak 2102 #SUP 0.90 #QF 0.22 165 LYS HB3 166 LEU HD2 5.26 #peak 2102 #SUP 0.90 #QF 0.22 25 VAL HG2 65 LYS HB3 6.50 #peak 2103 #SUP 0.80 #QF 0.62 125 VAL HG2 165 LYS HB3 6.50 #peak 2103 #SUP 0.80 #QF 0.62 65 LYS HB3 69 VAL HG2 6.50 #peak 2103 #SUP 0.80 #QF 0.62 165 LYS HB3 169 VAL HG2 6.50 #peak 2103 #SUP 0.80 #QF 0.62 62 LEU HA 65 LYS HB3 4.59 #peak 2106 #SUP 0.99 #QF 0.99 162 LEU HA 165 LYS HB3 4.59 #peak 2106 #SUP 0.99 #QF 0.99 29 PHE HE 65 LYS HB3 5.16 #peak 2108 #SUP 1.00 #QF 0.94 129 PHE HE 165 LYS HB3 5.16 #peak 2108 #SUP 1.00 #QF 0.94 29 PHE HZ 65 LYS HB3 5.62 #peak 2108 #SUP 1.00 #QF 0.94 129 PHE HZ 165 LYS HB3 5.62 #peak 2108 #SUP 1.00 #QF 0.94 29 PHE HD 65 LYS HB3 6.11 #peak 2109 #SUP 1.00 #QF 0.99 129 PHE HD 165 LYS HB3 6.11 #peak 2109 #SUP 1.00 #QF 0.99 65 LYS HB3 68 LYS H 6.50 #peak 2109 #SUP 1.00 #QF 0.99 165 LYS HB3 168 LYS H 6.50 #peak 2109 #SUP 1.00 #QF 0.99 62 LEU HD1 65 LYS HG3 6.50 #peak 2112 #SUP 0.99 #QF 0.99 65 LYS HG3 65 LYS HE 4.05 #peak 2114 #SUP 1.00 #QF 0.95 165 LYS HG2 165 LYS HE 4.05 #peak 2114 #SUP 1.00 #QF 0.95 29 PHE HE 65 LYS HG3 5.98 #peak 2117 #SUP 0.99 #QF 0.92 68 LYS HG2 69 VAL H 5.75 #peak 2118 #SUP 0.93 #QF 0.93 168 LYS HG2 169 VAL H 5.75 #peak 2118 #SUP 0.93 #QF 0.93 63 MET H 65 LYS HG3 6.34 #peak 2121 #SUP 0.99 #QF 0.26 62 LEU HD2 65 LYS HG2 5.48 #peak 2122 #SUP 1.00 62 LEU HA 65 LYS HG2 5.42 #peak 2123 #SUP 0.99 #QF 0.99 64 ASP HB3 65 LYS HG2 6.23 #peak 2124 #SUP 1.00 65 LYS HA 65 LYS HG2 3.77 #peak 2125 #SUP 1.00 165 LYS HA 165 LYS HG3 3.87 #peak 2125 #SUP 1.00 29 PHE HE 65 LYS HG2 5.51 #peak 2126 #SUP 0.87 #QF 0.81 29 PHE HZ 65 LYS HG2 6.26 #peak 2126 #SUP 0.87 #QF 0.81 129 PHE HZ 165 LYS HG3 6.41 #peak 2126 #SUP 0.87 #QF 0.81 65 LYS H 65 LYS HG2 4.02 #peak 2127 #SUP 1.00 165 LYS H 165 LYS HG3 4.02 #peak 2127 #SUP 1.00 62 LEU HA 65 LYS HD2 4.97 #peak 2130 #SUP 1.00 162 LEU HA 165 LYS HD2 4.97 #peak 2130 #SUP 1.00 65 LYS HA 65 LYS HD2 5.03 #peak 2131 #SUP 1.00 165 LYS HA 165 LYS HD2 5.03 #peak 2131 #SUP 1.00 29 PHE HE 65 LYS HD2 5.06 #peak 2133 #SUP 1.00 129 PHE HE 165 LYS HD2 5.06 #peak 2133 #SUP 1.00 62 LEU HA 65 LYS HD3 4.97 #peak 2137 #SUP 1.00 162 LEU HA 165 LYS HD3 4.97 #peak 2137 #SUP 1.00 65 LYS HA 65 LYS HD3 5.03 #peak 2138 #SUP 1.00 165 LYS HA 165 LYS HD3 5.03 #peak 2138 #SUP 1.00 65 LYS HA 65 LYS HE 4.72 #peak 2140 #SUP 0.97 #QF 0.92 165 LYS HA 165 LYS HE 4.72 #peak 2140 #SUP 0.97 #QF 0.92 65 LYS HA 68 LYS HE 5.13 #peak 2140 #SUP 0.97 #QF 0.92 165 LYS HA 168 LYS HE 5.13 #peak 2140 #SUP 0.97 #QF 0.92 41 LYS HE 44 ILE H 5.72 #peak 2141 #SUP 0.50 #QF 0.50 141 LYS HE 144 ILE H 5.72 #peak 2141 #SUP 0.50 #QF 0.50 66 LEU H 66 LEU HG 4.44 #peak 2164 #SUP 1.00 #QF 0.26 166 LEU H 166 LEU HG 4.44 #peak 2164 #SUP 1.00 #QF 0.26 63 MET HA 66 LEU HD1 4.11 #peak 2167 #SUP 0.92 #QF 0.92 163 MET HA 166 LEU HD1 4.11 #peak 2167 #SUP 0.92 #QF 0.92 63 MET HG3 66 LEU HD1 5.47 #peak 2168 #SUP 0.89 #QF 0.89 163 MET HG3 166 LEU HD1 5.47 #peak 2168 #SUP 0.89 #QF 0.89 66 LEU HA 66 LEU HD1 4.69 #peak 2169 #SUP 0.99 #QF 0.99 166 LEU HA 166 LEU HD1 4.69 #peak 2169 #SUP 0.99 #QF 0.99 66 LEU HD1 67 ARG H 5.19 #peak 2173 #SUP 0.86 #QF 0.86 166 LEU HD1 167 ARG H 5.19 #peak 2173 #SUP 0.86 #QF 0.86 66 LEU HA 66 LEU HD2 3.24 #peak 2174 #SUP 0.95 #QF 0.95 166 LEU HA 166 LEU HD2 3.24 #peak 2174 #SUP 0.95 #QF 0.95 66 LEU H 66 LEU HD2 4.00 #peak 2176 #SUP 1.00 166 LEU H 166 LEU HD2 4.00 #peak 2176 #SUP 1.00 67 ARG HA 72 VAL HB 4.86 #peak 2182 #SUP 0.96 #QF 0.96 167 ARG HA 172 VAL HB 4.86 #peak 2182 #SUP 0.96 #QF 0.96 67 ARG HA 69 VAL H 5.19 #peak 2185 #SUP 0.99 #QF 0.99 167 ARG HA 169 VAL H 5.19 #peak 2185 #SUP 0.99 #QF 0.99 67 ARG HB 75 VAL HG1 4.78 #peak 2187 #SUP 0.99 #QF 0.76 167 ARG HB 175 VAL HG1 4.78 #peak 2187 #SUP 0.99 #QF 0.76 67 ARG HB 75 VAL HG2 5.00 #peak 2187 #SUP 0.99 #QF 0.76 167 ARG HB 175 VAL HG2 5.00 #peak 2187 #SUP 0.99 #QF 0.76 67 ARG HB 68 LYS HE 6.17 #peak 2188 #SUP 0.85 #QF 0.26 167 ARG HB 168 LYS HE 6.17 #peak 2188 #SUP 0.85 #QF 0.26 64 ASP HA 67 ARG HG2 5.31 #peak 2197 #SUP 1.00 164 ASP HA 167 ARG HG2 5.31 #peak 2197 #SUP 1.00 64 ASP HA 67 ARG HG3 5.31 #peak 2203 #SUP 1.00 164 ASP HA 167 ARG HG3 5.31 #peak 2203 #SUP 1.00 67 ARG H 67 ARG HG3 4.71 #peak 2205 #SUP 0.99 #QF 0.99 167 ARG H 167 ARG HG3 4.71 #peak 2205 #SUP 0.99 #QF 0.99 67 ARG HD 75 VAL HG1 4.96 #peak 2206 #SUP 1.00 #QF 0.93 167 ARG HD 175 VAL HG1 4.96 #peak 2206 #SUP 1.00 #QF 0.93 67 ARG HD 75 VAL HG2 5.35 #peak 2206 #SUP 1.00 #QF 0.93 167 ARG HD 175 VAL HG2 5.35 #peak 2206 #SUP 1.00 #QF 0.93 67 ARG HB 67 ARG HD 3.61 #peak 2208 #SUP 0.90 #QF 0.82 167 ARG HB 167 ARG HD 3.61 #peak 2208 #SUP 0.90 #QF 0.82 67 ARG HA 67 ARG HD 4.92 #peak 2209 #SUP 1.00 167 ARG HA 167 ARG HD 4.92 #peak 2209 #SUP 1.00 67 ARG HD 68 LYS H 5.78 #peak 2213 #SUP 0.91 #QF 0.91 167 ARG HD 168 LYS H 5.78 #peak 2213 #SUP 0.91 #QF 0.91 64 ASP H 67 ARG HD 6.31 #peak 2216 #SUP 0.96 #QF 0.96 164 ASP H 167 ARG HD 6.31 #peak 2216 #SUP 0.96 #QF 0.96 68 LYS HA 69 VAL HG2 5.26 #peak 2217 #SUP 0.94 #QF 0.94 168 LYS HA 169 VAL HG2 5.26 #peak 2217 #SUP 0.94 #QF 0.94 68 LYS HA 68 LYS HG3 3.83 #peak 2218 #SUP 1.00 168 LYS HA 168 LYS HG3 3.83 #peak 2218 #SUP 1.00 68 LYS HA 68 LYS HD3 3.80 #peak 2219 #SUP 1.00 #QF 0.87 168 LYS HA 168 LYS HD3 3.80 #peak 2219 #SUP 1.00 #QF 0.87 68 LYS HA 69 VAL HB 6.11 #peak 2222 #SUP 0.91 #QF 0.91 168 LYS HA 169 VAL HB 6.11 #peak 2222 #SUP 0.91 #QF 0.91 68 LYS HA 69 VAL HA 5.08 #peak 2223 #SUP 0.95 #QF 0.95 168 LYS HA 169 VAL HA 5.08 #peak 2223 #SUP 0.95 #QF 0.95 65 LYS HB2 65 LYS HE 5.54 #peak 2229 #SUP 1.00 #QF 0.50 165 LYS HB2 165 LYS HE 5.54 #peak 2229 #SUP 1.00 #QF 0.50 68 LYS HB2 68 LYS HE 5.69 #peak 2234 #SUP 1.00 #QF 0.26 168 LYS HB2 168 LYS HE 5.69 #peak 2234 #SUP 1.00 #QF 0.26 68 LYS HB2 69 VAL HA 5.85 #peak 2235 #SUP 1.00 #QF 0.41 168 LYS HB2 169 VAL HA 5.85 #peak 2235 #SUP 1.00 #QF 0.41 65 LYS HA 68 LYS HB2 4.70 #peak 2236 #SUP 0.94 #QF 0.94 165 LYS HA 168 LYS HB2 4.70 #peak 2236 #SUP 0.94 #QF 0.94 66 LEU H 68 LYS HB2 6.43 #peak 2240 #SUP 1.00 #QF 0.91 166 LEU H 168 LYS HB2 6.43 #peak 2240 #SUP 1.00 #QF 0.91 68 LYS HA 68 LYS HG2 3.83 #peak 2243 #SUP 1.00 168 LYS HA 168 LYS HG2 3.83 #peak 2243 #SUP 1.00 68 LYS H 68 LYS HG2 4.18 #peak 2244 #SUP 1.00 168 LYS H 168 LYS HG2 4.18 #peak 2244 #SUP 1.00 65 LYS HG2 65 LYS HE 3.94 #peak 2246 #SUP 1.00 #QF 0.35 165 LYS HG3 165 LYS HE 4.05 #peak 2246 #SUP 1.00 #QF 0.35 64 ASP H 65 LYS HG2 6.27 #peak 2251 #SUP 0.95 #QF 0.95 68 LYS HA 68 LYS HE 4.44 #peak 2255 #SUP 0.99 #QF 0.99 168 LYS HA 168 LYS HE 4.44 #peak 2255 #SUP 0.99 #QF 0.99 29 PHE HD 65 LYS HE 4.59 #peak 2256 #SUP 0.87 #QF 0.82 129 PHE HD 165 LYS HE 4.59 #peak 2256 #SUP 0.87 #QF 0.82 68 LYS H 68 LYS HE 5.15 #peak 2256 #SUP 0.87 #QF 0.82 168 LYS H 168 LYS HE 5.15 #peak 2256 #SUP 0.87 #QF 0.82 15 LYS H 15 LYS HE 5.41 #peak 2257 #SUP 0.93 #QF 0.93 115 LYS H 115 LYS HE 5.41 #peak 2257 #SUP 0.93 #QF 0.93 15 LYS HE 16 ASN HD21 5.14 #peak 2259 #SUP 0.62 #QF 0.49 115 LYS HE 116 ASN HD21 5.14 #peak 2259 #SUP 0.62 #QF 0.49 15 LYS HE 18 MET H 6.50 #peak 2260 #SUP 0.83 #QF 0.64 115 LYS HE 118 MET H 6.50 #peak 2260 #SUP 0.83 #QF 0.64 67 ARG H 68 LYS HE 6.50 #peak 2260 #SUP 0.83 #QF 0.64 167 ARG H 168 LYS HE 6.50 #peak 2260 #SUP 0.83 #QF 0.64 68 LYS HB3 69 VAL HA 4.91 #peak 2263 #SUP 1.00 #QF 0.82 168 LYS HB3 169 VAL HA 4.91 #peak 2263 #SUP 1.00 #QF 0.82 69 VAL HB 70 GLN HA 6.50 #peak 2271 #SUP 1.00 #QF 0.98 169 VAL HB 170 GLN HA 6.50 #peak 2271 #SUP 1.00 #QF 0.98 69 VAL HB 72 VAL H 5.33 #peak 2274 #SUP 1.00 169 VAL HB 172 VAL H 5.33 #peak 2274 #SUP 1.00 15 LYS HD 69 VAL HG1 6.50 #peak 2276 #SUP 0.90 #QF 0.27 115 LYS HD 169 VAL HG1 6.50 #peak 2276 #SUP 0.90 #QF 0.27 22 ILE HB 69 VAL HG1 6.50 #peak 2276 #SUP 0.90 #QF 0.27 122 ILE HB 169 VAL HG1 6.50 #peak 2276 #SUP 0.90 #QF 0.27 69 VAL HA 69 VAL HG1 3.24 #peak 2280 #SUP 1.00 169 VAL HA 169 VAL HG1 3.24 #peak 2280 #SUP 1.00 69 VAL HG1 70 GLN HA 4.57 #peak 2281 #SUP 0.99 #QF 0.99 169 VAL HG1 170 GLN HA 4.57 #peak 2281 #SUP 0.99 #QF 0.99 69 VAL H 69 VAL HG1 3.84 #peak 2284 #SUP 1.00 169 VAL H 169 VAL HG1 3.84 #peak 2284 #SUP 1.00 69 VAL HA 69 VAL HG2 3.28 #peak 2289 #SUP 1.00 169 VAL HA 169 VAL HG2 3.28 #peak 2289 #SUP 1.00 66 LEU HA 69 VAL HG2 3.59 #peak 2290 #SUP 0.97 #QF 0.97 166 LEU HA 169 VAL HG2 3.59 #peak 2290 #SUP 0.97 #QF 0.97 45 PHE HE 69 VAL HG2 6.50 #peak 2291 #SUP 1.00 145 PHE HE 169 VAL HG2 6.50 #peak 2291 #SUP 1.00 69 VAL HG2 70 GLN H 4.41 #peak 2295 #SUP 1.00 169 VAL HG2 170 GLN H 4.41 #peak 2295 #SUP 1.00 22 ILE H 69 VAL HG2 6.50 #peak 2296 #SUP 1.00 #QF 0.93 122 ILE H 169 VAL HG2 6.50 #peak 2296 #SUP 1.00 #QF 0.93 69 VAL HG2 71 GLY H 6.50 #peak 2296 #SUP 1.00 #QF 0.93 169 VAL HG2 171 GLY H 6.50 #peak 2296 #SUP 1.00 #QF 0.93 20 ASN HA 22 ILE HB 5.32 #peak 2297 #SUP 0.63 #QF 0.63 120 ASN HA 122 ILE HB 5.32 #peak 2297 #SUP 0.63 #QF 0.63 66 LEU HA 69 VAL HB 4.92 #peak 2299 #SUP 0.72 #QF 0.72 166 LEU HA 169 VAL HB 4.92 #peak 2299 #SUP 0.72 #QF 0.72 70 GLN HA 70 GLN HG 3.83 #peak 2300 #SUP 1.00 170 GLN HA 170 GLN HG 3.83 #peak 2300 #SUP 1.00 19 THR HB 20 ASN HA 5.02 #peak 2301 #SUP 0.97 #QF 0.36 119 THR HB 120 ASN HA 5.02 #peak 2301 #SUP 0.97 #QF 0.36 69 VAL HA 70 GLN HA 5.66 #peak 2301 #SUP 0.97 #QF 0.36 169 VAL HA 170 GLN HA 5.66 #peak 2301 #SUP 0.97 #QF 0.36 70 GLN HA 71 GLY HA2 4.92 #peak 2302 #SUP 1.00 170 GLN HA 171 GLY HA2 4.92 #peak 2302 #SUP 1.00 66 LEU HA 68 LYS H 5.09 #peak 2303 #SUP 0.89 #QF 0.89 166 LEU HA 168 LYS H 5.09 #peak 2303 #SUP 0.89 #QF 0.89 69 VAL HG1 70 GLN HB 4.54 #peak 2308 #SUP 1.00 169 VAL HG1 170 GLN HB 4.54 #peak 2308 #SUP 1.00 69 VAL HG2 70 GLN HB 6.18 #peak 2309 #SUP 1.00 169 VAL HG2 170 GLN HB 6.18 #peak 2309 #SUP 1.00 69 VAL HA 70 GLN HB 4.68 #peak 2311 #SUP 1.00 169 VAL HA 170 GLN HB 4.68 #peak 2311 #SUP 1.00 70 GLN HB 71 GLY HA2 5.58 #peak 2313 #SUP 1.00 170 GLN HB 171 GLY HA2 5.58 #peak 2313 #SUP 1.00 69 VAL H 70 GLN HB 6.17 #peak 2314 #SUP 1.00 169 VAL H 170 GLN HB 6.17 #peak 2314 #SUP 1.00 70 GLN HB 72 VAL H 5.44 #peak 2315 #SUP 0.99 #QF 0.99 170 GLN HB 172 VAL H 5.44 #peak 2315 #SUP 0.99 #QF 0.99 21 GLN HG3 69 VAL HG1 4.51 #peak 2318 #SUP 0.99 #QF 0.92 121 GLN HG3 169 VAL HG1 4.51 #peak 2318 #SUP 0.99 #QF 0.92 69 VAL HG1 70 GLN HG 4.72 #peak 2318 #SUP 0.99 #QF 0.92 169 VAL HG1 170 GLN HG 4.72 #peak 2318 #SUP 0.99 #QF 0.92 21 GLN HG3 22 ILE HB 4.83 #peak 2319 #SUP 0.61 #QF 0.61 121 GLN HG3 122 ILE HB 4.83 #peak 2319 #SUP 0.61 #QF 0.61 70 GLN HB 70 GLN HG 2.72 #peak 2320 #SUP 1.00 170 GLN HB 170 GLN HG 2.72 #peak 2320 #SUP 1.00 69 VAL HA 70 GLN HG 4.14 #peak 2321 #SUP 0.99 #QF 0.99 169 VAL HA 170 GLN HG 4.14 #peak 2321 #SUP 0.99 #QF 0.99 70 GLN HG 71 GLY HA3 4.75 #peak 2322 #SUP 0.88 #QF 0.88 170 GLN HG 171 GLY HA3 4.75 #peak 2322 #SUP 0.88 #QF 0.88 21 GLN HA 21 GLN HG3 3.88 #peak 2323 #SUP 1.00 #QF 0.70 121 GLN HA 121 GLN HG3 3.88 #peak 2323 #SUP 1.00 #QF 0.70 70 GLN HG 71 GLY HA2 4.71 #peak 2324 #SUP 1.00 170 GLN HG 171 GLY HA2 4.71 #peak 2324 #SUP 1.00 70 GLN HG 72 VAL H 4.88 #peak 2327 #SUP 0.99 #QF 0.99 170 GLN HG 172 VAL H 4.88 #peak 2327 #SUP 0.99 #QF 0.99 70 GLN H 70 GLN HG 3.45 #peak 2328 #SUP 0.98 #QF 0.98 170 GLN H 170 GLN HG 3.45 #peak 2328 #SUP 0.98 #QF 0.98 21 GLN HG3 22 ILE H 4.08 #peak 2329 #SUP 0.97 #QF 0.61 121 GLN HG3 122 ILE H 4.08 #peak 2329 #SUP 0.97 #QF 0.61 12 GLY HA3 72 VAL HA 4.52 #peak 2333 #SUP 0.97 #QF 0.97 112 GLY HA3 172 VAL HA 4.52 #peak 2333 #SUP 0.97 #QF 0.97 69 VAL HG2 72 VAL HB 5.77 #peak 2338 #SUP 0.99 #QF 0.90 169 VAL HG2 172 VAL HB 5.77 #peak 2338 #SUP 0.99 #QF 0.90 10 ILE HG2 72 VAL HG1 3.13 #peak 2340 #SUP 0.90 #QF 0.90 110 ILE HG2 172 VAL HG1 3.13 #peak 2340 #SUP 0.90 #QF 0.90 72 VAL HA 72 VAL HG1 3.77 #peak 2342 #SUP 1.00 172 VAL HA 172 VAL HG1 3.77 #peak 2342 #SUP 1.00 67 ARG HA 72 VAL HG1 3.76 #peak 2343 #SUP 0.99 #QF 0.99 167 ARG HA 172 VAL HG1 3.76 #peak 2343 #SUP 0.99 #QF 0.99 66 LEU HA 72 VAL HG1 6.50 #peak 2344 #SUP 1.00 #QF 0.93 166 LEU HA 172 VAL HG1 6.50 #peak 2344 #SUP 1.00 #QF 0.93 72 VAL HG1 75 VAL HA 5.67 #peak 2345 #SUP 0.92 #QF 0.92 172 VAL HG1 175 VAL HA 5.67 #peak 2345 #SUP 0.92 #QF 0.92 10 ILE HA 72 VAL HG1 4.76 #peak 2346 #SUP 1.00 #QF 0.99 110 ILE HA 172 VAL HG1 4.76 #peak 2346 #SUP 1.00 #QF 0.99 45 PHE HZ 72 VAL HG1 5.95 #peak 2347 #SUP 0.99 #QF 0.99 145 PHE HZ 172 VAL HG1 5.95 #peak 2347 #SUP 0.99 #QF 0.99 45 PHE HE 72 VAL HG1 6.37 #peak 2348 #SUP 1.00 145 PHE HE 172 VAL HG1 6.37 #peak 2348 #SUP 1.00 69 VAL H 72 VAL HG1 5.69 #peak 2350 #SUP 0.93 #QF 0.93 169 VAL H 172 VAL HG1 5.69 #peak 2350 #SUP 0.93 #QF 0.93 11 VAL H 72 VAL HG1 4.49 #peak 2354 #SUP 1.00 111 VAL H 172 VAL HG1 4.49 #peak 2354 #SUP 1.00 72 VAL HG1 73 PHE H 3.97 #peak 2355 #SUP 0.99 #QF 0.99 172 VAL HG1 173 PHE H 3.97 #peak 2355 #SUP 0.99 #QF 0.99 69 VAL HB 72 VAL HG2 3.44 #peak 2358 #SUP 0.62 #QF 0.62 169 VAL HB 172 VAL HG2 3.44 #peak 2358 #SUP 0.62 #QF 0.62 12 GLY HA3 72 VAL HG2 5.37 #peak 2359 #SUP 1.00 112 GLY HA3 172 VAL HG2 5.37 #peak 2359 #SUP 1.00 12 GLY HA2 72 VAL HG2 4.84 #peak 2360 #SUP 1.00 112 GLY HA2 172 VAL HG2 4.84 #peak 2360 #SUP 1.00 66 LEU HA 72 VAL HG2 5.07 #peak 2361 #SUP 0.68 #QF 0.68 166 LEU HA 172 VAL HG2 5.07 #peak 2361 #SUP 0.68 #QF 0.68 34 ARG HA 119 THR HG2 5.94 #peak 2362 #SUP 0.96 #QF 0.34 19 THR HG2 134 ARG HA 5.94 #peak 2362 #SUP 0.96 #QF 0.34 15 LYS H 19 THR HG2 4.83 #peak 2365 #SUP 0.97 #QF 0.25 115 LYS H 119 THR HG2 4.83 #peak 2365 #SUP 0.97 #QF 0.25 69 VAL H 72 VAL HG2 5.04 #peak 2365 #SUP 0.97 #QF 0.25 169 VAL H 172 VAL HG2 5.04 #peak 2365 #SUP 0.97 #QF 0.25 72 VAL H 72 VAL HG2 3.57 #peak 2366 #SUP 0.99 #QF 0.99 172 VAL H 172 VAL HG2 3.57 #peak 2366 #SUP 0.99 #QF 0.99 13 GLU H 72 VAL HG2 5.67 #peak 2367 #SUP 1.00 113 GLU H 172 VAL HG2 5.67 #peak 2367 #SUP 1.00 11 VAL H 72 VAL HG2 5.63 #peak 2368 #SUP 0.92 #QF 0.50 111 VAL H 172 VAL HG2 5.63 #peak 2368 #SUP 0.92 #QF 0.50 72 VAL HG1 73 PHE HB2 5.69 #peak 2370 #SUP 0.98 #QF 0.98 172 VAL HG1 173 PHE HB2 5.69 #peak 2370 #SUP 0.98 #QF 0.98 11 VAL HG1 73 PHE HB3 6.33 #peak 2379 #SUP 0.98 #QF 0.98 111 VAL HG1 173 PHE HB3 6.33 #peak 2379 #SUP 0.98 #QF 0.98 72 VAL HG1 73 PHE HB3 5.81 #peak 2381 #SUP 0.97 #QF 0.97 172 VAL HG1 173 PHE HB3 5.81 #peak 2381 #SUP 0.97 #QF 0.97 12 GLY HA2 73 PHE HB3 5.84 #peak 2383 #SUP 0.99 #QF 0.99 112 GLY HA2 173 PHE HB3 5.84 #peak 2383 #SUP 0.99 #QF 0.99 72 VAL HA 73 PHE HB3 5.61 #peak 2384 #SUP 1.00 172 VAL HA 173 PHE HB3 5.61 #peak 2384 #SUP 1.00 73 PHE HB3 74 THR H 4.65 #peak 2388 #SUP 1.00 173 PHE HB3 174 THR H 4.65 #peak 2388 #SUP 1.00 72 VAL HG1 74 THR HB 4.91 #peak 2390 #SUP 0.92 #QF 0.92 172 VAL HG1 174 THR HB 4.91 #peak 2390 #SUP 0.92 #QF 0.92 11 VAL HB 74 THR HB 4.07 #peak 2393 #SUP 0.98 #QF 0.98 111 VAL HB 174 THR HB 4.07 #peak 2393 #SUP 0.98 #QF 0.98 74 THR HB 76 GLU HG 4.53 #peak 2394 #SUP 0.95 #QF 0.95 174 THR HB 176 GLU HG 4.53 #peak 2394 #SUP 0.95 #QF 0.95 10 ILE HA 74 THR HB 5.81 #peak 2396 #SUP 0.96 #QF 0.96 110 ILE HA 174 THR HB 5.81 #peak 2396 #SUP 0.96 #QF 0.96 74 THR HB 75 VAL H 3.59 #peak 2398 #SUP 0.96 #QF 0.96 174 THR HB 175 VAL H 3.59 #peak 2398 #SUP 0.96 #QF 0.96 11 VAL HB 74 THR HG2 3.69 #peak 2399 #SUP 0.90 #QF 0.90 111 VAL HB 174 THR HG2 3.69 #peak 2399 #SUP 0.90 #QF 0.90 73 PHE HB3 74 THR HG2 4.43 #peak 2401 #SUP 1.00 173 PHE HB3 174 THR HG2 4.43 #peak 2401 #SUP 1.00 73 PHE HB2 74 THR HG2 3.75 #peak 2402 #SUP 0.99 #QF 0.99 173 PHE HB2 174 THR HG2 3.75 #peak 2402 #SUP 0.99 #QF 0.99 74 THR HA 74 THR HG2 3.08 #peak 2405 #SUP 0.95 #QF 0.95 174 THR HA 174 THR HG2 3.08 #peak 2405 #SUP 0.95 #QF 0.95 73 PHE HA 74 THR HG2 4.34 #peak 2406 #SUP 0.99 #QF 0.99 173 PHE HA 174 THR HG2 4.34 #peak 2406 #SUP 0.99 #QF 0.99 73 PHE HD 74 THR HG2 4.65 #peak 2407 #SUP 1.00 173 PHE HD 174 THR HG2 4.65 #peak 2407 #SUP 1.00 74 THR H 74 THR HG2 3.83 #peak 2409 #SUP 1.00 174 THR H 174 THR HG2 3.83 #peak 2409 #SUP 1.00 11 VAL H 74 THR HG2 3.86 #peak 2410 #SUP 0.88 #QF 0.88 111 VAL H 174 THR HG2 3.86 #peak 2410 #SUP 0.88 #QF 0.88 73 PHE H 74 THR HG2 5.03 #peak 2412 #SUP 0.96 #QF 0.96 173 PHE H 174 THR HG2 5.03 #peak 2412 #SUP 0.96 #QF 0.96 10 ILE HG2 75 VAL HB 5.78 #peak 2414 #SUP 0.78 #QF 0.78 110 ILE HG2 175 VAL HB 5.78 #peak 2414 #SUP 0.78 #QF 0.78 63 MET HG3 75 VAL HG1 4.33 #peak 2421 #SUP 0.90 #QF 0.90 163 MET HG3 175 VAL HG1 4.33 #peak 2421 #SUP 0.90 #QF 0.90 63 MET HA 75 VAL HG1 3.48 #peak 2423 #SUP 0.62 #QF 0.62 163 MET HA 175 VAL HG1 3.48 #peak 2423 #SUP 0.62 #QF 0.62 75 VAL HA 75 VAL HG1 3.94 #peak 2424 #SUP 1.00 175 VAL HA 175 VAL HG1 3.94 #peak 2424 #SUP 1.00 63 MET H 75 VAL HG1 4.98 #peak 2427 #SUP 0.99 #QF 0.92 163 MET H 175 VAL HG1 4.98 #peak 2427 #SUP 0.99 #QF 0.92 9 ARG H 75 VAL HG1 5.21 #peak 2429 #SUP 0.81 #QF 0.81 109 ARG H 175 VAL HG1 5.21 #peak 2429 #SUP 0.81 #QF 0.81 67 ARG HA 75 VAL HG2 3.65 #peak 2434 #SUP 0.99 #QF 0.99 167 ARG HA 175 VAL HG2 3.65 #peak 2434 #SUP 0.99 #QF 0.99 64 ASP HA 75 VAL HG1 6.49 #peak 2435 #SUP 1.00 #QF 0.54 164 ASP HA 175 VAL HG1 6.49 #peak 2435 #SUP 1.00 #QF 0.54 10 ILE HA 75 VAL HG2 4.38 #peak 2438 #SUP 0.95 #QF 0.95 110 ILE HA 175 VAL HG2 4.38 #peak 2438 #SUP 0.95 #QF 0.95 66 LEU H 75 VAL HG1 4.97 #peak 2439 #SUP 0.90 #QF 0.31 166 LEU H 175 VAL HG1 4.97 #peak 2439 #SUP 0.90 #QF 0.31 9 ARG H 76 GLU HB3 6.08 #peak 2449 #SUP 1.00 8 ILE HG2 76 GLU HG 5.68 #peak 2450 #SUP 0.81 #QF 0.75 108 ILE HG2 176 GLU HG 5.68 #peak 2450 #SUP 0.81 #QF 0.75 76 GLU HG 78 LEU HD2 6.27 #peak 2450 #SUP 0.81 #QF 0.75 176 GLU HG 178 LEU HD2 6.27 #peak 2450 #SUP 0.81 #QF 0.75 74 THR HG2 76 GLU HG 5.19 #peak 2451 #SUP 0.98 #QF 0.98 174 THR HG2 176 GLU HG 5.19 #peak 2451 #SUP 0.98 #QF 0.98 9 ARG HB 76 GLU HG 4.88 #peak 2452 #SUP 0.92 #QF 0.88 109 ARG HB 176 GLU HG 4.88 #peak 2452 #SUP 0.92 #QF 0.88 74 THR HA 76 GLU HG 4.90 #peak 2455 #SUP 0.89 #QF 0.89 174 THR HA 176 GLU HG 4.90 #peak 2455 #SUP 0.89 #QF 0.89 9 ARG H 76 GLU HG 5.50 #peak 2458 #SUP 1.00 109 ARG H 176 GLU HG 5.50 #peak 2458 #SUP 1.00 59 LEU HD1 77 ARG HG2 5.42 #peak 2471 #SUP 0.97 #QF 0.97 159 LEU HD1 177 ARG HG2 5.42 #peak 2471 #SUP 0.97 #QF 0.97 77 ARG HA 77 ARG HG2 4.06 #peak 2476 #SUP 1.00 177 ARG HA 177 ARG HG2 4.06 #peak 2476 #SUP 1.00 77 ARG H 77 ARG HG2 4.71 #peak 2479 #SUP 1.00 177 ARG H 177 ARG HG2 4.71 #peak 2479 #SUP 1.00 59 LEU HD1 77 ARG HG3 5.42 #peak 2480 #SUP 0.98 #QF 0.98 159 LEU HD1 177 ARG HG3 5.42 #peak 2480 #SUP 0.98 #QF 0.98 59 LEU HD2 77 ARG HG3 4.60 #peak 2481 #SUP 0.95 #QF 0.95 159 LEU HD2 177 ARG HG3 4.60 #peak 2481 #SUP 0.95 #QF 0.95 77 ARG HA 77 ARG HG3 4.06 #peak 2484 #SUP 0.99 #QF 0.99 177 ARG HA 177 ARG HG3 4.06 #peak 2484 #SUP 0.99 #QF 0.99 77 ARG HG3 78 LEU H 4.61 #peak 2485 #SUP 0.99 #QF 0.99 177 ARG HG3 178 LEU H 4.61 #peak 2485 #SUP 0.99 #QF 0.99 77 ARG H 77 ARG HG3 4.71 #peak 2486 #SUP 0.99 #QF 0.99 177 ARG H 177 ARG HG3 4.71 #peak 2486 #SUP 0.99 #QF 0.99 59 LEU HD1 77 ARG HD 4.24 #peak 2487 #SUP 0.97 #QF 0.97 159 LEU HD1 177 ARG HD 4.24 #peak 2487 #SUP 0.97 #QF 0.97 59 LEU HD2 77 ARG HD 3.59 #peak 2488 #SUP 0.99 #QF 0.99 159 LEU HD2 177 ARG HD 3.59 #peak 2488 #SUP 0.99 #QF 0.99 6 ALA HB 77 ARG HD 4.49 #peak 2489 #SUP 0.94 #QF 0.94 106 ALA HB 177 ARG HD 4.49 #peak 2489 #SUP 0.94 #QF 0.94 77 ARG HB2 77 ARG HD 3.86 #peak 2490 #SUP 1.00 #QF 0.98 177 ARG HB2 177 ARG HD 3.86 #peak 2490 #SUP 1.00 #QF 0.98 77 ARG HB3 77 ARG HD 3.86 #peak 2491 #SUP 0.99 #QF 0.67 177 ARG HB3 177 ARG HD 3.86 #peak 2491 #SUP 0.99 #QF 0.67 4 PHE HZ 77 ARG HD 5.64 #peak 2492 #SUP 0.84 #QF 0.84 104 PHE HZ 177 ARG HD 5.64 #peak 2492 #SUP 0.84 #QF 0.84 4 PHE HE 77 ARG HD 5.28 #peak 2493 #SUP 1.00 104 PHE HE 177 ARG HD 5.28 #peak 2493 #SUP 1.00 77 ARG HD 78 LEU H 5.00 #peak 2495 #SUP 1.00 177 ARG HD 178 LEU H 5.00 #peak 2495 #SUP 1.00 78 LEU HB3 78 LEU HD1 4.04 #peak 2497 #SUP 1.00 178 LEU HB3 178 LEU HD1 4.04 #peak 2497 #SUP 1.00 78 LEU HB3 78 LEU HD2 4.21 #peak 2497 #SUP 1.00 178 LEU HB3 178 LEU HD2 4.21 #peak 2497 #SUP 1.00 7 GLY HA3 78 LEU HB3 5.24 #peak 2498 #SUP 1.00 107 GLY HA3 178 LEU HB3 5.24 #peak 2498 #SUP 1.00 77 ARG HA 78 LEU HB3 5.82 #peak 2500 #SUP 1.00 177 ARG HA 178 LEU HB3 5.82 #peak 2500 #SUP 1.00 7 GLY HA2 78 LEU HB3 5.90 #peak 2501 #SUP 1.00 107 GLY HA2 178 LEU HB3 5.90 #peak 2501 #SUP 1.00 8 ILE H 78 LEU HB3 6.35 #peak 2504 #SUP 1.00 108 ILE H 178 LEU HB3 6.35 #peak 2504 #SUP 1.00 9 ARG H 78 LEU HB3 6.50 #peak 2504 #SUP 1.00 109 ARG H 178 LEU HB3 6.50 #peak 2504 #SUP 1.00 78 LEU HB2 78 LEU HD1 3.74 #peak 2505 #SUP 1.00 178 LEU HB2 178 LEU HD1 3.74 #peak 2505 #SUP 1.00 77 ARG HA 78 LEU HB2 5.38 #peak 2508 #SUP 0.99 #QF 0.99 177 ARG HA 178 LEU HB2 5.38 #peak 2508 #SUP 0.99 #QF 0.99 7 GLY HA2 78 LEU HB2 5.26 #peak 2509 #SUP 0.98 #QF 0.98 107 GLY HA2 178 LEU HB2 5.26 #peak 2509 #SUP 0.98 #QF 0.98 78 LEU HB2 80 ASN H 5.96 #peak 2511 #SUP 0.27 #QF 0.27 178 LEU HB2 180 ASN H 5.96 #peak 2511 #SUP 0.27 #QF 0.27 7 GLY H 78 LEU HB2 6.19 #peak 2512 #SUP 1.00 107 GLY H 178 LEU HB2 6.19 #peak 2512 #SUP 1.00 77 ARG HA 78 LEU HG 5.15 #peak 2516 #SUP 0.98 #QF 0.98 177 ARG HA 178 LEU HG 5.15 #peak 2516 #SUP 0.98 #QF 0.98 9 ARG HA 78 LEU HG 5.55 #peak 2517 #SUP 1.00 109 ARG HA 178 LEU HG 5.55 #peak 2517 #SUP 1.00 7 GLY HA2 78 LEU HG 5.68 #peak 2518 #SUP 1.00 107 GLY HA2 178 LEU HG 5.68 #peak 2518 #SUP 1.00 78 LEU H 78 LEU HG 4.23 #peak 2519 #SUP 1.00 178 LEU H 178 LEU HG 4.23 #peak 2519 #SUP 1.00 9 ARG HB 78 LEU HD1 3.68 #peak 2521 #SUP 0.92 #QF 0.92 109 ARG HB 178 LEU HD1 3.68 #peak 2521 #SUP 0.92 #QF 0.92 50 MET HE 78 LEU HD1 4.08 #peak 2522 #SUP 0.91 #QF 0.91 150 MET HE 178 LEU HD1 4.08 #peak 2522 #SUP 0.91 #QF 0.91 48 ASN HB3 78 LEU HD1 4.80 #peak 2523 #SUP 0.94 #QF 0.94 148 ASN HB3 178 LEU HD1 4.80 #peak 2523 #SUP 0.94 #QF 0.94 48 ASN HB2 78 LEU HD1 4.80 #peak 2524 #SUP 1.00 148 ASN HB2 178 LEU HD1 4.80 #peak 2524 #SUP 1.00 9 ARG HD 78 LEU HD1 4.24 #peak 2525 #SUP 1.00 109 ARG HD 178 LEU HD1 4.24 #peak 2525 #SUP 1.00 7 GLY HA3 78 LEU HD1 3.94 #peak 2526 #SUP 1.00 107 GLY HA3 178 LEU HD1 3.94 #peak 2526 #SUP 1.00 78 LEU HA 78 LEU HD1 3.94 #peak 2527 #SUP 1.00 178 LEU HA 178 LEU HD1 3.94 #peak 2527 #SUP 1.00 8 ILE HA 78 LEU HD1 4.75 #peak 2528 #SUP 1.00 108 ILE HA 178 LEU HD1 4.75 #peak 2528 #SUP 1.00 9 ARG HA 78 LEU HD1 4.10 #peak 2529 #SUP 1.00 #QF 0.99 109 ARG HA 178 LEU HD1 4.10 #peak 2529 #SUP 1.00 #QF 0.99 48 ASN HA 78 LEU HD1 4.48 #peak 2529 #SUP 1.00 #QF 0.99 148 ASN HA 178 LEU HD1 4.48 #peak 2529 #SUP 1.00 #QF 0.99 7 GLY HA2 78 LEU HD1 4.13 #peak 2530 #SUP 1.00 107 GLY HA2 178 LEU HD1 4.13 #peak 2530 #SUP 1.00 48 ASN HD21 78 LEU HD1 4.66 #peak 2532 #SUP 1.00 148 ASN HD21 178 LEU HD1 4.66 #peak 2532 #SUP 1.00 7 GLY H 78 LEU HD1 6.06 #peak 2534 #SUP 1.00 107 GLY H 178 LEU HD1 6.06 #peak 2534 #SUP 1.00 78 LEU HD1 79 SER H 6.50 #peak 2534 #SUP 1.00 178 LEU HD1 179 SER H 6.50 #peak 2534 #SUP 1.00 50 MET H 78 LEU HD1 6.46 #peak 2535 #SUP 0.89 #QF 0.82 150 MET H 178 LEU HD1 6.46 #peak 2535 #SUP 0.89 #QF 0.82 76 GLU H 78 LEU HD1 6.50 #peak 2535 #SUP 0.89 #QF 0.82 176 GLU H 178 LEU HD1 6.50 #peak 2535 #SUP 0.89 #QF 0.82 8 ILE H 78 LEU HD1 3.96 #peak 2536 #SUP 1.00 108 ILE H 178 LEU HD1 3.96 #peak 2536 #SUP 1.00 9 ARG HB 78 LEU HD2 3.31 #peak 2538 #SUP 0.96 #QF 0.71 109 ARG HB 178 LEU HD2 3.31 #peak 2538 #SUP 0.96 #QF 0.71 9 ARG HD 78 LEU HD2 3.75 #peak 2540 #SUP 0.98 #QF 0.98 109 ARG HD 178 LEU HD2 3.75 #peak 2540 #SUP 0.98 #QF 0.98 8 ILE HA 78 LEU HD2 5.28 #peak 2542 #SUP 1.00 108 ILE HA 178 LEU HD2 5.28 #peak 2542 #SUP 1.00 9 ARG HA 78 LEU HD2 4.18 #peak 2543 #SUP 0.99 #QF 0.99 109 ARG HA 178 LEU HD2 4.18 #peak 2543 #SUP 0.99 #QF 0.99 48 ASN HD22 78 LEU HD2 5.18 #peak 2544 #SUP 1.00 148 ASN HD22 178 LEU HD2 5.18 #peak 2544 #SUP 1.00 78 LEU H 78 LEU HD2 4.21 #peak 2546 #SUP 1.00 178 LEU H 178 LEU HD2 4.21 #peak 2546 #SUP 1.00 76 GLU H 78 LEU HD2 6.34 #peak 2548 #SUP 0.97 #QF 0.97 176 GLU H 178 LEU HD2 6.34 #peak 2548 #SUP 0.97 #QF 0.97 9 ARG H 78 LEU HD2 4.39 #peak 2549 #SUP 1.00 109 ARG H 178 LEU HD2 4.39 #peak 2549 #SUP 1.00 78 LEU HB3 79 SER HB 5.83 #peak 2550 #SUP 0.84 #QF 0.84 178 LEU HB3 179 SER HB 5.83 #peak 2550 #SUP 0.84 #QF 0.84 78 LEU H 79 SER HB 5.91 #peak 2552 #SUP 0.64 #QF 0.64 178 LEU H 179 SER HB 5.91 #peak 2552 #SUP 0.64 #QF 0.64 80 ASN HB2 81 LEU HD2 5.84 #peak 2555 #SUP 0.69 #QF 0.69 180 ASN HB2 181 LEU HD2 5.84 #peak 2555 #SUP 0.69 #QF 0.69 80 ASN HB2 81 LEU H 4.92 #peak 2559 #SUP 1.00 180 ASN HB2 181 LEU H 4.92 #peak 2559 #SUP 1.00 80 ASN HB3 81 LEU HD2 5.84 #peak 2561 #SUP 0.76 #QF 0.76 180 ASN HB3 181 LEU HD2 5.84 #peak 2561 #SUP 0.76 #QF 0.76 80 ASN HB3 81 LEU H 4.92 #peak 2565 #SUP 1.00 180 ASN HB3 181 LEU H 4.92 #peak 2565 #SUP 1.00 81 LEU HA 82 GLU HB 5.42 #peak 2569 #SUP 1.00 #QF 0.95 181 LEU HA 182 GLU HB 5.42 #peak 2569 #SUP 1.00 #QF 0.95 81 LEU HB2 81 LEU HD1 3.68 #peak 2572 #SUP 1.00 181 LEU HB2 181 LEU HD1 3.68 #peak 2572 #SUP 1.00 81 LEU HB2 81 LEU HD2 4.00 #peak 2573 #SUP 1.00 181 LEU HB2 181 LEU HD2 4.00 #peak 2573 #SUP 1.00 81 LEU HA 81 LEU HG 3.99 #peak 2581 #SUP 1.00 181 LEU HA 181 LEU HG 3.99 #peak 2581 #SUP 1.00 81 LEU HB3 81 LEU HD1 3.24 #peak 2585 #SUP 1.00 #QF 0.82 181 LEU HB3 181 LEU HD1 3.24 #peak 2585 #SUP 1.00 #QF 0.82 50 MET HG2 81 LEU HD1 5.93 #peak 2587 #SUP 1.00 150 MET HG2 181 LEU HD1 5.93 #peak 2587 #SUP 1.00 50 MET HG3 81 LEU HD1 5.12 #peak 2588 #SUP 0.97 #QF 0.97 150 MET HG3 181 LEU HD1 5.12 #peak 2588 #SUP 0.97 #QF 0.97 7 GLY HA3 81 LEU HD1 4.98 #peak 2589 #SUP 1.00 107 GLY HA3 181 LEU HD1 4.98 #peak 2589 #SUP 1.00 81 LEU HA 81 LEU HD1 4.11 #peak 2590 #SUP 1.00 181 LEU HA 181 LEU HD1 4.11 #peak 2590 #SUP 1.00 5 LEU HA 81 LEU HD1 5.71 #peak 2591 #SUP 0.99 #QF 0.90 105 LEU HA 181 LEU HD1 5.71 #peak 2591 #SUP 0.99 #QF 0.90 79 SER HA 81 LEU HD1 6.19 #peak 2591 #SUP 0.99 #QF 0.90 179 SER HA 181 LEU HD1 6.19 #peak 2591 #SUP 0.99 #QF 0.90 7 GLY HA2 81 LEU HD1 4.72 #peak 2592 #SUP 0.98 #QF 0.98 107 GLY HA2 181 LEU HD1 4.72 #peak 2592 #SUP 0.98 #QF 0.98 81 LEU HD1 82 GLU H 5.18 #peak 2593 #SUP 1.00 181 LEU HD1 182 GLU H 5.18 #peak 2593 #SUP 1.00 7 GLY H 81 LEU HD1 4.18 #peak 2594 #SUP 0.99 #QF 0.99 107 GLY H 181 LEU HD1 4.18 #peak 2594 #SUP 0.99 #QF 0.99 6 ALA H 81 LEU HD1 5.27 #peak 2595 #SUP 0.98 #QF 0.98 106 ALA H 181 LEU HD1 5.27 #peak 2595 #SUP 0.98 #QF 0.98 81 LEU HB3 81 LEU HD2 3.20 #peak 2596 #SUP 1.00 #QF 0.95 181 LEU HB3 181 LEU HD2 3.20 #peak 2596 #SUP 1.00 #QF 0.95 50 MET HG3 81 LEU HD2 4.72 #peak 2598 #SUP 0.96 #QF 0.96 150 MET HG3 181 LEU HD2 4.72 #peak 2598 #SUP 0.96 #QF 0.96 7 GLY HA3 81 LEU HD2 4.09 #peak 2599 #SUP 0.99 #QF 0.99 107 GLY HA3 181 LEU HD2 4.09 #peak 2599 #SUP 0.99 #QF 0.99 81 LEU HA 81 LEU HD2 3.01 #peak 2600 #SUP 0.96 #QF 0.96 181 LEU HA 181 LEU HD2 3.01 #peak 2600 #SUP 0.96 #QF 0.96 7 GLY HA2 81 LEU HD2 4.30 #peak 2602 #SUP 0.99 #QF 0.99 107 GLY HA2 181 LEU HD2 4.30 #peak 2602 #SUP 0.99 #QF 0.99 81 LEU H 81 LEU HD2 4.22 #peak 2604 #SUP 1.00 181 LEU H 181 LEU HD2 4.22 #peak 2604 #SUP 1.00 7 GLY H 81 LEU HD2 4.31 #peak 2605 #SUP 0.98 #QF 0.97 107 GLY H 181 LEU HD2 4.31 #peak 2605 #SUP 0.98 #QF 0.97 79 SER H 81 LEU HD2 4.88 #peak 2605 #SUP 0.98 #QF 0.97 179 SER H 181 LEU HD2 4.88 #peak 2605 #SUP 0.98 #QF 0.97 8 ILE H 81 LEU HD2 5.19 #peak 2606 #SUP 0.96 #QF 0.96 108 ILE H 181 LEU HD2 5.19 #peak 2606 #SUP 0.96 #QF 0.96 82 GLU HA 83 HIS HB2 5.44 #peak 2609 #SUP 0.88 #QF 0.88 182 GLU HA 183 HIS HB2 5.44 #peak 2609 #SUP 0.88 #QF 0.88 82 GLU HB 83 HIS HD2 5.22 #peak 2614 #SUP 0.98 #QF 0.98 182 GLU HB 183 HIS HD2 5.22 #peak 2614 #SUP 0.98 #QF 0.98 82 GLU HA 82 GLU HG2 4.08 #peak 2617 #SUP 0.99 #QF 0.99 182 GLU HA 182 GLU HG2 4.08 #peak 2617 #SUP 0.99 #QF 0.99 82 GLU HG2 83 HIS HA 5.85 #peak 2618 #SUP 0.85 #QF 0.85 182 GLU HG2 183 HIS HA 5.85 #peak 2618 #SUP 0.85 #QF 0.85 82 GLU HA 82 GLU HG3 4.08 #peak 2622 #SUP 0.85 #QF 0.85 182 GLU HA 182 GLU HG3 4.08 #peak 2622 #SUP 0.85 #QF 0.85 82 GLU HG3 83 HIS HA 5.85 #peak 2623 #SUP 0.57 #QF 0.57 182 GLU HG3 183 HIS HA 5.85 #peak 2623 #SUP 0.57 #QF 0.57 82 GLU H 82 GLU HG3 4.29 #peak 2624 #SUP 1.00 182 GLU H 182 GLU HG3 4.29 #peak 2624 #SUP 1.00 5 LEU HB3 81 LEU HD1 4.89 #peak 2629 #SUP 0.98 #QF 0.98 105 LEU HB3 181 LEU HD1 4.89 #peak 2629 #SUP 0.98 #QF 0.98 8 ILE HB 9 ARG HA 6.35 #peak 2631 #SUP 1.00 108 ILE HB 109 ARG HA 6.35 #peak 2631 #SUP 1.00 8 ILE HB 48 ASN HA 6.50 #peak 2631 #SUP 1.00 108 ILE HB 148 ASN HA 6.50 #peak 2631 #SUP 1.00 10 ILE HG13 22 ILE HG2 5.55 #peak 2634 #SUP 1.00 #QF 0.36 110 ILE HG13 122 ILE HG2 5.55 #peak 2634 #SUP 1.00 #QF 0.36 10 ILE HG13 26 ILE HD1 5.85 #peak 2634 #SUP 1.00 #QF 0.36 110 ILE HG13 126 ILE HD1 5.85 #peak 2634 #SUP 1.00 #QF 0.36 8 ILE HG2 10 ILE HG13 4.00 #peak 2635 #SUP 0.97 #QF 0.96 108 ILE HG2 110 ILE HG13 4.00 #peak 2635 #SUP 0.97 #QF 0.96 10 ILE HG13 66 LEU HD1 4.40 #peak 2635 #SUP 0.97 #QF 0.96 110 ILE HG13 166 LEU HD1 4.40 #peak 2635 #SUP 0.97 #QF 0.96 11 VAL HG1 47 CYS H 6.04 #peak 2636 #SUP 1.00 111 VAL HG1 147 CYS H 6.04 #peak 2636 #SUP 1.00 12 GLY HA2 18 MET HE 5.88 #peak 2638 #SUP 1.00 #QF 0.83 112 GLY HA2 118 MET HE 5.88 #peak 2638 #SUP 1.00 #QF 0.83 115 LYS HB3 118 MET HB3 5.43 #peak 2640 #SUP 0.42 #QF 0.42 18 MET HE 69 VAL HG1 2.84 #peak 2641 #SUP 0.67 #QF 0.36 118 MET HE 169 VAL HG1 2.84 #peak 2641 #SUP 0.67 #QF 0.36 18 MET HE 72 VAL HG2 3.00 #peak 2641 #SUP 0.67 #QF 0.36 118 MET HE 172 VAL HG2 3.00 #peak 2641 #SUP 0.67 #QF 0.36 18 MET HE 21 GLN HE21 4.92 #peak 2642 #SUP 1.00 118 MET HE 121 GLN HE21 4.92 #peak 2642 #SUP 1.00 18 MET HA 21 GLN HB3 4.05 #peak 2643 #SUP 0.99 #QF 0.99 118 MET HA 121 GLN HB3 4.05 #peak 2643 #SUP 0.99 #QF 0.99 18 MET HA 21 GLN HB2 4.66 #peak 2644 #SUP 0.99 #QF 0.99 118 MET HA 121 GLN HB2 4.66 #peak 2644 #SUP 0.99 #QF 0.99 21 GLN HG3 24 GLY H 5.69 #peak 2646 #SUP 0.99 #QF 0.99 121 GLN HG3 124 GLY H 5.69 #peak 2646 #SUP 0.99 #QF 0.99 23 THR HG2 26 ILE H 5.01 #peak 2647 #SUP 0.96 #QF 0.96 123 THR HG2 126 ILE H 5.01 #peak 2647 #SUP 0.96 #QF 0.96 27 SER HA 33 ILE HG12 5.82 #peak 2653 #SUP 0.99 #QF 0.54 23 THR H 26 ILE HD1 5.39 #peak 2657 #SUP 0.98 #QF 0.96 123 THR H 126 ILE HD1 5.39 #peak 2657 #SUP 0.98 #QF 0.96 23 THR H 133 ILE HD1 6.05 #peak 2657 #SUP 0.98 #QF 0.96 33 ILE HD1 123 THR H 6.05 #peak 2657 #SUP 0.98 #QF 0.96 34 ARG HA 34 ARG HD3 5.61 #peak 2660 #SUP 0.94 #QF 0.94 134 ARG HA 134 ARG HD3 5.61 #peak 2660 #SUP 0.94 #QF 0.94 34 ARG HA 34 ARG HD2 5.61 #peak 2661 #SUP 1.00 134 ARG HA 134 ARG HD2 5.61 #peak 2661 #SUP 1.00 36 ILE HA 37 VAL HB 5.04 #peak 2662 #SUP 0.92 #QF 0.92 136 ILE HA 137 VAL HB 5.04 #peak 2662 #SUP 0.92 #QF 0.92 11 VAL HA 44 ILE HG2 4.69 #peak 2669 #SUP 0.94 #QF 0.94 111 VAL HA 144 ILE HG2 4.69 #peak 2669 #SUP 0.94 #QF 0.94 11 VAL HA 44 ILE HD1 5.95 #peak 2670 #SUP 1.00 111 VAL HA 144 ILE HD1 5.95 #peak 2670 #SUP 1.00 39 ASN H 46 THR HB 6.08 #peak 2671 #SUP 1.00 #QF 0.89 139 ASN H 146 THR HB 6.08 #peak 2671 #SUP 1.00 #QF 0.89 45 PHE H 46 THR HB 6.49 #peak 2671 #SUP 1.00 #QF 0.89 145 PHE H 146 THR HB 6.49 #peak 2671 #SUP 1.00 #QF 0.89 51 ILE HD1 53 VAL HA 5.05 #peak 2673 #SUP 0.79 #QF 0.79 151 ILE HD1 153 VAL HA 5.05 #peak 2673 #SUP 0.79 #QF 0.79 3 ASP HB2 54 LYS HA 5.60 #peak 2674 #SUP 0.95 #QF 0.72 103 ASP HB2 154 LYS HA 5.60 #peak 2674 #SUP 0.95 #QF 0.72 56 THR HG2 77 ARG HD 6.50 #peak 2676 #SUP 0.97 #QF 0.87 156 THR HG2 177 ARG HD 6.50 #peak 2676 #SUP 0.97 #QF 0.87 61 THR HG2 65 LYS HB3 5.35 #peak 2679 #SUP 0.92 #QF 0.92 161 THR HG2 165 LYS HB3 5.35 #peak 2679 #SUP 0.92 #QF 0.92 8 ILE HD1 62 LEU HA 5.82 #peak 2680 #SUP 1.00 108 ILE HD1 162 LEU HA 5.82 #peak 2680 #SUP 1.00 29 PHE HE 65 LYS HD3 5.06 #peak 2682 #SUP 0.95 #QF 0.84 129 PHE HE 165 LYS HD3 5.06 #peak 2682 #SUP 0.95 #QF 0.84 41 LYS HE 44 ILE HB 4.85 #peak 2684 #SUP 1.00 #QF 0.22 141 LYS HE 144 ILE HB 4.85 #peak 2684 #SUP 1.00 #QF 0.22 68 LYS HB3 68 LYS HE 5.30 #peak 2684 #SUP 1.00 #QF 0.22 168 LYS HB3 168 LYS HE 5.30 #peak 2684 #SUP 1.00 #QF 0.22 49 LEU HD2 62 LEU HD2 4.58 #peak 2686 #SUP 0.97 #QF 0.95 149 LEU HD2 162 LEU HD2 4.58 #peak 2686 #SUP 0.97 #QF 0.95 62 LEU HD2 66 LEU HD1 5.13 #peak 2686 #SUP 0.97 #QF 0.95 162 LEU HD2 166 LEU HD1 5.13 #peak 2686 #SUP 0.97 #QF 0.95 26 ILE H 66 LEU HD2 5.00 #peak 2688 #SUP 0.60 #QF 0.60 126 ILE H 166 LEU HD2 5.00 #peak 2688 #SUP 0.60 #QF 0.60 68 LYS HB2 69 VAL HG2 5.48 #peak 2689 #SUP 0.96 #QF 0.61 168 LYS HB2 169 VAL HG2 5.48 #peak 2689 #SUP 0.96 #QF 0.61 18 MET HE 72 VAL HA 5.17 #peak 2691 #SUP 0.98 #QF 0.98 118 MET HE 172 VAL HA 5.17 #peak 2691 #SUP 0.98 #QF 0.98 71 GLY H 72 VAL HB 5.43 #peak 2693 #SUP 0.90 #QF 0.90 171 GLY H 172 VAL HB 5.43 #peak 2693 #SUP 0.90 #QF 0.90 44 ILE HG2 73 PHE HB3 6.50 #peak 2694 #SUP 1.00 #QF 0.36 144 ILE HG2 173 PHE HB3 6.50 #peak 2694 #SUP 1.00 #QF 0.36 72 VAL HG2 73 PHE HB3 6.50 #peak 2694 #SUP 1.00 #QF 0.36 172 VAL HG2 173 PHE HB3 6.50 #peak 2694 #SUP 1.00 #QF 0.36 73 PHE HB3 75 VAL HG2 6.50 #peak 2694 #SUP 1.00 #QF 0.36 173 PHE HB3 175 VAL HG2 6.50 #peak 2694 #SUP 1.00 #QF 0.36 63 MET HA 75 VAL HB 5.67 #peak 2695 #SUP 0.91 #QF 0.91 163 MET HA 175 VAL HB 5.67 #peak 2695 #SUP 0.91 #QF 0.91 7 GLY HA3 78 LEU HG 5.79 #peak 2697 #SUP 0.89 #QF 0.89 107 GLY HA3 178 LEU HG 5.79 #peak 2697 #SUP 0.89 #QF 0.89 50 MET HG2 78 LEU HD1 5.11 #peak 2699 #SUP 0.97 #QF 0.97 150 MET HG2 178 LEU HD1 5.11 #peak 2699 #SUP 0.97 #QF 0.97 50 MET HE 81 LEU HB2 4.97 #peak 2701 #SUP 1.00 150 MET HE 181 LEU HB2 4.97 #peak 2701 #SUP 1.00 50 MET HE 81 LEU HB3 5.06 #peak 2702 #SUP 1.00 #QF 0.99 150 MET HE 181 LEU HB3 5.06 #peak 2702 #SUP 1.00 #QF 0.99 7 GLY H 81 LEU HG 6.50 #peak 2703 #SUP 1.00 107 GLY H 181 LEU HG 6.50 #peak 2703 #SUP 1.00 79 SER H 81 LEU HG 6.50 #peak 2703 #SUP 1.00 179 SER H 181 LEU HG 6.50 #peak 2703 #SUP 1.00 5 LEU HD1 81 LEU HD1 3.94 #peak 2704 #SUP 0.92 #QF 0.92 105 LEU HD1 181 LEU HD1 3.94 #peak 2704 #SUP 0.92 #QF 0.92 81 LEU HD1 83 HIS HB3 5.21 #peak 2706 #SUP 0.81 #QF 0.81 181 LEU HD1 183 HIS HB3 5.21 #peak 2706 #SUP 0.81 #QF 0.81 5 LEU HB2 83 HIS HB3 6.50 #peak 2708 #SUP 0.90 #QF 0.63 105 LEU HB2 183 HIS HB3 6.50 #peak 2708 #SUP 0.90 #QF 0.63 5 LEU HG 83 HIS HB3 6.50 #peak 2708 #SUP 0.90 #QF 0.63 105 LEU HG 183 HIS HB3 6.50 #peak 2708 #SUP 0.90 #QF 0.63 50 MET HE 83 HIS HB3 5.92 #peak 2709 #SUP 1.00 150 MET HE 183 HIS HB3 5.92 #peak 2709 #SUP 1.00 82 GLU H 83 HIS HB3 5.79 #peak 2713 #SUP 0.87 #QF 0.87 182 GLU H 183 HIS HB3 5.79 #peak 2713 #SUP 0.87 #QF 0.87 5 LEU HD2 83 HIS HB2 5.60 #peak 2714 #SUP 0.98 #QF 0.94 105 LEU HD2 183 HIS HB2 5.60 #peak 2714 #SUP 0.98 #QF 0.94 81 LEU HD1 83 HIS HB2 5.29 #peak 2715 #SUP 0.89 #QF 0.89 181 LEU HD1 183 HIS HB2 5.29 #peak 2715 #SUP 0.89 #QF 0.89 4 PHE HA 5 LEU HB2 4.74 #peak 1 #SUP 0.98 #QF 0.98 104 PHE HA 105 LEU HB2 4.74 #peak 1 #SUP 0.98 #QF 0.98 4 PHE HA 5 LEU HB3 4.93 #peak 2 #SUP 1.00 104 PHE HA 105 LEU HB3 4.93 #peak 2 #SUP 1.00 4 PHE HA 4 PHE HB 3.01 #peak 3 #SUP 0.99 #QF 0.99 104 PHE HA 104 PHE HB 3.01 #peak 3 #SUP 0.99 #QF 0.99 4 PHE HA 5 LEU H 3.11 #peak 8 #SUP 0.99 #QF 0.99 104 PHE HA 105 LEU H 3.11 #peak 8 #SUP 0.99 #QF 0.99 4 PHE HA 5 LEU HA 4.60 #peak 11 #SUP 1.00 104 PHE HA 105 LEU HA 4.60 #peak 11 #SUP 1.00 8 ILE HA 8 ILE HG2 3.47 #peak 15 #SUP 1.00 108 ILE HA 108 ILE HG2 3.47 #peak 15 #SUP 1.00 8 ILE HA 78 LEU HB2 4.31 #peak 17 #SUP 0.96 #QF 0.96 108 ILE HA 178 LEU HB2 4.31 #peak 17 #SUP 0.96 #QF 0.96 8 ILE HA 77 ARG HA 4.33 #peak 20 #SUP 0.95 #QF 0.95 108 ILE HA 177 ARG HA 4.33 #peak 20 #SUP 0.95 #QF 0.95 8 ILE HA 9 ARG H 3.39 #peak 22 #SUP 1.00 108 ILE HA 109 ARG H 3.39 #peak 22 #SUP 1.00 10 ILE HA 10 ILE HG2 3.47 #peak 23 #SUP 1.00 110 ILE HA 110 ILE HG2 3.47 #peak 23 #SUP 1.00 10 ILE HA 10 ILE HG12 4.14 #peak 24 #SUP 1.00 110 ILE HA 110 ILE HG12 4.14 #peak 24 #SUP 1.00 10 ILE HA 75 VAL HA 3.84 #peak 26 #SUP 0.98 #QF 0.98 110 ILE HA 175 VAL HA 3.84 #peak 26 #SUP 0.98 #QF 0.98 13 GLU HA 13 GLU HG 3.90 #peak 32 #SUP 1.00 113 GLU HA 113 GLU HG 3.90 #peak 32 #SUP 1.00 13 GLU HA 44 ILE HA 3.87 #peak 33 #SUP 0.99 #QF 0.99 113 GLU HA 144 ILE HA 3.87 #peak 33 #SUP 0.99 #QF 0.99 13 GLU HA 14 ASP H 3.28 #peak 35 #SUP 0.95 #QF 0.95 113 GLU HA 114 ASP H 3.28 #peak 35 #SUP 0.95 #QF 0.95 13 GLU HA 45 PHE H 4.42 #peak 36 #SUP 0.97 #QF 0.97 113 GLU HA 145 PHE H 4.42 #peak 36 #SUP 0.97 #QF 0.97 15 LYS HA 15 LYS HG 3.42 #peak 37 #SUP 1.00 115 LYS HA 115 LYS HG 3.42 #peak 37 #SUP 1.00 13 GLU HG 15 LYS HA 5.74 #peak 40 #SUP 1.00 113 GLU HG 115 LYS HA 5.74 #peak 40 #SUP 1.00 5 LEU HA 6 ALA HA 4.59 #peak 41 #SUP 0.49 #QF 0.49 105 LEU HA 106 ALA HA 4.59 #peak 41 #SUP 0.49 #QF 0.49 15 LYS HA 17 GLY H 4.42 #peak 43 #SUP 0.49 #QF 0.49 115 LYS HA 117 GLY H 4.42 #peak 43 #SUP 0.49 #QF 0.49 31 THR HA 31 THR HG2 3.37 #peak 50 #SUP 1.00 131 THR HA 131 THR HG2 3.37 #peak 50 #SUP 1.00 31 THR HA 32 ASN H 3.36 #peak 53 #SUP 0.97 #QF 0.97 131 THR HA 132 ASN H 3.36 #peak 53 #SUP 0.97 #QF 0.97 32 ASN HA 33 ILE HB 4.71 #peak 54 #SUP 0.94 #QF 0.94 132 ASN HA 133 ILE HB 4.71 #peak 54 #SUP 0.94 #QF 0.94 32 ASN HA 33 ILE H 3.46 #peak 57 #SUP 1.00 132 ASN HA 133 ILE H 3.46 #peak 57 #SUP 1.00 41 LYS HA 41 LYS HG 3.45 #peak 63 #SUP 1.00 141 LYS HA 141 LYS HG 3.45 #peak 63 #SUP 1.00 41 LYS HA 41 LYS HD 4.28 #peak 64 #SUP 0.98 #QF 0.98 141 LYS HA 141 LYS HD 4.28 #peak 64 #SUP 0.98 #QF 0.98 41 LYS HA 42 ASP H 3.07 #peak 67 #SUP 0.83 #QF 0.83 141 LYS HA 142 ASP H 3.07 #peak 67 #SUP 0.83 #QF 0.83 41 LYS HG 42 ASP HA 4.81 #peak 68 #SUP 0.95 #QF 0.95 141 LYS HG 142 ASP HA 4.81 #peak 68 #SUP 0.95 #QF 0.95 11 VAL HG2 46 THR HA 3.30 #peak 73 #SUP 0.97 #QF 0.97 111 VAL HG2 146 THR HA 3.30 #peak 73 #SUP 0.97 #QF 0.97 11 VAL HA 46 THR HA 3.81 #peak 76 #SUP 0.99 #QF 0.99 111 VAL HA 146 THR HA 3.81 #peak 76 #SUP 0.99 #QF 0.99 51 ILE HA 51 ILE HD1 4.52 #peak 78 #SUP 1.00 151 ILE HA 151 ILE HD1 4.52 #peak 78 #SUP 1.00 33 ILE HA 51 ILE HA 4.71 #peak 82 #SUP 0.94 #QF 0.94 133 ILE HA 151 ILE HA 4.71 #peak 82 #SUP 0.94 #QF 0.94 34 ARG H 51 ILE HA 4.24 #peak 84 #SUP 0.99 #QF 0.99 134 ARG H 151 ILE HA 4.24 #peak 84 #SUP 0.99 #QF 0.99 53 VAL HA 53 VAL HG2 3.83 #peak 86 #SUP 0.96 #QF 0.96 153 VAL HA 153 VAL HG2 3.83 #peak 86 #SUP 0.96 #QF 0.96 53 VAL HA 54 LYS H 3.37 #peak 89 #SUP 0.98 #QF 0.98 153 VAL HA 154 LYS H 3.37 #peak 89 #SUP 0.98 #QF 0.98 57 ASP HA 60 THR HG2 3.80 #peak 93 #SUP 0.59 #QF 0.59 157 ASP HA 160 THR HG2 3.80 #peak 93 #SUP 0.59 #QF 0.59 57 ASP HA 60 THR H 4.40 #peak 97 #SUP 0.87 #QF 0.87 157 ASP HA 160 THR H 4.40 #peak 97 #SUP 0.87 #QF 0.87 60 THR HB 61 THR H 4.01 #peak 100 #SUP 0.98 #QF 0.98 160 THR HB 161 THR H 4.01 #peak 100 #SUP 0.98 #QF 0.98 60 THR H 60 THR HB 3.71 #peak 101 #SUP 1.00 160 THR H 160 THR HB 3.71 #peak 101 #SUP 1.00 64 ASP HA 67 ARG HB 3.52 #peak 102 #SUP 0.97 #QF 0.97 164 ASP HA 167 ARG HB 3.52 #peak 102 #SUP 0.97 #QF 0.97 64 ASP HA 67 ARG HD 4.08 #peak 105 #SUP 0.96 #QF 0.96 164 ASP HA 167 ARG HD 4.08 #peak 105 #SUP 0.96 #QF 0.96 64 ASP HA 66 LEU H 4.61 #peak 106 #SUP 1.00 164 ASP HA 166 LEU H 4.61 #peak 106 #SUP 1.00 71 GLY HA2 72 VAL HG2 4.87 #peak 108 #SUP 0.48 #QF 0.48 171 GLY HA2 172 VAL HG2 4.87 #peak 108 #SUP 0.48 #QF 0.48 72 VAL HG1 73 PHE HA 4.34 #peak 117 #SUP 0.94 #QF 0.94 172 VAL HG1 173 PHE HA 4.34 #peak 117 #SUP 0.94 #QF 0.94 73 PHE HA 75 VAL HG2 4.88 #peak 118 #SUP 0.83 #QF 0.83 173 PHE HA 175 VAL HG2 4.88 #peak 118 #SUP 0.83 #QF 0.83 72 VAL HA 73 PHE HA 4.48 #peak 122 #SUP 0.90 #QF 0.90 172 VAL HA 173 PHE HA 4.48 #peak 122 #SUP 0.90 #QF 0.90 73 PHE HA 73 PHE HD 3.64 #peak 123 #SUP 0.98 #QF 0.98 173 PHE HA 173 PHE HD 3.64 #peak 123 #SUP 0.98 #QF 0.98 74 THR HA 75 VAL HG2 3.85 #peak 127 #SUP 0.94 #QF 0.94 174 THR HA 175 VAL HG2 3.85 #peak 127 #SUP 0.94 #QF 0.94 74 THR HA 75 VAL H 2.92 #peak 132 #SUP 0.94 #QF 0.94 174 THR HA 175 VAL H 2.92 #peak 132 #SUP 0.94 #QF 0.94 75 VAL HA 75 VAL HG2 4.01 #peak 133 #SUP 1.00 #QF 0.23 175 VAL HA 175 VAL HG2 4.01 #peak 133 #SUP 1.00 #QF 0.23 76 GLU HA 76 GLU HG 3.86 #peak 140 #SUP 0.99 #QF 0.99 176 GLU HA 176 GLU HG 3.86 #peak 140 #SUP 0.99 #QF 0.99 76 GLU HA 77 ARG H 2.95 #peak 141 #SUP 0.86 #QF 0.86 176 GLU HA 177 ARG H 2.95 #peak 141 #SUP 0.86 #QF 0.86 77 ARG HA 78 LEU H 3.23 #peak 143 #SUP 0.98 #QF 0.98 177 ARG HA 178 LEU H 3.23 #peak 143 #SUP 0.98 #QF 0.98 78 LEU HA 78 LEU HD2 2.95 #peak 144 #SUP 0.92 #QF 0.92 178 LEU HA 178 LEU HD2 2.95 #peak 144 #SUP 0.92 #QF 0.92 78 LEU HA 78 LEU HG 4.05 #peak 146 #SUP 0.97 #QF 0.91 178 LEU HA 178 LEU HG 4.05 #peak 146 #SUP 0.97 #QF 0.91 79 SER HA 81 LEU HD2 4.73 #peak 149 #SUP 0.51 #QF 0.51 179 SER HA 181 LEU HD2 4.73 #peak 149 #SUP 0.51 #QF 0.51 79 SER HA 81 LEU HG 4.99 #peak 150 #SUP 0.93 #QF 0.93 179 SER HA 181 LEU HG 4.99 #peak 150 #SUP 0.93 #QF 0.93 77 ARG HG3 79 SER HA 5.19 #peak 151 #SUP 0.63 #QF 0.63 177 ARG HG3 179 SER HA 5.19 #peak 151 #SUP 0.63 #QF 0.63 77 ARG HG2 79 SER HA 5.19 #peak 152 #SUP 0.91 #QF 0.91 177 ARG HG2 179 SER HA 5.19 #peak 152 #SUP 0.91 #QF 0.91 79 SER HA 79 SER HB 2.78 #peak 153 #SUP 0.99 #QF 0.99 179 SER HA 179 SER HB 2.78 #peak 153 #SUP 0.99 #QF 0.99 80 ASN HA 81 LEU HG 4.10 #peak 156 #SUP 0.79 #QF 0.79 180 ASN HA 181 LEU HG 4.10 #peak 156 #SUP 0.79 #QF 0.79 80 ASN HA 81 LEU H 3.16 #peak 158 #SUP 0.88 #QF 0.88 180 ASN HA 181 LEU H 3.16 #peak 158 #SUP 0.88 #QF 0.88 29 PHE HA 62 LEU HD2 4.80 #peak 162 #SUP 1.00 129 PHE HA 162 LEU HD2 4.80 #peak 162 #SUP 1.00 29 PHE HA 29 PHE HE 4.58 #peak 163 #SUP 0.93 #QF 0.93 129 PHE HA 129 PHE HE 4.58 #peak 163 #SUP 0.93 #QF 0.93 83 HIS HA 83 HIS HB3 2.55 #peak 165 #SUP 0.59 #QF 0.59 183 HIS HA 183 HIS HB3 2.55 #peak 165 #SUP 0.59 #QF 0.59 83 HIS HA 83 HIS HD2 3.77 #peak 166 #SUP 0.86 #QF 0.86 183 HIS HA 183 HIS HD2 3.77 #peak 166 #SUP 0.86 #QF 0.86 4 PHE HD 53 VAL HG2 3.41 #peak 1 #SUP 1.00 104 PHE HD 153 VAL HG2 3.41 #peak 1 #SUP 1.00 4 PHE HD 59 LEU HD2 4.69 #peak 3 #SUP 0.99 #QF 0.99 104 PHE HD 159 LEU HD2 4.69 #peak 3 #SUP 0.99 #QF 0.99 4 PHE HD 6 ALA HB 3.41 #peak 4 #SUP 0.99 #QF 0.99 104 PHE HD 106 ALA HB 3.41 #peak 4 #SUP 0.99 #QF 0.99 4 PHE HD 5 LEU HB3 4.73 #peak 5 #SUP 0.97 #QF 0.97 104 PHE HD 105 LEU HB3 4.73 #peak 5 #SUP 0.97 #QF 0.97 4 PHE HD 54 LYS HA 5.08 #peak 6 #SUP 0.92 #QF 0.92 104 PHE HD 154 LYS HA 5.08 #peak 6 #SUP 0.92 #QF 0.92 4 PHE HD 6 ALA HA 3.40 #peak 7 #SUP 0.82 #QF 0.82 104 PHE HD 106 ALA HA 3.40 #peak 7 #SUP 0.82 #QF 0.82 4 PHE HA 4 PHE HD 3.81 #peak 8 #SUP 0.98 #QF 0.98 104 PHE HA 104 PHE HD 3.81 #peak 8 #SUP 0.98 #QF 0.98 4 PHE HD 5 LEU H 3.45 #peak 9 #SUP 0.97 #QF 0.97 104 PHE HD 105 LEU H 3.45 #peak 9 #SUP 0.97 #QF 0.97 4 PHE H 4 PHE HD 3.19 #peak 10 #SUP 0.91 #QF 0.91 104 PHE H 104 PHE HD 3.19 #peak 10 #SUP 0.91 #QF 0.91 4 PHE HE 53 VAL HG2 3.47 #peak 11 #SUP 1.00 104 PHE HE 153 VAL HG2 3.47 #peak 11 #SUP 1.00 4 PHE HE 59 LEU HD2 2.77 #peak 13 #SUP 0.90 #QF 0.90 104 PHE HE 159 LEU HD2 2.77 #peak 13 #SUP 0.90 #QF 0.90 4 PHE HE 6 ALA HB 2.92 #peak 14 #SUP 0.99 #QF 0.94 104 PHE HE 106 ALA HB 2.92 #peak 14 #SUP 0.99 #QF 0.94 4 PHE HE 56 THR HG2 3.33 #peak 14 #SUP 0.99 #QF 0.94 104 PHE HE 156 THR HG2 3.33 #peak 14 #SUP 0.99 #QF 0.94 29 PHE HE 66 LEU HG 4.15 #peak 16 #SUP 0.84 #QF 0.84 129 PHE HE 166 LEU HG 4.15 #peak 16 #SUP 0.84 #QF 0.84 12 GLY HA2 73 PHE HD 4.22 #peak 18 #SUP 0.97 #QF 0.89 112 GLY HA2 173 PHE HD 4.22 #peak 18 #SUP 0.97 #QF 0.89 29 PHE HE 62 LEU HA 4.53 #peak 18 #SUP 0.97 #QF 0.89 129 PHE HE 162 LEU HA 4.53 #peak 18 #SUP 0.97 #QF 0.89 4 PHE HE 56 THR HA 3.85 #peak 19 #SUP 1.00 104 PHE HE 156 THR HA 3.85 #peak 19 #SUP 1.00 4 PHE HE 55 ASN HA 3.19 #peak 20 #SUP 0.38 #QF 0.38 104 PHE HE 155 ASN HA 3.19 #peak 20 #SUP 0.38 #QF 0.38 73 PHE HD 74 THR H 3.78 #peak 21 #SUP 0.98 #QF 0.98 173 PHE HD 174 THR H 3.78 #peak 21 #SUP 0.98 #QF 0.98 13 GLU H 73 PHE HD 4.32 #peak 22 #SUP 0.99 #QF 0.99 113 GLU H 173 PHE HD 4.32 #peak 22 #SUP 0.99 #QF 0.99 4 PHE H 4 PHE HE 4.73 #peak 23 #SUP 1.00 #QF 0.99 104 PHE H 104 PHE HE 4.73 #peak 23 #SUP 1.00 #QF 0.99 4 PHE HE 7 GLY H 5.23 #peak 23 #SUP 1.00 #QF 0.99 104 PHE HE 107 GLY H 5.23 #peak 23 #SUP 1.00 #QF 0.99 4 PHE HZ 53 VAL HG2 3.84 #peak 24 #SUP 1.00 104 PHE HZ 153 VAL HG2 3.84 #peak 24 #SUP 1.00 4 PHE HZ 53 VAL HG1 4.43 #peak 25 #SUP 1.00 104 PHE HZ 153 VAL HG1 4.43 #peak 25 #SUP 1.00 4 PHE HZ 59 LEU HD2 3.58 #peak 26 #SUP 0.97 #QF 0.97 104 PHE HZ 159 LEU HD2 3.58 #peak 26 #SUP 0.97 #QF 0.97 4 PHE HZ 56 THR HG2 3.35 #peak 27 #SUP 0.99 #QF 0.31 104 PHE HZ 156 THR HG2 3.35 #peak 27 #SUP 0.99 #QF 0.31 4 PHE HZ 56 THR HA 3.55 #peak 28 #SUP 0.99 #QF 0.99 104 PHE HZ 156 THR HA 3.55 #peak 28 #SUP 0.99 #QF 0.99 4 PHE HZ 56 THR HB 4.67 #peak 29 #SUP 1.00 104 PHE HZ 156 THR HB 4.67 #peak 29 #SUP 1.00 4 PHE HZ 6 ALA HA 5.40 #peak 30 #SUP 0.95 #QF 0.95 104 PHE HZ 106 ALA HA 5.40 #peak 30 #SUP 0.95 #QF 0.95 4 PHE HZ 55 ASN HA 5.12 #peak 31 #SUP 0.99 #QF 0.99 104 PHE HZ 155 ASN HA 5.12 #peak 31 #SUP 0.99 #QF 0.99 29 PHE HD 62 LEU HD2 3.94 #peak 32 #SUP 0.99 #QF 0.99 129 PHE HD 162 LEU HD2 3.94 #peak 32 #SUP 0.99 #QF 0.99 29 PHE HD 62 LEU HD1 3.82 #peak 33 #SUP 0.98 #QF 0.98 129 PHE HD 162 LEU HD1 3.82 #peak 33 #SUP 0.98 #QF 0.98 26 ILE HG2 29 PHE HD 4.15 #peak 34 #SUP 0.92 #QF 0.92 126 ILE HG2 129 PHE HD 4.15 #peak 34 #SUP 0.92 #QF 0.92 29 PHE HD 49 LEU HD2 3.56 #peak 35 #SUP 0.80 #QF 0.80 129 PHE HD 149 LEU HD2 3.56 #peak 35 #SUP 0.80 #QF 0.80 29 PHE HD 31 THR HG2 3.68 #peak 36 #SUP 1.00 129 PHE HD 131 THR HG2 3.68 #peak 36 #SUP 1.00 29 PHE HD 51 ILE HG12 5.04 #peak 37 #SUP 0.91 #QF 0.75 129 PHE HD 151 ILE HG12 5.04 #peak 37 #SUP 0.91 #QF 0.75 29 PHE HD 62 LEU HB3 5.64 #peak 37 #SUP 0.91 #QF 0.75 129 PHE HD 162 LEU HB3 5.64 #peak 37 #SUP 0.91 #QF 0.75 29 PHE HD 65 LYS HD3 4.66 #peak 38 #SUP 0.21 #QF 0.21 129 PHE HD 165 LYS HD3 4.66 #peak 38 #SUP 0.21 #QF 0.21 29 PHE HD 65 LYS HD2 4.66 #peak 39 #SUP 1.00 129 PHE HD 165 LYS HD2 4.66 #peak 39 #SUP 1.00 26 ILE HA 29 PHE HD 4.44 #peak 40 #SUP 0.98 #QF 0.98 126 ILE HA 129 PHE HD 4.44 #peak 40 #SUP 0.98 #QF 0.98 29 PHE HA 29 PHE HD 3.08 #peak 44 #SUP 0.95 #QF 0.95 129 PHE HA 129 PHE HD 3.08 #peak 44 #SUP 0.95 #QF 0.95 29 PHE H 29 PHE HD 3.45 #peak 45 #SUP 0.98 #QF 0.98 129 PHE H 129 PHE HD 3.45 #peak 45 #SUP 0.98 #QF 0.98 29 PHE HZ 66 LEU HD2 3.13 #peak 48 #SUP 0.90 #QF 0.90 129 PHE HZ 166 LEU HD2 3.13 #peak 48 #SUP 0.90 #QF 0.90 25 VAL HG1 29 PHE HZ 3.83 #peak 49 #SUP 0.85 #QF 0.85 125 VAL HG1 129 PHE HZ 3.83 #peak 49 #SUP 0.85 #QF 0.85 26 ILE HG2 29 PHE HZ 5.12 #peak 50 #SUP 0.92 #QF 0.30 126 ILE HG2 129 PHE HZ 5.12 #peak 50 #SUP 0.92 #QF 0.30 26 ILE HD1 29 PHE HZ 5.44 #peak 50 #SUP 0.92 #QF 0.30 126 ILE HD1 129 PHE HZ 5.44 #peak 50 #SUP 0.92 #QF 0.30 29 PHE HZ 62 LEU HB3 4.11 #peak 51 #SUP 0.51 #QF 0.51 129 PHE HZ 162 LEU HB3 4.11 #peak 51 #SUP 0.51 #QF 0.51 29 PHE HZ 65 LYS HG3 6.41 #peak 52 #SUP 1.00 #QF 0.95 129 PHE HZ 165 LYS HG2 6.41 #peak 52 #SUP 1.00 #QF 0.95 29 PHE HZ 66 LEU HG 3.63 #peak 54 #SUP 0.96 #QF 0.96 129 PHE HZ 166 LEU HG 3.63 #peak 54 #SUP 0.96 #QF 0.96 29 PHE HZ 66 LEU HA 4.98 #peak 55 #SUP 0.94 #QF 0.94 129 PHE HZ 166 LEU HA 4.98 #peak 55 #SUP 0.94 #QF 0.94 29 PHE HZ 66 LEU H 4.87 #peak 57 #SUP 0.99 #QF 0.99 129 PHE HZ 166 LEU H 4.87 #peak 57 #SUP 0.99 #QF 0.99 38 LEU HD1 45 PHE HD 3.62 #peak 58 #SUP 1.00 138 LEU HD1 145 PHE HD 3.62 #peak 58 #SUP 1.00 19 THR HG2 45 PHE HD 3.64 #peak 60 #SUP 0.99 #QF 0.98 119 THR HG2 145 PHE HD 3.64 #peak 60 #SUP 0.99 #QF 0.98 10 ILE HG2 45 PHE HD 5.53 #peak 61 #SUP 1.00 110 ILE HG2 145 PHE HD 5.53 #peak 61 #SUP 1.00 45 PHE HD 47 CYS HG 6.12 #peak 61 #SUP 1.00 145 PHE HD 147 CYS HG 6.12 #peak 61 #SUP 1.00 40 ALA HB 45 PHE HD 4.40 #peak 62 #SUP 1.00 140 ALA HB 145 PHE HD 4.40 #peak 62 #SUP 1.00 38 LEU HG 45 PHE HD 4.45 #peak 63 #SUP 1.00 #QF 0.80 138 LEU HG 145 PHE HD 4.45 #peak 63 #SUP 1.00 #QF 0.80 18 MET HE 45 PHE HD 4.45 #peak 64 #SUP 1.00 118 MET HE 145 PHE HD 4.45 #peak 64 #SUP 1.00 118 MET HB3 145 PHE HD 5.30 #peak 65 #SUP 0.87 #QF 0.68 45 PHE HD 47 CYS HB2 4.06 #peak 67 #SUP 0.98 #QF 0.98 145 PHE HD 147 CYS HB2 4.06 #peak 67 #SUP 0.98 #QF 0.98 14 ASP HA 45 PHE HD 3.84 #peak 69 #SUP 0.79 #QF 0.79 114 ASP HA 145 PHE HD 3.84 #peak 69 #SUP 0.79 #QF 0.79 44 ILE HA 45 PHE HD 4.59 #peak 70 #SUP 1.00 #QF 0.96 144 ILE HA 145 PHE HD 4.59 #peak 70 #SUP 1.00 #QF 0.96 45 PHE HD 46 THR HA 5.00 #peak 70 #SUP 1.00 #QF 0.96 145 PHE HD 146 THR HA 5.00 #peak 70 #SUP 1.00 #QF 0.96 45 PHE HA 45 PHE HD 4.10 #peak 71 #SUP 1.00 145 PHE HA 145 PHE HD 4.10 #peak 71 #SUP 1.00 12 GLY H 45 PHE HD 4.51 #peak 73 #SUP 0.99 #QF 0.99 112 GLY H 145 PHE HD 4.51 #peak 73 #SUP 0.99 #QF 0.99 14 ASP H 45 PHE HD 4.64 #peak 74 #SUP 0.96 #QF 0.96 114 ASP H 145 PHE HD 4.64 #peak 74 #SUP 0.96 #QF 0.96 45 PHE HD 46 THR H 4.19 #peak 75 #SUP 1.00 145 PHE HD 146 THR H 4.19 #peak 75 #SUP 1.00 45 PHE H 45 PHE HD 3.72 #peak 76 #SUP 0.97 #QF 0.97 145 PHE H 145 PHE HD 3.72 #peak 76 #SUP 0.97 #QF 0.97 22 ILE HG2 45 PHE HE 3.58 #peak 77 #SUP 1.00 #QF 0.99 122 ILE HG2 145 PHE HE 3.58 #peak 77 #SUP 1.00 #QF 0.99 38 LEU HD1 45 PHE HE 3.97 #peak 77 #SUP 1.00 #QF 0.99 138 LEU HD1 145 PHE HE 3.97 #peak 77 #SUP 1.00 #QF 0.99 22 ILE HD1 45 PHE HE 3.71 #peak 78 #SUP 1.00 122 ILE HD1 145 PHE HE 3.71 #peak 78 #SUP 1.00 19 THR HG2 45 PHE HE 4.29 #peak 79 #SUP 1.00 #QF 0.96 119 THR HG2 145 PHE HE 4.29 #peak 79 #SUP 1.00 #QF 0.96 45 PHE HE 72 VAL HG2 4.88 #peak 79 #SUP 1.00 #QF 0.96 145 PHE HE 172 VAL HG2 4.88 #peak 79 #SUP 1.00 #QF 0.96 10 ILE HG2 45 PHE HE 3.92 #peak 80 #SUP 1.00 110 ILE HG2 145 PHE HE 3.92 #peak 80 #SUP 1.00 22 ILE HG13 45 PHE HE 4.50 #peak 81 #SUP 0.98 #QF 0.98 122 ILE HG13 145 PHE HE 4.50 #peak 81 #SUP 0.98 #QF 0.98 10 ILE HB 45 PHE HE 4.42 #peak 82 #SUP 0.92 #QF 0.92 110 ILE HB 145 PHE HE 4.42 #peak 82 #SUP 0.92 #QF 0.92 18 MET HB2 45 PHE HE 4.10 #peak 84 #SUP 0.97 #QF 0.97 118 MET HB3 145 PHE HE 4.10 #peak 84 #SUP 0.97 #QF 0.97 18 MET HB3 45 PHE HE 4.10 #peak 85 #SUP 0.99 #QF 0.98 118 MET HB2 145 PHE HE 4.09 #peak 85 #SUP 0.99 #QF 0.98 45 PHE HE 47 CYS HB2 4.73 #peak 86 #SUP 0.96 #QF 0.96 145 PHE HE 147 CYS HB2 4.73 #peak 86 #SUP 0.96 #QF 0.96 12 GLY HA3 45 PHE HE 4.52 #peak 88 #SUP 0.98 #QF 0.98 112 GLY HA3 145 PHE HE 4.52 #peak 88 #SUP 0.98 #QF 0.98 12 GLY H 45 PHE HE 4.17 #peak 91 #SUP 0.96 #QF 0.96 112 GLY H 145 PHE HE 4.17 #peak 91 #SUP 0.96 #QF 0.96 13 GLU H 45 PHE HE 4.67 #peak 92 #SUP 0.99 #QF 0.99 113 GLU H 145 PHE HE 4.67 #peak 92 #SUP 0.99 #QF 0.99 22 ILE HG2 45 PHE HZ 3.95 #peak 93 #SUP 0.99 #QF 0.99 122 ILE HG2 145 PHE HZ 3.95 #peak 93 #SUP 0.99 #QF 0.99 22 ILE HD1 45 PHE HZ 3.52 #peak 94 #SUP 1.00 122 ILE HD1 145 PHE HZ 3.52 #peak 94 #SUP 1.00 45 PHE HZ 72 VAL HG2 3.71 #peak 95 #SUP 0.94 #QF 0.94 145 PHE HZ 172 VAL HG2 3.71 #peak 95 #SUP 0.94 #QF 0.94 10 ILE HG2 45 PHE HZ 4.21 #peak 96 #SUP 1.00 110 ILE HG2 145 PHE HZ 4.21 #peak 96 #SUP 1.00 22 ILE HG13 45 PHE HZ 4.40 #peak 97 #SUP 0.84 #QF 0.84 122 ILE HG13 145 PHE HZ 4.40 #peak 97 #SUP 0.84 #QF 0.84 45 PHE HZ 71 GLY HA3 6.10 #peak 99 #SUP 1.00 #QF 0.22 145 PHE HZ 171 GLY HA3 6.10 #peak 99 #SUP 1.00 #QF 0.22 45 PHE HZ 72 VAL HA 6.45 #peak 99 #SUP 1.00 #QF 0.22 145 PHE HZ 172 VAL HA 6.45 #peak 99 #SUP 1.00 #QF 0.22 5 LEU HD1 52 PHE HD 3.43 #peak 101 #SUP 0.99 #QF 0.99 105 LEU HD1 152 PHE HD 3.43 #peak 101 #SUP 0.99 #QF 0.99 51 ILE HD1 52 PHE HD 5.65 #peak 102 #SUP 1.00 #QF 0.68 151 ILE HD1 152 PHE HD 5.65 #peak 102 #SUP 1.00 #QF 0.68 52 PHE HD 53 VAL HG1 5.95 #peak 102 #SUP 1.00 #QF 0.68 152 PHE HD 153 VAL HG1 5.95 #peak 102 #SUP 1.00 #QF 0.68 5 LEU HD2 52 PHE HD 4.94 #peak 103 #SUP 0.98 #QF 0.98 105 LEU HD2 152 PHE HD 4.94 #peak 103 #SUP 0.98 #QF 0.98 5 LEU HB2 52 PHE HD 4.07 #peak 104 #SUP 0.81 #QF 0.81 105 LEU HB2 152 PHE HD 4.07 #peak 104 #SUP 0.81 #QF 0.81 5 LEU HB3 52 PHE HD 5.27 #peak 106 #SUP 1.00 105 LEU HB3 152 PHE HD 5.27 #peak 106 #SUP 1.00 5 LEU HA 52 PHE HD 3.33 #peak 110 #SUP 0.99 #QF 0.99 105 LEU HA 152 PHE HD 3.33 #peak 110 #SUP 0.99 #QF 0.99 4 PHE HA 52 PHE HD 3.56 #peak 112 #SUP 0.99 #QF 0.99 104 PHE HA 152 PHE HD 3.56 #peak 112 #SUP 0.99 #QF 0.99 52 PHE HA 52 PHE HD 3.13 #peak 113 #SUP 0.97 #QF 0.97 152 PHE HA 152 PHE HD 3.13 #peak 113 #SUP 0.97 #QF 0.97 52 PHE H 52 PHE HD 3.63 #peak 115 #SUP 0.93 #QF 0.93 152 PHE H 152 PHE HD 3.63 #peak 115 #SUP 0.93 #QF 0.93 5 LEU H 52 PHE HD 4.02 #peak 116 #SUP 0.97 #QF 0.97 105 LEU H 152 PHE HD 4.02 #peak 116 #SUP 0.97 #QF 0.97 4 PHE H 52 PHE HD 4.50 #peak 117 #SUP 1.00 104 PHE H 152 PHE HD 4.50 #peak 117 #SUP 1.00 52 PHE HD 53 VAL H 3.51 #peak 118 #SUP 0.99 #QF 0.99 152 PHE HD 153 VAL H 3.51 #peak 118 #SUP 0.99 #QF 0.99 6 ALA H 52 PHE HD 4.73 #peak 119 #SUP 0.99 #QF 0.99 106 ALA H 152 PHE HD 4.73 #peak 119 #SUP 0.99 #QF 0.99 5 LEU HD1 52 PHE HE 3.55 #peak 120 #SUP 1.00 105 LEU HD1 152 PHE HE 3.55 #peak 120 #SUP 1.00 5 LEU HD2 52 PHE HE 3.79 #peak 121 #SUP 1.00 105 LEU HD2 152 PHE HE 3.79 #peak 121 #SUP 1.00 5 LEU HB2 52 PHE HE 3.44 #peak 122 #SUP 1.00 105 LEU HB2 152 PHE HE 3.44 #peak 122 #SUP 1.00 5 LEU HB3 52 PHE HE 4.40 #peak 124 #SUP 1.00 105 LEU HB3 152 PHE HE 4.40 #peak 124 #SUP 1.00 4 PHE HB 52 PHE HE 4.67 #peak 126 #SUP 0.96 #QF 0.96 104 PHE HB 152 PHE HE 4.67 #peak 126 #SUP 0.96 #QF 0.96 4 PHE HA 52 PHE HE 3.99 #peak 127 #SUP 1.00 104 PHE HA 152 PHE HE 3.99 #peak 127 #SUP 1.00 5 LEU H 52 PHE HE 4.12 #peak 129 #SUP 1.00 105 LEU H 152 PHE HE 4.12 #peak 129 #SUP 1.00 5 LEU HD1 52 PHE HZ 4.09 #peak 130 #SUP 0.95 #QF 0.95 105 LEU HD1 152 PHE HZ 4.09 #peak 130 #SUP 0.95 #QF 0.95 5 LEU HD2 52 PHE HZ 4.20 #peak 131 #SUP 0.98 #QF 0.98 105 LEU HD2 152 PHE HZ 4.20 #peak 131 #SUP 0.98 #QF 0.98 5 LEU HB2 52 PHE HZ 3.95 #peak 132 #SUP 1.00 105 LEU HB2 152 PHE HZ 3.95 #peak 132 #SUP 1.00 29 PHE HE 65 LYS HE 3.67 #peak 133 #SUP 1.00 #QF 0.20 129 PHE HE 165 LYS HE 3.67 #peak 133 #SUP 1.00 #QF 0.20 73 PHE H 73 PHE HD 4.01 #peak 136 #SUP 0.98 #QF 0.98 173 PHE H 173 PHE HD 4.01 #peak 136 #SUP 0.98 #QF 0.98 44 ILE HD1 73 PHE HE 3.50 #peak 137 #SUP 0.99 #QF 0.99 144 ILE HD1 173 PHE HE 3.50 #peak 137 #SUP 0.99 #QF 0.99 44 ILE HG2 73 PHE HE 3.32 #peak 138 #SUP 0.99 #QF 0.99 144 ILE HG2 173 PHE HE 3.32 #peak 138 #SUP 0.99 #QF 0.99 73 PHE HE 74 THR HG2 4.08 #peak 139 #SUP 0.98 #QF 0.98 173 PHE HE 174 THR HG2 4.08 #peak 139 #SUP 0.98 #QF 0.98 44 ILE HG13 73 PHE HE 5.64 #peak 140 #SUP 1.00 144 ILE HG13 173 PHE HE 5.64 #peak 140 #SUP 1.00 44 ILE HG12 73 PHE HE 4.71 #peak 141 #SUP 1.00 144 ILE HG12 173 PHE HE 4.71 #peak 141 #SUP 1.00 13 GLU HB3 73 PHE HE 3.67 #peak 142 #SUP 0.99 #QF 0.99 113 GLU HB3 173 PHE HE 3.67 #peak 142 #SUP 0.99 #QF 0.99 13 GLU HG 73 PHE HE 3.68 #peak 144 #SUP 0.99 #QF 0.99 113 GLU HG 173 PHE HE 3.68 #peak 144 #SUP 0.99 #QF 0.99 13 GLU HA 73 PHE HE 3.91 #peak 145 #SUP 1.00 113 GLU HA 173 PHE HE 3.91 #peak 145 #SUP 1.00 13 GLU H 73 PHE HE 3.87 #peak 147 #SUP 0.98 #QF 0.98 113 GLU H 173 PHE HE 3.87 #peak 147 #SUP 0.98 #QF 0.98 44 ILE HG2 73 PHE HZ 3.65 #peak 148 #SUP 0.98 #QF 0.98 144 ILE HG2 173 PHE HZ 3.65 #peak 148 #SUP 0.98 #QF 0.98 73 PHE HZ 74 THR HG2 5.15 #peak 149 #SUP 0.99 #QF 0.99 173 PHE HZ 174 THR HG2 5.15 #peak 149 #SUP 0.99 #QF 0.99 13 GLU HB3 73 PHE HZ 3.63 #peak 150 #SUP 0.99 #QF 0.99 113 GLU HB3 173 PHE HZ 3.63 #peak 150 #SUP 0.99 #QF 0.99 13 GLU HA 73 PHE HZ 4.11 #peak 153 #SUP 1.00 113 GLU HA 173 PHE HZ 4.11 #peak 153 #SUP 1.00 13 GLU H 73 PHE HZ 4.09 #peak 154 #SUP 0.96 #QF 0.96 113 GLU H 173 PHE HZ 4.09 #peak 154 #SUP 0.96 #QF 0.96 4 PHE HD 53 VAL H 4.76 #peak 155 #SUP 1.00 104 PHE HD 153 VAL H 4.76 #peak 155 #SUP 1.00 4 PHE HE 53 VAL HG1 4.22 #peak 156 #SUP 1.00 104 PHE HE 153 VAL HG1 4.22 #peak 156 #SUP 1.00 26 ILE HG2 29 PHE HE 4.00 #peak 157 #SUP 0.94 #QF 0.39 126 ILE HG2 129 PHE HE 4.00 #peak 157 #SUP 0.94 #QF 0.39 29 PHE HE 49 LEU HD2 3.16 #peak 158 #SUP 0.81 #QF 0.71 129 PHE HE 149 LEU HD2 3.16 #peak 158 #SUP 0.81 #QF 0.71 5 LEU HD2 83 HIS HD2 4.23 #peak 159 #SUP 0.92 #QF 0.70 105 LEU HD2 183 HIS HD2 4.23 #peak 159 #SUP 0.92 #QF 0.70 81 LEU HD2 83 HIS HD2 4.49 #peak 159 #SUP 0.92 #QF 0.70 181 LEU HD2 183 HIS HD2 4.49 #peak 159 #SUP 0.92 #QF 0.70 81 LEU HD1 83 HIS HD2 3.62 #peak 160 #SUP 0.90 #QF 0.90 181 LEU HD1 183 HIS HD2 3.62 #peak 160 #SUP 0.90 #QF 0.90 5 LEU HG 83 HIS HD2 5.52 #peak 161 #SUP 0.94 #QF 0.94 105 LEU HG 183 HIS HD2 5.52 #peak 161 #SUP 0.94 #QF 0.94 81 LEU HB3 83 HIS HD2 3.97 #peak 162 #SUP 0.95 #QF 0.95 181 LEU HB3 183 HIS HD2 3.97 #peak 162 #SUP 0.95 #QF 0.95 50 MET HE 83 HIS HD2 3.86 #peak 163 #SUP 0.98 #QF 0.98 150 MET HE 183 HIS HD2 3.86 #peak 163 #SUP 0.98 #QF 0.98 82 GLU HG2 83 HIS HD2 5.07 #peak 164 #SUP 0.85 #QF 0.52 182 GLU HG2 183 HIS HD2 5.07 #peak 164 #SUP 0.85 #QF 0.52 82 GLU HG3 83 HIS HD2 5.07 #peak 164 #SUP 0.85 #QF 0.52 182 GLU HG3 183 HIS HD2 5.07 #peak 164 #SUP 0.85 #QF 0.52 83 HIS HB2 83 HIS HD2 3.19 #peak 165 #SUP 0.70 #QF 0.70 183 HIS HB2 183 HIS HD2 3.19 #peak 165 #SUP 0.70 #QF 0.70 82 GLU HA 83 HIS HD2 4.81 #peak 166 #SUP 0.96 #QF 0.96 182 GLU HA 183 HIS HD2 4.81 #peak 166 #SUP 0.96 #QF 0.96 81 LEU HA 83 HIS HD2 3.89 #peak 167 #SUP 0.97 #QF 0.97 181 LEU HA 183 HIS HD2 3.89 #peak 167 #SUP 0.97 #QF 0.97 81 LEU HD1 83 HIS HE1 4.79 #peak 168 #SUP 0.83 #QF 0.83 181 LEU HD1 183 HIS HE1 4.79 #peak 168 #SUP 0.83 #QF 0.83 50 MET HE 83 HIS HE1 4.83 #peak 170 #SUP 0.91 #QF 0.31 150 MET HE 183 HIS HE1 4.83 #peak 170 #SUP 0.91 #QF 0.31 3 ASP HA 54 LYS HB 4.80 #peak 1686 3 ASP HB 4 PHE H 3.68 #peak 7 3 ASP HB 52 PHE HB 4.97 #peak 1612 3 ASP HB 52 PHE HD 3.78 #peak 107 3 ASP HB 54 LYS HA 4.86 #peak 2674 4 PHE H 52 PHE HB 5.62 #peak 8 4 PHE H 54 LYS HB 6.27 #peak 5 4 PHE HZ 59 LEU HB 6.11 #peak 2628 5 LEU HD1 34 ARG HB 4.05 #peak 56 5 LEU HD1 34 ARG HG 4.40 #peak 56 5 LEU HD1 50 MET HB 4.16 #peak 59 5 LEU HD1 52 PHE HB 5.06 #peak 64 5 LEU HD2 50 MET HB 5.60 #peak 1471 6 ALA HB 59 LEU HB 5.37 #peak 97 6 ALA HB 77 ARG HG 5.72 #peak 2473 7 GLY H 77 ARG HG 5.53 #peak 2478 7 GLY HA2 8 ILE HG1 5.00 #peak 134 7 GLY HA3 8 ILE HG1 6.27 #peak 2633 8 ILE H 8 ILE HG1 3.85 #peak 135 8 ILE HA 8 ILE HG1 3.59 #peak 18 8 ILE HG2 8 ILE HG1 3.38 #peak 145 8 ILE HG2 66 LEU HB 4.68 #peak 148 8 ILE HG1 49 LEU HB3 5.31 #peak 138 8 ILE HG1 59 LEU HD1 3.70 #peak 1867 8 ILE HG1 63 MET HG2 5.70 #peak 139 8 ILE HG1 63 MET HE 5.90 #peak 139 8 ILE HG1 77 ARG HA 4.76 #peak 132 8 ILE HG1 77 ARG HB 5.01 #peak 2696 8 ILE HD1 63 MET HB 5.57 #peak 163 8 ILE HD1 66 LEU HB 6.07 #peak 163 9 ARG H 9 ARG HG 4.77 #peak 69 9 ARG HG 11 VAL HG2 3.92 #peak 285 9 ARG HG 47 CYS H 6.13 #peak 1202 9 ARG HG 76 GLU H 5.47 #peak 1109 9 ARG HD 48 ASN HD2 5.20 #peak 717 10 ILE HG2 66 LEU HB 5.35 #peak 239 10 ILE HD1 66 LEU HB 5.20 #peak 259 13 GLU HA 14 ASP HB 5.94 #peak 371 13 GLU HG 15 LYS HB 4.28 #peak 386 14 ASP H 14 ASP HB 3.58 #peak 138 14 ASP HA 15 LYS HB 5.77 #peak 400 14 ASP HA 18 MET HB 5.38 #peak 463 14 ASP HB 15 LYS HA 6.05 #peak 40 14 ASP HB 40 ALA HB 4.41 #peak 1162 14 ASP HB 43 GLY H 5.23 #peak 617 14 ASP HB 43 GLY HA 4.13 #peak 1196 14 ASP HB 44 ILE HA 5.13 #peak 373 14 ASP HB 44 ILE HG2 5.78 #peak 1244 14 ASP HB 45 PHE H 6.27 #peak 648 14 ASP HB 45 PHE HD 4.63 #peak 65 15 LYS H 18 MET HB 3.59 #peak 151 15 LYS H 18 MET HG 3.80 #peak 151 15 LYS HA 16 ASN HB 5.51 #peak 430 15 LYS HA 16 ASN HD2 5.66 #peak 181 15 LYS HB 15 LYS HE 4.68 #peak 398 15 LYS HB 16 ASN HB 4.82 #peak 437 15 LYS HB 18 MET H 5.95 #peak 196 15 LYS HB 18 MET HB 4.82 #peak 2640 15 LYS HB 18 MET HG 5.12 #peak 396 15 LYS HG 16 ASN HB 4.88 #peak 408 15 LYS HG 16 ASN HD2 4.81 #peak 176 15 LYS HG 18 MET HG 4.54 #peak 407 15 LYS HD 16 ASN HB 6.24 #peak 428 15 LYS HD 16 ASN HD2 4.69 #peak 1710 15 LYS HE 16 ASN HD2 4.49 #peak 179 16 ASN HA 16 ASN HD2 4.65 #peak 180 16 ASN HA 132 ASN HD2 5.68 #peak 467 16 ASN HB 16 ASN HD2 3.13 #peak 171 16 ASN HB 17 GLY H 4.00 #peak 434 16 ASN HB 18 MET H 5.59 #peak 433 17 GLY H 18 MET HG 5.09 #peak 187 17 GLY H 132 ASN HD2 5.54 #peak 474 17 GLY HA 19 THR H 4.90 #peak 222 17 GLY HA 20 ASN H 4.74 #peak 240 17 GLY HA 20 ASN HB 5.62 #peak 545 17 GLY HA 21 GLN HE21 5.62 #peak 1187 17 GLY HA 21 GLN HE22 6.27 #peak 300 18 MET H 18 MET HB 3.23 #peak 199 18 MET H 132 ASN HD2 5.51 #peak 464 18 MET HB 18 MET HE 3.57 #peak 498 18 MET HB 20 ASN H 5.61 #peak 232 18 MET HB 22 ILE HB 5.18 #peak 619 18 MET HB 22 ILE HG2 5.72 #peak 658 18 MET HB 22 ILE HG12 5.32 #peak 635 18 MET HB 45 PHE HD 4.91 #peak 65 18 MET HG 18 MET HE 3.38 #peak 499 18 MET HG 19 THR H 5.10 #peak 218 18 MET HG 21 GLN HE22 4.69 #peak 480 18 MET HG 45 PHE HE 4.58 #peak 87 18 MET HG 45 PHE HZ 5.47 #peak 479 18 MET HG 71 GLY H 6.27 #peak 489 19 THR HG2 45 PHE HB 3.81 #peak 530 20 ASN H 20 ASN HB 3.45 #peak 236 20 ASN H 132 ASN HB 6.14 #peak 919 20 ASN H 132 ASN HD2 5.69 #peak 464 20 ASN HA 127 SER HB 5.42 #peak 2301 20 ASN HB 21 GLN H 3.73 #peak 273 20 ASN HB 21 GLN HE21 5.32 #peak 290 20 ASN HB 133 ILE H 5.49 #peak 480 20 ASN HB 133 ILE HD1 4.73 #peak 955 20 ASN HD21 133 ILE HG1 5.29 #peak 250 20 ASN HD22 133 ILE HG1 4.43 #peak 257 23 THR HA 26 ILE HG1 4.77 #peak 857 23 THR HB 26 ILE HG1 6.27 #peak 701 23 THR HG2 24 GLY HA 5.23 #peak 2648 23 THR HG2 26 ILE HG1 5.38 #peak 706 23 THR HG2 27 SER HB 5.27 #peak 811 23 THR HG2 127 SER HB 5.70 #peak 811 24 GLY H 26 ILE HG1 6.27 #peak 341 24 GLY H 127 SER HB 5.20 #peak 815 24 GLY HA 25 VAL HA 4.67 #peak 729 24 GLY HA 26 ILE H 5.52 #peak 374 24 GLY HA 26 ILE HB 6.25 #peak 2649 24 GLY HA 26 ILE HG1 6.04 #peak 2649 24 GLY HA 27 SER HG 4.56 #peak 720 24 GLY HA 28 LYS HG 6.04 #peak 2649 24 GLY HA 28 LYS HE 6.27 #peak 2655 25 VAL H 26 ILE HG1 5.11 #peak 354 25 VAL H 28 LYS HG 5.16 #peak 354 25 VAL H 28 LYS HD 6.27 #peak 355 25 VAL HA 28 LYS HB 4.43 #peak 726 25 VAL HA 28 LYS HG 4.43 #peak 725 25 VAL HA 28 LYS HD 4.56 #peak 861 25 VAL HG1 28 LYS HB 5.95 #peak 2690 25 VAL HG1 28 LYS HG 4.61 #peak 841 25 VAL HG1 28 LYS HD 4.54 #peak 743 25 VAL HG2 28 LYS HG 4.12 #peak 757 26 ILE H 26 ILE HG1 3.66 #peak 368 26 ILE H 28 LYS HG 5.75 #peak 854 26 ILE HG2 29 PHE HB 5.23 #peak 872 26 ILE HG1 27 SER H 4.99 #peak 380 26 ILE HG1 27 SER HG 6.27 #peak 859 26 ILE HG1 29 PHE HZ 5.47 #peak 860 27 SER H 27 SER HB 3.38 #peak 385 27 SER H 28 LYS HB 5.64 #peak 381 27 SER HB 28 LYS H 4.15 #peak 400 27 SER HB 33 ILE HD1 3.91 #peak 957 27 SER HB 120 ASN HA 5.42 #peak 2301 27 SER HB 123 THR HG2 5.70 #peak 811 27 SER HB 124 GLY H 5.20 #peak 815 27 SER HG 28 LYS HD 5.59 #peak 863 28 LYS H 28 LYS HB 3.24 #peak 395 28 LYS H 28 LYS HG 3.41 #peak 394 28 LYS H 28 LYS HD 5.00 #peak 860 28 LYS H 29 PHE HB 6.06 #peak 398 28 LYS HA 28 LYS HG 3.39 #peak 843 28 LYS HA 28 LYS HD 4.56 #peak 858 28 LYS HB 28 LYS HD 3.23 #peak 855 28 LYS HB 28 LYS HE 4.01 #peak 867 28 LYS HB 29 PHE H 4.19 #peak 411 28 LYS HG 28 LYS HE 3.35 #peak 865 28 LYS HG 29 PHE H 5.04 #peak 410 29 PHE H 29 PHE HB 3.38 #peak 415 29 PHE HB 31 THR H 4.00 #peak 436 29 PHE HB 31 THR HG2 3.68 #peak 904 29 PHE HB 33 ILE HD1 6.05 #peak 872 29 PHE HB 51 ILE HD1 6.18 #peak 1583 29 PHE HB 62 LEU HD1 4.33 #peak 1986 29 PHE HB 62 LEU HD2 4.61 #peak 2009 29 PHE HD 65 LYS HD 3.86 #peak 38 29 PHE HE 65 LYS HD 4.24 #peak 2133 29 PHE HZ 65 LYS HD 4.54 #peak 53 31 THR HG2 58 LYS HE 3.96 #peak 1813 32 ASN H 32 ASN HB 3.51 #peak 451 32 ASN HB 33 ILE HG2 6.27 #peak 2656 32 ASN HB 33 ILE HG13 6.27 #peak 2656 32 ASN HB 33 ILE HD1 6.27 #peak 2656 32 ASN HB 51 ILE HG2 5.69 #peak 1563 32 ASN HB 120 ASN H 6.14 #peak 919 33 ILE H 120 ASN HB 5.49 #peak 480 33 ILE HD1 120 ASN HB 4.73 #peak 955 34 ARG H 50 MET HB 5.72 #peak 492 34 ARG HA 34 ARG HD 4.86 #peak 2661 34 ARG HB 35 THR H 3.97 #peak 503 34 ARG HB 50 MET HG2 6.27 #peak 1492 34 ARG HB 50 MET HG3 6.10 #peak 1480 34 ARG HB 51 ILE H 5.21 #peak 745 34 ARG HB 51 ILE HA 4.38 #peak 80 34 ARG HG 35 THR H 6.27 #peak 853 34 ARG HG 52 PHE HD 3.87 #peak 105 34 ARG HG 52 PHE HE 4.13 #peak 123 35 THR H 50 MET HB 3.92 #peak 504 35 THR HB 50 MET HB 3.66 #peak 980 35 THR HG2 50 MET HB 4.09 #peak 989 35 THR HG2 139 ASN HD2 5.53 #peak 812 36 ILE HG2 48 ASN HB 6.27 #peak 1016 36 ILE HG1 37 VAL H 4.37 #peak 532 36 ILE HG1 37 VAL HA 4.48 #peak 59 36 ILE HG1 37 VAL HG2 4.90 #peak 1059 36 ILE HG1 49 LEU HA 5.41 #peak 1011 37 VAL H 48 ASN HB 4.58 #peak 535 37 VAL HB 48 ASN HB 3.94 #peak 1043 37 VAL HB 48 ASN HD2 4.92 #peak 705 37 VAL HG1 39 ASN HD2 3.54 #peak 562 37 VAL HG1 48 ASN HB 4.55 #peak 1050 37 VAL HG1 48 ASN HD2 4.78 #peak 1054 37 VAL HG2 48 ASN HB 3.97 #peak 1062 37 VAL HG2 48 ASN HD2 5.04 #peak 1069 38 LEU HD1 45 PHE HB 4.60 #peak 1097 38 LEU HD2 39 ASN HD2 6.27 #peak 1128 38 LEU HD2 45 PHE HB 4.15 #peak 1117 39 ASN H 45 PHE HB 5.39 #peak 1303 39 ASN HA 39 ASN HD2 4.73 #peak 573 39 ASN HB 39 ASN HD2 3.19 #peak 570 39 ASN HD2 41 LYS HB 5.39 #peak 1179 39 ASN HD2 41 LYS HD 4.62 #peak 566 39 ASN HD2 41 LYS HE 4.90 #peak 569 39 ASN HD2 46 THR HB 5.34 #peak 1309 39 ASN HD2 46 THR HG2 4.29 #peak 1324 39 ASN HD2 48 ASN HD2 6.03 #peak 572 39 ASN HD2 135 THR HG2 5.53 #peak 812 41 LYS H 45 PHE HB 4.74 #peak 591 41 LYS HB 42 ASP HB 5.57 #peak 2665 41 LYS HG 42 ASP HB 4.33 #peak 1188 42 ASP HB 44 ILE H 5.05 #peak 1198 42 ASP HB 44 ILE HG12 5.11 #peak 1223 42 ASP HB 44 ILE HG13 5.12 #peak 1233 43 GLY HA 44 ILE HG2 6.09 #peak 1245 43 GLY HA 44 ILE HG13 6.22 #peak 1235 45 PHE HB 46 THR H 3.83 #peak 666 46 THR HG2 48 ASN HD2 4.99 #peak 1326 46 THR HG1 48 ASN HD2 5.65 #peak 709 48 ASN H 48 ASN HD2 5.55 #peak 699 48 ASN HB 49 LEU H 4.32 #peak 727 48 ASN HB 78 LEU HD1 3.94 #peak 2523 48 ASN HD2 50 MET HE 6.27 #peak 1520 50 MET HB 83 HIS HE1 4.39 #peak 170 51 ILE HG2 52 PHE HB 6.07 #peak 1563 51 ILE HD1 52 PHE HB 6.27 #peak 1583 51 ILE HD1 58 LYS HE 5.53 #peak 1584 52 PHE H 52 PHE HB 3.68 #peak 762 52 PHE HB 53 VAL H 4.05 #peak 777 53 VAL HA 54 LYS HB 4.78 #peak 1685 53 VAL HG1 58 LYS HB 5.47 #peak 1773 53 VAL HG1 58 LYS HE 4.92 #peak 1634 53 VAL HG2 54 LYS HB 5.39 #peak 1681 53 VAL HG2 54 LYS HG 5.26 #peak 1793 53 VAL HG2 58 LYS HB 5.00 #peak 1767 54 LYS H 54 LYS HG 3.96 #peak 790 54 LYS HB 54 LYS HE 4.24 #peak 1691 54 LYS HB 55 ASN HB 6.04 #peak 1718 54 LYS HB 55 ASN HD2 4.58 #peak 1185 54 LYS HG 55 ASN H 4.91 #peak 798 54 LYS HG 55 ASN HD2 4.14 #peak 807 54 LYS HD 55 ASN HB 6.27 #peak 1718 54 LYS HD 55 ASN HD2 4.29 #peak 808 54 LYS HE 55 ASN HD2 4.17 #peak 1715 55 ASN H 58 LYS HB 4.33 #peak 800 55 ASN HB 56 THR HG2 5.91 #peak 2676 55 ASN HB 57 ASP H 4.47 #peak 826 55 ASN HD2 57 ASP HB 4.81 #peak 809 55 ASN HD2 58 LYS H 5.94 #peak 842 55 ASN HD2 58 LYS HG3 6.27 #peak 1787 56 THR HA 59 LEU HB 3.79 #peak 1730 56 THR HB 59 LEU HB 6.08 #peak 16 56 THR HG2 59 LEU HB 4.68 #peak 1744 57 ASP H 58 LYS HB 5.69 #peak 824 57 ASP HB 58 LYS HB 5.57 #peak 1753 58 LYS H 58 LYS HB 3.10 #peak 1169 58 LYS HA 58 LYS HE 5.74 #peak 869 58 LYS HB 59 LEU H 4.30 #peak 852 58 LYS HG2 58 LYS HE 3.62 #peak 865 58 LYS HE 59 LEU HA 6.27 #peak 2655 58 LYS HE 62 LEU H 5.93 #peak 1815 58 LYS HE 62 LEU HD1 4.21 #peak 1985 58 LYS HE 62 LEU HD2 4.10 #peak 1811 59 LEU HB 60 THR H 3.65 #peak 867 59 LEU HB 60 THR HG2 5.00 #peak 1907 59 LEU HD1 77 ARG HB 5.20 #peak 2459 59 LEU HD1 77 ARG HG 4.54 #peak 2471 59 LEU HD2 77 ARG HB 5.05 #peak 2460 59 LEU HD2 77 ARG HG 3.89 #peak 1879 60 THR HA 63 MET HB 4.20 #peak 1899 60 THR HG2 63 MET HB 5.50 #peak 1907 62 LEU H 63 MET HB 6.27 #peak 897 62 LEU H 65 LYS HD 5.66 #peak 2139 62 LEU HA 65 LYS HD 4.22 #peak 2137 62 LEU HD1 65 LYS HD 5.37 #peak 2129 62 LEU HD2 65 LYS HD 4.10 #peak 2005 63 MET HA 66 LEU HB 4.66 #peak 2025 63 MET HB 64 ASP H 3.58 #peak 927 63 MET HB 75 VAL HG1 4.18 #peak 827 63 MET HE 77 ARG HB 2.98 #peak 2049 64 ASP HA 67 ARG HG 4.64 #peak 2197 64 ASP HB3 68 LYS HG 6.27 #peak 2124 65 LYS H 65 LYS HD 4.62 #peak 2134 65 LYS HA 65 LYS HD 4.24 #peak 2131 65 LYS HA 68 LYS HG 4.09 #peak 2085 65 LYS HA 68 LYS HD 5.36 #peak 2138 66 LEU HB 67 ARG H 3.77 #peak 967 66 LEU HB 67 ARG HA 5.18 #peak 2181 66 LEU HB 68 LYS H 5.10 #peak 996 66 LEU HB 75 VAL HG1 4.00 #peak 2420 67 ARG H 67 ARG HG 3.98 #peak 965 67 ARG H 68 LYS HG 5.04 #peak 2250 67 ARG HA 67 ARG HG 3.74 #peak 2179 67 ARG HG 68 LYS H 5.34 #peak 2204 67 ARG HG 72 VAL HG1 5.23 #peak 2199 67 ARG HG 75 VAL H 4.89 #peak 1102 67 ARG HG 75 VAL HG1 4.63 #peak 2200 67 ARG HG 75 VAL HG2 3.74 #peak 2430 68 LYS H 68 LYS HG 3.57 #peak 991 68 LYS H 68 LYS HD 4.24 #peak 2254 68 LYS HA 68 LYS HG 3.30 #peak 2218 68 LYS HA 68 LYS HD 3.31 #peak 862 68 LYS HD 69 VAL H 6.27 #peak 1010 69 VAL HG1 70 GLN HE2 5.32 #peak 1031 76 GLU HA 77 ARG HB 4.77 #peak 2464 77 ARG H 77 ARG HB 3.16 #peak 1116 77 ARG H 77 ARG HG 3.97 #peak 2486 77 ARG HB 77 ARG HD 3.21 #peak 2490 77 ARG HB 77 ARG HE 6.15 #peak 1125 77 ARG HG 78 LEU H 3.96 #peak 1130 77 ARG HG 78 LEU HA 6.18 #peak 2483 77 ARG HG 78 LEU HB2 6.08 #peak 2473 77 ARG HG 79 SER HA 4.34 #peak 151 80 ASN HB 80 ASN HD2 3.15 #peak 1150 80 ASN HB 81 LEU HD2 5.08 #peak 2561 81 LEU H 82 GLU HG 6.18 #peak 1163 82 GLU H 82 GLU HG 3.57 #peak 1170 82 GLU HA 82 GLU HG 3.55 #peak 2617 82 GLU HG 83 HIS HA 5.04 #peak 2623 82 GLU HG 83 HIS HD2 4.34 #peak 164 103 ASP HA 154 LYS HB 4.80 #peak 1686 103 ASP HB 104 PHE H 3.68 #peak 7 103 ASP HB 152 PHE HB 4.97 #peak 1612 103 ASP HB 152 PHE HD 3.78 #peak 107 103 ASP HB 154 LYS HA 4.86 #peak 2674 104 PHE H 152 PHE HB 5.62 #peak 8 104 PHE H 154 LYS HB 6.27 #peak 5 104 PHE HZ 159 LEU HB 6.11 #peak 2628 105 LEU HD1 134 ARG HB 4.05 #peak 56 105 LEU HD1 134 ARG HG 4.40 #peak 56 105 LEU HD1 150 MET HB 4.16 #peak 59 105 LEU HD1 152 PHE HB 5.06 #peak 64 105 LEU HD2 150 MET HB 5.60 #peak 1471 106 ALA HB 159 LEU HB 5.37 #peak 97 106 ALA HB 177 ARG HG 5.72 #peak 2473 107 GLY H 177 ARG HG 5.53 #peak 2478 107 GLY HA2 108 ILE HG1 5.00 #peak 134 107 GLY HA3 108 ILE HG1 6.27 #peak 2633 108 ILE H 108 ILE HG1 3.85 #peak 135 108 ILE HA 108 ILE HG1 3.59 #peak 18 108 ILE HG2 108 ILE HG1 3.38 #peak 145 108 ILE HG2 166 LEU HB 4.68 #peak 148 108 ILE HG1 149 LEU HB3 5.31 #peak 138 108 ILE HG1 159 LEU HD1 3.70 #peak 1867 108 ILE HG1 163 MET HG2 5.70 #peak 139 108 ILE HG1 163 MET HE 5.90 #peak 139 108 ILE HG1 177 ARG HA 4.76 #peak 132 108 ILE HG1 177 ARG HB 5.01 #peak 2696 108 ILE HD1 163 MET HB 5.57 #peak 163 108 ILE HD1 166 LEU HB 6.07 #peak 163 109 ARG H 109 ARG HG 4.77 #peak 69 109 ARG H 176 GLU HB 4.85 #peak 70 109 ARG HG 111 VAL HG2 3.92 #peak 285 109 ARG HG 147 CYS H 6.13 #peak 1202 109 ARG HG 176 GLU H 5.47 #peak 1109 109 ARG HD 148 ASN HD2 5.20 #peak 717 109 ARG HD 176 GLU HB 5.98 #peak 200 110 ILE HG2 166 LEU HB 5.35 #peak 239 110 ILE HD1 166 LEU HB 5.20 #peak 259 113 GLU HA 114 ASP HB 5.94 #peak 371 114 ASP H 114 ASP HB 3.58 #peak 138 114 ASP HB 115 LYS HA 6.05 #peak 40 114 ASP HB 140 ALA HB 4.41 #peak 1162 114 ASP HB 143 GLY H 5.23 #peak 617 114 ASP HB 143 GLY HA 4.13 #peak 1196 114 ASP HB 144 ILE HA 5.13 #peak 373 114 ASP HB 144 ILE HG2 5.78 #peak 1244 114 ASP HB 145 PHE H 6.27 #peak 648 114 ASP HB 145 PHE HD 4.63 #peak 65 115 LYS H 118 MET HG 3.80 #peak 151 115 LYS HA 116 ASN HB 5.51 #peak 430 115 LYS HA 116 ASN HD2 5.66 #peak 181 115 LYS HB2 118 MET HG 6.06 #peak 387 115 LYS HB3 118 MET HG 5.52 #peak 396 115 LYS HG 116 ASN HB 4.88 #peak 408 115 LYS HG 116 ASN HD2 4.81 #peak 176 115 LYS HG 118 MET HG 4.54 #peak 407 115 LYS HD 116 ASN HB 6.24 #peak 428 115 LYS HD 116 ASN HD2 4.69 #peak 1710 115 LYS HE 116 ASN HD2 4.49 #peak 179 116 ASN HA 116 ASN HD2 4.65 #peak 180 116 ASN HB 116 ASN HD2 3.13 #peak 171 116 ASN HB 117 GLY H 4.00 #peak 434 116 ASN HB 118 MET H 5.59 #peak 433 117 GLY H 118 MET HG 5.09 #peak 187 117 GLY HA 119 THR H 4.90 #peak 222 117 GLY HA 120 ASN H 4.74 #peak 240 117 GLY HA 120 ASN HB 5.62 #peak 545 117 GLY HA 121 GLN HE21 5.62 #peak 1187 117 GLY HA 121 GLN HE22 6.27 #peak 300 118 MET HG 118 MET HE 3.38 #peak 499 118 MET HG 119 THR H 5.10 #peak 218 118 MET HG 121 GLN HE22 4.69 #peak 480 118 MET HG 145 PHE HE 4.58 #peak 87 118 MET HG 145 PHE HZ 5.47 #peak 479 118 MET HG 171 GLY H 6.27 #peak 489 119 THR HG2 145 PHE HB 3.81 #peak 530 120 ASN H 120 ASN HB 3.45 #peak 236 120 ASN HB 121 GLN H 3.73 #peak 273 120 ASN HB 121 GLN HE21 5.32 #peak 290 123 THR HA 126 ILE HG1 4.77 #peak 857 123 THR HB 126 ILE HG1 6.27 #peak 701 123 THR HG2 124 GLY HA 5.23 #peak 2648 123 THR HG2 126 ILE HG1 5.38 #peak 706 123 THR HG2 127 SER HB 5.27 #peak 811 124 GLY H 126 ILE HG1 6.27 #peak 341 124 GLY HA 125 VAL HA 4.67 #peak 729 124 GLY HA 126 ILE H 5.52 #peak 374 124 GLY HA 126 ILE HB 6.25 #peak 2649 124 GLY HA 126 ILE HG1 6.04 #peak 2649 124 GLY HA 127 SER HG 4.56 #peak 720 124 GLY HA 128 LYS HG 6.04 #peak 2649 124 GLY HA 128 LYS HE 6.27 #peak 2655 125 VAL H 126 ILE HG1 5.11 #peak 354 125 VAL H 128 LYS HG 5.16 #peak 354 125 VAL H 128 LYS HD 6.27 #peak 355 125 VAL HA 128 LYS HB 4.43 #peak 726 125 VAL HA 128 LYS HG 4.43 #peak 725 125 VAL HA 128 LYS HD 4.56 #peak 861 125 VAL HG1 128 LYS HB 5.95 #peak 2690 125 VAL HG1 128 LYS HG 4.61 #peak 841 125 VAL HG1 128 LYS HD 4.54 #peak 743 125 VAL HG2 128 LYS HG 4.12 #peak 757 126 ILE H 126 ILE HG1 3.66 #peak 368 126 ILE H 128 LYS HG 5.75 #peak 854 126 ILE HG2 129 PHE HB 5.23 #peak 872 126 ILE HG1 127 SER H 4.99 #peak 380 126 ILE HG1 127 SER HG 6.27 #peak 859 126 ILE HG1 129 PHE HZ 5.47 #peak 860 127 SER H 127 SER HB 3.38 #peak 385 127 SER H 128 LYS HB 5.64 #peak 381 127 SER H 133 ILE HG1 6.16 #peak 381 127 SER HA 133 ILE HG1 5.64 #peak 2653 127 SER HB 128 LYS H 4.15 #peak 400 127 SER HB 133 ILE HD1 3.91 #peak 957 127 SER HG 128 LYS HD 5.59 #peak 863 128 LYS H 128 LYS HB 3.24 #peak 395 128 LYS H 128 LYS HG 3.41 #peak 394 128 LYS H 128 LYS HD 5.00 #peak 860 128 LYS H 129 PHE HB 6.06 #peak 398 128 LYS HA 128 LYS HG 3.39 #peak 843 128 LYS HA 128 LYS HD 4.56 #peak 858 128 LYS HB 128 LYS HD 3.23 #peak 855 128 LYS HB 128 LYS HE 4.01 #peak 867 128 LYS HB 129 PHE H 4.19 #peak 411 128 LYS HG 128 LYS HE 3.35 #peak 865 128 LYS HG 129 PHE H 5.04 #peak 410 129 PHE H 129 PHE HB 3.38 #peak 415 129 PHE HB 131 THR H 4.00 #peak 436 129 PHE HB 131 THR HG2 3.68 #peak 904 129 PHE HB 133 ILE HD1 6.05 #peak 872 129 PHE HB 151 ILE HD1 6.18 #peak 1583 129 PHE HB 162 LEU HD1 4.33 #peak 1986 129 PHE HB 162 LEU HD2 4.61 #peak 2009 129 PHE HD 165 LYS HD 3.86 #peak 38 129 PHE HE 165 LYS HG 5.09 #peak 2126 129 PHE HE 165 LYS HD 4.24 #peak 2133 129 PHE HZ 165 LYS HG 5.64 #peak 2126 129 PHE HZ 165 LYS HD 4.54 #peak 53 131 THR HG2 158 LYS HE 3.96 #peak 1813 132 ASN H 132 ASN HB 3.51 #peak 451 132 ASN H 132 ASN HD2 5.93 #peak 473 132 ASN HA 132 ASN HD2 4.71 #peak 461 132 ASN HB 132 ASN HD2 3.21 #peak 458 132 ASN HB 133 ILE HG2 6.27 #peak 2656 132 ASN HB 133 ILE HG1 6.04 #peak 2656 132 ASN HB 133 ILE HD1 6.27 #peak 2656 132 ASN HB 151 ILE HG2 5.69 #peak 1563 132 ASN HD2 133 ILE H 4.69 #peak 463 132 ASN HD2 133 ILE HB 5.74 #peak 457 133 ILE H 133 ILE HG1 3.75 #peak 475 133 ILE HG1 149 LEU HD1 3.93 #peak 1427 133 ILE HG1 151 ILE HG2 4.55 #peak 936 134 ARG H 150 MET HB 5.72 #peak 492 134 ARG HA 134 ARG HD 4.86 #peak 2661 134 ARG HB 135 THR H 3.97 #peak 503 134 ARG HB 150 MET HG2 6.27 #peak 1492 134 ARG HB 150 MET HG3 6.10 #peak 1480 134 ARG HB 151 ILE H 5.21 #peak 745 134 ARG HB 151 ILE HA 4.38 #peak 80 134 ARG HG 135 THR H 6.27 #peak 853 134 ARG HG 152 PHE HD 3.87 #peak 105 134 ARG HG 152 PHE HE 4.13 #peak 123 135 THR H 150 MET HB 3.92 #peak 504 135 THR HB 150 MET HB 3.66 #peak 980 135 THR HG2 150 MET HB 4.09 #peak 989 136 ILE HG2 148 ASN HB 6.27 #peak 1016 136 ILE HG1 137 VAL H 4.37 #peak 532 136 ILE HG1 137 VAL HA 4.48 #peak 59 136 ILE HG1 137 VAL HG2 4.90 #peak 1059 136 ILE HG1 149 LEU HA 5.41 #peak 1011 137 VAL H 148 ASN HB 4.58 #peak 535 137 VAL HB 148 ASN HB 3.94 #peak 1043 137 VAL HB 148 ASN HD2 4.92 #peak 705 137 VAL HG1 139 ASN HD2 3.54 #peak 562 137 VAL HG1 148 ASN HB 4.55 #peak 1050 137 VAL HG1 148 ASN HD2 4.78 #peak 1054 137 VAL HG2 148 ASN HB 3.97 #peak 1062 137 VAL HG2 148 ASN HD2 5.04 #peak 1069 138 LEU HD1 145 PHE HB 4.60 #peak 1097 138 LEU HD2 139 ASN HD2 6.27 #peak 1128 138 LEU HD2 145 PHE HB 4.15 #peak 1117 139 ASN H 145 PHE HB 5.39 #peak 1303 139 ASN HA 139 ASN HD2 4.73 #peak 573 139 ASN HB 139 ASN HD2 3.19 #peak 570 139 ASN HD2 141 LYS HB 5.39 #peak 1179 139 ASN HD2 141 LYS HD 4.62 #peak 566 139 ASN HD2 141 LYS HE 4.90 #peak 569 139 ASN HD2 146 THR HB 5.34 #peak 1309 139 ASN HD2 146 THR HG2 4.29 #peak 1324 139 ASN HD2 148 ASN HD2 6.03 #peak 572 141 LYS H 145 PHE HB 4.74 #peak 591 141 LYS HB 142 ASP HB 5.57 #peak 2665 141 LYS HG 142 ASP HB 4.33 #peak 1188 142 ASP HB 144 ILE H 5.05 #peak 1198 142 ASP HB 144 ILE HG12 5.11 #peak 1223 142 ASP HB 144 ILE HG13 5.12 #peak 1233 143 GLY HA 144 ILE HG2 6.09 #peak 1245 143 GLY HA 144 ILE HG13 6.22 #peak 1235 145 PHE HB 146 THR H 3.83 #peak 666 146 THR HG2 148 ASN HD2 4.99 #peak 1326 146 THR HG1 148 ASN HD2 5.65 #peak 709 148 ASN H 148 ASN HD2 5.55 #peak 699 148 ASN HB 149 LEU H 4.32 #peak 727 148 ASN HB 178 LEU HD1 3.94 #peak 2523 148 ASN HD2 150 MET HE 6.27 #peak 1520 150 MET HB 183 HIS HE1 4.39 #peak 170 151 ILE HG2 152 PHE HB 6.07 #peak 1563 151 ILE HD1 152 PHE HB 6.27 #peak 1583 151 ILE HD1 158 LYS HE 5.53 #peak 1584 152 PHE H 152 PHE HB 3.68 #peak 762 152 PHE HB 153 VAL H 4.05 #peak 777 153 VAL HA 154 LYS HB 4.78 #peak 1685 153 VAL HG1 158 LYS HB 5.47 #peak 1773 153 VAL HG1 158 LYS HE 4.92 #peak 1634 153 VAL HG2 154 LYS HB 5.39 #peak 1681 153 VAL HG2 154 LYS HG 5.26 #peak 1793 153 VAL HG2 158 LYS HB 5.00 #peak 1767 154 LYS H 154 LYS HG 3.96 #peak 790 154 LYS HB 154 LYS HE 4.24 #peak 1691 154 LYS HB 155 ASN HB 6.04 #peak 1718 154 LYS HB 155 ASN HD2 4.58 #peak 1185 154 LYS HG 155 ASN H 4.91 #peak 798 154 LYS HG 155 ASN HD2 4.14 #peak 807 154 LYS HD 155 ASN HB 6.27 #peak 1718 154 LYS HD 155 ASN HD2 4.29 #peak 808 154 LYS HE 155 ASN HD2 4.17 #peak 1715 155 ASN H 158 LYS HB 4.33 #peak 800 155 ASN HB 156 THR HG2 5.91 #peak 2676 155 ASN HB 157 ASP H 4.47 #peak 826 155 ASN HD2 157 ASP HB 4.81 #peak 809 155 ASN HD2 158 LYS H 5.94 #peak 842 155 ASN HD2 158 LYS HG3 6.27 #peak 1787 156 THR HA 159 LEU HB 3.79 #peak 1730 156 THR HB 159 LEU HB 6.08 #peak 16 156 THR HG2 159 LEU HB 4.68 #peak 1744 157 ASP H 158 LYS HB 5.69 #peak 824 157 ASP HB 158 LYS HB 5.57 #peak 1753 158 LYS H 158 LYS HB 3.10 #peak 1169 158 LYS HA 158 LYS HE 5.74 #peak 869 158 LYS HB 159 LEU H 4.30 #peak 852 158 LYS HG2 158 LYS HE 3.62 #peak 865 158 LYS HE 159 LEU HA 6.27 #peak 2655 158 LYS HE 162 LEU H 5.93 #peak 1815 158 LYS HE 162 LEU HD1 4.21 #peak 1985 158 LYS HE 162 LEU HD2 4.10 #peak 1811 159 LEU HB 160 THR H 3.65 #peak 867 159 LEU HB 160 THR HG2 5.00 #peak 1907 159 LEU HD1 177 ARG HB 5.20 #peak 2459 159 LEU HD1 177 ARG HG 4.54 #peak 2471 159 LEU HD2 177 ARG HB 5.05 #peak 2460 159 LEU HD2 177 ARG HG 3.89 #peak 1879 160 THR HA 163 MET HB 4.20 #peak 1899 160 THR HG2 163 MET HB 5.50 #peak 1907 162 LEU H 163 MET HB 6.27 #peak 897 162 LEU H 165 LYS HD 5.66 #peak 2139 162 LEU HA 165 LYS HG 4.38 #peak 1946 162 LEU HA 165 LYS HD 4.22 #peak 2137 162 LEU HD1 165 LYS HG 6.27 #peak 2112 162 LEU HD1 165 LYS HD 5.37 #peak 2129 162 LEU HD2 165 LYS HG 5.33 #peak 2122 162 LEU HD2 165 LYS HD 4.10 #peak 2005 163 MET H 165 LYS HG 6.13 #peak 2121 163 MET HA 166 LEU HB 4.66 #peak 2025 163 MET HB 164 ASP H 3.58 #peak 927 163 MET HB 175 VAL HG1 4.18 #peak 827 163 MET HE 177 ARG HB 2.98 #peak 2049 164 ASP H 165 LYS HG 4.95 #peak 926 164 ASP HA 167 ARG HG 4.64 #peak 2197 164 ASP HB2 165 LYS HG 5.41 #peak 2065 164 ASP HB3 165 LYS HG 4.75 #peak 2075 164 ASP HB3 168 LYS HG 6.27 #peak 2124 165 LYS H 165 LYS HG 3.35 #peak 938 165 LYS H 165 LYS HD 4.62 #peak 2134 165 LYS HA 165 LYS HD 4.24 #peak 2131 165 LYS HA 168 LYS HG 4.09 #peak 2085 165 LYS HA 168 LYS HD 5.36 #peak 2138 165 LYS HG 165 LYS HE 3.56 #peak 2246 166 LEU HB 167 ARG H 3.77 #peak 967 166 LEU HB 167 ARG HA 5.18 #peak 2181 166 LEU HB 168 LYS H 5.10 #peak 996 166 LEU HB 175 VAL HG1 4.00 #peak 2420 167 ARG H 167 ARG HG 3.98 #peak 965 167 ARG H 168 LYS HG 5.04 #peak 2250 167 ARG HA 167 ARG HG 3.74 #peak 2179 167 ARG HG 168 LYS H 5.34 #peak 2204 167 ARG HG 172 VAL HG1 5.23 #peak 2199 167 ARG HG 175 VAL H 4.89 #peak 1102 167 ARG HG 175 VAL HG1 4.63 #peak 2200 167 ARG HG 175 VAL HG2 3.74 #peak 2430 168 LYS H 168 LYS HG 3.57 #peak 991 168 LYS H 168 LYS HD 4.24 #peak 2254 168 LYS HA 168 LYS HG 3.30 #peak 2218 168 LYS HA 168 LYS HD 3.31 #peak 862 168 LYS HD 169 VAL H 6.27 #peak 1010 169 VAL HG1 170 GLN HE2 5.32 #peak 1031 176 GLU H 176 GLU HB 3.62 #peak 1106 176 GLU HA 177 ARG HB 4.77 #peak 2464 176 GLU HB 177 ARG H 3.45 #peak 1117 177 ARG H 177 ARG HB 3.16 #peak 1116 177 ARG H 177 ARG HG 3.97 #peak 2486 177 ARG HB 177 ARG HD 3.21 #peak 2490 177 ARG HB 177 ARG HE 6.15 #peak 1125 177 ARG HG 178 LEU H 3.96 #peak 1130 177 ARG HG 178 LEU HA 6.18 #peak 2483 177 ARG HG 178 LEU HB2 6.08 #peak 2473 177 ARG HG 179 SER HA 4.34 #peak 151 180 ASN HB 180 ASN HD2 3.15 #peak 1150 180 ASN HB 181 LEU HD2 5.08 #peak 2561 181 LEU H 182 GLU HG 6.18 #peak 1163 182 GLU H 182 GLU HG 3.57 #peak 1170 182 GLU HA 182 GLU HG 3.55 #peak 2617 182 GLU HG 183 HIS HA 5.04 #peak 2623 182 GLU HG 183 HIS HD2 4.34 #peak 164 Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 12.255 -22.624 15.032 2 H2 MET 1 H2 MET 1 10.730 -23.047 14.434 3 H3 MET 1 H3 MET 1 10.857 -22.075 15.812 4 HA MET 1 HA MET 1 11.869 -20.314 14.526 5 HB2 MET 1 HB2 MET 1 11.350 -22.170 12.189 6 HB3 MET 1 HB3 MET 1 11.855 -20.490 12.047 7 HG2 MET 1 HG2 MET 1 13.949 -21.013 13.182 8 HG3 MET 1 HG3 MET 1 13.438 -22.691 13.368 9 HE1 MET 1 HE1 MET 1 13.382 -23.956 9.665 10 HE2 MET 1 HE2 MET 1 12.033 -23.321 10.607 11 HE3 MET 1 HE3 MET 1 13.200 -24.407 11.361 12 H THR 2 H THR 2 10.187 -19.095 15.176 13 HA THR 2 HA THR 2 7.450 -19.740 14.484 14 HB THR 2 HB THR 2 8.498 -17.282 15.919 15 HG1 THR 2 HG1 THR 2 7.378 -19.379 17.374 16 HG21 THR 2 HG21 THR 2 5.772 -18.600 15.951 17 HG22 THR 2 HG22 THR 2 6.174 -17.073 15.162 18 HG23 THR 2 HG23 THR 2 6.253 -17.207 16.919 19 H ASP 3 H ASP 3 5.995 -18.303 13.377 20 HA ASP 3 HA ASP 3 6.755 -15.798 12.305 21 HB2 ASP 3 HB2 ASP 3 7.966 -17.385 10.738 22 HB3 ASP 3 HB3 ASP 3 6.386 -17.923 10.192 23 H PHE 4 H PHE 4 4.911 -14.665 12.268 24 HA PHE 4 HA PHE 4 2.374 -16.051 11.740 25 HB2 PHE 4 HB2 PHE 4 1.308 -14.873 13.621 26 HB3 PHE 4 HB3 PHE 4 2.606 -15.924 14.171 27 HD1 PHE 4 HD1 PHE 4 1.544 -12.437 13.705 28 HD2 PHE 4 HD2 PHE 4 4.606 -15.011 15.185 29 HE1 PHE 4 HE1 PHE 4 2.566 -10.538 14.890 30 HE2 PHE 4 HE2 PHE 4 5.627 -13.112 16.373 31 HZ PHE 4 HZ PHE 4 4.614 -10.869 16.212 32 H LEU 5 H LEU 5 0.609 -14.652 11.165 33 HA LEU 5 HA LEU 5 1.435 -12.491 9.452 34 HB2 LEU 5 HB2 LEU 5 -0.294 -14.044 8.744 35 HB3 LEU 5 HB3 LEU 5 -1.276 -13.626 10.131 36 HG LEU 5 HG LEU 5 -1.600 -11.355 9.230 37 HD11 LEU 5 HD11 LEU 5 0.488 -11.087 8.018 38 HD12 LEU 5 HD12 LEU 5 -0.882 -10.821 6.942 39 HD13 LEU 5 HD13 LEU 5 0.011 -12.340 6.873 40 HD21 LEU 5 HD21 LEU 5 -2.251 -13.542 7.258 41 HD22 LEU 5 HD22 LEU 5 -3.025 -11.958 7.337 42 HD23 LEU 5 HD23 LEU 5 -3.207 -13.096 8.672 43 H ALA 6 H ALA 6 2.010 -10.668 10.471 44 HA ALA 6 HA ALA 6 0.555 -9.729 12.821 45 HB1 ALA 6 HB1 ALA 6 2.401 -8.164 13.085 46 HB2 ALA 6 HB2 ALA 6 3.083 -8.688 11.545 47 HB3 ALA 6 HB3 ALA 6 2.996 -9.813 12.901 48 H GLY 7 H GLY 7 -0.901 -8.128 12.765 49 HA2 GLY 7 HA2 GLY 7 -1.137 -6.482 10.324 50 HA3 GLY 7 HA3 GLY 7 -2.422 -6.780 11.481 51 H ILE 8 H ILE 8 -1.172 -4.269 10.378 52 HA ILE 8 HA ILE 8 -0.761 -2.917 12.972 53 HB ILE 8 HB ILE 8 0.782 -2.310 10.429 54 HG12 ILE 8 HG12 ILE 8 1.762 -3.499 13.047 55 HG13 ILE 8 HG13 ILE 8 1.557 -4.384 11.539 56 HG21 ILE 8 HG21 ILE 8 0.347 -0.289 11.698 57 HG22 ILE 8 HG22 ILE 8 2.050 -0.724 11.841 58 HG23 ILE 8 HG23 ILE 8 0.942 -1.052 13.174 59 HD11 ILE 8 HD11 ILE 8 3.281 -3.002 10.495 60 HD12 ILE 8 HD12 ILE 8 3.887 -3.827 11.930 61 HD13 ILE 8 HD13 ILE 8 3.482 -2.113 12.005 62 H ARG 9 H ARG 9 -1.843 -0.984 13.202 63 HA ARG 9 HA ARG 9 -3.312 0.041 10.855 64 HB2 ARG 9 HB2 ARG 9 -4.992 -0.726 12.273 65 HB3 ARG 9 HB3 ARG 9 -4.134 -0.240 13.727 66 HG2 ARG 9 HG2 ARG 9 -4.958 1.871 13.681 67 HG3 ARG 9 HG3 ARG 9 -4.955 1.956 11.920 68 HD2 ARG 9 HD2 ARG 9 -6.911 0.170 13.326 69 HD3 ARG 9 HD3 ARG 9 -7.218 1.904 13.217 70 HE ARG 9 HE ARG 9 -6.601 1.093 10.659 71 HH11 ARG 9 HH11 ARG 9 -8.977 0.124 12.970 72 HH12 ARG 9 HH12 ARG 9 -10.208 -0.062 11.770 73 HH21 ARG 9 HH21 ARG 9 -8.174 0.850 9.150 74 HH22 ARG 9 HH22 ARG 9 -9.758 0.340 9.623 75 H ILE 10 H ILE 10 -2.652 1.923 10.147 76 HA ILE 10 HA ILE 10 -1.287 3.815 11.969 77 HB ILE 10 HB ILE 10 -1.073 3.668 8.952 78 HG12 ILE 10 HG12 ILE 10 0.928 2.648 10.991 79 HG13 ILE 10 HG13 ILE 10 -0.167 1.620 10.072 80 HG21 ILE 10 HG21 ILE 10 0.895 5.105 9.259 81 HG22 ILE 10 HG22 ILE 10 0.579 5.162 10.993 82 HG23 ILE 10 HG23 ILE 10 -0.576 5.868 9.863 83 HD11 ILE 10 HD11 ILE 10 1.993 3.377 8.932 84 HD12 ILE 10 HD12 ILE 10 0.875 2.388 7.993 85 HD13 ILE 10 HD13 ILE 10 2.032 1.620 9.079 86 H VAL 11 H VAL 11 -2.536 5.585 12.482 87 HA VAL 11 HA VAL 11 -4.231 6.701 10.324 88 HB VAL 11 HB VAL 11 -4.717 6.766 13.307 89 HG11 VAL 11 HG11 VAL 11 -6.684 8.152 12.841 90 HG12 VAL 11 HG12 VAL 11 -6.217 8.248 11.142 91 HG13 VAL 11 HG13 VAL 11 -5.196 8.980 12.380 92 HG21 VAL 11 HG21 VAL 11 -6.411 5.734 11.023 93 HG22 VAL 11 HG22 VAL 11 -6.810 5.655 12.740 94 HG23 VAL 11 HG23 VAL 11 -5.446 4.731 12.109 95 H GLY 12 H GLY 12 -3.465 8.478 9.489 96 HA2 GLY 12 HA2 GLY 12 -2.144 10.476 11.218 97 HA3 GLY 12 HA3 GLY 12 -1.373 9.959 9.725 98 H GLU 13 H GLU 13 -1.872 12.607 10.010 99 HA GLU 13 HA GLU 13 -4.452 13.358 9.018 100 HB2 GLU 13 HB2 GLU 13 -3.469 15.629 8.834 101 HB3 GLU 13 HB3 GLU 13 -3.242 14.896 10.416 102 HG2 GLU 13 HG2 GLU 13 -0.920 14.311 9.777 103 HG3 GLU 13 HG3 GLU 13 -1.161 15.141 8.240 104 H ASP 14 H ASP 14 -5.160 13.628 6.990 105 HA ASP 14 HA ASP 14 -3.729 12.573 4.792 106 HB2 ASP 14 HB2 ASP 14 -6.132 12.440 4.799 107 HB3 ASP 14 HB3 ASP 14 -6.286 14.188 4.947 108 H LYS 15 H LYS 15 -1.757 13.782 4.777 109 HA LYS 15 HA LYS 15 -1.984 16.507 3.768 110 HB2 LYS 15 HB2 LYS 15 0.132 15.044 5.258 111 HB3 LYS 15 HB3 LYS 15 0.594 16.402 4.236 112 HG2 LYS 15 HG2 LYS 15 -1.059 17.792 5.420 113 HG3 LYS 15 HG3 LYS 15 -1.348 16.445 6.528 114 HD2 LYS 15 HD2 LYS 15 0.490 16.934 7.722 115 HD3 LYS 15 HD3 LYS 15 1.490 17.012 6.266 116 HE2 LYS 15 HE2 LYS 15 1.519 19.155 7.364 117 HE3 LYS 15 HE3 LYS 15 0.641 19.275 5.839 118 HZ1 LYS 15 HZ1 LYS 15 -0.454 20.441 7.710 119 HZ2 LYS 15 HZ2 LYS 15 -0.665 18.954 8.490 120 HZ3 LYS 15 HZ3 LYS 15 -1.430 19.250 7.011 121 H ASN 16 H ASN 16 -0.677 17.303 2.234 122 HA ASN 16 HA ASN 16 -0.475 15.982 -0.181 123 HB2 ASN 16 HB2 ASN 16 1.189 17.918 -0.670 124 HB3 ASN 16 HB3 ASN 16 -0.472 18.310 -0.245 125 HD21 ASN 16 HD21 ASN 16 2.823 18.268 0.920 126 HD22 ASN 16 HD22 ASN 16 2.557 19.349 2.236 127 H GLY 17 H GLY 17 0.455 13.935 0.701 128 HA2 GLY 17 HA2 GLY 17 2.495 12.956 -0.530 129 HA3 GLY 17 HA3 GLY 17 3.418 13.961 0.571 130 H MET 18 H MET 18 1.302 13.282 2.697 131 HA MET 18 HA MET 18 2.826 11.417 4.100 132 HB2 MET 18 HB2 MET 18 0.026 12.457 4.390 133 HB3 MET 18 HB3 MET 18 0.542 11.122 5.409 134 HG2 MET 18 HG2 MET 18 2.019 13.738 5.230 135 HG3 MET 18 HG3 MET 18 0.765 13.399 6.422 136 HE1 MET 18 HE1 MET 18 1.377 10.227 6.862 137 HE2 MET 18 HE2 MET 18 0.922 11.349 8.144 138 HE3 MET 18 HE3 MET 18 2.355 10.336 8.325 139 H THR 19 H THR 19 -0.260 10.793 2.404 140 HA THR 19 HA THR 19 -0.474 8.071 2.977 141 HB THR 19 HB THR 19 -1.925 7.923 0.979 142 HG1 THR 19 HG1 THR 19 -2.207 10.008 -0.175 143 HG21 THR 19 HG21 THR 19 -2.322 10.440 2.613 144 HG22 THR 19 HG22 THR 19 -2.887 8.822 3.033 145 HG23 THR 19 HG23 THR 19 -3.562 9.657 1.633 146 H ASN 20 H ASN 20 1.454 9.708 0.539 147 HA ASN 20 HA ASN 20 2.137 7.332 -0.928 148 HB2 ASN 20 HB2 ASN 20 3.430 10.075 -0.892 149 HB3 ASN 20 HB3 ASN 20 3.815 8.792 -2.035 150 HD21 ASN 20 HD21 ASN 20 2.385 8.327 -3.675 151 HD22 ASN 20 HD22 ASN 20 1.073 9.372 -4.086 152 H GLN 21 H GLN 21 3.808 9.392 1.446 153 HA GLN 21 HA GLN 21 6.228 7.935 1.394 154 HB2 GLN 21 HB2 GLN 21 6.946 9.280 3.214 155 HB3 GLN 21 HB3 GLN 21 5.979 10.305 2.174 156 HG2 GLN 21 HG2 GLN 21 4.111 10.152 3.703 157 HG3 GLN 21 HG3 GLN 21 4.997 9.010 4.712 158 HE21 GLN 21 HE21 GLN 21 4.793 12.336 3.671 159 HE22 GLN 21 HE22 GLN 21 5.766 12.985 4.936 160 H ILE 22 H ILE 22 3.348 7.677 3.394 161 HA ILE 22 HA ILE 22 4.361 6.093 5.461 162 HB ILE 22 HB ILE 22 1.609 6.483 4.320 163 HG12 ILE 22 HG12 ILE 22 2.578 8.287 5.658 164 HG13 ILE 22 HG13 ILE 22 1.221 7.555 6.506 165 HG21 ILE 22 HG21 ILE 22 0.665 5.189 6.195 166 HG22 ILE 22 HG22 ILE 22 2.290 4.641 6.615 167 HG23 ILE 22 HG23 ILE 22 1.575 4.185 5.068 168 HD11 ILE 22 HD11 ILE 22 2.768 6.288 7.898 169 HD12 ILE 22 HD12 ILE 22 3.054 8.024 8.017 170 HD13 ILE 22 HD13 ILE 22 4.130 7.019 7.048 171 H THR 23 H THR 23 2.577 4.979 2.549 172 HA THR 23 HA THR 23 3.106 2.233 3.155 173 HB THR 23 HB THR 23 2.229 3.309 0.458 174 HG1 THR 23 HG1 THR 23 0.434 3.851 1.452 175 HG21 THR 23 HG21 THR 23 2.913 0.948 0.487 176 HG22 THR 23 HG22 THR 23 1.174 1.105 0.237 177 HG23 THR 23 HG23 THR 23 1.799 0.641 1.819 178 H GLY 24 H GLY 24 4.700 4.709 1.270 179 HA2 GLY 24 HA2 GLY 24 6.559 3.147 -0.148 180 HA3 GLY 24 HA3 GLY 24 6.824 4.797 0.395 181 H VAL 25 H VAL 25 6.662 4.389 3.177 182 HA VAL 25 HA VAL 25 9.225 3.371 3.846 183 HB VAL 25 HB VAL 25 6.843 4.079 5.579 184 HG11 VAL 25 HG11 VAL 25 8.382 4.056 7.494 185 HG12 VAL 25 HG12 VAL 25 9.657 3.412 6.459 186 HG13 VAL 25 HG13 VAL 25 8.211 2.453 6.778 187 HG21 VAL 25 HG21 VAL 25 7.832 5.949 4.376 188 HG22 VAL 25 HG22 VAL 25 9.429 5.525 4.994 189 HG23 VAL 25 HG23 VAL 25 8.173 6.080 6.102 190 H ILE 26 H ILE 26 5.960 2.034 4.137 191 HA ILE 26 HA ILE 26 6.481 -0.313 5.523 192 HB ILE 26 HB ILE 26 4.465 0.254 3.348 193 HG12 ILE 26 HG12 ILE 26 4.205 0.079 6.367 194 HG13 ILE 26 HG13 ILE 26 4.246 1.568 5.429 195 HG21 ILE 26 HG21 ILE 26 4.605 -2.162 5.156 196 HG22 ILE 26 HG22 ILE 26 4.843 -2.149 3.408 197 HG23 ILE 26 HG23 ILE 26 3.263 -1.758 4.084 198 HD11 ILE 26 HD11 ILE 26 2.158 0.900 4.322 199 HD12 ILE 26 HD12 ILE 26 1.987 1.030 6.073 200 HD13 ILE 26 HD13 ILE 26 2.117 -0.558 5.317 201 H SER 27 H SER 27 6.655 0.225 2.001 202 HA SER 27 HA SER 27 7.279 -2.404 1.241 203 HB2 SER 27 HB2 SER 27 8.018 -1.499 -0.870 204 HB3 SER 27 HB3 SER 27 6.637 -0.547 -0.328 205 HG SER 27 HG SER 27 7.953 1.125 0.152 206 H LYS 28 H LYS 28 9.235 -0.079 2.851 207 HA LYS 28 HA LYS 28 11.786 -1.091 1.962 208 HB2 LYS 28 HB2 LYS 28 11.177 0.768 4.273 209 HB3 LYS 28 HB3 LYS 28 12.747 0.512 3.520 210 HG2 LYS 28 HG2 LYS 28 11.877 1.469 1.421 211 HG3 LYS 28 HG3 LYS 28 10.326 1.755 2.212 212 HD2 LYS 28 HD2 LYS 28 11.626 3.803 2.171 213 HD3 LYS 28 HD3 LYS 28 11.441 3.241 3.833 214 HE2 LYS 28 HE2 LYS 28 13.714 4.011 3.447 215 HE3 LYS 28 HE3 LYS 28 13.701 2.274 3.741 216 HZ1 LYS 28 HZ1 LYS 28 13.918 3.602 1.094 217 HZ2 LYS 28 HZ2 LYS 28 13.834 1.929 1.332 218 HZ3 LYS 28 HZ3 LYS 28 15.159 2.798 1.917 219 H PHE 29 H PHE 29 9.557 -2.330 4.121 220 HA PHE 29 HA PHE 29 11.238 -3.074 6.306 221 HB2 PHE 29 HB2 PHE 29 8.577 -4.201 5.405 222 HB3 PHE 29 HB3 PHE 29 9.374 -4.619 6.917 223 HD1 PHE 29 HD2 PHE 29 10.250 -1.366 6.760 224 HD2 PHE 29 HD1 PHE 29 6.708 -3.713 7.118 225 HE1 PHE 29 HE2 PHE 29 9.118 0.509 7.878 226 HE2 PHE 29 HE1 PHE 29 5.580 -1.838 8.236 227 HZ PHE 29 HZ PHE 29 6.786 0.274 8.619 228 H ASP 30 H ASP 30 11.596 -5.384 6.957 229 HA ASP 30 HA ASP 30 12.881 -6.851 4.811 230 HB2 ASP 30 HB2 ASP 30 12.622 -7.605 7.732 231 HB3 ASP 30 HB3 ASP 30 13.753 -8.286 6.567 232 H THR 31 H THR 31 9.781 -6.694 5.329 233 HA THR 31 HA THR 31 9.286 -9.600 5.164 234 HB THR 31 HB THR 31 8.495 -8.953 7.315 235 HG1 THR 31 HG1 THR 31 6.993 -10.295 6.524 236 HG21 THR 31 HG21 THR 31 6.980 -6.716 5.960 237 HG22 THR 31 HG22 THR 31 8.393 -6.536 7.002 238 HG23 THR 31 HG23 THR 31 6.877 -7.141 7.670 239 H ASN 32 H ASN 32 7.377 -10.245 3.998 240 HA ASN 32 HA ASN 32 6.996 -8.559 1.646 241 HB2 ASN 32 HB2 ASN 32 7.587 -10.866 1.221 242 HB3 ASN 32 HB3 ASN 32 6.237 -11.435 2.198 243 HD21 ASN 32 HD21 ASN 32 7.102 -9.781 -0.767 244 HD22 ASN 32 HD22 ASN 32 5.616 -10.102 -1.589 245 H ILE 33 H ILE 33 5.180 -7.498 1.155 246 HA ILE 33 HA ILE 33 3.105 -7.196 3.070 247 HB ILE 33 HB ILE 33 3.168 -6.297 0.177 248 HG12 ILE 33 HG12 ILE 33 3.884 -4.793 2.717 249 HG13 ILE 33 HG13 ILE 33 5.037 -5.400 1.533 250 HG21 ILE 33 HG21 ILE 33 1.405 -5.385 2.460 251 HG22 ILE 33 HG22 ILE 33 0.891 -6.339 1.069 252 HG23 ILE 33 HG23 ILE 33 1.441 -4.679 0.843 253 HD11 ILE 33 HD11 ILE 33 4.112 -3.898 -0.146 254 HD12 ILE 33 HD12 ILE 33 4.661 -3.015 1.279 255 HD13 ILE 33 HD13 ILE 33 2.939 -3.299 1.028 256 H ARG 34 H ARG 34 1.600 -8.712 3.463 257 HA ARG 34 HA ARG 34 0.687 -10.490 1.338 258 HB2 ARG 34 HB2 ARG 34 -0.296 -10.379 4.198 259 HB3 ARG 34 HB3 ARG 34 -0.462 -11.710 3.060 260 HG2 ARG 34 HG2 ARG 34 2.050 -10.748 4.416 261 HG3 ARG 34 HG3 ARG 34 1.233 -12.298 4.619 262 HD2 ARG 34 HD2 ARG 34 2.633 -11.322 2.124 263 HD3 ARG 34 HD3 ARG 34 3.231 -12.543 3.244 264 HE ARG 34 HE ARG 34 1.138 -13.817 2.544 265 HH11 ARG 34 HH11 ARG 34 2.829 -11.647 0.476 266 HH12 ARG 34 HH12 ARG 34 2.360 -12.481 -0.963 267 HH21 ARG 34 HH21 ARG 34 0.568 -14.895 0.671 268 HH22 ARG 34 HH22 ARG 34 1.124 -14.301 -0.853 269 H THR 35 H THR 35 -0.514 -7.848 3.319 270 HA THR 35 HA THR 35 -2.487 -7.186 1.318 271 HB THR 35 HB THR 35 -3.423 -7.884 4.119 272 HG1 THR 35 HG1 THR 35 -3.554 -9.189 1.642 273 HG21 THR 35 HG21 THR 35 -4.978 -6.784 1.767 274 HG22 THR 35 HG22 THR 35 -4.602 -5.924 3.260 275 HG23 THR 35 HG23 THR 35 -5.675 -7.323 3.296 276 H ILE 36 H ILE 36 -2.673 -5.006 1.195 277 HA ILE 36 HA ILE 36 -2.158 -3.399 3.615 278 HB ILE 36 HB ILE 36 -0.160 -3.289 2.136 279 HG12 ILE 36 HG12 ILE 36 -0.055 -0.782 1.975 280 HG13 ILE 36 HG13 ILE 36 -1.763 -0.731 2.398 281 HG21 ILE 36 HG21 ILE 36 -1.212 -3.601 -0.028 282 HG22 ILE 36 HG22 ILE 36 -0.289 -2.096 -0.013 283 HG23 ILE 36 HG23 ILE 36 -2.047 -2.055 0.132 284 HD11 ILE 36 HD11 ILE 36 0.461 -1.816 4.110 285 HD12 ILE 36 HD12 ILE 36 -1.249 -1.787 4.543 286 HD13 ILE 36 HD13 ILE 36 -0.370 -0.275 4.320 287 H VAL 37 H VAL 37 -3.750 -1.969 4.044 288 HA VAL 37 HA VAL 37 -5.563 -1.169 1.848 289 HB VAL 37 HB VAL 37 -6.433 -1.935 4.648 290 HG11 VAL 37 HG11 VAL 37 -8.726 -1.625 3.789 291 HG12 VAL 37 HG12 VAL 37 -8.064 -1.021 2.270 292 HG13 VAL 37 HG13 VAL 37 -7.799 -0.126 3.767 293 HG21 VAL 37 HG21 VAL 37 -6.892 -3.345 2.014 294 HG22 VAL 37 HG22 VAL 37 -7.605 -3.807 3.560 295 HG23 VAL 37 HG23 VAL 37 -5.858 -3.902 3.330 296 H LEU 38 H LEU 38 -4.978 0.924 1.609 297 HA LEU 38 HA LEU 38 -5.031 2.672 3.991 298 HB2 LEU 38 HB2 LEU 38 -2.905 2.657 2.700 299 HB3 LEU 38 HB3 LEU 38 -3.776 3.188 1.277 300 HG LEU 38 HG LEU 38 -3.755 4.871 3.787 301 HD11 LEU 38 HD11 LEU 38 -1.837 6.106 2.893 302 HD12 LEU 38 HD12 LEU 38 -1.688 4.932 1.583 303 HD13 LEU 38 HD13 LEU 38 -1.416 4.430 3.252 304 HD21 LEU 38 HD21 LEU 38 -4.074 5.562 0.858 305 HD22 LEU 38 HD22 LEU 38 -4.089 6.714 2.194 306 HD23 LEU 38 HD23 LEU 38 -5.363 5.505 2.060 307 H ASN 39 H ASN 39 -6.687 4.074 4.180 308 HA ASN 39 HA ASN 39 -7.858 5.248 1.800 309 HB2 ASN 39 HB2 ASN 39 -10.230 4.762 2.734 310 HB3 ASN 39 HB3 ASN 39 -9.395 3.507 1.833 311 HD21 ASN 39 HD21 ASN 39 -8.527 4.269 5.136 312 HD22 ASN 39 HD22 ASN 39 -9.148 2.814 5.810 313 H ALA 40 H ALA 40 -8.650 7.255 2.075 314 HA ALA 40 HA ALA 40 -8.284 8.511 4.704 315 HB1 ALA 40 HB1 ALA 40 -7.168 9.563 2.794 316 HB2 ALA 40 HB2 ALA 40 -8.393 10.635 3.472 317 HB3 ALA 40 HB3 ALA 40 -8.718 9.759 1.975 318 H LYS 41 H LYS 41 -9.910 9.747 5.672 319 HA LYS 41 HA LYS 41 -12.625 8.940 4.890 320 HB2 LYS 41 HB2 LYS 41 -11.377 8.004 6.988 321 HB3 LYS 41 HB3 LYS 41 -11.852 9.532 7.707 322 HG2 LYS 41 HG2 LYS 41 -13.917 8.803 8.070 323 HG3 LYS 41 HG3 LYS 41 -14.095 8.290 6.390 324 HD2 LYS 41 HD2 LYS 41 -14.346 6.390 7.928 325 HD3 LYS 41 HD3 LYS 41 -12.928 6.196 6.887 326 HE2 LYS 41 HE2 LYS 41 -12.361 5.568 9.160 327 HE3 LYS 41 HE3 LYS 41 -11.503 7.048 8.725 328 HZ1 LYS 41 HZ1 LYS 41 -12.425 7.175 10.946 329 HZ2 LYS 41 HZ2 LYS 41 -13.985 6.904 10.355 330 HZ3 LYS 41 HZ3 LYS 41 -13.156 8.318 9.938 331 H ASP 42 H ASP 42 -11.456 11.172 7.268 332 HA ASP 42 HA ASP 42 -12.745 13.433 5.911 333 HB2 ASP 42 HB2 ASP 42 -14.336 12.631 7.593 334 HB3 ASP 42 HB3 ASP 42 -13.088 12.715 8.835 335 H GLY 43 H GLY 43 -10.567 13.980 5.328 336 HA2 GLY 43 HA2 GLY 43 -8.657 15.255 5.588 337 HA3 GLY 43 HA3 GLY 43 -9.244 15.716 7.177 338 H ILE 44 H ILE 44 -9.279 12.450 7.269 339 HA ILE 44 HA ILE 44 -6.453 12.191 8.099 340 HB ILE 44 HB ILE 44 -8.566 10.463 9.345 341 HG12 ILE 44 HG12 ILE 44 -7.978 13.300 10.236 342 HG13 ILE 44 HG13 ILE 44 -9.512 12.684 9.638 343 HG21 ILE 44 HG21 ILE 44 -5.992 11.648 10.394 344 HG22 ILE 44 HG22 ILE 44 -6.200 10.014 9.762 345 HG23 ILE 44 HG23 ILE 44 -7.024 10.496 11.245 346 HD11 ILE 44 HD11 ILE 44 -8.143 11.823 12.171 347 HD12 ILE 44 HD12 ILE 44 -9.686 11.215 11.572 348 HD13 ILE 44 HD13 ILE 44 -9.532 12.905 12.055 349 H PHE 45 H PHE 45 -5.608 9.972 7.888 350 HA PHE 45 HA PHE 45 -7.205 8.225 6.131 351 HB2 PHE 45 HB2 PHE 45 -5.383 7.762 4.667 352 HB3 PHE 45 HB3 PHE 45 -5.452 9.514 4.812 353 HD1 PHE 45 HD2 PHE 45 -3.722 10.732 6.038 354 HD2 PHE 45 HD1 PHE 45 -3.527 6.502 5.557 355 HE1 PHE 45 HE2 PHE 45 -1.360 10.760 6.724 356 HE2 PHE 45 HE1 PHE 45 -1.168 6.530 6.246 357 HZ PHE 45 HZ PHE 45 -0.091 8.659 6.834 358 H THR 46 H THR 46 -7.086 6.071 6.586 359 HA THR 46 HA THR 46 -5.132 5.247 8.647 360 HB THR 46 HB THR 46 -7.328 5.084 9.618 361 HG1 THR 46 HG1 THR 46 -5.820 3.363 10.027 362 HG21 THR 46 HG21 THR 46 -8.091 3.292 7.307 363 HG22 THR 46 HG22 THR 46 -8.659 4.944 7.552 364 HG23 THR 46 HG23 THR 46 -9.097 3.680 8.702 365 H CYS 47 H CYS 47 -3.580 4.022 7.871 366 HA CYS 47 HA CYS 47 -4.121 2.198 5.614 367 HB2 CYS 47 HB2 CYS 47 -2.272 3.808 5.311 368 HB3 CYS 47 HB3 CYS 47 -1.470 3.156 6.735 369 HG CYS 47 HG CYS 47 -0.657 2.359 3.888 370 H ASN 48 H ASN 48 -4.291 0.063 6.006 371 HA ASN 48 HA ASN 48 -3.319 -0.999 8.581 372 HB2 ASN 48 HB2 ASN 48 -5.396 -2.149 6.696 373 HB3 ASN 48 HB3 ASN 48 -4.865 -2.897 8.197 374 HD21 ASN 48 HD21 ASN 48 -7.498 -2.276 7.604 375 HD22 ASN 48 HD22 ASN 48 -8.046 -1.076 8.715 376 H LEU 49 H LEU 49 -1.469 -2.094 8.483 377 HA LEU 49 HA LEU 49 -0.620 -3.306 5.950 378 HB2 LEU 49 HB2 LEU 49 0.981 -1.803 6.942 379 HB3 LEU 49 HB3 LEU 49 0.896 -2.652 8.475 380 HG LEU 49 HG LEU 49 1.933 -4.635 7.447 381 HD11 LEU 49 HD11 LEU 49 2.908 -4.461 5.186 382 HD12 LEU 49 HD12 LEU 49 2.066 -2.927 4.962 383 HD13 LEU 49 HD13 LEU 49 1.147 -4.416 5.181 384 HD21 LEU 49 HD21 LEU 49 3.492 -2.082 7.021 385 HD22 LEU 49 HD22 LEU 49 4.180 -3.702 7.141 386 HD23 LEU 49 HD23 LEU 49 3.360 -2.988 8.529 387 H MET 50 H MET 50 -0.651 -5.427 5.634 388 HA MET 50 HA MET 50 -0.700 -7.237 7.970 389 HB2 MET 50 HB2 MET 50 -1.940 -7.759 5.260 390 HB3 MET 50 HB3 MET 50 -2.037 -8.795 6.678 391 HG2 MET 50 HG2 MET 50 -3.283 -6.078 6.321 392 HG3 MET 50 HG3 MET 50 -4.107 -7.631 6.412 393 HE1 MET 50 HE1 MET 50 -3.906 -9.203 8.657 394 HE2 MET 50 HE2 MET 50 -3.212 -8.614 10.167 395 HE3 MET 50 HE3 MET 50 -2.169 -8.903 8.774 396 H ILE 51 H ILE 51 1.221 -8.156 8.162 397 HA ILE 51 HA ILE 51 2.562 -9.309 5.811 398 HB ILE 51 HB ILE 51 4.780 -8.441 6.799 399 HG12 ILE 51 HG12 ILE 51 4.381 -6.093 7.870 400 HG13 ILE 51 HG13 ILE 51 2.781 -6.716 8.263 401 HG21 ILE 51 HG21 ILE 51 3.905 -7.686 4.671 402 HG22 ILE 51 HG22 ILE 51 4.631 -6.339 5.547 403 HG23 ILE 51 HG23 ILE 51 2.876 -6.508 5.485 404 HD11 ILE 51 HD11 ILE 51 3.776 -8.496 9.565 405 HD12 ILE 51 HD12 ILE 51 4.354 -6.924 10.116 406 HD13 ILE 51 HD13 ILE 51 5.392 -7.945 9.118 407 H PHE 52 H PHE 52 4.640 -10.579 6.663 408 HA PHE 52 HA PHE 52 3.765 -12.115 9.032 409 HB2 PHE 52 HB2 PHE 52 5.135 -12.929 6.499 410 HB3 PHE 52 HB3 PHE 52 5.470 -13.844 7.964 411 HD1 PHE 52 HD2 PHE 52 3.705 -15.141 9.061 412 HD2 PHE 52 HD1 PHE 52 2.983 -13.053 5.420 413 HE1 PHE 52 HE2 PHE 52 1.646 -16.445 8.724 414 HE2 PHE 52 HE1 PHE 52 0.928 -14.357 5.076 415 HZ PHE 52 HZ PHE 52 0.255 -16.056 6.728 416 H VAL 53 H VAL 53 5.227 -12.669 10.648 417 HA VAL 53 HA VAL 53 7.949 -11.585 10.531 418 HB VAL 53 HB VAL 53 7.806 -10.444 12.667 419 HG11 VAL 53 HG11 VAL 53 5.596 -9.527 10.833 420 HG12 VAL 53 HG12 VAL 53 7.294 -9.049 10.758 421 HG13 VAL 53 HG13 VAL 53 6.301 -8.572 12.137 422 HG21 VAL 53 HG21 VAL 53 4.882 -11.180 12.683 423 HG22 VAL 53 HG22 VAL 53 5.690 -10.134 13.852 424 HG23 VAL 53 HG23 VAL 53 6.130 -11.837 13.741 425 H LYS 54 H LYS 54 9.405 -12.775 11.751 426 HA LYS 54 HA LYS 54 8.642 -15.348 12.651 427 HB2 LYS 54 HB2 LYS 54 11.180 -13.837 13.260 428 HB3 LYS 54 HB3 LYS 54 10.931 -15.566 13.472 429 HG2 LYS 54 HG2 LYS 54 10.607 -15.807 11.061 430 HG3 LYS 54 HG3 LYS 54 10.887 -14.074 10.860 431 HD2 LYS 54 HD2 LYS 54 13.115 -14.527 12.098 432 HD3 LYS 54 HD3 LYS 54 12.819 -16.218 11.686 433 HE2 LYS 54 HE2 LYS 54 12.864 -13.956 9.717 434 HE3 LYS 54 HE3 LYS 54 14.240 -15.004 10.055 435 HZ1 LYS 54 HZ1 LYS 54 13.072 -15.749 8.089 436 HZ2 LYS 54 HZ2 LYS 54 11.617 -15.859 8.940 437 HZ3 LYS 54 HZ3 LYS 54 12.896 -16.898 9.315 438 H ASN 55 H ASN 55 9.404 -12.356 14.348 439 HA ASN 55 HA ASN 55 8.616 -13.591 16.905 440 HB2 ASN 55 HB2 ASN 55 10.934 -11.673 16.544 441 HB3 ASN 55 HB3 ASN 55 10.489 -12.545 18.010 442 HD21 ASN 55 HD21 ASN 55 11.999 -12.794 14.870 443 HD22 ASN 55 HD22 ASN 55 12.690 -14.354 15.115 444 H THR 56 H THR 56 7.636 -12.192 18.430 445 HA THR 56 HA THR 56 6.046 -10.105 17.379 446 HB THR 56 HB THR 56 5.406 -9.578 19.693 447 HG1 THR 56 HG1 THR 56 7.698 -11.118 20.278 448 HG21 THR 56 HG21 THR 56 4.550 -11.793 20.351 449 HG22 THR 56 HG22 THR 56 5.628 -12.550 19.178 450 HG23 THR 56 HG23 THR 56 4.330 -11.490 18.628 451 H ASP 57 H ASP 57 9.228 -10.107 18.744 452 HA ASP 57 HA ASP 57 9.464 -7.349 19.390 453 HB2 ASP 57 HB2 ASP 57 11.735 -9.143 18.497 454 HB3 ASP 57 HB3 ASP 57 11.799 -7.782 19.614 455 H LYS 58 H LYS 58 10.184 -9.268 16.520 456 HA LYS 58 HA LYS 58 11.180 -7.286 14.832 457 HB2 LYS 58 HB2 LYS 58 11.360 -9.598 14.229 458 HB3 LYS 58 HB3 LYS 58 9.620 -9.821 14.306 459 HG2 LYS 58 HG2 LYS 58 10.374 -9.780 12.010 460 HG3 LYS 58 HG3 LYS 58 9.342 -8.391 12.361 461 HD2 LYS 58 HD2 LYS 58 11.312 -6.958 12.578 462 HD3 LYS 58 HD3 LYS 58 12.370 -8.344 12.308 463 HE2 LYS 58 HE2 LYS 58 12.124 -6.969 10.287 464 HE3 LYS 58 HE3 LYS 58 11.494 -8.598 10.049 465 HZ1 LYS 58 HZ1 LYS 58 9.313 -7.843 10.123 466 HZ2 LYS 58 HZ2 LYS 58 10.114 -6.660 9.209 467 HZ3 LYS 58 HZ3 LYS 58 9.733 -6.362 10.828 468 H LEU 59 H LEU 59 7.884 -8.062 15.765 469 HA LEU 59 HA LEU 59 6.622 -6.394 13.793 470 HB2 LEU 59 HB2 LEU 59 5.391 -8.254 14.659 471 HB3 LEU 59 HB3 LEU 59 5.628 -7.723 16.313 472 HG LEU 59 HG LEU 59 4.158 -5.800 15.931 473 HD11 LEU 59 HD11 LEU 59 2.850 -5.629 13.856 474 HD12 LEU 59 HD12 LEU 59 3.827 -6.914 13.146 475 HD13 LEU 59 HD13 LEU 59 4.575 -5.378 13.588 476 HD21 LEU 59 HD21 LEU 59 3.170 -7.851 16.756 477 HD22 LEU 59 HD22 LEU 59 2.949 -8.440 15.108 478 HD23 LEU 59 HD23 LEU 59 2.045 -7.034 15.673 479 H THR 60 H THR 60 7.237 -6.051 17.309 480 HA THR 60 HA THR 60 6.103 -3.496 17.627 481 HB THR 60 HB THR 60 7.470 -3.264 19.654 482 HG1 THR 60 HG1 THR 60 9.105 -4.715 20.112 483 HG21 THR 60 HG21 THR 60 6.411 -6.073 19.273 484 HG22 THR 60 HG22 THR 60 5.479 -4.671 19.797 485 HG23 THR 60 HG23 THR 60 6.758 -5.313 20.827 486 H THR 61 H THR 61 9.230 -4.505 16.444 487 HA THR 61 HA THR 61 10.539 -2.012 16.448 488 HB THR 61 HB THR 61 10.932 -4.322 14.521 489 HG1 THR 61 HG1 THR 61 11.233 -4.735 16.851 490 HG21 THR 61 HG21 THR 61 11.946 -2.245 13.686 491 HG22 THR 61 HG22 THR 61 13.185 -3.403 14.172 492 HG23 THR 61 HG23 THR 61 12.793 -2.038 15.218 493 H LEU 62 H LEU 62 8.399 -3.526 14.057 494 HA LEU 62 HA LEU 62 8.756 -1.668 11.972 495 HB2 LEU 62 HB2 LEU 62 6.317 -3.314 12.669 496 HB3 LEU 62 HB3 LEU 62 6.534 -2.444 11.162 497 HG LEU 62 HG LEU 62 8.145 -4.806 12.138 498 HD11 LEU 62 HD11 LEU 62 6.287 -4.451 9.787 499 HD12 LEU 62 HD12 LEU 62 5.969 -5.396 11.243 500 HD13 LEU 62 HD13 LEU 62 7.242 -5.894 10.130 501 HD21 LEU 62 HD21 LEU 62 8.532 -3.132 9.652 502 HD22 LEU 62 HD22 LEU 62 9.359 -4.650 10.004 503 HD23 LEU 62 HD23 LEU 62 9.636 -3.239 11.024 504 H MET 63 H MET 63 6.527 -1.677 14.728 505 HA MET 63 HA MET 63 4.996 0.570 14.133 506 HB2 MET 63 HB2 MET 63 6.053 -0.212 16.863 507 HB3 MET 63 HB3 MET 63 4.664 0.819 16.544 508 HG2 MET 63 HG2 MET 63 3.453 -1.035 15.591 509 HG3 MET 63 HG3 MET 63 4.864 -2.081 15.763 510 HE1 MET 63 HE1 MET 63 3.463 -3.875 17.006 511 HE2 MET 63 HE2 MET 63 1.985 -2.907 16.933 512 HE3 MET 63 HE3 MET 63 2.523 -3.587 18.470 513 H ASP 64 H ASP 64 8.014 0.441 16.021 514 HA ASP 64 HA ASP 64 8.390 3.149 16.487 515 HB2 ASP 64 HB2 ASP 64 9.677 1.345 17.550 516 HB3 ASP 64 HB3 ASP 64 10.459 1.000 16.021 517 H LYS 65 H LYS 65 9.282 1.228 13.662 518 HA LYS 65 HA LYS 65 10.722 3.219 12.258 519 HB2 LYS 65 HB2 LYS 65 9.188 0.790 11.329 520 HB3 LYS 65 HB3 LYS 65 10.132 1.793 10.235 521 HG2 LYS 65 HG2 LYS 65 12.155 1.291 11.527 522 HG3 LYS 65 HG3 LYS 65 11.202 0.293 12.626 523 HD2 LYS 65 HD2 LYS 65 12.374 -1.082 10.978 524 HD3 LYS 65 HD3 LYS 65 10.626 -1.207 10.779 525 HE2 LYS 65 HE2 LYS 65 11.726 -1.021 8.614 526 HE3 LYS 65 HE3 LYS 65 10.722 0.392 8.923 527 HZ1 LYS 65 HZ1 LYS 65 13.674 0.250 9.230 528 HZ2 LYS 65 HZ2 LYS 65 12.724 1.606 9.560 529 HZ3 LYS 65 HZ3 LYS 65 12.836 1.021 7.979 530 H LEU 66 H LEU 66 7.284 2.364 12.279 531 HA LEU 66 HA LEU 66 6.531 4.286 10.273 532 HB2 LEU 66 HB2 LEU 66 4.885 2.713 12.263 533 HB3 LEU 66 HB3 LEU 66 4.220 3.654 10.937 534 HG LEU 66 HG LEU 66 6.119 1.337 10.526 535 HD11 LEU 66 HD11 LEU 66 4.122 0.487 11.607 536 HD12 LEU 66 HD12 LEU 66 4.141 0.013 9.909 537 HD13 LEU 66 HD13 LEU 66 3.102 1.333 10.445 538 HD21 LEU 66 HD21 LEU 66 4.260 2.789 8.636 539 HD22 LEU 66 HD22 LEU 66 5.285 1.412 8.228 540 HD23 LEU 66 HD23 LEU 66 6.018 2.948 8.688 541 H ARG 67 H ARG 67 6.746 4.278 13.758 542 HA ARG 67 HA ARG 67 5.094 6.550 14.242 543 HB2 ARG 67 HB2 ARG 67 7.205 5.223 15.971 544 HB3 ARG 67 HB3 ARG 67 6.097 6.481 16.530 545 HG2 ARG 67 HG2 ARG 67 4.200 4.980 15.909 546 HG3 ARG 67 HG3 ARG 67 5.377 3.721 15.553 547 HD2 ARG 67 HD2 ARG 67 4.654 3.252 17.726 548 HD3 ARG 67 HD3 ARG 67 6.206 4.062 17.948 549 HE ARG 67 HE ARG 67 4.094 5.938 18.016 550 HH11 ARG 67 HH11 ARG 67 5.569 3.465 19.907 551 HH12 ARG 67 HH12 ARG 67 5.019 4.136 21.404 552 HH21 ARG 67 HH21 ARG 67 3.433 6.808 19.936 553 HH22 ARG 67 HH22 ARG 67 3.830 6.012 21.420 554 H LYS 68 H LYS 68 8.127 6.323 12.862 555 HA LYS 68 HA LYS 68 9.390 8.659 13.903 556 HB2 LYS 68 HB2 LYS 68 9.802 7.119 11.331 557 HB3 LYS 68 HB3 LYS 68 10.827 8.456 11.839 558 HG2 LYS 68 HG2 LYS 68 10.420 5.899 13.382 559 HG3 LYS 68 HG3 LYS 68 11.800 6.258 12.340 560 HD2 LYS 68 HD2 LYS 68 12.352 8.192 13.762 561 HD3 LYS 68 HD3 LYS 68 10.992 7.794 14.816 562 HE2 LYS 68 HE2 LYS 68 13.333 5.983 14.246 563 HE3 LYS 68 HE3 LYS 68 13.158 6.987 15.685 564 HZ1 LYS 68 HZ1 LYS 68 11.156 5.762 16.249 565 HZ2 LYS 68 HZ2 LYS 68 12.470 4.710 16.104 566 HZ3 LYS 68 HZ3 LYS 68 11.318 4.802 14.871 567 H VAL 69 H VAL 69 6.694 8.338 11.925 568 HA VAL 69 HA VAL 69 7.249 10.687 10.285 569 HB VAL 69 HB VAL 69 4.811 8.899 10.284 570 HG11 VAL 69 HG11 VAL 69 5.782 10.939 8.274 571 HG12 VAL 69 HG12 VAL 69 4.369 11.096 9.320 572 HG13 VAL 69 HG13 VAL 69 4.398 9.866 8.057 573 HG21 VAL 69 HG21 VAL 69 5.825 7.812 8.332 574 HG22 VAL 69 HG22 VAL 69 6.856 7.643 9.756 575 HG23 VAL 69 HG23 VAL 69 7.261 8.824 8.509 576 H GLN 70 H GLN 70 6.719 12.632 10.932 577 HA GLN 70 HA GLN 70 5.391 13.238 13.322 578 HB2 GLN 70 HB2 GLN 70 5.496 15.584 12.537 579 HB3 GLN 70 HB3 GLN 70 7.023 14.732 12.344 580 HG2 GLN 70 HG2 GLN 70 6.352 14.328 9.937 581 HG3 GLN 70 HG3 GLN 70 5.031 15.464 10.208 582 HE21 GLN 70 HE21 GLN 70 8.476 15.090 9.919 583 HE22 GLN 70 HE22 GLN 70 8.841 16.768 9.745 584 H GLY 71 H GLY 71 4.123 12.844 10.087 585 HA2 GLY 71 HA2 GLY 71 1.656 14.231 10.532 586 HA3 GLY 71 HA3 GLY 71 2.021 13.163 9.190 587 H VAL 72 H VAL 72 2.731 11.074 11.420 588 HA VAL 72 HA VAL 72 -0.005 10.038 11.635 589 HB VAL 72 HB VAL 72 2.636 8.692 12.252 590 HG11 VAL 72 HG11 VAL 72 1.330 6.609 12.342 591 HG12 VAL 72 HG12 VAL 72 -0.159 7.534 12.147 592 HG13 VAL 72 HG13 VAL 72 0.826 7.743 13.595 593 HG21 VAL 72 HG21 VAL 72 2.220 7.423 10.190 594 HG22 VAL 72 HG22 VAL 72 2.369 9.152 9.874 595 HG23 VAL 72 HG23 VAL 72 0.777 8.392 9.889 596 H PHE 73 H PHE 73 -1.060 9.699 13.551 597 HA PHE 73 HA PHE 73 0.400 10.391 16.017 598 HB2 PHE 73 HB2 PHE 73 -2.097 11.003 16.777 599 HB3 PHE 73 HB3 PHE 73 -1.008 12.158 16.034 600 HD1 PHE 73 HD2 PHE 73 -1.357 12.949 13.780 601 HD2 PHE 73 HD1 PHE 73 -4.021 10.123 15.545 602 HE1 PHE 73 HE2 PHE 73 -3.008 13.406 12.017 603 HE2 PHE 73 HE1 PHE 73 -5.674 10.585 13.778 604 HZ PHE 73 HZ PHE 73 -5.166 12.227 12.015 605 H THR 74 H THR 74 -1.447 7.962 14.446 606 HA THR 74 HA THR 74 -1.380 6.429 16.975 607 HB THR 74 HB THR 74 -3.450 5.394 16.634 608 HG1 THR 74 HG1 THR 74 -3.613 4.805 14.572 609 HG21 THR 74 HG21 THR 74 -5.100 7.173 16.354 610 HG22 THR 74 HG22 THR 74 -3.878 8.211 15.621 611 HG23 THR 74 HG23 THR 74 -3.739 7.749 17.319 612 H VAL 75 H VAL 75 -0.137 4.703 16.830 613 HA VAL 75 HA VAL 75 -0.079 3.156 14.317 614 HB VAL 75 HB VAL 75 2.312 3.719 16.102 615 HG11 VAL 75 HG11 VAL 75 2.362 1.451 15.180 616 HG12 VAL 75 HG12 VAL 75 3.624 2.463 14.480 617 HG13 VAL 75 HG13 VAL 75 2.166 2.106 13.552 618 HG21 VAL 75 HG21 VAL 75 1.741 5.648 14.722 619 HG22 VAL 75 HG22 VAL 75 1.735 4.635 13.278 620 HG23 VAL 75 HG23 VAL 75 3.239 4.904 14.159 621 H GLU 76 H GLU 76 -1.199 1.354 14.863 622 HA GLU 76 HA GLU 76 -0.760 0.167 17.543 623 HB2 GLU 76 HB2 GLU 76 -3.382 0.331 16.034 624 HB3 GLU 76 HB3 GLU 76 -3.146 -0.382 17.623 625 HG2 GLU 76 HG2 GLU 76 -2.707 2.531 16.970 626 HG3 GLU 76 HG3 GLU 76 -4.186 1.868 17.661 627 H ARG 77 H ARG 77 -1.418 -2.110 17.738 628 HA ARG 77 HA ARG 77 -0.831 -3.667 15.322 629 HB2 ARG 77 HB2 ARG 77 0.501 -4.373 17.137 630 HB3 ARG 77 HB3 ARG 77 -0.842 -4.310 18.268 631 HG2 ARG 77 HG2 ARG 77 -1.828 -6.280 17.305 632 HG3 ARG 77 HG3 ARG 77 -0.639 -6.292 16.001 633 HD2 ARG 77 HD2 ARG 77 1.129 -6.830 17.518 634 HD3 ARG 77 HD3 ARG 77 0.095 -6.550 18.917 635 HE ARG 77 HE ARG 77 -0.450 -8.747 18.767 636 HH11 ARG 77 HH11 ARG 77 0.164 -7.678 15.535 637 HH12 ARG 77 HH12 ARG 77 -0.233 -9.214 14.853 638 HH21 ARG 77 HH21 ARG 77 -0.907 -10.692 17.867 639 HH22 ARG 77 HH22 ARG 77 -0.802 -10.903 16.153 640 H LEU 78 H LEU 78 -2.345 -4.825 14.261 641 HA LEU 78 HA LEU 78 -5.077 -4.912 15.278 642 HB2 LEU 78 HB2 LEU 78 -3.903 -5.851 12.653 643 HB3 LEU 78 HB3 LEU 78 -5.608 -5.908 13.058 644 HG LEU 78 HG LEU 78 -3.957 -3.382 12.816 645 HD11 LEU 78 HD11 LEU 78 -6.040 -4.543 10.960 646 HD12 LEU 78 HD12 LEU 78 -4.306 -4.435 10.648 647 HD13 LEU 78 HD13 LEU 78 -5.268 -2.965 10.789 648 HD21 LEU 78 HD21 LEU 78 -6.922 -3.759 13.273 649 HD22 LEU 78 HD22 LEU 78 -6.108 -2.218 12.997 650 HD23 LEU 78 HD23 LEU 78 -5.756 -3.152 14.450 651 H SER 79 H SER 79 -5.335 -6.445 16.815 652 HA SER 79 HA SER 79 -4.020 -9.017 16.670 653 HB2 SER 79 HB2 SER 79 -5.296 -9.483 18.774 654 HB3 SER 79 HB3 SER 79 -4.322 -8.015 18.851 655 HG SER 79 HG SER 79 -6.256 -7.397 19.622 656 H ASN 80 H ASN 80 -7.473 -8.091 16.893 657 HA ASN 80 HA ASN 80 -8.389 -10.642 16.013 658 HB2 ASN 80 HB2 ASN 80 -10.626 -9.523 15.868 659 HB3 ASN 80 HB3 ASN 80 -9.823 -9.313 17.420 660 HD21 ASN 80 HD21 ASN 80 -11.012 -7.751 14.593 661 HD22 ASN 80 HD22 ASN 80 -10.731 -6.130 15.114 662 H LEU 81 H LEU 81 -7.913 -11.363 14.026 663 HA LEU 81 HA LEU 81 -8.072 -9.488 11.753 664 HB2 LEU 81 HB2 LEU 81 -6.597 -12.119 11.967 665 HB3 LEU 81 HB3 LEU 81 -6.632 -11.091 10.547 666 HG LEU 81 HG LEU 81 -5.361 -10.452 13.213 667 HD11 LEU 81 HD11 LEU 81 -4.153 -10.830 10.467 668 HD12 LEU 81 HD12 LEU 81 -4.097 -12.002 11.786 669 HD13 LEU 81 HD13 LEU 81 -3.279 -10.450 11.954 670 HD21 LEU 81 HD21 LEU 81 -6.370 -8.432 12.315 671 HD22 LEU 81 HD22 LEU 81 -5.608 -8.717 10.750 672 HD23 LEU 81 HD23 LEU 81 -4.615 -8.352 12.162 673 H GLU 82 H GLU 82 -9.133 -10.036 9.869 674 HA GLU 82 HA GLU 82 -11.208 -12.081 10.054 675 HB2 GLU 82 HB2 GLU 82 -12.116 -11.004 8.055 676 HB3 GLU 82 HB3 GLU 82 -11.746 -9.793 9.278 677 HG2 GLU 82 HG2 GLU 82 -9.467 -9.611 8.009 678 HG3 GLU 82 HG3 GLU 82 -10.366 -10.350 6.686 679 H HIS 83 H HIS 83 -8.181 -12.476 9.488 680 HA HIS 83 HA HIS 83 -8.136 -13.497 6.770 681 HB2 HIS 83 HB2 HIS 83 -5.987 -13.349 8.892 682 HB3 HIS 83 HB3 HIS 83 -5.725 -13.919 7.247 683 HD1 HIS 83 HD1 HIS 83 -4.821 -12.177 5.744 684 HD2 HIS 83 HD2 HIS 83 -7.058 -10.525 8.829 685 HE1 HIS 83 HE1 HIS 83 -4.627 -9.693 5.464 686 HE2 HIS 83 HE2 HIS 83 -6.170 -8.729 7.200 687 H HIS 84 H HIS 84 -9.614 -15.267 7.022 688 HA HIS 84 HA HIS 84 -8.945 -17.485 8.704 689 HB2 HIS 84 HB2 HIS 84 -10.632 -18.710 7.183 690 HB3 HIS 84 HB3 HIS 84 -11.224 -17.387 8.178 691 HD1 HIS 84 HD1 HIS 84 -10.342 -18.183 4.585 692 HD2 HIS 84 HD2 HIS 84 -12.381 -15.310 6.793 693 HE1 HIS 84 HE1 HIS 84 -11.526 -16.751 2.899 694 HE2 HIS 84 HE2 HIS 84 -12.708 -14.991 4.249 695 H HIS 85 H HIS 85 -6.761 -17.879 8.240 696 HA HIS 85 HA HIS 85 -6.076 -18.829 5.539 697 HB2 HIS 85 HB2 HIS 85 -4.661 -17.069 6.581 698 HB3 HIS 85 HB3 HIS 85 -4.266 -18.179 7.885 699 HD1 HIS 85 HD1 HIS 85 -2.329 -19.737 7.503 700 HD2 HIS 85 HD2 HIS 85 -3.565 -17.854 4.013 701 HE1 HIS 85 HE1 HIS 85 -0.569 -20.263 5.797 702 HE2 HIS 85 HE2 HIS 85 -1.243 -18.961 3.756 703 H HIS 86 H HIS 86 -6.780 -20.935 5.443 704 HA HIS 86 HA HIS 86 -5.515 -22.859 7.282 705 HB2 HIS 86 HB2 HIS 86 -8.466 -22.845 6.573 706 HB3 HIS 86 HB3 HIS 86 -7.645 -24.134 7.448 707 HD1 HIS 86 HD1 HIS 86 -7.023 -23.687 9.913 708 HD2 HIS 86 HD2 HIS 86 -8.999 -20.534 8.067 709 HE1 HIS 86 HE1 HIS 86 -7.710 -22.143 11.769 710 HE2 HIS 86 HE2 HIS 86 -9.046 -20.333 10.639 711 H HIS 87 H HIS 87 -6.351 -25.214 6.407 712 HA HIS 87 HA HIS 87 -6.169 -25.223 3.459 713 HB2 HIS 87 HB2 HIS 87 -4.825 -27.290 3.571 714 HB3 HIS 87 HB3 HIS 87 -4.004 -25.940 4.344 715 HD1 HIS 87 HD1 HIS 87 -5.714 -29.191 5.135 716 HD2 HIS 87 HD2 HIS 87 -3.508 -26.245 7.062 717 HE1 HIS 87 HE1 HIS 87 -5.151 -30.140 7.385 718 HE2 HIS 87 HE2 HIS 87 -3.713 -28.394 8.485 719 H HIS 88 H HIS 88 -7.600 -26.549 2.416 720 HA HIS 88 HA HIS 88 -9.340 -28.224 4.126 721 HB2 HIS 88 HB2 HIS 88 -10.390 -26.138 3.135 722 HB3 HIS 88 HB3 HIS 88 -10.184 -26.877 1.551 723 HD1 HIS 88 HD1 HIS 88 -11.476 -29.266 1.282 724 HD2 HIS 88 HD2 HIS 88 -12.715 -26.802 4.381 725 HE1 HIS 88 HE1 HIS 88 -13.728 -30.124 1.954 726 HE2 HIS 88 HE2 HIS 88 -14.551 -28.475 3.658 727 H1 MET 1 H1 MET 1 -13.759 19.491 -9.995 728 H2 MET 1 H2 MET 1 -12.190 19.234 -10.578 729 H3 MET 1 H3 MET 1 -13.338 17.993 -10.659 730 HA MET 1 HA MET 1 -14.664 19.197 -12.209 731 HB2 MET 1 HB2 MET 1 -13.626 21.336 -13.200 732 HB3 MET 1 HB3 MET 1 -14.417 21.442 -11.636 733 HG2 MET 1 HG2 MET 1 -12.196 21.309 -10.548 734 HG3 MET 1 HG3 MET 1 -11.449 21.329 -12.145 735 HE1 MET 1 HE1 MET 1 -13.369 23.362 -13.716 736 HE2 MET 1 HE2 MET 1 -11.610 23.411 -13.825 737 HE3 MET 1 HE3 MET 1 -12.513 24.882 -13.464 738 H THR 2 H THR 2 -11.305 20.135 -13.058 739 HA THR 2 HA THR 2 -11.268 18.314 -15.281 740 HB THR 2 HB THR 2 -9.940 20.416 -15.288 741 HG1 THR 2 HG1 THR 2 -8.531 17.951 -15.589 742 HG21 THR 2 HG21 THR 2 -9.218 20.428 -12.944 743 HG22 THR 2 HG22 THR 2 -7.838 20.548 -14.033 744 HG23 THR 2 HG23 THR 2 -8.203 19.013 -13.246 745 H ASP 3 H ASP 3 -10.371 18.257 -11.981 746 HA ASP 3 HA ASP 3 -8.844 15.800 -12.103 747 HB2 ASP 3 HB2 ASP 3 -8.674 16.150 -9.635 748 HB3 ASP 3 HB3 ASP 3 -8.100 17.523 -10.576 749 H PHE 4 H PHE 4 -9.494 13.829 -11.250 750 HA PHE 4 HA PHE 4 -12.000 13.560 -9.838 751 HB2 PHE 4 HB2 PHE 4 -12.960 11.895 -11.369 752 HB3 PHE 4 HB3 PHE 4 -12.789 13.460 -12.151 753 HD1 PHE 4 HD1 PHE 4 -11.612 9.996 -12.051 754 HD2 PHE 4 HD2 PHE 4 -11.195 13.780 -13.971 755 HE1 PHE 4 HE1 PHE 4 -10.368 8.927 -13.883 756 HE2 PHE 4 HE2 PHE 4 -9.954 12.710 -15.808 757 HZ PHE 4 HZ PHE 4 -9.527 10.278 -15.757 758 H LEU 5 H LEU 5 -12.294 11.423 -8.927 759 HA LEU 5 HA LEU 5 -9.788 10.229 -8.154 760 HB2 LEU 5 HB2 LEU 5 -11.638 10.552 -6.554 761 HB3 LEU 5 HB3 LEU 5 -12.627 9.447 -7.484 762 HG LEU 5 HG LEU 5 -11.129 7.593 -6.931 763 HD11 LEU 5 HD11 LEU 5 -9.307 7.887 -5.315 764 HD12 LEU 5 HD12 LEU 5 -9.570 9.632 -5.338 765 HD13 LEU 5 HD13 LEU 5 -9.019 8.804 -6.794 766 HD21 LEU 5 HD21 LEU 5 -11.973 9.178 -4.504 767 HD22 LEU 5 HD22 LEU 5 -11.606 7.453 -4.537 768 HD23 LEU 5 HD23 LEU 5 -12.991 8.075 -5.431 769 H ALA 6 H ALA 6 -8.812 9.004 -9.662 770 HA ALA 6 HA ALA 6 -10.375 7.210 -11.364 771 HB1 ALA 6 HB1 ALA 6 -7.434 7.897 -11.438 772 HB2 ALA 6 HB2 ALA 6 -8.696 8.641 -12.420 773 HB3 ALA 6 HB3 ALA 6 -8.306 6.934 -12.633 774 H GLY 7 H GLY 7 -9.988 4.973 -11.507 775 HA2 GLY 7 HA2 GLY 7 -8.582 3.800 -9.179 776 HA3 GLY 7 HA3 GLY 7 -10.092 3.170 -9.810 777 H ILE 8 H ILE 8 -7.262 2.079 -9.477 778 HA ILE 8 HA ILE 8 -7.107 0.813 -12.143 779 HB ILE 8 HB ILE 8 -4.707 1.416 -10.382 780 HG12 ILE 8 HG12 ILE 8 -5.574 2.773 -12.954 781 HG13 ILE 8 HG13 ILE 8 -5.634 3.492 -11.349 782 HG21 ILE 8 HG21 ILE 8 -4.888 0.312 -13.191 783 HG22 ILE 8 HG22 ILE 8 -4.437 -0.588 -11.743 784 HG23 ILE 8 HG23 ILE 8 -3.393 0.702 -12.339 785 HD11 ILE 8 HD11 ILE 8 -3.144 2.650 -12.819 786 HD12 ILE 8 HD12 ILE 8 -3.196 3.360 -11.205 787 HD13 ILE 8 HD13 ILE 8 -3.724 4.300 -12.601 788 H ARG 9 H ARG 9 -6.569 -1.423 -12.119 789 HA ARG 9 HA ARG 9 -6.406 -2.702 -9.466 790 HB2 ARG 9 HB2 ARG 9 -8.694 -2.943 -10.333 791 HB3 ARG 9 HB3 ARG 9 -8.067 -3.652 -11.814 792 HG2 ARG 9 HG2 ARG 9 -7.182 -5.549 -10.522 793 HG3 ARG 9 HG3 ARG 9 -7.850 -4.843 -9.049 794 HD2 ARG 9 HD2 ARG 9 -10.102 -5.012 -9.973 795 HD3 ARG 9 HD3 ARG 9 -9.448 -5.657 -11.478 796 HE ARG 9 HE ARG 9 -9.329 -7.054 -8.881 797 HH11 ARG 9 HH11 ARG 9 -9.569 -7.065 -12.321 798 HH12 ARG 9 HH12 ARG 9 -9.674 -8.789 -12.416 799 HH21 ARG 9 HH21 ARG 9 -9.525 -9.253 -9.006 800 HH22 ARG 9 HH22 ARG 9 -9.645 -10.022 -10.553 801 H ILE 10 H ILE 10 -4.607 -3.870 -9.289 802 HA ILE 10 HA ILE 10 -3.264 -4.837 -11.748 803 HB ILE 10 HB ILE 10 -2.010 -4.253 -9.053 804 HG12 ILE 10 HG12 ILE 10 -1.886 -2.516 -11.536 805 HG13 ILE 10 HG13 ILE 10 -2.955 -2.205 -10.170 806 HG21 ILE 10 HG21 ILE 10 -0.749 -5.864 -10.350 807 HG22 ILE 10 HG22 ILE 10 0.116 -4.329 -10.296 808 HG23 ILE 10 HG23 ILE 10 -0.765 -4.792 -11.752 809 HD11 ILE 10 HD11 ILE 10 -0.992 -0.823 -10.025 810 HD12 ILE 10 HD12 ILE 10 0.054 -2.241 -10.112 811 HD13 ILE 10 HD13 ILE 10 -0.990 -1.999 -8.711 812 H VAL 11 H VAL 11 -3.481 -7.044 -11.990 813 HA VAL 11 HA VAL 11 -3.230 -8.674 -9.534 814 HB VAL 11 HB VAL 11 -4.771 -9.270 -12.061 815 HG11 VAL 11 HG11 VAL 11 -5.216 -11.508 -11.171 816 HG12 VAL 11 HG12 VAL 11 -4.114 -11.201 -9.829 817 HG13 VAL 11 HG13 VAL 11 -3.493 -11.282 -11.478 818 HG21 VAL 11 HG21 VAL 11 -5.931 -7.975 -10.325 819 HG22 VAL 11 HG22 VAL 11 -5.568 -9.235 -9.140 820 HG23 VAL 11 HG23 VAL 11 -6.637 -9.583 -10.501 821 H GLY 12 H GLY 12 -1.319 -9.506 -9.305 822 HA2 GLY 12 HA2 GLY 12 0.063 -10.682 -11.637 823 HA3 GLY 12 HA3 GLY 12 0.931 -9.611 -10.544 824 H GLU 13 H GLU 13 1.996 -12.043 -10.845 825 HA GLU 13 HA GLU 13 0.932 -14.065 -9.152 826 HB2 GLU 13 HB2 GLU 13 3.077 -15.203 -9.499 827 HB3 GLU 13 HB3 GLU 13 2.413 -14.591 -11.008 828 HG2 GLU 13 HG2 GLU 13 3.944 -12.636 -10.824 829 HG3 GLU 13 HG3 GLU 13 4.668 -13.393 -9.406 830 H ASP 14 H ASP 14 1.188 -14.469 -7.028 831 HA ASP 14 HA ASP 14 2.330 -12.469 -5.339 832 HB2 ASP 14 HB2 ASP 14 0.364 -13.575 -4.561 833 HB3 ASP 14 HB3 ASP 14 1.095 -15.164 -4.763 834 H LYS 15 H LYS 15 4.566 -12.492 -6.024 835 HA LYS 15 HA LYS 15 6.121 -14.654 -4.832 836 HB2 LYS 15 HB2 LYS 15 6.602 -12.688 -6.978 837 HB3 LYS 15 HB3 LYS 15 7.994 -13.102 -5.980 838 HG2 LYS 15 HG2 LYS 15 7.772 -15.406 -6.481 839 HG3 LYS 15 HG3 LYS 15 6.231 -15.134 -7.304 840 HD2 LYS 15 HD2 LYS 15 7.286 -13.976 -9.090 841 HD3 LYS 15 HD3 LYS 15 8.823 -13.897 -8.217 842 HE2 LYS 15 HE2 LYS 15 8.783 -15.634 -9.969 843 HE3 LYS 15 HE3 LYS 15 9.082 -16.267 -8.352 844 HZ1 LYS 15 HZ1 LYS 15 6.822 -17.012 -8.219 845 HZ2 LYS 15 HZ2 LYS 15 7.495 -17.608 -9.654 846 HZ3 LYS 15 HZ3 LYS 15 6.442 -16.293 -9.701 847 H ASN 16 H ASN 16 7.849 -14.330 -3.525 848 HA ASN 16 HA ASN 16 7.639 -12.471 -1.447 849 HB2 ASN 16 HB2 ASN 16 10.050 -13.265 -0.975 850 HB3 ASN 16 HB3 ASN 16 8.755 -14.452 -0.939 851 HD21 ASN 16 HD21 ASN 16 10.076 -13.195 -3.956 852 HD22 ASN 16 HD22 ASN 16 10.850 -14.663 -4.418 853 H GLY 17 H GLY 17 7.369 -10.595 -2.969 854 HA2 GLY 17 HA2 GLY 17 9.165 -8.626 -2.577 855 HA3 GLY 17 HA3 GLY 17 9.821 -9.414 -4.003 856 H MET 18 H MET 18 7.284 -10.087 -5.176 857 HA MET 18 HA MET 18 6.835 -7.876 -6.796 858 HB2 MET 18 HB2 MET 18 5.205 -10.332 -6.188 859 HB3 MET 18 HB3 MET 18 4.566 -9.095 -7.262 860 HG2 MET 18 HG2 MET 18 7.219 -10.456 -7.679 861 HG3 MET 18 HG3 MET 18 5.704 -11.012 -8.393 862 HE1 MET 18 HE1 MET 18 4.705 -7.904 -10.584 863 HE2 MET 18 HE2 MET 18 4.301 -8.117 -8.881 864 HE3 MET 18 HE3 MET 18 4.209 -9.487 -9.987 865 H THR 19 H THR 19 4.774 -8.946 -4.074 866 HA THR 19 HA THR 19 2.860 -6.915 -4.237 867 HB THR 19 HB THR 19 2.377 -7.412 -1.848 868 HG1 THR 19 HG1 THR 19 3.690 -8.914 -0.764 869 HG21 THR 19 HG21 THR 19 2.892 -9.855 -3.562 870 HG22 THR 19 HG22 THR 19 1.427 -8.870 -3.566 871 HG23 THR 19 HG23 THR 19 1.855 -9.810 -2.136 872 H ASN 20 H ASN 20 6.058 -6.904 -2.789 873 HA ASN 20 HA ASN 20 5.715 -4.431 -1.370 874 HB2 ASN 20 HB2 ASN 20 8.240 -5.930 -2.129 875 HB3 ASN 20 HB3 ASN 20 8.168 -4.565 -1.018 876 HD21 ASN 20 HD21 ASN 20 7.463 -4.891 1.056 877 HD22 ASN 20 HD22 ASN 20 7.160 -6.457 1.714 878 H GLN 21 H GLN 21 7.377 -5.394 -4.369 879 HA GLN 21 HA GLN 21 8.393 -2.834 -4.978 880 HB2 GLN 21 HB2 GLN 21 9.014 -3.725 -7.105 881 HB3 GLN 21 HB3 GLN 21 9.269 -4.982 -5.912 882 HG2 GLN 21 HG2 GLN 21 7.254 -6.110 -6.611 883 HG3 GLN 21 HG3 GLN 21 6.864 -4.795 -7.715 884 HE21 GLN 21 HE21 GLN 21 8.934 -7.535 -7.161 885 HE22 GLN 21 HE22 GLN 21 9.547 -7.631 -8.770 886 H ILE 22 H ILE 22 5.418 -4.486 -5.898 887 HA ILE 22 HA ILE 22 4.570 -2.764 -7.935 888 HB ILE 22 HB ILE 22 3.122 -4.644 -6.088 889 HG12 ILE 22 HG12 ILE 22 4.474 -5.623 -7.866 890 HG13 ILE 22 HG13 ILE 22 2.767 -5.887 -8.207 891 HG21 ILE 22 HG21 ILE 22 1.057 -4.319 -7.393 892 HG22 ILE 22 HG22 ILE 22 1.809 -2.958 -8.228 893 HG23 ILE 22 HG23 ILE 22 1.512 -2.873 -6.492 894 HD11 ILE 22 HD11 ILE 22 4.521 -3.792 -9.462 895 HD12 ILE 22 HD12 ILE 22 2.804 -4.024 -9.791 896 HD13 ILE 22 HD13 ILE 22 3.962 -5.284 -10.217 897 H THR 23 H THR 23 3.562 -2.745 -4.491 898 HA THR 23 HA THR 23 2.097 -0.314 -4.813 899 HB THR 23 HB THR 23 3.063 -1.466 -2.178 900 HG1 THR 23 HG1 THR 23 1.851 -3.100 -2.920 901 HG21 THR 23 HG21 THR 23 2.172 0.828 -2.065 902 HG22 THR 23 HG22 THR 23 1.109 -0.322 -1.257 903 HG23 THR 23 HG23 THR 23 0.692 0.285 -2.859 904 H GLY 24 H GLY 24 5.397 -1.103 -3.967 905 HA2 GLY 24 HA2 GLY 24 6.281 1.404 -3.048 906 HA3 GLY 24 HA3 GLY 24 7.276 0.220 -3.882 907 H VAL 25 H VAL 25 6.218 0.121 -6.387 908 HA VAL 25 HA VAL 25 7.089 2.437 -7.704 909 HB VAL 25 HB VAL 25 5.156 0.319 -8.694 910 HG11 VAL 25 HG11 VAL 25 5.718 1.079 -10.954 911 HG12 VAL 25 HG12 VAL 25 6.707 2.375 -10.282 912 HG13 VAL 25 HG13 VAL 25 4.963 2.370 -10.018 913 HG21 VAL 25 HG21 VAL 25 7.324 -0.609 -8.080 914 HG22 VAL 25 HG22 VAL 25 8.146 0.604 -9.061 915 HG23 VAL 25 HG23 VAL 25 7.132 -0.616 -9.833 916 H ILE 26 H ILE 26 3.857 1.450 -6.690 917 HA ILE 26 HA ILE 26 2.412 3.598 -7.808 918 HB ILE 26 HB ILE 26 1.828 1.860 -5.406 919 HG12 ILE 26 HG12 ILE 26 0.782 1.796 -8.256 920 HG13 ILE 26 HG13 ILE 26 1.959 0.682 -7.568 921 HG21 ILE 26 HG21 ILE 26 -0.003 3.805 -6.813 922 HG22 ILE 26 HG22 ILE 26 0.607 3.942 -5.164 923 HG23 ILE 26 HG23 ILE 26 -0.500 2.638 -5.588 924 HD11 ILE 26 HD11 ILE 26 0.268 -0.138 -6.009 925 HD12 ILE 26 HD12 ILE 26 -0.243 -0.322 -7.687 926 HD13 ILE 26 HD13 ILE 26 -0.910 0.979 -6.700 927 H SER 27 H SER 27 3.940 3.228 -4.615 928 HA SER 27 HA SER 27 2.884 5.609 -3.495 929 HB2 SER 27 HB2 SER 27 4.471 5.318 -1.688 930 HB3 SER 27 HB3 SER 27 3.837 3.737 -2.139 931 HG SER 27 HG SER 27 5.834 3.678 -3.536 932 H LYS 28 H LYS 28 5.514 5.088 -5.673 933 HA LYS 28 HA LYS 28 6.673 7.723 -5.106 934 HB2 LYS 28 HB2 LYS 28 8.539 7.027 -6.521 935 HB3 LYS 28 HB3 LYS 28 8.225 5.829 -5.274 936 HG2 LYS 28 HG2 LYS 28 6.913 4.542 -7.006 937 HG3 LYS 28 HG3 LYS 28 7.563 5.660 -8.205 938 HD2 LYS 28 HD2 LYS 28 9.185 3.874 -6.380 939 HD3 LYS 28 HD3 LYS 28 8.874 3.590 -8.093 940 HE2 LYS 28 HE2 LYS 28 10.070 5.661 -8.647 941 HE3 LYS 28 HE3 LYS 28 10.389 5.935 -6.933 942 HZ1 LYS 28 HZ1 LYS 28 11.649 3.872 -6.878 943 HZ2 LYS 28 HZ2 LYS 28 12.285 4.927 -8.036 944 HZ3 LYS 28 HZ3 LYS 28 11.340 3.612 -8.520 945 H PHE 29 H PHE 29 4.094 6.890 -6.792 946 HA PHE 29 HA PHE 29 4.519 8.038 -9.347 947 HB2 PHE 29 HB2 PHE 29 2.056 7.567 -7.690 948 HB3 PHE 29 HB3 PHE 29 1.950 8.495 -9.179 949 HD1 PHE 29 HD1 PHE 29 4.212 6.712 -10.526 950 HD2 PHE 29 HD2 PHE 29 0.515 5.908 -8.556 951 HE1 PHE 29 HE1 PHE 29 3.974 4.634 -11.820 952 HE2 PHE 29 HE2 PHE 29 0.282 3.824 -9.846 953 HZ PHE 29 HZ PHE 29 2.013 3.189 -11.480 954 H ASP 30 H ASP 30 3.005 10.004 -9.945 955 HA ASP 30 HA ASP 30 4.167 12.316 -8.659 956 HB2 ASP 30 HB2 ASP 30 2.037 12.632 -10.723 957 HB3 ASP 30 HB3 ASP 30 3.602 13.431 -10.591 958 H THR 31 H THR 31 1.189 10.596 -8.538 959 HA THR 31 HA THR 31 -0.347 12.860 -7.490 960 HB THR 31 HB THR 31 -1.405 11.589 -9.261 961 HG1 THR 31 HG1 THR 31 -3.331 11.569 -8.291 962 HG21 THR 31 HG21 THR 31 -1.167 9.200 -7.425 963 HG22 THR 31 HG22 THR 31 -0.300 9.440 -8.943 964 HG23 THR 31 HG23 THR 31 -2.052 9.235 -8.951 965 H ASN 32 H ASN 32 -2.002 12.230 -5.730 966 HA ASN 32 HA ASN 32 -0.504 11.011 -3.511 967 HB2 ASN 32 HB2 ASN 32 -1.322 13.359 -3.263 968 HB3 ASN 32 HB3 ASN 32 -2.975 12.762 -3.393 969 HD21 ASN 32 HD21 ASN 32 -0.155 12.952 -1.399 970 HD22 ASN 32 HD22 ASN 32 -0.898 12.371 0.048 971 H ILE 33 H ILE 33 -1.196 9.207 -2.481 972 HA ILE 33 HA ILE 33 -3.311 7.662 -3.717 973 HB ILE 33 HB ILE 33 -1.541 6.945 -1.367 974 HG12 ILE 33 HG12 ILE 33 -1.212 6.264 -4.305 975 HG13 ILE 33 HG13 ILE 33 -0.248 7.444 -3.422 976 HG21 ILE 33 HG21 ILE 33 -3.558 5.577 -1.465 977 HG22 ILE 33 HG22 ILE 33 -2.144 4.620 -1.903 978 HG23 ILE 33 HG23 ILE 33 -3.239 5.197 -3.159 979 HD11 ILE 33 HD11 ILE 33 -0.353 4.484 -2.885 980 HD12 ILE 33 HD12 ILE 33 0.601 5.662 -1.982 981 HD13 ILE 33 HD13 ILE 33 0.952 5.362 -3.684 982 H ARG 34 H ARG 34 -5.372 8.213 -3.127 983 HA ARG 34 HA ARG 34 -5.949 8.864 -0.343 984 HB2 ARG 34 HB2 ARG 34 -7.280 9.332 -2.912 985 HB3 ARG 34 HB3 ARG 34 -8.396 8.848 -1.640 986 HG2 ARG 34 HG2 ARG 34 -8.175 11.281 -1.771 987 HG3 ARG 34 HG3 ARG 34 -7.613 10.660 -0.217 988 HD2 ARG 34 HD2 ARG 34 -5.270 10.674 -1.302 989 HD3 ARG 34 HD3 ARG 34 -6.000 11.716 -2.524 990 HE ARG 34 HE ARG 34 -6.048 12.398 0.347 991 HH11 ARG 34 HH11 ARG 34 -5.355 13.239 -2.922 992 HH12 ARG 34 HH12 ARG 34 -4.938 14.866 -2.526 993 HH21 ARG 34 HH21 ARG 34 -5.491 14.449 0.844 994 HH22 ARG 34 HH22 ARG 34 -5.015 15.548 -0.404 995 H THR 35 H THR 35 -6.267 6.166 -2.496 996 HA THR 35 HA THR 35 -6.904 4.491 -0.217 997 HB THR 35 HB THR 35 -8.712 4.290 -2.634 998 HG1 THR 35 HG1 THR 35 -8.981 5.753 -0.257 999 HG21 THR 35 HG21 THR 35 -10.037 2.794 -1.219 1000 HG22 THR 35 HG22 THR 35 -8.873 2.995 0.091 1001 HG23 THR 35 HG23 THR 35 -8.389 2.194 -1.404 1002 H ILE 36 H ILE 36 -6.134 2.406 -0.457 1003 HA ILE 36 HA ILE 36 -5.719 1.269 -3.055 1004 HB ILE 36 HB ILE 36 -3.668 2.656 -2.794 1005 HG12 ILE 36 HG12 ILE 36 -3.061 -0.311 -2.763 1006 HG13 ILE 36 HG13 ILE 36 -3.779 0.524 -4.139 1007 HG21 ILE 36 HG21 ILE 36 -1.910 1.926 -1.224 1008 HG22 ILE 36 HG22 ILE 36 -3.050 0.796 -0.492 1009 HG23 ILE 36 HG23 ILE 36 -3.344 2.533 -0.392 1010 HD11 ILE 36 HD11 ILE 36 -1.806 1.965 -4.271 1011 HD12 ILE 36 HD12 ILE 36 -1.408 0.256 -4.458 1012 HD13 ILE 36 HD13 ILE 36 -1.082 1.075 -2.931 1013 H VAL 37 H VAL 37 -6.036 -0.865 -2.959 1014 HA VAL 37 HA VAL 37 -5.652 -2.237 -0.369 1015 HB VAL 37 HB VAL 37 -7.978 -2.676 -2.263 1016 HG11 VAL 37 HG11 VAL 37 -7.359 -3.942 0.412 1017 HG12 VAL 37 HG12 VAL 37 -7.315 -4.743 -1.159 1018 HG13 VAL 37 HG13 VAL 37 -8.848 -4.165 -0.506 1019 HG21 VAL 37 HG21 VAL 37 -8.210 -0.573 -1.048 1020 HG22 VAL 37 HG22 VAL 37 -7.922 -1.406 0.480 1021 HG23 VAL 37 HG23 VAL 37 -9.373 -1.760 -0.458 1022 H LEU 38 H LEU 38 -3.873 -3.437 -0.819 1023 HA LEU 38 HA LEU 38 -3.945 -5.223 -3.173 1024 HB2 LEU 38 HB2 LEU 38 -1.921 -3.805 -2.936 1025 HB3 LEU 38 HB3 LEU 38 -1.613 -4.512 -1.365 1026 HG LEU 38 HG LEU 38 -1.655 -6.207 -3.874 1027 HD11 LEU 38 HD11 LEU 38 0.725 -4.775 -2.681 1028 HD12 LEU 38 HD12 LEU 38 -0.010 -4.455 -4.253 1029 HD13 LEU 38 HD13 LEU 38 0.793 -5.997 -3.953 1030 HD21 LEU 38 HD21 LEU 38 -0.365 -6.582 -1.163 1031 HD22 LEU 38 HD22 LEU 38 -0.181 -7.673 -2.536 1032 HD23 LEU 38 HD23 LEU 38 -1.763 -7.455 -1.792 1033 H ASN 39 H ASN 39 -4.502 -7.296 -2.824 1034 HA ASN 39 HA ASN 39 -3.735 -8.523 -0.266 1035 HB2 ASN 39 HB2 ASN 39 -5.893 -9.715 -0.133 1036 HB3 ASN 39 HB3 ASN 39 -6.091 -7.970 -0.027 1037 HD21 ASN 39 HD21 ASN 39 -6.946 -6.858 -1.841 1038 HD22 ASN 39 HD22 ASN 39 -7.900 -7.690 -3.013 1039 H ALA 40 H ALA 40 -2.502 -10.202 -0.603 1040 HA ALA 40 HA ALA 40 -2.571 -11.664 -3.140 1041 HB1 ALA 40 HB1 ALA 40 -0.388 -10.964 -2.266 1042 HB2 ALA 40 HB2 ALA 40 -0.502 -12.722 -2.342 1043 HB3 ALA 40 HB3 ALA 40 -0.665 -11.893 -0.793 1044 H LYS 41 H LYS 41 -3.961 -13.276 -3.281 1045 HA LYS 41 HA LYS 41 -4.474 -14.985 -0.928 1046 HB2 LYS 41 HB2 LYS 41 -6.811 -15.108 -1.564 1047 HB3 LYS 41 HB3 LYS 41 -6.346 -13.417 -1.399 1048 HG2 LYS 41 HG2 LYS 41 -6.042 -13.332 -3.875 1049 HG3 LYS 41 HG3 LYS 41 -6.707 -14.967 -3.956 1050 HD2 LYS 41 HD2 LYS 41 -8.794 -14.165 -2.948 1051 HD3 LYS 41 HD3 LYS 41 -8.123 -12.535 -2.844 1052 HE2 LYS 41 HE2 LYS 41 -7.931 -12.452 -5.285 1053 HE3 LYS 41 HE3 LYS 41 -8.582 -14.089 -5.397 1054 HZ1 LYS 41 HZ1 LYS 41 -9.998 -11.686 -4.388 1055 HZ2 LYS 41 HZ2 LYS 41 -10.621 -13.253 -4.323 1056 HZ3 LYS 41 HZ3 LYS 41 -10.319 -12.530 -5.818 1057 H ASP 42 H ASP 42 -4.335 -17.129 -1.269 1058 HA ASP 42 HA ASP 42 -4.303 -19.167 -2.246 1059 HB2 ASP 42 HB2 ASP 42 -6.342 -18.329 -3.446 1060 HB3 ASP 42 HB3 ASP 42 -5.294 -17.847 -4.778 1061 H GLY 43 H GLY 43 -2.724 -16.558 -3.956 1062 HA2 GLY 43 HA2 GLY 43 -0.265 -17.482 -4.368 1063 HA3 GLY 43 HA3 GLY 43 -1.141 -18.349 -5.621 1064 H ILE 44 H ILE 44 -2.872 -15.656 -5.488 1065 HA ILE 44 HA ILE 44 -1.069 -14.055 -7.212 1066 HB ILE 44 HB ILE 44 -4.039 -13.946 -7.618 1067 HG12 ILE 44 HG12 ILE 44 -2.250 -16.104 -8.771 1068 HG13 ILE 44 HG13 ILE 44 -3.585 -16.342 -7.653 1069 HG21 ILE 44 HG21 ILE 44 -3.384 -13.439 -9.923 1070 HG22 ILE 44 HG22 ILE 44 -1.690 -13.697 -9.505 1071 HG23 ILE 44 HG23 ILE 44 -2.583 -12.361 -8.780 1072 HD11 ILE 44 HD11 ILE 44 -5.159 -15.592 -9.323 1073 HD12 ILE 44 HD12 ILE 44 -4.180 -16.920 -9.949 1074 HD13 ILE 44 HD13 ILE 44 -3.838 -15.260 -10.444 1075 H PHE 45 H PHE 45 -1.600 -11.702 -7.226 1076 HA PHE 45 HA PHE 45 -3.078 -10.869 -4.803 1077 HB2 PHE 45 HB2 PHE 45 -1.470 -9.177 -4.282 1078 HB3 PHE 45 HB3 PHE 45 -0.589 -10.680 -4.496 1079 HD1 PHE 45 HD2 PHE 45 -1.334 -7.394 -5.971 1080 HD2 PHE 45 HD1 PHE 45 1.036 -10.923 -6.251 1081 HE1 PHE 45 HE2 PHE 45 0.137 -6.271 -7.585 1082 HE2 PHE 45 HE1 PHE 45 2.514 -9.798 -7.865 1083 HZ PHE 45 HZ PHE 45 2.057 -7.473 -8.534 1084 H THR 46 H THR 46 -4.379 -9.089 -4.959 1085 HA THR 46 HA THR 46 -4.448 -7.691 -7.565 1086 HB THR 46 HB THR 46 -6.484 -8.921 -7.412 1087 HG1 THR 46 HG1 THR 46 -7.110 -6.252 -6.592 1088 HG21 THR 46 HG21 THR 46 -6.913 -7.702 -4.679 1089 HG22 THR 46 HG22 THR 46 -6.501 -9.386 -5.008 1090 HG23 THR 46 HG23 THR 46 -8.053 -8.737 -5.539 1091 H CYS 47 H CYS 47 -3.404 -5.823 -7.250 1092 HA CYS 47 HA CYS 47 -3.859 -4.259 -4.815 1093 HB2 CYS 47 HB2 CYS 47 -1.533 -4.536 -5.596 1094 HB3 CYS 47 HB3 CYS 47 -1.946 -3.745 -7.111 1095 HG CYS 47 HG CYS 47 -0.978 -2.404 -4.284 1096 H ASN 48 H ASN 48 -5.709 -3.143 -4.897 1097 HA ASN 48 HA ASN 48 -6.568 -1.806 -7.344 1098 HB2 ASN 48 HB2 ASN 48 -7.873 -1.987 -4.613 1099 HB3 ASN 48 HB3 ASN 48 -8.590 -1.211 -6.021 1100 HD21 ASN 48 HD21 ASN 48 -10.343 -2.583 -6.073 1101 HD22 ASN 48 HD22 ASN 48 -10.217 -4.241 -6.525 1102 H LEU 49 H LEU 49 -5.662 0.111 -7.774 1103 HA LEU 49 HA LEU 49 -4.802 1.863 -5.585 1104 HB2 LEU 49 HB2 LEU 49 -3.096 1.420 -7.195 1105 HB3 LEU 49 HB3 LEU 49 -4.166 1.805 -8.531 1106 HG LEU 49 HG LEU 49 -4.174 4.170 -7.860 1107 HD11 LEU 49 HD11 LEU 49 -3.874 3.954 -5.470 1108 HD12 LEU 49 HD12 LEU 49 -2.595 4.966 -6.141 1109 HD13 LEU 49 HD13 LEU 49 -2.256 3.292 -5.701 1110 HD21 LEU 49 HD21 LEU 49 -2.518 3.423 -9.476 1111 HD22 LEU 49 HD22 LEU 49 -1.402 3.011 -8.173 1112 HD23 LEU 49 HD23 LEU 49 -1.851 4.694 -8.452 1113 H MET 50 H MET 50 -5.700 3.807 -5.169 1114 HA MET 50 HA MET 50 -7.633 4.927 -7.101 1115 HB2 MET 50 HB2 MET 50 -7.940 4.879 -4.099 1116 HB3 MET 50 HB3 MET 50 -9.050 5.632 -5.233 1117 HG2 MET 50 HG2 MET 50 -8.433 2.690 -5.050 1118 HG3 MET 50 HG3 MET 50 -9.884 3.486 -4.451 1119 HE1 MET 50 HE1 MET 50 -11.394 5.052 -6.242 1120 HE2 MET 50 HE2 MET 50 -11.209 4.899 -7.989 1121 HE3 MET 50 HE3 MET 50 -9.940 5.664 -7.034 1122 H ILE 51 H ILE 51 -6.891 6.813 -7.793 1123 HA ILE 51 HA ILE 51 -5.695 8.721 -5.925 1124 HB ILE 51 HB ILE 51 -3.855 9.155 -7.697 1125 HG12 ILE 51 HG12 ILE 51 -3.150 6.891 -8.764 1126 HG13 ILE 51 HG13 ILE 51 -4.822 6.408 -8.511 1127 HG21 ILE 51 HG21 ILE 51 -3.731 6.661 -6.000 1128 HG22 ILE 51 HG22 ILE 51 -3.424 8.307 -5.449 1129 HG23 ILE 51 HG23 ILE 51 -2.349 7.560 -6.631 1130 HD11 ILE 51 HD11 ILE 51 -3.881 8.742 -10.165 1131 HD12 ILE 51 HD12 ILE 51 -5.561 8.254 -9.929 1132 HD13 ILE 51 HD13 ILE 51 -4.443 7.186 -10.776 1133 H PHE 52 H PHE 52 -5.451 10.903 -6.853 1134 HA PHE 52 HA PHE 52 -7.682 11.479 -8.648 1135 HB2 PHE 52 HB2 PHE 52 -6.029 13.159 -6.778 1136 HB3 PHE 52 HB3 PHE 52 -6.991 13.927 -8.038 1137 HD1 PHE 52 HD2 PHE 52 -9.455 13.602 -8.078 1138 HD2 PHE 52 HD1 PHE 52 -7.057 12.299 -4.805 1139 HE1 PHE 52 HE2 PHE 52 -11.467 13.454 -6.673 1140 HE2 PHE 52 HE1 PHE 52 -9.066 12.148 -3.391 1141 HZ PHE 52 HZ PHE 52 -11.274 12.728 -4.322 1142 H VAL 53 H VAL 53 -7.504 12.184 -10.694 1143 HA VAL 53 HA VAL 53 -4.805 12.819 -11.743 1144 HB VAL 53 HB VAL 53 -5.371 11.723 -13.847 1145 HG11 VAL 53 HG11 VAL 53 -4.310 10.333 -12.151 1146 HG12 VAL 53 HG12 VAL 53 -5.444 9.384 -13.116 1147 HG13 VAL 53 HG13 VAL 53 -5.891 9.909 -11.492 1148 HG21 VAL 53 HG21 VAL 53 -7.427 10.392 -14.073 1149 HG22 VAL 53 HG22 VAL 53 -7.765 12.111 -13.872 1150 HG23 VAL 53 HG23 VAL 53 -7.982 11.005 -12.514 1151 H LYS 54 H LYS 54 -4.745 14.275 -13.567 1152 HA LYS 54 HA LYS 54 -6.822 16.295 -13.501 1153 HB2 LYS 54 HB2 LYS 54 -4.313 16.120 -15.188 1154 HB3 LYS 54 HB3 LYS 54 -5.364 17.524 -15.069 1155 HG2 LYS 54 HG2 LYS 54 -4.838 17.692 -12.667 1156 HG3 LYS 54 HG3 LYS 54 -3.743 16.317 -12.830 1157 HD2 LYS 54 HD2 LYS 54 -2.500 18.417 -12.897 1158 HD3 LYS 54 HD3 LYS 54 -2.397 17.587 -14.450 1159 HE2 LYS 54 HE2 LYS 54 -4.151 19.053 -15.348 1160 HE3 LYS 54 HE3 LYS 54 -4.262 19.876 -13.793 1161 HZ1 LYS 54 HZ1 LYS 54 -1.874 19.817 -15.556 1162 HZ2 LYS 54 HZ2 LYS 54 -1.967 20.596 -14.059 1163 HZ3 LYS 54 HZ3 LYS 54 -2.921 21.131 -15.348 1164 H ASN 55 H ASN 55 -6.191 13.517 -15.390 1165 HA ASN 55 HA ASN 55 -8.414 13.944 -17.119 1166 HB2 ASN 55 HB2 ASN 55 -7.005 13.834 -19.263 1167 HB3 ASN 55 HB3 ASN 55 -7.061 15.376 -18.415 1168 HD21 ASN 55 HD21 ASN 55 -5.223 16.213 -17.576 1169 HD22 ASN 55 HD22 ASN 55 -3.660 15.502 -17.773 1170 H THR 56 H THR 56 -8.531 12.184 -18.861 1171 HA THR 56 HA THR 56 -8.199 9.654 -17.577 1172 HB THR 56 HB THR 56 -9.143 8.663 -19.589 1173 HG1 THR 56 HG1 THR 56 -8.706 9.583 -21.431 1174 HG21 THR 56 HG21 THR 56 -10.701 9.758 -18.051 1175 HG22 THR 56 HG22 THR 56 -11.255 9.917 -19.717 1176 HG23 THR 56 HG23 THR 56 -10.492 11.286 -18.907 1177 H ASP 57 H ASP 57 -6.358 11.409 -19.984 1178 HA ASP 57 HA ASP 57 -4.811 9.265 -20.991 1179 HB2 ASP 57 HB2 ASP 57 -4.985 11.467 -22.110 1180 HB3 ASP 57 HB3 ASP 57 -4.088 12.203 -20.785 1181 H LYS 58 H LYS 58 -4.403 11.462 -18.289 1182 HA LYS 58 HA LYS 58 -1.919 10.662 -17.329 1183 HB2 LYS 58 HB2 LYS 58 -2.993 12.572 -16.381 1184 HB3 LYS 58 HB3 LYS 58 -4.418 11.642 -15.943 1185 HG2 LYS 58 HG2 LYS 58 -3.099 12.159 -13.985 1186 HG3 LYS 58 HG3 LYS 58 -3.129 10.422 -14.291 1187 HD2 LYS 58 HD2 LYS 58 -0.896 10.603 -15.356 1188 HD3 LYS 58 HD3 LYS 58 -0.876 12.325 -14.970 1189 HE2 LYS 58 HE2 LYS 58 -1.024 11.771 -12.577 1190 HE3 LYS 58 HE3 LYS 58 -0.998 10.054 -12.982 1191 HZ1 LYS 58 HZ1 LYS 58 1.182 10.431 -14.031 1192 HZ2 LYS 58 HZ2 LYS 58 1.189 10.752 -12.373 1193 HZ3 LYS 58 HZ3 LYS 58 1.156 12.027 -13.477 1194 H LEU 59 H LEU 59 -5.138 9.287 -16.727 1195 HA LEU 59 HA LEU 59 -4.333 7.294 -14.893 1196 HB2 LEU 59 HB2 LEU 59 -6.652 8.030 -15.129 1197 HB3 LEU 59 HB3 LEU 59 -6.711 7.379 -16.755 1198 HG LEU 59 HG LEU 59 -6.477 5.101 -15.874 1199 HD11 LEU 59 HD11 LEU 59 -5.146 5.581 -13.892 1200 HD12 LEU 59 HD12 LEU 59 -6.599 4.675 -13.469 1201 HD13 LEU 59 HD13 LEU 59 -6.517 6.409 -13.154 1202 HD21 LEU 59 HD21 LEU 59 -8.713 6.000 -16.181 1203 HD22 LEU 59 HD22 LEU 59 -8.681 6.697 -14.562 1204 HD23 LEU 59 HD23 LEU 59 -8.671 4.945 -14.768 1205 H THR 60 H THR 60 -4.860 7.148 -18.430 1206 HA THR 60 HA THR 60 -4.218 4.412 -18.730 1207 HB THR 60 HB THR 60 -3.868 4.898 -21.124 1208 HG1 THR 60 HG1 THR 60 -2.945 6.856 -21.304 1209 HG21 THR 60 HG21 THR 60 -6.107 5.809 -21.613 1210 HG22 THR 60 HG22 THR 60 -6.254 6.331 -19.934 1211 HG23 THR 60 HG23 THR 60 -6.159 4.613 -20.316 1212 H THR 61 H THR 61 -2.205 7.272 -18.510 1213 HA THR 61 HA THR 61 0.215 6.141 -19.449 1214 HB THR 61 HB THR 61 -0.199 8.407 -17.473 1215 HG1 THR 61 HG1 THR 61 -0.965 9.146 -19.358 1216 HG21 THR 61 HG21 THR 61 2.071 7.493 -17.277 1217 HG22 THR 61 HG22 THR 61 2.096 9.086 -18.033 1218 HG23 THR 61 HG23 THR 61 2.287 7.638 -19.023 1219 H LEU 62 H LEU 62 -1.173 6.365 -16.179 1220 HA LEU 62 HA LEU 62 0.986 5.246 -14.773 1221 HB2 LEU 62 HB2 LEU 62 -1.968 5.109 -14.144 1222 HB3 LEU 62 HB3 LEU 62 -0.687 4.686 -13.021 1223 HG LEU 62 HG LEU 62 -1.223 7.433 -14.170 1224 HD11 LEU 62 HD11 LEU 62 -1.751 8.034 -11.865 1225 HD12 LEU 62 HD12 LEU 62 -1.484 6.364 -11.362 1226 HD13 LEU 62 HD13 LEU 62 -2.815 6.755 -12.452 1227 HD21 LEU 62 HD21 LEU 62 1.178 7.089 -13.908 1228 HD22 LEU 62 HD22 LEU 62 0.933 6.530 -12.252 1229 HD23 LEU 62 HD23 LEU 62 0.575 8.203 -12.681 1230 H MET 63 H MET 63 -1.697 3.709 -16.472 1231 HA MET 63 HA MET 63 -1.395 1.064 -15.671 1232 HB2 MET 63 HB2 MET 63 -2.039 2.057 -18.459 1233 HB3 MET 63 HB3 MET 63 -2.364 0.442 -17.843 1234 HG2 MET 63 HG2 MET 63 -3.958 1.320 -16.264 1235 HG3 MET 63 HG3 MET 63 -3.568 2.972 -16.745 1236 HE1 MET 63 HE1 MET 63 -6.576 1.823 -16.703 1237 HE2 MET 63 HE2 MET 63 -7.157 2.572 -18.192 1238 HE3 MET 63 HE3 MET 63 -6.096 3.474 -17.108 1239 H ASP 64 H ASP 64 0.214 2.720 -18.385 1240 HA ASP 64 HA ASP 64 1.773 0.541 -19.245 1241 HB2 ASP 64 HB2 ASP 64 1.298 2.652 -20.524 1242 HB3 ASP 64 HB3 ASP 64 2.467 3.475 -19.501 1243 H LYS 65 H LYS 65 2.389 3.064 -16.858 1244 HA LYS 65 HA LYS 65 5.100 2.494 -16.333 1245 HB2 LYS 65 HB2 LYS 65 2.964 3.618 -14.509 1246 HB3 LYS 65 HB3 LYS 65 4.689 3.642 -14.155 1247 HG2 LYS 65 HG2 LYS 65 4.994 4.990 -16.260 1248 HG3 LYS 65 HG3 LYS 65 3.236 5.098 -16.362 1249 HD2 LYS 65 HD2 LYS 65 4.045 7.098 -15.300 1250 HD3 LYS 65 HD3 LYS 65 3.237 6.121 -14.076 1251 HE2 LYS 65 HE2 LYS 65 5.351 5.359 -13.214 1252 HE3 LYS 65 HE3 LYS 65 6.222 6.138 -14.536 1253 HZ1 LYS 65 HZ1 LYS 65 4.663 7.537 -12.432 1254 HZ2 LYS 65 HZ2 LYS 65 5.488 8.284 -13.700 1255 HZ3 LYS 65 HZ3 LYS 65 6.346 7.442 -12.516 1256 H LEU 66 H LEU 66 2.120 1.133 -15.032 1257 HA LEU 66 HA LEU 66 3.421 -0.542 -13.083 1258 HB2 LEU 66 HB2 LEU 66 0.606 -0.590 -14.188 1259 HB3 LEU 66 HB3 LEU 66 1.159 -1.506 -12.795 1260 HG LEU 66 HG LEU 66 1.234 1.515 -12.922 1261 HD11 LEU 66 HD11 LEU 66 -1.080 0.773 -13.105 1262 HD12 LEU 66 HD12 LEU 66 -0.772 1.502 -11.530 1263 HD13 LEU 66 HD13 LEU 66 -0.877 -0.252 -11.684 1264 HD21 LEU 66 HD21 LEU 66 2.784 0.506 -11.326 1265 HD22 LEU 66 HD22 LEU 66 1.461 -0.411 -10.605 1266 HD23 LEU 66 HD23 LEU 66 1.477 1.349 -10.495 1267 H ARG 67 H ARG 67 2.223 -0.965 -16.368 1268 HA ARG 67 HA ARG 67 2.392 -3.784 -16.509 1269 HB2 ARG 67 HB2 ARG 67 2.464 -1.654 -18.654 1270 HB3 ARG 67 HB3 ARG 67 2.468 -3.378 -19.019 1271 HG2 ARG 67 HG2 ARG 67 0.325 -3.639 -17.888 1272 HG3 ARG 67 HG3 ARG 67 0.326 -1.926 -17.470 1273 HD2 ARG 67 HD2 ARG 67 0.276 -1.346 -19.853 1274 HD3 ARG 67 HD3 ARG 67 0.276 -3.062 -20.269 1275 HE ARG 67 HE ARG 67 -1.875 -3.003 -18.778 1276 HH11 ARG 67 HH11 ARG 67 -0.875 -0.713 -21.160 1277 HH12 ARG 67 HH12 ARG 67 -2.495 -0.198 -21.493 1278 HH21 ARG 67 HH21 ARG 67 -3.943 -2.330 -19.217 1279 HH22 ARG 67 HH22 ARG 67 -4.202 -1.075 -20.386 1280 H LYS 68 H LYS 68 4.883 -1.588 -16.153 1281 HA LYS 68 HA LYS 68 6.905 -2.757 -17.789 1282 HB2 LYS 68 HB2 LYS 68 7.096 -1.028 -15.308 1283 HB3 LYS 68 HB3 LYS 68 8.467 -1.454 -16.326 1284 HG2 LYS 68 HG2 LYS 68 6.037 -0.003 -17.352 1285 HG3 LYS 68 HG3 LYS 68 7.469 0.817 -16.725 1286 HD2 LYS 68 HD2 LYS 68 8.845 -0.090 -18.451 1287 HD3 LYS 68 HD3 LYS 68 7.573 -1.197 -18.973 1288 HE2 LYS 68 HE2 LYS 68 7.295 1.800 -19.069 1289 HE3 LYS 68 HE3 LYS 68 7.920 0.847 -20.415 1290 HZ1 LYS 68 HZ1 LYS 68 5.556 1.282 -20.657 1291 HZ2 LYS 68 HZ2 LYS 68 5.238 0.534 -19.176 1292 HZ3 LYS 68 HZ3 LYS 68 5.836 -0.375 -20.468 1293 H VAL 69 H VAL 69 5.418 -3.828 -14.939 1294 HA VAL 69 HA VAL 69 7.740 -5.300 -13.958 1295 HB VAL 69 HB VAL 69 4.919 -5.201 -12.860 1296 HG11 VAL 69 HG11 VAL 69 6.138 -7.177 -12.131 1297 HG12 VAL 69 HG12 VAL 69 5.942 -6.049 -10.790 1298 HG13 VAL 69 HG13 VAL 69 7.496 -6.175 -11.615 1299 HG21 VAL 69 HG21 VAL 69 5.820 -3.597 -11.217 1300 HG22 VAL 69 HG22 VAL 69 5.912 -2.977 -12.867 1301 HG23 VAL 69 HG23 VAL 69 7.362 -3.596 -12.075 1302 H GLN 70 H GLN 70 8.187 -7.201 -14.863 1303 HA GLN 70 HA GLN 70 6.548 -8.561 -16.666 1304 HB2 GLN 70 HB2 GLN 70 8.210 -10.316 -16.638 1305 HB3 GLN 70 HB3 GLN 70 9.007 -8.750 -16.577 1306 HG2 GLN 70 HG2 GLN 70 9.346 -9.019 -14.162 1307 HG3 GLN 70 HG3 GLN 70 8.549 -10.591 -14.229 1308 HE21 GLN 70 HE21 GLN 70 10.341 -11.717 -13.524 1309 HE22 GLN 70 HE22 GLN 70 11.756 -11.924 -14.490 1310 H GLY 71 H GLY 71 6.748 -8.888 -13.193 1311 HA2 GLY 71 HA2 GLY 71 5.555 -11.458 -12.960 1312 HA3 GLY 71 HA3 GLY 71 5.659 -10.251 -11.691 1313 H VAL 72 H VAL 72 4.180 -8.314 -13.544 1314 HA VAL 72 HA VAL 72 1.505 -9.126 -12.697 1315 HB VAL 72 HB VAL 72 2.454 -6.554 -13.983 1316 HG11 VAL 72 HG11 VAL 72 -0.243 -7.259 -12.799 1317 HG12 VAL 72 HG12 VAL 72 0.107 -6.944 -14.499 1318 HG13 VAL 72 HG13 VAL 72 0.255 -5.647 -13.315 1319 HG21 VAL 72 HG21 VAL 72 2.171 -5.590 -11.740 1320 HG22 VAL 72 HG22 VAL 72 3.370 -6.884 -11.745 1321 HG23 VAL 72 HG23 VAL 72 1.751 -7.183 -11.109 1322 H PHE 73 H PHE 73 -0.127 -9.737 -14.030 1323 HA PHE 73 HA PHE 73 0.422 -9.725 -16.927 1324 HB2 PHE 73 HB2 PHE 73 -1.396 -11.699 -16.776 1325 HB3 PHE 73 HB3 PHE 73 0.332 -11.959 -16.644 1326 HD1 PHE 73 HD1 PHE 73 -2.843 -11.895 -14.799 1327 HD2 PHE 73 HD2 PHE 73 1.358 -12.562 -14.555 1328 HE1 PHE 73 HE1 PHE 73 -3.141 -13.004 -12.616 1329 HE2 PHE 73 HE2 PHE 73 1.063 -13.662 -12.380 1330 HZ PHE 73 HZ PHE 73 -1.183 -13.886 -11.409 1331 H THR 74 H THR 74 -1.772 -8.643 -14.500 1332 HA THR 74 HA THR 74 -3.482 -7.596 -16.673 1333 HB THR 74 HB THR 74 -5.478 -7.881 -15.491 1334 HG1 THR 74 HG1 THR 74 -5.589 -7.800 -13.379 1335 HG21 THR 74 HG21 THR 74 -5.616 -10.238 -14.893 1336 HG22 THR 74 HG22 THR 74 -3.860 -10.325 -14.752 1337 HG23 THR 74 HG23 THR 74 -4.605 -10.037 -16.325 1338 H VAL 75 H VAL 75 -3.217 -5.466 -16.788 1339 HA VAL 75 HA VAL 75 -3.437 -3.920 -14.277 1340 HB VAL 75 HB VAL 75 -1.950 -3.020 -16.764 1341 HG11 VAL 75 HG11 VAL 75 -1.169 -1.171 -15.345 1342 HG12 VAL 75 HG12 VAL 75 -2.161 -1.771 -14.016 1343 HG13 VAL 75 HG13 VAL 75 -2.927 -1.177 -15.489 1344 HG21 VAL 75 HG21 VAL 75 -0.736 -4.840 -15.672 1345 HG22 VAL 75 HG22 VAL 75 -0.837 -3.994 -14.126 1346 HG23 VAL 75 HG23 VAL 75 0.106 -3.304 -15.447 1347 H GLU 76 H GLU 76 -5.496 -3.232 -14.250 1348 HA GLU 76 HA GLU 76 -6.736 -2.330 -16.775 1349 HB2 GLU 76 HB2 GLU 76 -8.857 -3.456 -15.907 1350 HB3 GLU 76 HB3 GLU 76 -7.579 -4.522 -16.476 1351 HG2 GLU 76 HG2 GLU 76 -6.859 -4.849 -14.122 1352 HG3 GLU 76 HG3 GLU 76 -8.227 -3.869 -13.602 1353 H ARG 77 H ARG 77 -8.675 -1.028 -16.511 1354 HA ARG 77 HA ARG 77 -8.356 0.908 -14.350 1355 HB2 ARG 77 HB2 ARG 77 -8.498 1.802 -16.581 1356 HB3 ARG 77 HB3 ARG 77 -9.980 0.918 -16.901 1357 HG2 ARG 77 HG2 ARG 77 -11.167 2.291 -15.265 1358 HG3 ARG 77 HG3 ARG 77 -9.677 3.164 -14.905 1359 HD2 ARG 77 HD2 ARG 77 -11.210 4.362 -16.471 1360 HD3 ARG 77 HD3 ARG 77 -9.593 4.079 -17.117 1361 HE ARG 77 HE ARG 77 -10.526 2.291 -18.459 1362 HH11 ARG 77 HH11 ARG 77 -12.817 4.429 -17.017 1363 HH12 ARG 77 HH12 ARG 77 -14.049 4.049 -18.170 1364 HH21 ARG 77 HH21 ARG 77 -12.124 1.825 -19.927 1365 HH22 ARG 77 HH22 ARG 77 -13.662 2.604 -19.786 1366 H LEU 78 H LEU 78 -9.917 1.437 -12.857 1367 HA LEU 78 HA LEU 78 -12.245 -0.346 -12.651 1368 HB2 LEU 78 HB2 LEU 78 -11.010 1.519 -10.611 1369 HB3 LEU 78 HB3 LEU 78 -12.422 0.518 -10.326 1370 HG LEU 78 HG LEU 78 -9.639 -0.507 -10.929 1371 HD11 LEU 78 HD11 LEU 78 -9.783 0.477 -8.707 1372 HD12 LEU 78 HD12 LEU 78 -9.648 -1.279 -8.604 1373 HD13 LEU 78 HD13 LEU 78 -11.210 -0.498 -8.349 1374 HD21 LEU 78 HD21 LEU 78 -10.574 -2.716 -10.383 1375 HD22 LEU 78 HD22 LEU 78 -11.341 -2.008 -11.802 1376 HD23 LEU 78 HD23 LEU 78 -12.181 -1.996 -10.251 1377 H SER 79 H SER 79 -13.778 0.537 -13.980 1378 HA SER 79 HA SER 79 -14.401 3.332 -14.078 1379 HB2 SER 79 HB2 SER 79 -16.400 2.592 -15.362 1380 HB3 SER 79 HB3 SER 79 -14.913 1.862 -15.970 1381 HG SER 79 HG SER 79 -16.376 0.221 -15.800 1382 H ASN 80 H ASN 80 -16.285 0.567 -12.855 1383 HA ASN 80 HA ASN 80 -17.863 2.207 -11.083 1384 HB2 ASN 80 HB2 ASN 80 -18.697 -0.054 -10.261 1385 HB3 ASN 80 HB3 ASN 80 -18.959 0.283 -11.969 1386 HD21 ASN 80 HD21 ASN 80 -17.716 -0.816 -13.511 1387 HD22 ASN 80 HD22 ASN 80 -16.859 -2.269 -13.116 1388 H LEU 81 H LEU 81 -17.206 2.914 -9.133 1389 HA LEU 81 HA LEU 81 -14.752 1.769 -8.017 1390 HB2 LEU 81 HB2 LEU 81 -16.172 4.354 -7.370 1391 HB3 LEU 81 HB3 LEU 81 -14.680 3.818 -6.622 1392 HG LEU 81 HG LEU 81 -15.099 4.632 -9.499 1393 HD11 LEU 81 HD11 LEU 81 -13.341 5.727 -7.297 1394 HD12 LEU 81 HD12 LEU 81 -14.804 6.475 -7.946 1395 HD13 LEU 81 HD13 LEU 81 -13.376 6.303 -8.966 1396 HD21 LEU 81 HD21 LEU 81 -12.728 4.108 -9.864 1397 HD22 LEU 81 HD22 LEU 81 -13.666 2.664 -9.486 1398 HD23 LEU 81 HD23 LEU 81 -12.639 3.396 -8.251 1399 H GLU 82 H GLU 82 -14.505 1.751 -5.674 1400 HA GLU 82 HA GLU 82 -16.811 0.517 -4.328 1401 HB2 GLU 82 HB2 GLU 82 -14.933 -0.221 -2.714 1402 HB3 GLU 82 HB3 GLU 82 -14.980 -0.956 -4.310 1403 HG2 GLU 82 HG2 GLU 82 -12.952 -0.186 -4.830 1404 HG3 GLU 82 HG3 GLU 82 -13.364 1.449 -4.332 1405 H HIS 83 H HIS 83 -16.274 3.498 -4.570 1406 HA HIS 83 HA HIS 83 -15.506 4.200 -1.825 1407 HB2 HIS 83 HB2 HIS 83 -15.589 5.823 -4.372 1408 HB3 HIS 83 HB3 HIS 83 -15.241 6.529 -2.793 1409 HD1 HIS 83 HD1 HIS 83 -12.812 6.729 -2.385 1410 HD2 HIS 83 HD2 HIS 83 -13.709 3.440 -4.751 1411 HE1 HIS 83 HE1 HIS 83 -10.612 5.645 -2.897 1412 HE2 HIS 83 HE2 HIS 83 -11.239 3.488 -4.025 1413 H HIS 84 H HIS 84 -17.199 4.167 -0.525 1414 HA HIS 84 HA HIS 84 -19.251 6.152 -0.761 1415 HB2 HIS 84 HB2 HIS 84 -21.161 4.523 -0.659 1416 HB3 HIS 84 HB3 HIS 84 -20.304 4.517 -2.195 1417 HD1 HIS 84 HD1 HIS 84 -19.275 2.344 -2.940 1418 HD2 HIS 84 HD2 HIS 84 -20.646 2.199 0.975 1419 HE1 HIS 84 HE1 HIS 84 -19.114 -0.064 -2.266 1420 HE2 HIS 84 HE2 HIS 84 -20.168 -0.152 0.012 1421 H HIS 85 H HIS 85 -20.866 5.859 1.158 1422 HA HIS 85 HA HIS 85 -19.619 5.843 3.596 1423 HB2 HIS 85 HB2 HIS 85 -21.884 5.388 4.596 1424 HB3 HIS 85 HB3 HIS 85 -21.851 6.691 3.416 1425 HD1 HIS 85 HD1 HIS 85 -23.810 3.848 4.319 1426 HD2 HIS 85 HD2 HIS 85 -22.720 5.614 0.717 1427 HE1 HIS 85 HE1 HIS 85 -25.484 3.042 2.637 1428 HE2 HIS 85 HE2 HIS 85 -24.918 4.272 0.522 1429 H HIS 86 H HIS 86 -18.692 4.390 4.863 1430 HA HIS 86 HA HIS 86 -18.017 2.458 5.829 1431 HB2 HIS 86 HB2 HIS 86 -20.500 1.246 4.596 1432 HB3 HIS 86 HB3 HIS 86 -19.439 0.417 5.729 1433 HD1 HIS 86 HD1 HIS 86 -22.569 1.639 5.893 1434 HD2 HIS 86 HD2 HIS 86 -19.169 2.647 8.049 1435 HE1 HIS 86 HE1 HIS 86 -23.409 2.667 8.022 1436 HE2 HIS 86 HE2 HIS 86 -21.337 3.095 9.385 1437 H HIS 87 H HIS 87 -16.121 2.225 4.744 1438 HA HIS 87 HA HIS 87 -16.133 0.511 2.337 1439 HB2 HIS 87 HB2 HIS 87 -15.157 2.632 1.802 1440 HB3 HIS 87 HB3 HIS 87 -14.159 2.612 3.253 1441 HD1 HIS 87 HD1 HIS 87 -11.888 1.536 3.072 1442 HD2 HIS 87 HD2 HIS 87 -14.288 0.741 -0.225 1443 HE1 HIS 87 HE1 HIS 87 -10.394 0.396 1.414 1444 HE2 HIS 87 HE2 HIS 87 -11.814 0.120 -0.639 1445 H HIS 88 H HIS 88 -15.307 -1.471 2.508 1446 HA HIS 88 HA HIS 88 -12.931 -2.026 4.001 1447 HB2 HIS 88 HB2 HIS 88 -14.721 -2.085 5.792 1448 HB3 HIS 88 HB3 HIS 88 -15.433 -3.454 4.947 1449 HD1 HIS 88 HD1 HIS 88 -13.266 -2.765 7.673 1450 HD2 HIS 88 HD2 HIS 88 -13.300 -5.622 4.653 1451 HE1 HIS 88 HE1 HIS 88 -11.810 -4.633 8.494 1452 HE2 HIS 88 HE2 HIS 88 -11.930 -6.388 6.705 Start of MODEL 2 1 H1 MET 1 H1 MET 1 12.200 -22.698 15.449 2 H2 MET 1 H2 MET 1 12.396 -22.179 13.852 3 H3 MET 1 H3 MET 1 11.012 -23.042 14.293 4 HA MET 1 HA MET 1 10.325 -21.250 15.755 5 HB2 MET 1 HB2 MET 1 12.628 -20.417 16.191 6 HB3 MET 1 HB3 MET 1 12.689 -19.782 14.554 7 HG2 MET 1 HG2 MET 1 10.953 -18.196 15.035 8 HG3 MET 1 HG3 MET 1 10.672 -18.915 16.622 9 HE1 MET 1 HE1 MET 1 13.664 -19.494 17.577 10 HE2 MET 1 HE2 MET 1 12.428 -18.799 18.626 11 HE3 MET 1 HE3 MET 1 14.009 -18.027 18.490 12 H THR 2 H THR 2 8.512 -20.589 14.790 13 HA THR 2 HA THR 2 8.540 -20.284 11.850 14 HB THR 2 HB THR 2 6.186 -20.926 13.651 15 HG1 THR 2 HG1 THR 2 8.022 -22.534 13.335 16 HG21 THR 2 HG21 THR 2 6.471 -21.045 10.640 17 HG22 THR 2 HG22 THR 2 5.521 -19.866 11.543 18 HG23 THR 2 HG23 THR 2 5.062 -21.568 11.562 19 H ASP 3 H ASP 3 7.733 -18.514 10.842 20 HA ASP 3 HA ASP 3 7.327 -16.072 12.257 21 HB2 ASP 3 HB2 ASP 3 6.702 -16.743 9.364 22 HB3 ASP 3 HB3 ASP 3 6.866 -15.126 10.039 23 H PHE 4 H PHE 4 5.383 -14.803 12.399 24 HA PHE 4 HA PHE 4 2.882 -16.269 11.885 25 HB2 PHE 4 HB2 PHE 4 1.882 -15.359 13.893 26 HB3 PHE 4 HB3 PHE 4 3.356 -16.214 14.315 27 HD1 PHE 4 HD1 PHE 4 1.797 -12.889 13.990 28 HD2 PHE 4 HD2 PHE 4 5.209 -15.063 15.332 29 HE1 PHE 4 HE1 PHE 4 2.567 -10.911 15.224 30 HE2 PHE 4 HE2 PHE 4 5.981 -13.083 16.565 31 HZ PHE 4 HZ PHE 4 4.661 -11.001 16.505 32 H LEU 5 H LEU 5 1.054 -15.019 11.331 33 HA LEU 5 HA LEU 5 1.700 -12.750 9.696 34 HB2 LEU 5 HB2 LEU 5 0.070 -14.381 8.962 35 HB3 LEU 5 HB3 LEU 5 -0.916 -14.076 10.376 36 HG LEU 5 HG LEU 5 -1.434 -11.818 9.563 37 HD11 LEU 5 HD11 LEU 5 0.656 -11.340 8.393 38 HD12 LEU 5 HD12 LEU 5 -0.729 -11.094 7.332 39 HD13 LEU 5 HD13 LEU 5 0.261 -12.545 7.167 40 HD21 LEU 5 HD21 LEU 5 -2.895 -13.643 8.888 41 HD22 LEU 5 HD22 LEU 5 -1.883 -13.955 7.476 42 HD23 LEU 5 HD23 LEU 5 -2.775 -12.437 7.606 43 H ALA 6 H ALA 6 2.156 -10.905 10.705 44 HA ALA 6 HA ALA 6 0.594 -10.033 13.025 45 HB1 ALA 6 HB1 ALA 6 3.149 -8.923 11.862 46 HB2 ALA 6 HB2 ALA 6 3.032 -10.051 13.214 47 HB3 ALA 6 HB3 ALA 6 2.384 -8.419 13.369 48 H GLY 7 H GLY 7 -0.592 -8.148 13.064 49 HA2 GLY 7 HA2 GLY 7 -0.867 -6.682 10.503 50 HA3 GLY 7 HA3 GLY 7 -2.204 -6.977 11.603 51 H ILE 8 H ILE 8 -1.144 -4.438 10.550 52 HA ILE 8 HA ILE 8 -0.757 -3.063 13.125 53 HB ILE 8 HB ILE 8 0.756 -2.268 10.619 54 HG12 ILE 8 HG12 ILE 8 1.805 -3.772 13.041 55 HG13 ILE 8 HG13 ILE 8 1.593 -4.447 11.430 56 HG21 ILE 8 HG21 ILE 8 1.023 -1.373 13.495 57 HG22 ILE 8 HG22 ILE 8 0.314 -0.441 12.176 58 HG23 ILE 8 HG23 ILE 8 2.033 -0.833 12.152 59 HD11 ILE 8 HD11 ILE 8 3.504 -2.244 12.192 60 HD12 ILE 8 HD12 ILE 8 3.282 -2.894 10.567 61 HD13 ILE 8 HD13 ILE 8 3.919 -3.923 11.850 62 H ARG 9 H ARG 9 -1.782 -1.043 13.272 63 HA ARG 9 HA ARG 9 -3.255 -0.109 10.881 64 HB2 ARG 9 HB2 ARG 9 -4.800 -1.004 12.574 65 HB3 ARG 9 HB3 ARG 9 -4.125 0.084 13.779 66 HG2 ARG 9 HG2 ARG 9 -4.924 2.013 12.481 67 HG3 ARG 9 HG3 ARG 9 -5.611 0.914 11.283 68 HD2 ARG 9 HD2 ARG 9 -7.132 0.003 12.936 69 HD3 ARG 9 HD3 ARG 9 -6.386 0.975 14.203 70 HE ARG 9 HE ARG 9 -7.653 2.333 11.932 71 HH11 ARG 9 HH11 ARG 9 -7.654 1.520 15.285 72 HH12 ARG 9 HH12 ARG 9 -8.824 2.728 15.693 73 HH21 ARG 9 HH21 ARG 9 -9.171 3.881 12.474 74 HH22 ARG 9 HH22 ARG 9 -9.666 4.048 14.122 75 H ILE 10 H ILE 10 -2.568 1.793 10.168 76 HA ILE 10 HA ILE 10 -1.161 3.631 12.014 77 HB ILE 10 HB ILE 10 -1.059 3.585 8.985 78 HG12 ILE 10 HG12 ILE 10 1.014 2.501 10.913 79 HG13 ILE 10 HG13 ILE 10 -0.130 1.500 10.024 80 HG21 ILE 10 HG21 ILE 10 0.684 4.991 11.013 81 HG22 ILE 10 HG22 ILE 10 -0.511 5.750 9.963 82 HG23 ILE 10 HG23 ILE 10 0.927 5.004 9.265 83 HD11 ILE 10 HD11 ILE 10 2.033 1.515 8.942 84 HD12 ILE 10 HD12 ILE 10 1.983 3.273 8.817 85 HD13 ILE 10 HD13 ILE 10 0.827 2.289 7.916 86 H VAL 11 H VAL 11 -2.447 5.338 12.660 87 HA VAL 11 HA VAL 11 -4.150 6.571 10.583 88 HB VAL 11 HB VAL 11 -4.681 6.429 13.559 89 HG11 VAL 11 HG11 VAL 11 -6.732 7.709 13.101 90 HG12 VAL 11 HG12 VAL 11 -6.197 7.951 11.437 91 HG13 VAL 11 HG13 VAL 11 -5.277 8.649 12.771 92 HG21 VAL 11 HG21 VAL 11 -6.259 5.389 11.194 93 HG22 VAL 11 HG22 VAL 11 -6.713 5.241 12.894 94 HG23 VAL 11 HG23 VAL 11 -5.279 4.411 12.290 95 H GLY 12 H GLY 12 -3.380 8.407 9.888 96 HA2 GLY 12 HA2 GLY 12 -2.194 10.331 11.774 97 HA3 GLY 12 HA3 GLY 12 -1.249 9.837 10.375 98 H GLU 13 H GLU 13 -1.725 12.466 10.627 99 HA GLU 13 HA GLU 13 -4.183 13.328 9.463 100 HB2 GLU 13 HB2 GLU 13 -3.154 15.554 9.422 101 HB3 GLU 13 HB3 GLU 13 -2.910 14.762 10.975 102 HG2 GLU 13 HG2 GLU 13 -0.619 14.187 10.320 103 HG3 GLU 13 HG3 GLU 13 -0.864 14.979 8.766 104 H ASP 14 H ASP 14 -4.757 13.457 7.383 105 HA ASP 14 HA ASP 14 -2.987 12.555 5.311 106 HB2 ASP 14 HB2 ASP 14 -5.310 11.918 5.226 107 HB3 ASP 14 HB3 ASP 14 -5.829 13.599 5.279 108 H LYS 15 H LYS 15 -1.341 13.959 4.799 109 HA LYS 15 HA LYS 15 -2.041 16.366 3.354 110 HB2 LYS 15 HB2 LYS 15 -0.517 17.816 4.743 111 HB3 LYS 15 HB3 LYS 15 -2.038 17.378 5.501 112 HG2 LYS 15 HG2 LYS 15 -0.996 16.434 7.231 113 HG3 LYS 15 HG3 LYS 15 0.012 15.452 6.171 114 HD2 LYS 15 HD2 LYS 15 1.283 16.972 7.698 115 HD3 LYS 15 HD3 LYS 15 1.644 17.195 5.986 116 HE2 LYS 15 HE2 LYS 15 1.423 19.338 7.164 117 HE3 LYS 15 HE3 LYS 15 0.196 19.149 5.914 118 HZ1 LYS 15 HZ1 LYS 15 -0.250 18.638 8.803 119 HZ2 LYS 15 HZ2 LYS 15 -1.422 18.613 7.580 120 HZ3 LYS 15 HZ3 LYS 15 -0.673 20.065 8.001 121 H ASN 16 H ASN 16 -0.278 17.275 2.159 122 HA ASN 16 HA ASN 16 1.620 17.231 0.902 123 HB2 ASN 16 HB2 ASN 16 2.804 16.152 3.473 124 HB3 ASN 16 HB3 ASN 16 3.725 16.838 2.136 125 HD21 ASN 16 HD21 ASN 16 3.585 17.718 4.890 126 HD22 ASN 16 HD22 ASN 16 3.034 19.354 4.846 127 H GLY 17 H GLY 17 -0.024 14.754 0.847 128 HA2 GLY 17 HA2 GLY 17 0.079 12.702 -0.191 129 HA3 GLY 17 HA3 GLY 17 1.728 13.089 -0.657 130 H MET 18 H MET 18 0.568 12.957 2.669 131 HA MET 18 HA MET 18 2.659 11.349 3.589 132 HB2 MET 18 HB2 MET 18 -0.017 12.094 4.722 133 HB3 MET 18 HB3 MET 18 0.953 10.874 5.541 134 HG2 MET 18 HG2 MET 18 2.822 12.546 5.583 135 HG3 MET 18 HG3 MET 18 1.677 13.744 5.005 136 HE1 MET 18 HE1 MET 18 2.303 11.082 7.863 137 HE2 MET 18 HE2 MET 18 0.632 10.831 7.358 138 HE3 MET 18 HE3 MET 18 0.980 11.482 8.959 139 H THR 19 H THR 19 -0.448 10.401 2.271 140 HA THR 19 HA THR 19 -0.524 7.715 3.043 141 HB THR 19 HB THR 19 -1.948 7.345 1.069 142 HG1 THR 19 HG1 THR 19 -2.263 9.427 -0.205 143 HG21 THR 19 HG21 THR 19 -2.476 10.002 2.423 144 HG22 THR 19 HG22 THR 19 -2.956 8.418 3.034 145 HG23 THR 19 HG23 THR 19 -3.666 9.044 1.546 146 H ASN 20 H ASN 20 1.132 9.275 0.311 147 HA ASN 20 HA ASN 20 1.960 6.889 -0.985 148 HB2 ASN 20 HB2 ASN 20 3.131 9.684 -1.079 149 HB3 ASN 20 HB3 ASN 20 3.649 8.368 -2.124 150 HD21 ASN 20 HD21 ASN 20 3.051 9.370 -3.993 151 HD22 ASN 20 HD22 ASN 20 1.401 9.639 -4.436 152 H GLN 21 H GLN 21 3.604 9.088 1.257 153 HA GLN 21 HA GLN 21 6.063 7.690 1.267 154 HB2 GLN 21 HB2 GLN 21 6.722 9.126 3.039 155 HB3 GLN 21 HB3 GLN 21 5.732 10.083 1.959 156 HG2 GLN 21 HG2 GLN 21 3.860 9.925 3.467 157 HG3 GLN 21 HG3 GLN 21 4.754 8.826 4.514 158 HE21 GLN 21 HE21 GLN 21 4.485 12.120 3.404 159 HE22 GLN 21 HE22 GLN 21 5.412 12.820 4.680 160 H ILE 22 H ILE 22 3.174 7.446 3.287 161 HA ILE 22 HA ILE 22 4.267 5.907 5.375 162 HB ILE 22 HB ILE 22 1.465 6.264 4.337 163 HG12 ILE 22 HG12 ILE 22 2.496 8.107 5.599 164 HG13 ILE 22 HG13 ILE 22 1.156 7.404 6.496 165 HG21 ILE 22 HG21 ILE 22 0.614 4.991 6.266 166 HG22 ILE 22 HG22 ILE 22 2.264 4.508 6.664 167 HG23 ILE 22 HG23 ILE 22 1.528 3.974 5.153 168 HD11 ILE 22 HD11 ILE 22 3.042 7.905 7.944 169 HD12 ILE 22 HD12 ILE 22 4.074 6.849 6.980 170 HD13 ILE 22 HD13 ILE 22 2.724 6.172 7.890 171 H THR 23 H THR 23 2.379 4.796 2.524 172 HA THR 23 HA THR 23 2.907 2.050 3.135 173 HB THR 23 HB THR 23 2.049 3.061 0.413 174 HG1 THR 23 HG1 THR 23 0.633 2.929 2.843 175 HG21 THR 23 HG21 THR 23 2.619 0.683 0.558 176 HG22 THR 23 HG22 THR 23 0.883 0.894 0.328 177 HG23 THR 23 HG23 THR 23 1.520 0.494 1.924 178 H GLY 24 H GLY 24 4.484 4.504 1.195 179 HA2 GLY 24 HA2 GLY 24 6.324 2.961 -0.239 180 HA3 GLY 24 HA3 GLY 24 6.626 4.585 0.360 181 H VAL 25 H VAL 25 6.706 4.346 3.040 182 HA VAL 25 HA VAL 25 9.174 3.171 3.648 183 HB VAL 25 HB VAL 25 6.921 3.917 5.535 184 HG11 VAL 25 HG11 VAL 25 8.646 3.963 7.297 185 HG12 VAL 25 HG12 VAL 25 9.821 3.310 6.153 186 HG13 VAL 25 HG13 VAL 25 8.423 2.344 6.630 187 HG21 VAL 25 HG21 VAL 25 8.262 5.965 5.907 188 HG22 VAL 25 HG22 VAL 25 7.732 5.809 4.233 189 HG23 VAL 25 HG23 VAL 25 9.398 5.426 4.667 190 H ILE 26 H ILE 26 5.882 1.944 4.151 191 HA ILE 26 HA ILE 26 6.439 -0.443 5.475 192 HB ILE 26 HB ILE 26 4.279 0.206 3.464 193 HG12 ILE 26 HG12 ILE 26 4.252 0.038 6.492 194 HG13 ILE 26 HG13 ILE 26 4.234 1.519 5.543 195 HG21 ILE 26 HG21 ILE 26 3.077 -1.776 4.277 196 HG22 ILE 26 HG22 ILE 26 4.486 -2.230 5.236 197 HG23 ILE 26 HG23 ILE 26 4.588 -2.203 3.476 198 HD11 ILE 26 HD11 ILE 26 2.072 -0.576 5.621 199 HD12 ILE 26 HD12 ILE 26 2.056 0.873 4.614 200 HD13 ILE 26 HD13 ILE 26 2.027 1.020 6.371 201 H SER 27 H SER 27 6.402 0.201 1.981 202 HA SER 27 HA SER 27 6.774 -2.347 0.962 203 HB2 SER 27 HB2 SER 27 8.147 0.118 -0.148 204 HB3 SER 27 HB3 SER 27 7.610 -1.308 -1.037 205 HG SER 27 HG SER 27 6.114 0.814 0.026 206 H LYS 28 H LYS 28 9.062 -0.316 2.606 207 HA LYS 28 HA LYS 28 11.418 -1.562 1.496 208 HB2 LYS 28 HB2 LYS 28 11.385 0.279 3.879 209 HB3 LYS 28 HB3 LYS 28 12.648 0.066 2.672 210 HG2 LYS 28 HG2 LYS 28 11.149 1.098 0.988 211 HG3 LYS 28 HG3 LYS 28 9.975 1.393 2.268 212 HD2 LYS 28 HD2 LYS 28 12.745 2.563 2.021 213 HD3 LYS 28 HD3 LYS 28 11.207 3.407 1.854 214 HE2 LYS 28 HE2 LYS 28 11.907 3.995 3.999 215 HE3 LYS 28 HE3 LYS 28 10.777 2.676 4.294 216 HZ1 LYS 28 HZ1 LYS 28 12.589 1.181 4.649 217 HZ2 LYS 28 HZ2 LYS 28 12.870 2.551 5.595 218 HZ3 LYS 28 HZ3 LYS 28 13.723 2.330 4.152 219 H PHE 29 H PHE 29 9.320 -2.474 3.969 220 HA PHE 29 HA PHE 29 11.072 -3.221 6.036 221 HB2 PHE 29 HB2 PHE 29 8.357 -4.306 5.276 222 HB3 PHE 29 HB3 PHE 29 9.225 -4.818 6.718 223 HD1 PHE 29 HD2 PHE 29 10.364 -1.830 7.050 224 HD2 PHE 29 HD1 PHE 29 6.494 -3.588 6.705 225 HE1 PHE 29 HE2 PHE 29 9.399 0.051 8.303 226 HE2 PHE 29 HE1 PHE 29 5.531 -1.708 7.968 227 HZ PHE 29 HZ PHE 29 6.983 0.111 8.768 228 H ASP 30 H ASP 30 11.652 -5.351 6.764 229 HA ASP 30 HA ASP 30 13.057 -6.871 4.828 230 HB2 ASP 30 HB2 ASP 30 12.374 -7.845 7.605 231 HB3 ASP 30 HB3 ASP 30 13.816 -8.182 6.653 232 H THR 31 H THR 31 9.812 -6.887 5.540 233 HA THR 31 HA THR 31 9.447 -9.765 4.994 234 HB THR 31 HB THR 31 8.624 -9.162 7.195 235 HG1 THR 31 HG1 THR 31 7.010 -10.456 6.834 236 HG21 THR 31 HG21 THR 31 6.835 -7.544 7.522 237 HG22 THR 31 HG22 THR 31 6.840 -7.165 5.800 238 HG23 THR 31 HG23 THR 31 8.242 -6.767 6.796 239 H ASN 32 H ASN 32 7.251 -10.244 3.993 240 HA ASN 32 HA ASN 32 6.996 -8.541 1.614 241 HB2 ASN 32 HB2 ASN 32 7.541 -10.918 1.251 242 HB3 ASN 32 HB3 ASN 32 6.057 -11.385 2.075 243 HD21 ASN 32 HD21 ASN 32 7.403 -9.925 -0.781 244 HD22 ASN 32 HD22 ASN 32 5.975 -10.058 -1.746 245 H ILE 33 H ILE 33 5.175 -7.431 1.157 246 HA ILE 33 HA ILE 33 3.125 -7.138 3.102 247 HB ILE 33 HB ILE 33 3.126 -6.249 0.202 248 HG12 ILE 33 HG12 ILE 33 3.917 -4.757 2.726 249 HG13 ILE 33 HG13 ILE 33 5.024 -5.332 1.483 250 HG21 ILE 33 HG21 ILE 33 1.402 -5.354 2.523 251 HG22 ILE 33 HG22 ILE 33 0.870 -6.270 1.112 252 HG23 ILE 33 HG23 ILE 33 1.429 -4.609 0.924 253 HD11 ILE 33 HD11 ILE 33 2.896 -3.231 1.121 254 HD12 ILE 33 HD12 ILE 33 4.002 -3.807 -0.129 255 HD13 ILE 33 HD13 ILE 33 4.628 -2.949 1.279 256 H ARG 34 H ARG 34 1.700 -8.734 3.531 257 HA ARG 34 HA ARG 34 0.812 -10.532 1.409 258 HB2 ARG 34 HB2 ARG 34 0.015 -10.571 4.329 259 HB3 ARG 34 HB3 ARG 34 -0.156 -11.875 3.159 260 HG2 ARG 34 HG2 ARG 34 2.389 -10.795 4.353 261 HG3 ARG 34 HG3 ARG 34 1.690 -12.400 4.565 262 HD2 ARG 34 HD2 ARG 34 2.836 -11.256 2.011 263 HD3 ARG 34 HD3 ARG 34 3.574 -12.491 3.029 264 HE ARG 34 HE ARG 34 1.423 -13.790 2.434 265 HH11 ARG 34 HH11 ARG 34 3.073 -11.628 0.316 266 HH12 ARG 34 HH12 ARG 34 2.589 -12.487 -1.104 267 HH21 ARG 34 HH21 ARG 34 0.833 -14.880 0.606 268 HH22 ARG 34 HH22 ARG 34 1.366 -14.317 -0.944 269 H THR 35 H THR 35 -0.460 -7.984 3.451 270 HA THR 35 HA THR 35 -2.677 -7.542 1.638 271 HB THR 35 HB THR 35 -3.313 -8.112 4.548 272 HG1 THR 35 HG1 THR 35 -3.329 -9.769 2.283 273 HG21 THR 35 HG21 THR 35 -5.133 -7.637 2.178 274 HG22 THR 35 HG22 THR 35 -4.822 -6.494 3.485 275 HG23 THR 35 HG23 THR 35 -5.655 -8.012 3.821 276 H ILE 36 H ILE 36 -3.503 -5.407 1.824 277 HA ILE 36 HA ILE 36 -2.898 -3.836 4.158 278 HB ILE 36 HB ILE 36 -0.765 -3.730 2.843 279 HG12 ILE 36 HG12 ILE 36 -2.096 -1.023 3.063 280 HG13 ILE 36 HG13 ILE 36 -1.602 -1.955 4.474 281 HG21 ILE 36 HG21 ILE 36 -1.656 -3.717 0.586 282 HG22 ILE 36 HG22 ILE 36 -0.682 -2.271 0.860 283 HG23 ILE 36 HG23 ILE 36 -2.443 -2.165 0.877 284 HD11 ILE 36 HD11 ILE 36 0.053 -0.283 3.882 285 HD12 ILE 36 HD12 ILE 36 0.219 -1.000 2.279 286 HD13 ILE 36 HD13 ILE 36 0.698 -1.914 3.710 287 H VAL 37 H VAL 37 -4.200 -2.091 4.419 288 HA VAL 37 HA VAL 37 -5.975 -1.259 2.215 289 HB VAL 37 HB VAL 37 -6.880 -1.971 5.022 290 HG11 VAL 37 HG11 VAL 37 -9.151 -1.383 4.261 291 HG12 VAL 37 HG12 VAL 37 -8.475 -0.785 2.745 292 HG13 VAL 37 HG13 VAL 37 -8.068 0.010 4.269 293 HG21 VAL 37 HG21 VAL 37 -7.583 -3.215 2.358 294 HG22 VAL 37 HG22 VAL 37 -8.291 -3.653 3.913 295 HG23 VAL 37 HG23 VAL 37 -6.578 -3.938 3.615 296 H LEU 38 H LEU 38 -5.242 0.821 1.961 297 HA LEU 38 HA LEU 38 -5.239 2.552 4.359 298 HB2 LEU 38 HB2 LEU 38 -3.059 2.357 3.179 299 HB3 LEU 38 HB3 LEU 38 -3.799 3.004 1.733 300 HG LEU 38 HG LEU 38 -3.708 4.588 4.308 301 HD11 LEU 38 HD11 LEU 38 -1.704 5.723 3.422 302 HD12 LEU 38 HD12 LEU 38 -1.633 4.541 2.112 303 HD13 LEU 38 HD13 LEU 38 -1.410 4.019 3.783 304 HD21 LEU 38 HD21 LEU 38 -3.883 6.516 2.775 305 HD22 LEU 38 HD22 LEU 38 -5.261 5.427 2.637 306 HD23 LEU 38 HD23 LEU 38 -3.996 5.404 1.409 307 H ASN 39 H ASN 39 -6.981 3.804 4.524 308 HA ASN 39 HA ASN 39 -8.003 5.152 2.131 309 HB2 ASN 39 HB2 ASN 39 -10.385 4.715 3.087 310 HB3 ASN 39 HB3 ASN 39 -9.584 3.447 2.167 311 HD21 ASN 39 HD21 ASN 39 -10.700 4.426 5.299 312 HD22 ASN 39 HD22 ASN 39 -10.452 2.900 6.066 313 H ALA 40 H ALA 40 -8.753 7.197 2.445 314 HA ALA 40 HA ALA 40 -8.128 8.374 5.071 315 HB1 ALA 40 HB1 ALA 40 -8.401 9.700 2.370 316 HB2 ALA 40 HB2 ALA 40 -6.888 9.220 3.137 317 HB3 ALA 40 HB3 ALA 40 -7.882 10.480 3.866 318 H LYS 41 H LYS 41 -9.507 9.634 6.203 319 HA LYS 41 HA LYS 41 -12.052 10.516 5.152 320 HB2 LYS 41 HB2 LYS 41 -13.467 9.362 6.713 321 HB3 LYS 41 HB3 LYS 41 -12.487 8.156 5.895 322 HG2 LYS 41 HG2 LYS 41 -11.930 9.253 8.649 323 HG3 LYS 41 HG3 LYS 41 -12.751 7.729 8.313 324 HD2 LYS 41 HD2 LYS 41 -10.739 6.872 7.218 325 HD3 LYS 41 HD3 LYS 41 -9.919 8.411 7.484 326 HE2 LYS 41 HE2 LYS 41 -9.203 6.788 9.138 327 HE3 LYS 41 HE3 LYS 41 -10.122 8.075 9.917 328 HZ1 LYS 41 HZ1 LYS 41 -10.761 5.911 10.753 329 HZ2 LYS 41 HZ2 LYS 41 -11.166 5.393 9.196 330 HZ3 LYS 41 HZ3 LYS 41 -12.059 6.623 9.934 331 H ASP 42 H ASP 42 -12.876 12.277 6.286 332 HA ASP 42 HA ASP 42 -12.949 14.053 7.701 333 HB2 ASP 42 HB2 ASP 42 -11.925 11.933 9.586 334 HB3 ASP 42 HB3 ASP 42 -12.291 13.569 10.125 335 H GLY 43 H GLY 43 -10.470 13.674 6.107 336 HA2 GLY 43 HA2 GLY 43 -8.546 14.960 5.843 337 HA3 GLY 43 HA3 GLY 43 -8.827 15.663 7.428 338 H ILE 44 H ILE 44 -9.006 12.376 7.710 339 HA ILE 44 HA ILE 44 -6.152 12.096 8.451 340 HB ILE 44 HB ILE 44 -8.336 10.396 9.653 341 HG12 ILE 44 HG12 ILE 44 -7.532 13.151 10.637 342 HG13 ILE 44 HG13 ILE 44 -9.096 12.704 9.961 343 HG21 ILE 44 HG21 ILE 44 -5.664 11.353 10.694 344 HG22 ILE 44 HG22 ILE 44 -6.037 9.740 10.086 345 HG23 ILE 44 HG23 ILE 44 -6.789 10.316 11.572 346 HD11 ILE 44 HD11 ILE 44 -9.482 11.205 11.848 347 HD12 ILE 44 HD12 ILE 44 -9.195 12.862 12.378 348 HD13 ILE 44 HD13 ILE 44 -7.917 11.656 12.527 349 H PHE 45 H PHE 45 -5.469 9.664 8.383 350 HA PHE 45 HA PHE 45 -7.085 8.092 6.490 351 HB2 PHE 45 HB2 PHE 45 -5.198 7.423 5.174 352 HB3 PHE 45 HB3 PHE 45 -5.156 9.180 5.269 353 HD1 PHE 45 HD1 PHE 45 -3.525 6.063 6.311 354 HD2 PHE 45 HD2 PHE 45 -3.397 10.322 6.493 355 HE1 PHE 45 HE1 PHE 45 -1.224 5.958 7.162 356 HE2 PHE 45 HE2 PHE 45 -1.092 10.216 7.344 357 HZ PHE 45 HZ PHE 45 -0.009 8.032 7.684 358 H THR 46 H THR 46 -6.837 5.805 6.675 359 HA THR 46 HA THR 46 -5.272 4.880 9.009 360 HB THR 46 HB THR 46 -7.555 4.766 9.720 361 HG1 THR 46 HG1 THR 46 -7.428 2.098 9.086 362 HG21 THR 46 HG21 THR 46 -8.662 4.883 7.549 363 HG22 THR 46 HG22 THR 46 -9.282 3.531 8.496 364 HG23 THR 46 HG23 THR 46 -8.143 3.237 7.182 365 H CYS 47 H CYS 47 -3.710 3.558 8.397 366 HA CYS 47 HA CYS 47 -4.013 1.991 5.920 367 HB2 CYS 47 HB2 CYS 47 -2.173 3.614 5.886 368 HB3 CYS 47 HB3 CYS 47 -1.488 2.886 7.334 369 HG CYS 47 HG CYS 47 -0.887 0.454 6.097 370 H ASN 48 H ASN 48 -4.820 0.060 6.544 371 HA ASN 48 HA ASN 48 -3.809 -1.427 8.807 372 HB2 ASN 48 HB2 ASN 48 -5.700 -2.223 6.572 373 HB3 ASN 48 HB3 ASN 48 -5.354 -3.200 7.993 374 HD21 ASN 48 HD21 ASN 48 -6.318 -2.705 9.904 375 HD22 ASN 48 HD22 ASN 48 -7.542 -1.498 10.063 376 H LEU 49 H LEU 49 -1.762 -2.210 8.607 377 HA LEU 49 HA LEU 49 -0.888 -3.416 6.077 378 HB2 LEU 49 HB2 LEU 49 0.657 -1.823 6.995 379 HB3 LEU 49 HB3 LEU 49 0.610 -2.600 8.566 380 HG LEU 49 HG LEU 49 1.756 -4.575 7.624 381 HD11 LEU 49 HD11 LEU 49 1.849 -2.953 5.083 382 HD12 LEU 49 HD12 LEU 49 0.992 -4.475 5.336 383 HD13 LEU 49 HD13 LEU 49 2.754 -4.439 5.377 384 HD21 LEU 49 HD21 LEU 49 3.172 -1.956 7.127 385 HD22 LEU 49 HD22 LEU 49 3.953 -3.529 7.293 386 HD23 LEU 49 HD23 LEU 49 3.086 -2.828 8.659 387 H MET 50 H MET 50 -0.474 -5.558 5.830 388 HA MET 50 HA MET 50 -0.500 -7.292 8.220 389 HB2 MET 50 HB2 MET 50 -1.840 -7.857 5.567 390 HB3 MET 50 HB3 MET 50 -1.697 -9.006 6.890 391 HG2 MET 50 HG2 MET 50 -3.210 -6.402 6.946 392 HG3 MET 50 HG3 MET 50 -3.905 -8.018 6.849 393 HE1 MET 50 HE1 MET 50 -3.304 -9.891 8.817 394 HE2 MET 50 HE2 MET 50 -2.594 -9.433 10.365 395 HE3 MET 50 HE3 MET 50 -1.618 -9.373 8.898 396 H ILE 51 H ILE 51 1.436 -8.206 8.418 397 HA ILE 51 HA ILE 51 2.766 -9.370 6.079 398 HB ILE 51 HB ILE 51 4.982 -8.396 6.932 399 HG12 ILE 51 HG12 ILE 51 4.542 -6.002 7.912 400 HG13 ILE 51 HG13 ILE 51 3.011 -6.687 8.445 401 HG21 ILE 51 HG21 ILE 51 3.989 -7.746 4.818 402 HG22 ILE 51 HG22 ILE 51 4.725 -6.352 5.608 403 HG23 ILE 51 HG23 ILE 51 2.972 -6.558 5.635 404 HD11 ILE 51 HD11 ILE 51 4.645 -6.755 10.217 405 HD12 ILE 51 HD12 ILE 51 5.766 -7.654 9.192 406 HD13 ILE 51 HD13 ILE 51 4.249 -8.396 9.706 407 H PHE 52 H PHE 52 4.726 -10.715 6.753 408 HA PHE 52 HA PHE 52 4.049 -12.185 9.207 409 HB2 PHE 52 HB2 PHE 52 5.540 -12.898 6.703 410 HB3 PHE 52 HB3 PHE 52 5.879 -13.792 8.180 411 HD1 PHE 52 HD2 PHE 52 4.124 -15.127 9.257 412 HD2 PHE 52 HD1 PHE 52 3.479 -13.224 5.500 413 HE1 PHE 52 HE2 PHE 52 2.168 -16.566 8.871 414 HE2 PHE 52 HE1 PHE 52 1.523 -14.662 5.105 415 HZ PHE 52 HZ PHE 52 0.864 -16.337 6.791 416 H VAL 53 H VAL 53 5.429 -12.426 10.920 417 HA VAL 53 HA VAL 53 8.110 -11.196 10.728 418 HB VAL 53 HB VAL 53 7.910 -10.314 12.996 419 HG11 VAL 53 HG11 VAL 53 5.618 -9.448 11.234 420 HG12 VAL 53 HG12 VAL 53 7.270 -8.830 11.182 421 HG13 VAL 53 HG13 VAL 53 6.261 -8.536 12.600 422 HG21 VAL 53 HG21 VAL 53 6.373 -11.946 13.927 423 HG22 VAL 53 HG22 VAL 53 5.072 -11.335 12.904 424 HG23 VAL 53 HG23 VAL 53 5.756 -10.312 14.169 425 H LYS 54 H LYS 54 9.762 -12.226 11.763 426 HA LYS 54 HA LYS 54 9.454 -14.982 12.435 427 HB2 LYS 54 HB2 LYS 54 11.888 -14.893 12.867 428 HB3 LYS 54 HB3 LYS 54 11.447 -14.185 11.318 429 HG2 LYS 54 HG2 LYS 54 11.555 -11.934 12.375 430 HG3 LYS 54 HG3 LYS 54 12.145 -12.703 13.844 431 HD2 LYS 54 HD2 LYS 54 14.067 -11.928 12.707 432 HD3 LYS 54 HD3 LYS 54 14.019 -13.669 12.432 433 HE2 LYS 54 HE2 LYS 54 13.066 -13.316 10.218 434 HE3 LYS 54 HE3 LYS 54 13.015 -11.575 10.498 435 HZ1 LYS 54 HZ1 LYS 54 15.466 -11.650 10.733 436 HZ2 LYS 54 HZ2 LYS 54 14.922 -12.080 9.190 437 HZ3 LYS 54 HZ3 LYS 54 15.434 -13.277 10.269 438 H ASN 55 H ASN 55 9.384 -12.089 14.315 439 HA ASN 55 HA ASN 55 8.692 -13.579 16.671 440 HB2 ASN 55 HB2 ASN 55 10.344 -12.435 18.157 441 HB3 ASN 55 HB3 ASN 55 11.082 -13.573 17.037 442 HD21 ASN 55 HD21 ASN 55 12.530 -12.839 15.565 443 HD22 ASN 55 HD22 ASN 55 13.054 -11.196 15.452 444 H THR 56 H THR 56 8.003 -12.043 18.470 445 HA THR 56 HA THR 56 6.190 -10.206 17.215 446 HB THR 56 HB THR 56 6.490 -10.319 20.202 447 HG1 THR 56 HG1 THR 56 5.512 -12.377 18.489 448 HG21 THR 56 HG21 THR 56 4.795 -8.850 19.186 449 HG22 THR 56 HG22 THR 56 4.043 -10.157 20.102 450 HG23 THR 56 HG23 THR 56 4.105 -10.238 18.339 451 H ASP 57 H ASP 57 9.191 -9.894 18.969 452 HA ASP 57 HA ASP 57 9.078 -7.139 19.591 453 HB2 ASP 57 HB2 ASP 57 10.739 -8.671 20.575 454 HB3 ASP 57 HB3 ASP 57 11.492 -8.882 18.998 455 H LYS 58 H LYS 58 10.085 -8.911 16.738 456 HA LYS 58 HA LYS 58 11.040 -6.849 15.131 457 HB2 LYS 58 HB2 LYS 58 11.339 -9.067 14.379 458 HB3 LYS 58 HB3 LYS 58 9.635 -9.452 14.556 459 HG2 LYS 58 HG2 LYS 58 10.268 -9.295 12.217 460 HG3 LYS 58 HG3 LYS 58 9.093 -8.051 12.654 461 HD2 LYS 58 HD2 LYS 58 10.896 -6.396 12.811 462 HD3 LYS 58 HD3 LYS 58 12.085 -7.640 12.417 463 HE2 LYS 58 HE2 LYS 58 11.127 -7.924 10.217 464 HE3 LYS 58 HE3 LYS 58 9.814 -6.811 10.609 465 HZ1 LYS 58 HZ1 LYS 58 11.380 -5.022 10.776 466 HZ2 LYS 58 HZ2 LYS 58 11.594 -5.784 9.283 467 HZ3 LYS 58 HZ3 LYS 58 12.686 -6.063 10.541 468 H LEU 59 H LEU 59 7.716 -7.879 15.770 469 HA LEU 59 HA LEU 59 6.455 -6.243 13.833 470 HB2 LEU 59 HB2 LEU 59 5.296 -8.123 14.785 471 HB3 LEU 59 HB3 LEU 59 5.435 -7.454 16.401 472 HG LEU 59 HG LEU 59 3.926 -5.611 15.772 473 HD11 LEU 59 HD11 LEU 59 3.708 -7.049 13.129 474 HD12 LEU 59 HD12 LEU 59 4.420 -5.460 13.406 475 HD13 LEU 59 HD13 LEU 59 2.692 -5.705 13.652 476 HD21 LEU 59 HD21 LEU 59 2.814 -8.362 15.219 477 HD22 LEU 59 HD22 LEU 59 1.864 -6.933 15.625 478 HD23 LEU 59 HD23 LEU 59 2.993 -7.604 16.802 479 H THR 60 H THR 60 6.975 -5.725 17.340 480 HA THR 60 HA THR 60 5.776 -3.147 17.360 481 HB THR 60 HB THR 60 5.929 -4.312 19.436 482 HG1 THR 60 HG1 THR 60 6.345 -1.882 19.297 483 HG21 THR 60 HG21 THR 60 7.910 -5.631 19.063 484 HG22 THR 60 HG22 THR 60 8.079 -4.720 20.564 485 HG23 THR 60 HG23 THR 60 8.917 -4.186 19.108 486 H THR 61 H THR 61 9.027 -4.252 16.717 487 HA THR 61 HA THR 61 10.369 -1.778 16.680 488 HB THR 61 HB THR 61 10.826 -4.189 14.894 489 HG1 THR 61 HG1 THR 61 11.060 -4.200 17.386 490 HG21 THR 61 HG21 THR 61 12.632 -1.831 15.481 491 HG22 THR 61 HG22 THR 61 11.892 -2.219 13.926 492 HG23 THR 61 HG23 THR 61 13.113 -3.288 14.615 493 H LEU 62 H LEU 62 8.411 -3.397 14.198 494 HA LEU 62 HA LEU 62 8.761 -1.495 12.138 495 HB2 LEU 62 HB2 LEU 62 6.423 -3.323 12.707 496 HB3 LEU 62 HB3 LEU 62 6.642 -2.424 11.218 497 HG LEU 62 HG LEU 62 8.473 -4.601 12.245 498 HD11 LEU 62 HD11 LEU 62 6.520 -4.583 9.946 499 HD12 LEU 62 HD12 LEU 62 6.321 -5.448 11.471 500 HD13 LEU 62 HD13 LEU 62 7.619 -5.899 10.364 501 HD21 LEU 62 HD21 LEU 62 8.546 -3.060 9.647 502 HD22 LEU 62 HD22 LEU 62 9.601 -4.404 10.090 503 HD23 LEU 62 HD23 LEU 62 9.687 -2.885 10.981 504 H MET 63 H MET 63 6.416 -1.698 14.786 505 HA MET 63 HA MET 63 4.683 0.361 14.119 506 HB2 MET 63 HB2 MET 63 5.713 -0.231 16.906 507 HB3 MET 63 HB3 MET 63 4.214 0.593 16.501 508 HG2 MET 63 HG2 MET 63 3.317 -1.438 15.538 509 HG3 MET 63 HG3 MET 63 4.844 -2.275 15.827 510 HE1 MET 63 HE1 MET 63 2.727 -4.070 18.510 511 HE2 MET 63 HE2 MET 63 4.052 -4.253 17.360 512 HE3 MET 63 HE3 MET 63 2.450 -3.761 16.795 513 H ASP 64 H ASP 64 7.707 0.613 16.011 514 HA ASP 64 HA ASP 64 7.720 3.391 16.317 515 HB2 ASP 64 HB2 ASP 64 9.231 1.824 17.524 516 HB3 ASP 64 HB3 ASP 64 10.138 1.588 16.035 517 H LYS 65 H LYS 65 9.247 1.392 13.782 518 HA LYS 65 HA LYS 65 10.437 3.363 12.250 519 HB2 LYS 65 HB2 LYS 65 9.047 0.841 11.328 520 HB3 LYS 65 HB3 LYS 65 10.083 1.823 10.300 521 HG2 LYS 65 HG2 LYS 65 11.953 1.413 11.896 522 HG3 LYS 65 HG3 LYS 65 10.894 0.315 12.784 523 HD2 LYS 65 HD2 LYS 65 12.285 -0.987 11.306 524 HD3 LYS 65 HD3 LYS 65 10.630 -1.027 10.702 525 HE2 LYS 65 HE2 LYS 65 12.199 -0.716 8.868 526 HE3 LYS 65 HE3 LYS 65 11.193 0.718 9.065 527 HZ1 LYS 65 HZ1 LYS 65 13.940 0.449 10.164 528 HZ2 LYS 65 HZ2 LYS 65 12.988 1.846 10.143 529 HZ3 LYS 65 HZ3 LYS 65 13.574 1.204 8.696 530 H LEU 66 H LEU 66 7.044 2.386 12.281 531 HA LEU 66 HA LEU 66 6.282 4.199 10.167 532 HB2 LEU 66 HB2 LEU 66 4.622 2.626 12.140 533 HB3 LEU 66 HB3 LEU 66 3.986 3.480 10.746 534 HG LEU 66 HG LEU 66 5.989 1.224 10.533 535 HD11 LEU 66 HD11 LEU 66 4.113 -0.206 9.872 536 HD12 LEU 66 HD12 LEU 66 2.987 1.092 10.265 537 HD13 LEU 66 HD13 LEU 66 3.955 0.351 11.538 538 HD21 LEU 66 HD21 LEU 66 4.205 2.544 8.483 539 HD22 LEU 66 HD22 LEU 66 5.273 1.172 8.189 540 HD23 LEU 66 HD23 LEU 66 5.954 2.738 8.623 541 H ARG 67 H ARG 67 6.425 4.287 13.658 542 HA ARG 67 HA ARG 67 4.859 6.667 14.002 543 HB2 ARG 67 HB2 ARG 67 6.785 5.218 15.822 544 HB3 ARG 67 HB3 ARG 67 5.905 6.661 16.308 545 HG2 ARG 67 HG2 ARG 67 3.788 5.511 16.010 546 HG3 ARG 67 HG3 ARG 67 4.629 4.074 15.424 547 HD2 ARG 67 HD2 ARG 67 5.739 3.831 17.588 548 HD3 ARG 67 HD3 ARG 67 4.933 5.286 18.173 549 HE ARG 67 HE ARG 67 2.872 3.690 17.439 550 HH11 ARG 67 HH11 ARG 67 5.623 3.217 19.459 551 HH12 ARG 67 HH12 ARG 67 4.797 2.126 20.515 552 HH21 ARG 67 HH21 ARG 67 1.804 2.294 18.818 553 HH22 ARG 67 HH22 ARG 67 2.663 1.618 20.160 554 H LYS 68 H LYS 68 7.955 6.192 12.746 555 HA LYS 68 HA LYS 68 9.259 8.513 13.790 556 HB2 LYS 68 HB2 LYS 68 9.887 7.233 11.126 557 HB3 LYS 68 HB3 LYS 68 10.969 8.143 12.169 558 HG2 LYS 68 HG2 LYS 68 9.854 5.391 12.668 559 HG3 LYS 68 HG3 LYS 68 11.520 5.810 12.278 560 HD2 LYS 68 HD2 LYS 68 10.096 6.752 14.769 561 HD3 LYS 68 HD3 LYS 68 11.067 5.285 14.700 562 HE2 LYS 68 HE2 LYS 68 13.013 6.671 14.003 563 HE3 LYS 68 HE3 LYS 68 12.019 8.111 14.229 564 HZ1 LYS 68 HZ1 LYS 68 12.674 6.131 16.346 565 HZ2 LYS 68 HZ2 LYS 68 11.762 7.537 16.554 566 HZ3 LYS 68 HZ3 LYS 68 13.403 7.645 16.163 567 H VAL 69 H VAL 69 6.702 8.162 11.635 568 HA VAL 69 HA VAL 69 7.215 10.559 10.081 569 HB VAL 69 HB VAL 69 4.721 8.842 10.264 570 HG11 VAL 69 HG11 VAL 69 5.476 10.968 8.252 571 HG12 VAL 69 HG12 VAL 69 4.215 11.098 9.478 572 HG13 VAL 69 HG13 VAL 69 4.054 9.929 8.166 573 HG21 VAL 69 HG21 VAL 69 5.461 7.881 8.127 574 HG22 VAL 69 HG22 VAL 69 6.633 7.581 9.410 575 HG23 VAL 69 HG23 VAL 69 6.943 8.836 8.210 576 H GLN 70 H GLN 70 6.866 12.530 10.898 577 HA GLN 70 HA GLN 70 5.799 13.044 13.426 578 HB2 GLN 70 HB2 GLN 70 5.929 15.414 12.814 579 HB3 GLN 70 HB3 GLN 70 7.369 14.538 12.313 580 HG2 GLN 70 HG2 GLN 70 6.373 14.388 10.016 581 HG3 GLN 70 HG3 GLN 70 5.095 15.468 10.569 582 HE21 GLN 70 HE21 GLN 70 8.459 15.189 9.768 583 HE22 GLN 70 HE22 GLN 70 8.780 16.884 9.679 584 H GLY 71 H GLY 71 4.160 12.959 10.319 585 HA2 GLY 71 HA2 GLY 71 1.809 14.351 11.206 586 HA3 GLY 71 HA3 GLY 71 1.984 13.451 9.712 587 H VAL 72 H VAL 72 2.827 11.054 11.551 588 HA VAL 72 HA VAL 72 0.087 10.085 11.846 589 HB VAL 72 HB VAL 72 2.697 8.596 12.221 590 HG11 VAL 72 HG11 VAL 72 1.289 6.566 12.129 591 HG12 VAL 72 HG12 VAL 72 -0.152 7.582 12.105 592 HG13 VAL 72 HG13 VAL 72 0.899 7.578 13.521 593 HG21 VAL 72 HG21 VAL 72 2.172 7.568 10.050 594 HG22 VAL 72 HG22 VAL 72 2.366 9.315 9.906 595 HG23 VAL 72 HG23 VAL 72 0.751 8.605 9.904 596 H PHE 73 H PHE 73 -0.888 9.520 13.761 597 HA PHE 73 HA PHE 73 0.642 10.081 16.218 598 HB2 PHE 73 HB2 PHE 73 -1.802 10.721 17.081 599 HB3 PHE 73 HB3 PHE 73 -0.723 11.877 16.322 600 HD1 PHE 73 HD1 PHE 73 -3.745 9.828 15.839 601 HD2 PHE 73 HD2 PHE 73 -1.194 12.810 14.174 602 HE1 PHE 73 HE1 PHE 73 -5.464 10.366 14.158 603 HE2 PHE 73 HE2 PHE 73 -2.904 13.343 12.495 604 HZ PHE 73 HZ PHE 73 -5.039 12.130 12.484 605 H THR 74 H THR 74 -1.124 7.731 14.564 606 HA THR 74 HA THR 74 -1.029 6.078 16.999 607 HB THR 74 HB THR 74 -3.123 5.088 16.726 608 HG1 THR 74 HG1 THR 74 -4.277 5.084 14.848 609 HG21 THR 74 HG21 THR 74 -4.780 6.890 16.590 610 HG22 THR 74 HG22 THR 74 -3.566 7.957 15.884 611 HG23 THR 74 HG23 THR 74 -3.381 7.390 17.544 612 H VAL 75 H VAL 75 0.187 4.344 16.668 613 HA VAL 75 HA VAL 75 -0.147 2.809 14.190 614 HB VAL 75 HB VAL 75 2.590 3.352 15.386 615 HG11 VAL 75 HG11 VAL 75 1.795 1.885 12.868 616 HG12 VAL 75 HG12 VAL 75 2.360 1.139 14.364 617 HG13 VAL 75 HG13 VAL 75 3.443 2.169 13.430 618 HG21 VAL 75 HG21 VAL 75 1.782 5.369 14.279 619 HG22 VAL 75 HG22 VAL 75 1.383 4.437 12.834 620 HG23 VAL 75 HG23 VAL 75 3.068 4.620 13.326 621 H GLU 76 H GLU 76 -1.096 1.019 15.056 622 HA GLU 76 HA GLU 76 0.160 -0.225 17.426 623 HB2 GLU 76 HB2 GLU 76 -2.822 0.097 17.000 624 HB3 GLU 76 HB3 GLU 76 -2.059 -0.712 18.360 625 HG2 GLU 76 HG2 GLU 76 -1.960 2.227 17.705 626 HG3 GLU 76 HG3 GLU 76 -2.815 1.460 19.041 627 H ARG 77 H ARG 77 -0.593 -2.499 17.787 628 HA ARG 77 HA ARG 77 -0.537 -4.002 15.321 629 HB2 ARG 77 HB2 ARG 77 0.718 -4.850 17.201 630 HB3 ARG 77 HB3 ARG 77 -0.716 -4.857 18.219 631 HG2 ARG 77 HG2 ARG 77 -1.703 -6.595 16.740 632 HG3 ARG 77 HG3 ARG 77 -0.186 -6.633 15.836 633 HD2 ARG 77 HD2 ARG 77 1.015 -7.320 17.835 634 HD3 ARG 77 HD3 ARG 77 -0.463 -7.206 18.787 635 HE ARG 77 HE ARG 77 -0.695 -9.021 16.578 636 HH11 ARG 77 HH11 ARG 77 0.325 -8.672 19.847 637 HH12 ARG 77 HH12 ARG 77 0.209 -10.363 20.187 638 HH21 ARG 77 HH21 ARG 77 -0.861 -11.207 17.025 639 HH22 ARG 77 HH22 ARG 77 -0.449 -11.779 18.602 640 H LEU 78 H LEU 78 -2.163 -5.236 14.428 641 HA LEU 78 HA LEU 78 -4.888 -4.766 15.335 642 HB2 LEU 78 HB2 LEU 78 -3.748 -6.181 12.921 643 HB3 LEU 78 HB3 LEU 78 -5.467 -6.103 13.265 644 HG LEU 78 HG LEU 78 -3.699 -3.690 12.806 645 HD11 LEU 78 HD11 LEU 78 -3.934 -5.047 10.774 646 HD12 LEU 78 HD12 LEU 78 -4.776 -3.504 10.637 647 HD13 LEU 78 HD13 LEU 78 -5.690 -4.983 10.939 648 HD21 LEU 78 HD21 LEU 78 -6.697 -3.959 13.083 649 HD22 LEU 78 HD22 LEU 78 -5.838 -2.482 12.644 650 HD23 LEU 78 HD23 LEU 78 -5.600 -3.199 14.237 651 H SER 79 H SER 79 -5.350 -5.970 17.109 652 HA SER 79 HA SER 79 -4.473 -8.629 17.579 653 HB2 SER 79 HB2 SER 79 -6.235 -8.643 19.359 654 HB3 SER 79 HB3 SER 79 -5.185 -7.229 19.436 655 HG SER 79 HG SER 79 -6.930 -6.085 19.290 656 H ASN 80 H ASN 80 -7.613 -7.349 16.488 657 HA ASN 80 HA ASN 80 -8.582 -9.971 15.758 658 HB2 ASN 80 HB2 ASN 80 -10.150 -8.244 16.547 659 HB3 ASN 80 HB3 ASN 80 -9.725 -7.221 15.177 660 HD21 ASN 80 HD21 ASN 80 -11.830 -7.188 14.399 661 HD22 ASN 80 HD22 ASN 80 -12.557 -8.563 13.653 662 H LEU 81 H LEU 81 -8.395 -10.937 13.816 663 HA LEU 81 HA LEU 81 -7.499 -9.374 11.512 664 HB2 LEU 81 HB2 LEU 81 -6.365 -12.020 12.443 665 HB3 LEU 81 HB3 LEU 81 -6.068 -11.332 10.857 666 HG LEU 81 HG LEU 81 -5.140 -10.266 13.527 667 HD11 LEU 81 HD11 LEU 81 -3.806 -12.077 12.582 668 HD12 LEU 81 HD12 LEU 81 -2.917 -10.555 12.539 669 HD13 LEU 81 HD13 LEU 81 -3.650 -11.190 11.061 670 HD21 LEU 81 HD21 LEU 81 -4.118 -8.407 12.287 671 HD22 LEU 81 HD22 LEU 81 -5.876 -8.374 12.174 672 HD23 LEU 81 HD23 LEU 81 -4.918 -8.951 10.812 673 H GLU 82 H GLU 82 -8.829 -9.627 9.917 674 HA GLU 82 HA GLU 82 -10.964 -11.544 9.984 675 HB2 GLU 82 HB2 GLU 82 -11.816 -10.361 8.064 676 HB3 GLU 82 HB3 GLU 82 -11.271 -9.200 9.265 677 HG2 GLU 82 HG2 GLU 82 -9.663 -10.049 6.880 678 HG3 GLU 82 HG3 GLU 82 -10.706 -8.641 6.918 679 H HIS 83 H HIS 83 -8.269 -12.620 9.661 680 HA HIS 83 HA HIS 83 -8.155 -13.490 6.867 681 HB2 HIS 83 HB2 HIS 83 -6.035 -13.671 9.019 682 HB3 HIS 83 HB3 HIS 83 -5.825 -14.044 7.317 683 HD1 HIS 83 HD1 HIS 83 -4.728 -12.214 6.055 684 HD2 HIS 83 HD2 HIS 83 -6.907 -10.790 9.279 685 HE1 HIS 83 HE1 HIS 83 -4.336 -9.742 6.100 686 HE2 HIS 83 HE2 HIS 83 -5.944 -8.888 7.831 687 H HIS 84 H HIS 84 -9.232 -14.638 9.842 688 HA HIS 84 HA HIS 84 -8.283 -17.349 9.624 689 HB2 HIS 84 HB2 HIS 84 -10.428 -16.151 11.391 690 HB3 HIS 84 HB3 HIS 84 -9.847 -17.810 11.507 691 HD1 HIS 84 HD1 HIS 84 -7.236 -18.049 12.155 692 HD2 HIS 84 HD2 HIS 84 -8.966 -14.327 12.816 693 HE1 HIS 84 HE1 HIS 84 -5.684 -16.855 13.723 694 HE2 HIS 84 HE2 HIS 84 -6.790 -14.643 14.179 695 H HIS 85 H HIS 85 -8.909 -17.969 7.571 696 HA HIS 85 HA HIS 85 -11.708 -18.842 7.334 697 HB2 HIS 85 HB2 HIS 85 -10.162 -17.382 5.166 698 HB3 HIS 85 HB3 HIS 85 -11.706 -18.187 4.918 699 HD1 HIS 85 HD1 HIS 85 -13.801 -17.083 6.066 700 HD2 HIS 85 HD2 HIS 85 -10.310 -14.840 6.241 701 HE1 HIS 85 HE1 HIS 85 -14.521 -14.769 6.705 702 HE2 HIS 85 HE2 HIS 85 -12.425 -13.390 6.564 703 H HIS 86 H HIS 86 -11.615 -20.098 4.912 704 HA HIS 86 HA HIS 86 -9.475 -22.086 5.198 705 HB2 HIS 86 HB2 HIS 86 -11.959 -22.076 3.458 706 HB3 HIS 86 HB3 HIS 86 -10.780 -23.384 3.519 707 HD1 HIS 86 HD1 HIS 86 -10.621 -24.693 5.822 708 HD2 HIS 86 HD2 HIS 86 -13.853 -22.114 5.456 709 HE1 HIS 86 HE1 HIS 86 -12.221 -25.365 7.629 710 HE2 HIS 86 HE2 HIS 86 -14.245 -23.923 7.262 711 H HIS 87 H HIS 87 -7.673 -21.862 4.035 712 HA HIS 87 HA HIS 87 -7.029 -19.780 2.411 713 HB2 HIS 87 HB2 HIS 87 -5.311 -21.240 3.259 714 HB3 HIS 87 HB3 HIS 87 -5.917 -22.591 2.308 715 HD1 HIS 87 HD1 HIS 87 -4.053 -19.334 1.936 716 HD2 HIS 87 HD2 HIS 87 -5.025 -22.686 -0.327 717 HE1 HIS 87 HE1 HIS 87 -2.728 -19.127 -0.189 718 HE2 HIS 87 HE2 HIS 87 -3.497 -21.049 -1.616 719 H HIS 88 H HIS 88 -7.554 -19.085 0.475 720 HA HIS 88 HA HIS 88 -8.664 -20.925 -1.527 721 HB2 HIS 88 HB2 HIS 88 -8.578 -17.893 -1.466 722 HB3 HIS 88 HB3 HIS 88 -9.309 -18.859 -2.746 723 HD1 HIS 88 HD1 HIS 88 -11.439 -20.302 -2.021 724 HD2 HIS 88 HD2 HIS 88 -10.216 -17.410 0.700 725 HE1 HIS 88 HE1 HIS 88 -13.385 -19.972 -0.476 726 HE2 HIS 88 HE2 HIS 88 -12.664 -18.152 1.101 727 H1 MET 1 H1 MET 1 -9.893 23.497 -15.023 728 H2 MET 1 H2 MET 1 -8.400 24.125 -14.549 729 H3 MET 1 H3 MET 1 -9.621 23.897 -13.405 730 HA MET 1 HA MET 1 -8.244 21.757 -14.921 731 HB2 MET 1 HB2 MET 1 -8.069 22.493 -11.986 732 HB3 MET 1 HB3 MET 1 -7.262 21.126 -12.749 733 HG2 MET 1 HG2 MET 1 -6.762 24.051 -13.251 734 HG3 MET 1 HG3 MET 1 -5.682 22.901 -12.461 735 HE1 MET 1 HE1 MET 1 -4.888 24.858 -14.934 736 HE2 MET 1 HE2 MET 1 -3.879 23.752 -15.866 737 HE3 MET 1 HE3 MET 1 -3.751 23.791 -14.107 738 H THR 2 H THR 2 -8.861 19.590 -14.317 739 HA THR 2 HA THR 2 -11.369 19.324 -12.817 740 HB THR 2 HB THR 2 -12.085 19.709 -15.131 741 HG1 THR 2 HG1 THR 2 -12.449 16.978 -14.368 742 HG21 THR 2 HG21 THR 2 -10.104 18.860 -16.300 743 HG22 THR 2 HG22 THR 2 -11.572 18.094 -16.901 744 HG23 THR 2 HG23 THR 2 -10.506 17.216 -15.803 745 H ASP 3 H ASP 3 -8.631 18.425 -12.316 746 HA ASP 3 HA ASP 3 -8.073 15.783 -12.773 747 HB2 ASP 3 HB2 ASP 3 -7.787 17.224 -10.124 748 HB3 ASP 3 HB3 ASP 3 -6.909 15.775 -10.606 749 H PHE 4 H PHE 4 -9.301 13.988 -12.559 750 HA PHE 4 HA PHE 4 -11.503 14.019 -10.607 751 HB2 PHE 4 HB2 PHE 4 -12.659 12.443 -12.068 752 HB3 PHE 4 HB3 PHE 4 -12.208 13.884 -12.970 753 HD1 PHE 4 HD1 PHE 4 -11.522 10.304 -12.474 754 HD2 PHE 4 HD2 PHE 4 -10.603 13.775 -14.775 755 HE1 PHE 4 HE1 PHE 4 -10.384 8.898 -14.140 756 HE2 PHE 4 HE2 PHE 4 -9.471 12.366 -16.445 757 HZ PHE 4 HZ PHE 4 -9.348 9.923 -16.118 758 H LEU 5 H LEU 5 -12.101 11.939 -9.681 759 HA LEU 5 HA LEU 5 -9.781 10.545 -8.700 760 HB2 LEU 5 HB2 LEU 5 -11.607 11.135 -7.216 761 HB3 LEU 5 HB3 LEU 5 -12.723 10.202 -8.188 762 HG LEU 5 HG LEU 5 -11.586 8.121 -7.532 763 HD11 LEU 5 HD11 LEU 5 -9.821 9.911 -5.855 764 HD12 LEU 5 HD12 LEU 5 -9.322 8.983 -7.270 765 HD13 LEU 5 HD13 LEU 5 -9.842 8.148 -5.808 766 HD21 LEU 5 HD21 LEU 5 -12.330 9.873 -5.185 767 HD22 LEU 5 HD22 LEU 5 -12.226 8.112 -5.161 768 HD23 LEU 5 HD23 LEU 5 -13.439 8.909 -6.161 769 H ALA 6 H ALA 6 -8.871 8.990 -9.846 770 HA ALA 6 HA ALA 6 -10.518 7.222 -11.534 771 HB1 ALA 6 HB1 ALA 6 -7.575 7.861 -11.724 772 HB2 ALA 6 HB2 ALA 6 -8.849 8.541 -12.735 773 HB3 ALA 6 HB3 ALA 6 -8.482 6.817 -12.818 774 H GLY 7 H GLY 7 -10.128 4.970 -11.513 775 HA2 GLY 7 HA2 GLY 7 -8.640 3.970 -9.152 776 HA3 GLY 7 HA3 GLY 7 -10.135 3.253 -9.733 777 H ILE 8 H ILE 8 -7.345 2.182 -9.369 778 HA ILE 8 HA ILE 8 -7.079 0.984 -12.054 779 HB ILE 8 HB ILE 8 -4.766 1.685 -10.211 780 HG12 ILE 8 HG12 ILE 8 -5.600 2.914 -12.860 781 HG13 ILE 8 HG13 ILE 8 -5.717 3.685 -11.283 782 HG21 ILE 8 HG21 ILE 8 -4.747 0.484 -12.988 783 HG22 ILE 8 HG22 ILE 8 -4.356 -0.359 -11.489 784 HG23 ILE 8 HG23 ILE 8 -3.325 0.954 -12.056 785 HD11 ILE 8 HD11 ILE 8 -3.281 3.652 -11.088 786 HD12 ILE 8 HD12 ILE 8 -3.814 4.520 -12.529 787 HD13 ILE 8 HD13 ILE 8 -3.168 2.885 -12.672 788 H ARG 9 H ARG 9 -6.528 -1.210 -12.103 789 HA ARG 9 HA ARG 9 -6.440 -2.628 -9.514 790 HB2 ARG 9 HB2 ARG 9 -8.652 -2.882 -10.571 791 HB3 ARG 9 HB3 ARG 9 -7.886 -3.504 -12.027 792 HG2 ARG 9 HG2 ARG 9 -7.036 -5.426 -10.742 793 HG3 ARG 9 HG3 ARG 9 -7.861 -4.810 -9.307 794 HD2 ARG 9 HD2 ARG 9 -10.008 -4.961 -10.510 795 HD3 ARG 9 HD3 ARG 9 -9.164 -5.636 -11.902 796 HE ARG 9 HE ARG 9 -9.041 -7.011 -9.311 797 HH11 ARG 9 HH11 ARG 9 -9.936 -6.972 -12.643 798 HH12 ARG 9 HH12 ARG 9 -10.468 -8.616 -12.624 799 HH21 ARG 9 HH21 ARG 9 -9.708 -9.105 -9.304 800 HH22 ARG 9 HH22 ARG 9 -10.331 -9.822 -10.750 801 H ILE 10 H ILE 10 -4.591 -3.712 -9.287 802 HA ILE 10 HA ILE 10 -3.085 -4.540 -11.702 803 HB ILE 10 HB ILE 10 -1.991 -4.056 -8.918 804 HG12 ILE 10 HG12 ILE 10 -1.802 -2.196 -11.305 805 HG13 ILE 10 HG13 ILE 10 -2.948 -1.984 -9.986 806 HG21 ILE 10 HG21 ILE 10 -0.633 -5.563 -10.269 807 HG22 ILE 10 HG22 ILE 10 0.193 -4.021 -10.042 808 HG23 ILE 10 HG23 ILE 10 -0.595 -4.380 -11.578 809 HD11 ILE 10 HD11 ILE 10 -1.042 -0.546 -9.683 810 HD12 ILE 10 HD12 ILE 10 0.054 -1.925 -9.773 811 HD13 ILE 10 HD13 ILE 10 -1.067 -1.775 -8.418 812 H VAL 11 H VAL 11 -3.166 -6.723 -12.057 813 HA VAL 11 HA VAL 11 -3.132 -8.486 -9.684 814 HB VAL 11 HB VAL 11 -4.523 -8.931 -12.329 815 HG11 VAL 11 HG11 VAL 11 -5.177 -11.137 -11.482 816 HG12 VAL 11 HG12 VAL 11 -4.143 -10.900 -10.073 817 HG13 VAL 11 HG13 VAL 11 -3.429 -11.010 -11.681 818 HG21 VAL 11 HG21 VAL 11 -5.739 -7.569 -10.694 819 HG22 VAL 11 HG22 VAL 11 -5.554 -8.844 -9.486 820 HG23 VAL 11 HG23 VAL 11 -6.527 -9.130 -10.932 821 H GLY 12 H GLY 12 -1.318 -9.530 -9.426 822 HA2 GLY 12 HA2 GLY 12 0.126 -10.625 -11.742 823 HA3 GLY 12 HA3 GLY 12 0.999 -9.557 -10.650 824 H GLU 13 H GLU 13 2.060 -11.986 -10.933 825 HA GLU 13 HA GLU 13 0.963 -14.004 -9.248 826 HB2 GLU 13 HB2 GLU 13 3.074 -15.185 -9.586 827 HB3 GLU 13 HB3 GLU 13 2.469 -14.534 -11.104 828 HG2 GLU 13 HG2 GLU 13 4.067 -12.738 -11.039 829 HG3 GLU 13 HG3 GLU 13 4.602 -13.217 -9.429 830 H ASP 14 H ASP 14 1.383 -14.561 -7.148 831 HA ASP 14 HA ASP 14 2.416 -12.532 -5.414 832 HB2 ASP 14 HB2 ASP 14 0.549 -13.869 -4.663 833 HB3 ASP 14 HB3 ASP 14 1.473 -15.355 -4.865 834 H LYS 15 H LYS 15 4.615 -12.428 -6.318 835 HA LYS 15 HA LYS 15 6.436 -14.508 -5.439 836 HB2 LYS 15 HB2 LYS 15 6.656 -12.030 -7.065 837 HB3 LYS 15 HB3 LYS 15 8.107 -12.601 -6.247 838 HG2 LYS 15 HG2 LYS 15 7.980 -14.710 -7.357 839 HG3 LYS 15 HG3 LYS 15 6.421 -14.294 -8.077 840 HD2 LYS 15 HD2 LYS 15 7.359 -12.849 -9.611 841 HD3 LYS 15 HD3 LYS 15 8.753 -12.497 -8.585 842 HE2 LYS 15 HE2 LYS 15 9.362 -13.824 -10.555 843 HE3 LYS 15 HE3 LYS 15 9.691 -14.663 -9.045 844 HZ1 LYS 15 HZ1 LYS 15 7.340 -15.146 -10.787 845 HZ2 LYS 15 HZ2 LYS 15 7.709 -15.974 -9.360 846 HZ3 LYS 15 HZ3 LYS 15 8.718 -16.122 -10.705 847 H ASN 16 H ASN 16 8.292 -14.048 -4.156 848 HA ASN 16 HA ASN 16 7.678 -12.798 -1.678 849 HB2 ASN 16 HB2 ASN 16 9.835 -13.643 -0.988 850 HB3 ASN 16 HB3 ASN 16 9.014 -14.851 -1.964 851 HD21 ASN 16 HD21 ASN 16 9.720 -13.278 -4.455 852 HD22 ASN 16 HD22 ASN 16 11.373 -13.661 -4.731 853 H GLY 17 H GLY 17 7.472 -10.730 -3.408 854 HA2 GLY 17 HA2 GLY 17 8.997 -8.675 -2.363 855 HA3 GLY 17 HA3 GLY 17 9.858 -9.213 -3.798 856 H MET 18 H MET 18 7.261 -9.909 -5.136 857 HA MET 18 HA MET 18 6.870 -7.637 -6.666 858 HB2 MET 18 HB2 MET 18 5.214 -10.084 -6.146 859 HB3 MET 18 HB3 MET 18 4.516 -8.777 -7.091 860 HG2 MET 18 HG2 MET 18 7.129 -10.115 -7.751 861 HG3 MET 18 HG3 MET 18 5.572 -10.591 -8.429 862 HE1 MET 18 HE1 MET 18 4.531 -7.278 -10.289 863 HE2 MET 18 HE2 MET 18 4.215 -7.632 -8.593 864 HE3 MET 18 HE3 MET 18 4.019 -8.896 -9.807 865 H THR 19 H THR 19 4.780 -8.712 -3.964 866 HA THR 19 HA THR 19 2.925 -6.627 -4.085 867 HB THR 19 HB THR 19 2.461 -7.128 -1.684 868 HG1 THR 19 HG1 THR 19 3.722 -8.834 -0.735 869 HG21 THR 19 HG21 THR 19 2.863 -9.577 -3.416 870 HG22 THR 19 HG22 THR 19 1.453 -8.516 -3.447 871 HG23 THR 19 HG23 THR 19 1.808 -9.470 -2.005 872 H ASN 20 H ASN 20 6.134 -6.695 -2.645 873 HA ASN 20 HA ASN 20 5.854 -4.223 -1.204 874 HB2 ASN 20 HB2 ASN 20 8.319 -5.815 -1.968 875 HB3 ASN 20 HB3 ASN 20 8.327 -4.415 -0.901 876 HD21 ASN 20 HD21 ASN 20 7.656 -4.644 1.189 877 HD22 ASN 20 HD22 ASN 20 7.292 -6.173 1.904 878 H GLN 21 H GLN 21 7.325 -5.191 -4.287 879 HA GLN 21 HA GLN 21 8.409 -2.613 -4.836 880 HB2 GLN 21 HB2 GLN 21 9.047 -3.478 -6.963 881 HB3 GLN 21 HB3 GLN 21 9.296 -4.749 -5.783 882 HG2 GLN 21 HG2 GLN 21 7.246 -5.838 -6.495 883 HG3 GLN 21 HG3 GLN 21 6.934 -4.531 -7.636 884 HE21 GLN 21 HE21 GLN 21 8.967 -7.271 -6.922 885 HE22 GLN 21 HE22 GLN 21 9.641 -7.423 -8.503 886 H ILE 22 H ILE 22 5.387 -4.205 -5.635 887 HA ILE 22 HA ILE 22 4.566 -2.565 -7.755 888 HB ILE 22 HB ILE 22 3.075 -4.294 -5.797 889 HG12 ILE 22 HG12 ILE 22 4.406 -5.399 -7.532 890 HG13 ILE 22 HG13 ILE 22 2.690 -5.660 -7.818 891 HG21 ILE 22 HG21 ILE 22 1.824 -2.697 -8.039 892 HG22 ILE 22 HG22 ILE 22 1.538 -2.480 -6.311 893 HG23 ILE 22 HG23 ILE 22 1.022 -3.966 -7.110 894 HD11 ILE 22 HD11 ILE 22 3.908 -5.196 -9.879 895 HD12 ILE 22 HD12 ILE 22 4.406 -3.632 -9.232 896 HD13 ILE 22 HD13 ILE 22 2.700 -3.955 -9.545 897 H THR 23 H THR 23 3.605 -2.355 -4.292 898 HA THR 23 HA THR 23 2.225 0.114 -4.746 899 HB THR 23 HB THR 23 3.123 -0.786 -2.008 900 HG1 THR 23 HG1 THR 23 1.140 -1.917 -3.691 901 HG21 THR 23 HG21 THR 23 2.003 1.383 -2.182 902 HG22 THR 23 HG22 THR 23 0.976 0.218 -1.347 903 HG23 THR 23 HG23 THR 23 0.653 0.628 -3.031 904 H GLY 24 H GLY 24 5.461 -0.777 -3.752 905 HA2 GLY 24 HA2 GLY 24 6.428 1.700 -2.868 906 HA3 GLY 24 HA3 GLY 24 7.396 0.454 -3.641 907 H VAL 25 H VAL 25 6.285 0.391 -6.191 908 HA VAL 25 HA VAL 25 7.387 2.713 -7.416 909 HB VAL 25 HB VAL 25 5.666 0.510 -8.585 910 HG11 VAL 25 HG11 VAL 25 6.450 1.284 -10.790 911 HG12 VAL 25 HG12 VAL 25 7.233 2.664 -10.019 912 HG13 VAL 25 HG13 VAL 25 5.477 2.508 -9.974 913 HG21 VAL 25 HG21 VAL 25 7.830 -0.283 -9.513 914 HG22 VAL 25 HG22 VAL 25 7.789 -0.303 -7.751 915 HG23 VAL 25 HG23 VAL 25 8.652 0.981 -8.596 916 H ILE 26 H ILE 26 4.065 1.692 -6.717 917 HA ILE 26 HA ILE 26 2.641 3.677 -8.054 918 HB ILE 26 HB ILE 26 2.034 2.281 -5.444 919 HG12 ILE 26 HG12 ILE 26 0.939 1.890 -8.246 920 HG13 ILE 26 HG13 ILE 26 2.119 0.851 -7.460 921 HG21 ILE 26 HG21 ILE 26 0.217 4.076 -7.056 922 HG22 ILE 26 HG22 ILE 26 0.826 4.378 -5.429 923 HG23 ILE 26 HG23 ILE 26 -0.296 3.050 -5.716 924 HD11 ILE 26 HD11 ILE 26 -0.729 1.281 -6.586 925 HD12 ILE 26 HD12 ILE 26 0.452 0.264 -5.759 926 HD13 ILE 26 HD13 ILE 26 -0.079 -0.147 -7.390 927 H SER 27 H SER 27 4.038 3.792 -4.773 928 HA SER 27 HA SER 27 3.030 6.290 -4.001 929 HB2 SER 27 HB2 SER 27 4.748 6.329 -2.290 930 HB3 SER 27 HB3 SER 27 4.160 4.675 -2.462 931 HG SER 27 HG SER 27 6.019 4.095 -3.439 932 H LYS 28 H LYS 28 5.544 5.566 -6.265 933 HA LYS 28 HA LYS 28 6.872 8.125 -6.069 934 HB2 LYS 28 HB2 LYS 28 7.141 6.018 -8.224 935 HB3 LYS 28 HB3 LYS 28 8.238 7.362 -7.933 936 HG2 LYS 28 HG2 LYS 28 8.663 6.357 -5.647 937 HG3 LYS 28 HG3 LYS 28 7.788 4.931 -6.212 938 HD2 LYS 28 HD2 LYS 28 10.291 6.099 -7.447 939 HD3 LYS 28 HD3 LYS 28 10.193 4.628 -6.479 940 HE2 LYS 28 HE2 LYS 28 8.636 3.696 -8.212 941 HE3 LYS 28 HE3 LYS 28 8.977 5.115 -9.199 942 HZ1 LYS 28 HZ1 LYS 28 11.337 4.492 -9.146 943 HZ2 LYS 28 HZ2 LYS 28 10.377 3.304 -9.868 944 HZ3 LYS 28 HZ3 LYS 28 10.944 3.086 -8.290 945 H PHE 29 H PHE 29 3.923 7.344 -7.341 946 HA PHE 29 HA PHE 29 4.015 8.729 -9.840 947 HB2 PHE 29 HB2 PHE 29 1.671 7.999 -8.068 948 HB3 PHE 29 HB3 PHE 29 1.508 8.730 -9.661 949 HD1 PHE 29 HD1 PHE 29 4.055 6.984 -10.629 950 HD2 PHE 29 HD2 PHE 29 0.261 6.141 -8.872 951 HE1 PHE 29 HE1 PHE 29 4.061 4.761 -11.679 952 HE2 PHE 29 HE2 PHE 29 0.275 3.916 -9.918 953 HZ PHE 29 HZ PHE 29 2.173 3.223 -11.326 954 H ASP 30 H ASP 30 2.964 10.747 -10.351 955 HA ASP 30 HA ASP 30 3.713 12.895 -8.669 956 HB2 ASP 30 HB2 ASP 30 1.671 13.150 -10.875 957 HB3 ASP 30 HB3 ASP 30 2.908 14.303 -10.378 958 H THR 31 H THR 31 0.903 10.959 -8.743 959 HA THR 31 HA THR 31 -0.845 12.999 -7.590 960 HB THR 31 HB THR 31 -1.821 11.669 -9.356 961 HG1 THR 31 HG1 THR 31 -3.672 11.464 -8.319 962 HG21 THR 31 HG21 THR 31 -1.269 9.249 -7.626 963 HG22 THR 31 HG22 THR 31 -0.429 9.656 -9.122 964 HG23 THR 31 HG23 THR 31 -2.146 9.253 -9.156 965 H ASN 32 H ASN 32 -2.210 12.428 -5.731 966 HA ASN 32 HA ASN 32 -0.603 11.103 -3.656 967 HB2 ASN 32 HB2 ASN 32 -1.200 13.437 -3.223 968 HB3 ASN 32 HB3 ASN 32 -2.908 13.058 -3.425 969 HD21 ASN 32 HD21 ASN 32 -3.320 13.826 -1.330 970 HD22 ASN 32 HD22 ASN 32 -2.910 12.901 0.066 971 H ILE 33 H ILE 33 -1.259 9.272 -2.707 972 HA ILE 33 HA ILE 33 -3.426 7.788 -3.782 973 HB ILE 33 HB ILE 33 -1.783 7.266 -1.295 974 HG12 ILE 33 HG12 ILE 33 -1.531 6.153 -4.106 975 HG13 ILE 33 HG13 ILE 33 -0.466 7.359 -3.392 976 HG21 ILE 33 HG21 ILE 33 -3.911 6.061 -1.219 977 HG22 ILE 33 HG22 ILE 33 -2.565 4.951 -1.464 978 HG23 ILE 33 HG23 ILE 33 -3.598 5.393 -2.822 979 HD11 ILE 33 HD11 ILE 33 0.228 5.710 -1.705 980 HD12 ILE 33 HD12 ILE 33 0.580 5.194 -3.354 981 HD13 ILE 33 HD13 ILE 33 -0.795 4.505 -2.489 982 H ARG 34 H ARG 34 -5.516 7.790 -3.239 983 HA ARG 34 HA ARG 34 -6.318 9.068 -0.706 984 HB2 ARG 34 HB2 ARG 34 -8.145 8.336 -3.000 985 HB3 ARG 34 HB3 ARG 34 -8.466 9.451 -1.677 986 HG2 ARG 34 HG2 ARG 34 -6.656 9.837 -4.047 987 HG3 ARG 34 HG3 ARG 34 -8.062 10.789 -3.574 988 HD2 ARG 34 HD2 ARG 34 -5.420 10.654 -2.107 989 HD3 ARG 34 HD3 ARG 34 -5.983 11.986 -3.112 990 HE ARG 34 HE ARG 34 -7.857 12.141 -1.402 991 HH11 ARG 34 HH11 ARG 34 -4.714 10.978 -0.582 992 HH12 ARG 34 HH12 ARG 34 -4.788 11.614 1.027 993 HH21 ARG 34 HH21 ARG 34 -7.930 12.936 0.661 994 HH22 ARG 34 HH22 ARG 34 -6.568 12.725 1.705 995 H THR 35 H THR 35 -6.524 6.113 -2.555 996 HA THR 35 HA THR 35 -6.980 4.603 -0.123 997 HB THR 35 HB THR 35 -8.900 4.270 -2.454 998 HG1 THR 35 HG1 THR 35 -9.058 5.695 -0.065 999 HG21 THR 35 HG21 THR 35 -8.402 2.153 -1.327 1000 HG22 THR 35 HG22 THR 35 -10.053 2.668 -0.985 1001 HG23 THR 35 HG23 THR 35 -8.795 2.879 0.233 1002 H ILE 36 H ILE 36 -5.784 2.752 -0.197 1003 HA ILE 36 HA ILE 36 -5.246 1.501 -2.803 1004 HB ILE 36 HB ILE 36 -3.261 2.899 -2.269 1005 HG12 ILE 36 HG12 ILE 36 -1.554 1.087 -2.515 1006 HG13 ILE 36 HG13 ILE 36 -2.809 -0.098 -2.164 1007 HG21 ILE 36 HG21 ILE 36 -3.345 2.836 0.158 1008 HG22 ILE 36 HG22 ILE 36 -1.778 2.265 -0.416 1009 HG23 ILE 36 HG23 ILE 36 -2.987 1.108 0.143 1010 HD11 ILE 36 HD11 ILE 36 -2.353 0.090 -4.551 1011 HD12 ILE 36 HD12 ILE 36 -2.796 1.797 -4.502 1012 HD13 ILE 36 HD13 ILE 36 -4.008 0.561 -4.167 1013 H VAL 37 H VAL 37 -5.585 -0.626 -2.755 1014 HA VAL 37 HA VAL 37 -5.445 -2.050 -0.167 1015 HB VAL 37 HB VAL 37 -7.544 -2.486 -2.316 1016 HG11 VAL 37 HG11 VAL 37 -7.181 -3.825 0.371 1017 HG12 VAL 37 HG12 VAL 37 -6.954 -4.574 -1.210 1018 HG13 VAL 37 HG13 VAL 37 -8.561 -4.052 -0.704 1019 HG21 VAL 37 HG21 VAL 37 -7.961 -0.429 -1.070 1020 HG22 VAL 37 HG22 VAL 37 -7.818 -1.305 0.455 1021 HG23 VAL 37 HG23 VAL 37 -9.150 -1.661 -0.644 1022 H LEU 38 H LEU 38 -4.567 -4.110 -0.223 1023 HA LEU 38 HA LEU 38 -4.033 -5.360 -2.818 1024 HB2 LEU 38 HB2 LEU 38 -2.046 -3.975 -2.225 1025 HB3 LEU 38 HB3 LEU 38 -1.862 -4.904 -0.752 1026 HG LEU 38 HG LEU 38 -1.771 -6.274 -3.438 1027 HD11 LEU 38 HD11 LEU 38 0.564 -4.951 -2.043 1028 HD12 LEU 38 HD12 LEU 38 -0.157 -4.442 -3.571 1029 HD13 LEU 38 HD13 LEU 38 0.664 -5.999 -3.460 1030 HD21 LEU 38 HD21 LEU 38 -0.518 -6.896 -0.756 1031 HD22 LEU 38 HD22 LEU 38 -0.336 -7.861 -2.222 1032 HD23 LEU 38 HD23 LEU 38 -1.919 -7.702 -1.464 1033 H ASN 39 H ASN 39 -4.537 -7.477 -2.754 1034 HA ASN 39 HA ASN 39 -4.055 -8.999 -0.300 1035 HB2 ASN 39 HB2 ASN 39 -6.257 -10.001 -0.254 1036 HB3 ASN 39 HB3 ASN 39 -6.435 -8.252 -0.206 1037 HD21 ASN 39 HD21 ASN 39 -7.232 -7.184 -2.056 1038 HD22 ASN 39 HD22 ASN 39 -8.099 -8.039 -3.278 1039 H ALA 40 H ALA 40 -3.649 -11.198 -0.629 1040 HA ALA 40 HA ALA 40 -3.254 -11.988 -3.460 1041 HB1 ALA 40 HB1 ALA 40 -1.175 -11.762 -2.172 1042 HB2 ALA 40 HB2 ALA 40 -1.448 -13.431 -2.671 1043 HB3 ALA 40 HB3 ALA 40 -1.761 -12.946 -1.005 1044 H LYS 41 H LYS 41 -4.506 -13.506 -4.197 1045 HA LYS 41 HA LYS 41 -5.448 -15.711 -2.485 1046 HB2 LYS 41 HB2 LYS 41 -7.694 -15.519 -3.355 1047 HB3 LYS 41 HB3 LYS 41 -7.230 -13.946 -2.709 1048 HG2 LYS 41 HG2 LYS 41 -6.647 -13.210 -4.989 1049 HG3 LYS 41 HG3 LYS 41 -7.202 -14.764 -5.608 1050 HD2 LYS 41 HD2 LYS 41 -9.445 -14.225 -4.549 1051 HD3 LYS 41 HD3 LYS 41 -8.825 -12.584 -4.318 1052 HE2 LYS 41 HE2 LYS 41 -10.022 -12.582 -6.377 1053 HE3 LYS 41 HE3 LYS 41 -8.301 -12.552 -6.776 1054 HZ1 LYS 41 HZ1 LYS 41 -10.115 -14.899 -6.885 1055 HZ2 LYS 41 HZ2 LYS 41 -8.438 -14.998 -7.069 1056 HZ3 LYS 41 HZ3 LYS 41 -9.358 -14.127 -8.186 1057 H ASP 42 H ASP 42 -5.823 -17.676 -3.662 1058 HA ASP 42 HA ASP 42 -5.460 -19.249 -5.273 1059 HB2 ASP 42 HB2 ASP 42 -5.872 -16.911 -7.159 1060 HB3 ASP 42 HB3 ASP 42 -5.909 -18.609 -7.619 1061 H GLY 43 H GLY 43 -3.175 -17.505 -4.272 1062 HA2 GLY 43 HA2 GLY 43 -0.874 -17.567 -4.594 1063 HA3 GLY 43 HA3 GLY 43 -1.131 -18.444 -6.093 1064 H ILE 44 H ILE 44 -3.070 -15.737 -6.126 1065 HA ILE 44 HA ILE 44 -1.043 -14.107 -7.545 1066 HB ILE 44 HB ILE 44 -4.020 -14.072 -8.079 1067 HG12 ILE 44 HG12 ILE 44 -1.918 -15.720 -9.508 1068 HG13 ILE 44 HG13 ILE 44 -3.206 -16.344 -8.479 1069 HG21 ILE 44 HG21 ILE 44 -3.363 -13.083 -10.223 1070 HG22 ILE 44 HG22 ILE 44 -1.668 -13.169 -9.742 1071 HG23 ILE 44 HG23 ILE 44 -2.783 -12.126 -8.860 1072 HD11 ILE 44 HD11 ILE 44 -3.729 -16.622 -10.835 1073 HD12 ILE 44 HD12 ILE 44 -3.582 -14.883 -11.087 1074 HD13 ILE 44 HD13 ILE 44 -4.868 -15.521 -10.061 1075 H PHE 45 H PHE 45 -1.574 -11.700 -7.451 1076 HA PHE 45 HA PHE 45 -3.190 -11.038 -5.063 1077 HB2 PHE 45 HB2 PHE 45 -1.654 -9.405 -4.322 1078 HB3 PHE 45 HB3 PHE 45 -0.652 -10.786 -4.749 1079 HD1 PHE 45 HD2 PHE 45 -1.634 -7.375 -5.658 1080 HD2 PHE 45 HD1 PHE 45 0.849 -10.692 -6.651 1081 HE1 PHE 45 HE2 PHE 45 -0.323 -5.936 -7.157 1082 HE2 PHE 45 HE1 PHE 45 2.167 -9.251 -8.150 1083 HZ PHE 45 HZ PHE 45 1.572 -6.877 -8.408 1084 H THR 46 H THR 46 -4.376 -9.118 -5.125 1085 HA THR 46 HA THR 46 -4.388 -7.649 -7.686 1086 HB THR 46 HB THR 46 -6.402 -8.936 -7.748 1087 HG1 THR 46 HG1 THR 46 -7.741 -6.740 -6.907 1088 HG21 THR 46 HG21 THR 46 -7.016 -7.882 -4.981 1089 HG22 THR 46 HG22 THR 46 -6.579 -9.543 -5.387 1090 HG23 THR 46 HG23 THR 46 -8.098 -8.861 -5.971 1091 H CYS 47 H CYS 47 -4.043 -5.546 -7.479 1092 HA CYS 47 HA CYS 47 -4.316 -4.302 -4.814 1093 HB2 CYS 47 HB2 CYS 47 -1.998 -4.461 -5.667 1094 HB3 CYS 47 HB3 CYS 47 -2.463 -3.518 -7.079 1095 HG CYS 47 HG CYS 47 -2.830 -2.249 -3.937 1096 H ASN 48 H ASN 48 -5.746 -2.696 -4.583 1097 HA ASN 48 HA ASN 48 -6.992 -1.512 -6.975 1098 HB2 ASN 48 HB2 ASN 48 -7.944 -1.549 -4.093 1099 HB3 ASN 48 HB3 ASN 48 -8.811 -0.816 -5.437 1100 HD21 ASN 48 HD21 ASN 48 -10.592 -2.130 -5.159 1101 HD22 ASN 48 HD22 ASN 48 -10.585 -3.813 -5.548 1102 H LEU 49 H LEU 49 -5.944 0.308 -7.564 1103 HA LEU 49 HA LEU 49 -4.951 2.153 -5.504 1104 HB2 LEU 49 HB2 LEU 49 -3.314 1.486 -7.148 1105 HB3 LEU 49 HB3 LEU 49 -4.380 1.949 -8.462 1106 HG LEU 49 HG LEU 49 -4.178 4.313 -7.798 1107 HD11 LEU 49 HD11 LEU 49 -3.803 4.041 -5.416 1108 HD12 LEU 49 HD12 LEU 49 -2.501 4.986 -6.137 1109 HD13 LEU 49 HD13 LEU 49 -2.236 3.291 -5.726 1110 HD21 LEU 49 HD21 LEU 49 -2.645 3.390 -9.471 1111 HD22 LEU 49 HD22 LEU 49 -1.510 2.948 -8.195 1112 HD23 LEU 49 HD23 LEU 49 -1.864 4.647 -8.511 1113 H MET 50 H MET 50 -6.123 3.889 -4.992 1114 HA MET 50 HA MET 50 -7.916 5.071 -7.028 1115 HB2 MET 50 HB2 MET 50 -8.180 5.133 -4.011 1116 HB3 MET 50 HB3 MET 50 -9.262 5.938 -5.142 1117 HG2 MET 50 HG2 MET 50 -8.845 2.970 -4.840 1118 HG3 MET 50 HG3 MET 50 -10.266 3.897 -4.364 1119 HE1 MET 50 HE1 MET 50 -11.368 5.167 -8.017 1120 HE2 MET 50 HE2 MET 50 -10.127 5.926 -7.022 1121 HE3 MET 50 HE3 MET 50 -11.642 5.392 -6.289 1122 H ILE 51 H ILE 51 -7.010 6.828 -7.870 1123 HA ILE 51 HA ILE 51 -5.857 8.875 -6.113 1124 HB ILE 51 HB ILE 51 -3.923 9.143 -7.772 1125 HG12 ILE 51 HG12 ILE 51 -3.272 6.760 -8.695 1126 HG13 ILE 51 HG13 ILE 51 -5.008 6.475 -8.631 1127 HG21 ILE 51 HG21 ILE 51 -4.003 6.728 -5.971 1128 HG22 ILE 51 HG22 ILE 51 -3.552 8.373 -5.522 1129 HG23 ILE 51 HG23 ILE 51 -2.538 7.454 -6.634 1130 HD11 ILE 51 HD11 ILE 51 -3.630 8.666 -10.174 1131 HD12 ILE 51 HD12 ILE 51 -5.370 8.367 -10.125 1132 HD13 ILE 51 HD13 ILE 51 -4.288 7.172 -10.840 1133 H PHE 52 H PHE 52 -5.519 10.968 -7.217 1134 HA PHE 52 HA PHE 52 -7.635 11.450 -9.169 1135 HB2 PHE 52 HB2 PHE 52 -5.940 13.257 -7.455 1136 HB3 PHE 52 HB3 PHE 52 -6.878 13.907 -8.796 1137 HD1 PHE 52 HD2 PHE 52 -9.315 13.828 -8.766 1138 HD2 PHE 52 HD1 PHE 52 -7.019 12.497 -5.432 1139 HE1 PHE 52 HE2 PHE 52 -11.324 13.916 -7.357 1140 HE2 PHE 52 HE1 PHE 52 -9.031 12.587 -4.011 1141 HZ PHE 52 HZ PHE 52 -11.186 13.299 -4.973 1142 H VAL 53 H VAL 53 -7.359 12.137 -11.249 1143 HA VAL 53 HA VAL 53 -4.599 12.554 -12.226 1144 HB VAL 53 HB VAL 53 -5.011 11.298 -14.239 1145 HG11 VAL 53 HG11 VAL 53 -4.210 9.979 -12.372 1146 HG12 VAL 53 HG12 VAL 53 -5.311 9.023 -13.370 1147 HG13 VAL 53 HG13 VAL 53 -5.868 9.694 -11.836 1148 HG21 VAL 53 HG21 VAL 53 -7.356 11.791 -14.569 1149 HG22 VAL 53 HG22 VAL 53 -7.787 10.800 -13.175 1150 HG23 VAL 53 HG23 VAL 53 -7.092 10.048 -14.612 1151 H LYS 54 H LYS 54 -4.321 14.150 -13.706 1152 HA LYS 54 HA LYS 54 -6.260 16.141 -14.132 1153 HB2 LYS 54 HB2 LYS 54 -4.635 17.001 -15.847 1154 HB3 LYS 54 HB3 LYS 54 -3.933 16.699 -14.261 1155 HG2 LYS 54 HG2 LYS 54 -2.997 14.595 -15.043 1156 HG3 LYS 54 HG3 LYS 54 -3.746 14.828 -16.623 1157 HD2 LYS 54 HD2 LYS 54 -1.709 16.697 -15.402 1158 HD3 LYS 54 HD3 LYS 54 -1.324 15.411 -16.548 1159 HE2 LYS 54 HE2 LYS 54 -2.866 16.484 -18.183 1160 HE3 LYS 54 HE3 LYS 54 -3.086 17.812 -17.045 1161 HZ1 LYS 54 HZ1 LYS 54 -1.416 18.287 -18.754 1162 HZ2 LYS 54 HZ2 LYS 54 -0.477 16.993 -18.200 1163 HZ3 LYS 54 HZ3 LYS 54 -0.757 18.320 -17.199 1164 H ASN 55 H ASN 55 -5.283 13.394 -16.141 1165 HA ASN 55 HA ASN 55 -7.540 13.905 -17.954 1166 HB2 ASN 55 HB2 ASN 55 -4.675 13.457 -18.826 1167 HB3 ASN 55 HB3 ASN 55 -6.058 13.406 -19.911 1168 HD21 ASN 55 HD21 ASN 55 -3.672 15.153 -19.742 1169 HD22 ASN 55 HD22 ASN 55 -4.304 16.762 -19.750 1170 H THR 56 H THR 56 -8.081 12.065 -19.324 1171 HA THR 56 HA THR 56 -8.049 9.548 -18.040 1172 HB THR 56 HB THR 56 -8.932 8.642 -20.178 1173 HG1 THR 56 HG1 THR 56 -8.873 9.813 -21.998 1174 HG21 THR 56 HG21 THR 56 -10.969 10.000 -20.280 1175 HG22 THR 56 HG22 THR 56 -10.161 11.298 -19.399 1176 HG23 THR 56 HG23 THR 56 -10.470 9.752 -18.606 1177 H ASP 57 H ASP 57 -6.077 10.865 -20.677 1178 HA ASP 57 HA ASP 57 -4.585 8.553 -21.274 1179 HB2 ASP 57 HB2 ASP 57 -2.826 10.274 -22.040 1180 HB3 ASP 57 HB3 ASP 57 -4.390 10.278 -22.845 1181 H LYS 58 H LYS 58 -4.004 11.162 -18.972 1182 HA LYS 58 HA LYS 58 -1.566 10.342 -17.930 1183 HB2 LYS 58 HB2 LYS 58 -2.351 12.447 -17.250 1184 HB3 LYS 58 HB3 LYS 58 -3.928 11.819 -16.793 1185 HG2 LYS 58 HG2 LYS 58 -2.670 12.432 -14.828 1186 HG3 LYS 58 HG3 LYS 58 -2.928 10.687 -14.896 1187 HD2 LYS 58 HD2 LYS 58 -0.642 10.361 -15.710 1188 HD3 LYS 58 HD3 LYS 58 -0.383 12.106 -15.725 1189 HE2 LYS 58 HE2 LYS 58 -0.664 12.177 -13.302 1190 HE3 LYS 58 HE3 LYS 58 -0.970 10.441 -13.273 1191 HZ1 LYS 58 HZ1 LYS 58 1.546 11.632 -14.292 1192 HZ2 LYS 58 HZ2 LYS 58 1.247 10.006 -13.949 1193 HZ3 LYS 58 HZ3 LYS 58 1.346 11.132 -12.693 1194 H LEU 59 H LEU 59 -4.848 9.263 -17.110 1195 HA LEU 59 HA LEU 59 -4.127 7.465 -15.045 1196 HB2 LEU 59 HB2 LEU 59 -6.415 8.205 -15.309 1197 HB3 LEU 59 HB3 LEU 59 -6.500 7.504 -16.914 1198 HG LEU 59 HG LEU 59 -6.307 5.244 -15.937 1199 HD11 LEU 59 HD11 LEU 59 -6.516 4.925 -13.523 1200 HD12 LEU 59 HD12 LEU 59 -6.417 6.669 -13.278 1201 HD13 LEU 59 HD13 LEU 59 -5.036 5.789 -13.934 1202 HD21 LEU 59 HD21 LEU 59 -8.509 6.158 -16.379 1203 HD22 LEU 59 HD22 LEU 59 -8.532 6.938 -14.797 1204 HD23 LEU 59 HD23 LEU 59 -8.545 5.179 -14.912 1205 H THR 60 H THR 60 -4.683 6.942 -18.538 1206 HA THR 60 HA THR 60 -4.126 4.163 -18.521 1207 HB THR 60 HB THR 60 -3.881 4.308 -20.946 1208 HG1 THR 60 HG1 THR 60 -3.705 6.247 -21.995 1209 HG21 THR 60 HG21 THR 60 -6.100 6.106 -19.947 1210 HG22 THR 60 HG22 THR 60 -6.157 4.346 -20.037 1211 HG23 THR 60 HG23 THR 60 -6.052 5.303 -21.516 1212 H THR 61 H THR 61 -2.054 6.970 -18.631 1213 HA THR 61 HA THR 61 0.313 5.695 -19.518 1214 HB THR 61 HB THR 61 0.005 8.164 -17.785 1215 HG1 THR 61 HG1 THR 61 -0.839 8.122 -20.048 1216 HG21 THR 61 HG21 THR 61 2.254 7.197 -17.541 1217 HG22 THR 61 HG22 THR 61 2.306 8.715 -18.439 1218 HG23 THR 61 HG23 THR 61 2.436 7.178 -19.295 1219 H LEU 62 H LEU 62 -1.035 6.221 -16.269 1220 HA LEU 62 HA LEU 62 1.087 5.113 -14.797 1221 HB2 LEU 62 HB2 LEU 62 -1.873 5.051 -14.186 1222 HB3 LEU 62 HB3 LEU 62 -0.605 4.654 -13.039 1223 HG LEU 62 HG LEU 62 -1.144 7.358 -14.280 1224 HD11 LEU 62 HD11 LEU 62 -1.568 8.034 -11.967 1225 HD12 LEU 62 HD12 LEU 62 -1.298 6.375 -11.432 1226 HD13 LEU 62 HD13 LEU 62 -2.666 6.755 -12.481 1227 HD21 LEU 62 HD21 LEU 62 1.265 7.008 -14.097 1228 HD22 LEU 62 HD22 LEU 62 1.081 6.533 -12.408 1229 HD23 LEU 62 HD23 LEU 62 0.710 8.184 -12.907 1230 H MET 63 H MET 63 -1.657 3.597 -16.421 1231 HA MET 63 HA MET 63 -1.306 0.943 -15.643 1232 HB2 MET 63 HB2 MET 63 -2.120 1.972 -18.375 1233 HB3 MET 63 HB3 MET 63 -2.381 0.339 -17.780 1234 HG2 MET 63 HG2 MET 63 -3.897 1.148 -16.092 1235 HG3 MET 63 HG3 MET 63 -3.560 2.821 -16.547 1236 HE1 MET 63 HE1 MET 63 -6.543 1.648 -16.361 1237 HE2 MET 63 HE2 MET 63 -7.215 2.423 -17.798 1238 HE3 MET 63 HE3 MET 63 -6.097 3.310 -16.759 1239 H ASP 64 H ASP 64 0.195 2.710 -18.335 1240 HA ASP 64 HA ASP 64 1.802 0.700 -19.397 1241 HB2 ASP 64 HB2 ASP 64 1.467 2.891 -20.454 1242 HB3 ASP 64 HB3 ASP 64 2.367 3.668 -19.160 1243 H LYS 65 H LYS 65 2.608 3.067 -16.858 1244 HA LYS 65 HA LYS 65 5.221 2.239 -16.318 1245 HB2 LYS 65 HB2 LYS 65 3.164 3.442 -14.453 1246 HB3 LYS 65 HB3 LYS 65 4.880 3.332 -14.094 1247 HG2 LYS 65 HG2 LYS 65 5.266 4.697 -16.200 1248 HG3 LYS 65 HG3 LYS 65 3.526 4.980 -16.212 1249 HD2 LYS 65 HD2 LYS 65 4.318 6.849 -15.087 1250 HD3 LYS 65 HD3 LYS 65 3.890 5.774 -13.757 1251 HE2 LYS 65 HE2 LYS 65 6.673 6.091 -14.898 1252 HE3 LYS 65 HE3 LYS 65 6.081 6.905 -13.454 1253 HZ1 LYS 65 HZ1 LYS 65 7.411 4.897 -13.002 1254 HZ2 LYS 65 HZ2 LYS 65 6.235 3.954 -13.758 1255 HZ3 LYS 65 HZ3 LYS 65 5.856 4.815 -12.351 1256 H LEU 66 H LEU 66 2.182 1.155 -14.826 1257 HA LEU 66 HA LEU 66 3.423 -0.684 -13.021 1258 HB2 LEU 66 HB2 LEU 66 0.563 -0.506 -13.992 1259 HB3 LEU 66 HB3 LEU 66 1.109 -1.453 -12.619 1260 HG LEU 66 HG LEU 66 1.386 1.553 -12.780 1261 HD11 LEU 66 HD11 LEU 66 -0.967 1.023 -12.819 1262 HD12 LEU 66 HD12 LEU 66 -0.526 1.651 -11.232 1263 HD13 LEU 66 HD13 LEU 66 -0.777 -0.080 -11.458 1264 HD21 LEU 66 HD21 LEU 66 1.641 -0.372 -10.465 1265 HD22 LEU 66 HD22 LEU 66 1.758 1.385 -10.364 1266 HD23 LEU 66 HD23 LEU 66 2.965 0.474 -11.269 1267 H ARG 67 H ARG 67 2.215 -0.894 -16.286 1268 HA ARG 67 HA ARG 67 2.019 -3.734 -16.447 1269 HB2 ARG 67 HB2 ARG 67 0.788 -2.138 -17.899 1270 HB3 ARG 67 HB3 ARG 67 2.304 -1.697 -18.669 1271 HG2 ARG 67 HG2 ARG 67 2.545 -3.933 -19.566 1272 HG3 ARG 67 HG3 ARG 67 1.103 -4.465 -18.696 1273 HD2 ARG 67 HD2 ARG 67 1.159 -2.323 -20.827 1274 HD3 ARG 67 HD3 ARG 67 0.662 -3.994 -21.084 1275 HE ARG 67 HE ARG 67 -1.162 -3.540 -19.473 1276 HH11 ARG 67 HH11 ARG 67 0.338 -0.883 -21.071 1277 HH12 ARG 67 HH12 ARG 67 -1.060 0.127 -20.941 1278 HH21 ARG 67 HH21 ARG 67 -2.953 -2.261 -19.330 1279 HH22 ARG 67 HH22 ARG 67 -2.916 -0.652 -19.969 1280 H LYS 68 H LYS 68 4.699 -1.641 -16.442 1281 HA LYS 68 HA LYS 68 6.446 -3.113 -18.157 1282 HB2 LYS 68 HB2 LYS 68 7.131 -1.193 -15.918 1283 HB3 LYS 68 HB3 LYS 68 8.245 -1.765 -17.154 1284 HG2 LYS 68 HG2 LYS 68 5.791 -0.074 -17.611 1285 HG3 LYS 68 HG3 LYS 68 7.466 0.477 -17.656 1286 HD2 LYS 68 HD2 LYS 68 7.901 -0.996 -19.569 1287 HD3 LYS 68 HD3 LYS 68 6.230 -1.565 -19.516 1288 HE2 LYS 68 HE2 LYS 68 5.430 0.685 -19.992 1289 HE3 LYS 68 HE3 LYS 68 7.083 1.294 -19.985 1290 HZ1 LYS 68 HZ1 LYS 68 6.338 0.961 -22.230 1291 HZ2 LYS 68 HZ2 LYS 68 5.934 -0.649 -21.909 1292 HZ3 LYS 68 HZ3 LYS 68 7.551 -0.164 -21.881 1293 H VAL 69 H VAL 69 5.294 -3.746 -15.004 1294 HA VAL 69 HA VAL 69 7.645 -5.145 -14.059 1295 HB VAL 69 HB VAL 69 4.841 -5.157 -12.912 1296 HG11 VAL 69 HG11 VAL 69 6.156 -7.057 -12.149 1297 HG12 VAL 69 HG12 VAL 69 5.952 -5.896 -10.836 1298 HG13 VAL 69 HG13 VAL 69 7.487 -5.988 -11.702 1299 HG21 VAL 69 HG21 VAL 69 5.708 -3.486 -11.317 1300 HG22 VAL 69 HG22 VAL 69 5.731 -2.894 -12.977 1301 HG23 VAL 69 HG23 VAL 69 7.226 -3.433 -12.212 1302 H GLN 70 H GLN 70 8.192 -7.109 -14.704 1303 HA GLN 70 HA GLN 70 6.733 -8.781 -16.381 1304 HB2 GLN 70 HB2 GLN 70 8.426 -10.496 -15.855 1305 HB3 GLN 70 HB3 GLN 70 9.155 -8.921 -16.148 1306 HG2 GLN 70 HG2 GLN 70 9.404 -8.567 -13.750 1307 HG3 GLN 70 HG3 GLN 70 8.631 -10.119 -13.427 1308 HE21 GLN 70 HE21 GLN 70 9.756 -12.018 -13.898 1309 HE22 GLN 70 HE22 GLN 70 11.470 -12.027 -14.113 1310 H GLY 71 H GLY 71 6.773 -8.675 -12.861 1311 HA2 GLY 71 HA2 GLY 71 5.540 -11.194 -12.394 1312 HA3 GLY 71 HA3 GLY 71 5.619 -9.857 -11.261 1313 H VAL 72 H VAL 72 4.203 -8.148 -13.398 1314 HA VAL 72 HA VAL 72 1.487 -8.951 -12.626 1315 HB VAL 72 HB VAL 72 2.409 -6.381 -13.939 1316 HG11 VAL 72 HG11 VAL 72 -0.262 -7.096 -12.709 1317 HG12 VAL 72 HG12 VAL 72 0.061 -6.913 -14.432 1318 HG13 VAL 72 HG13 VAL 72 0.189 -5.519 -13.360 1319 HG21 VAL 72 HG21 VAL 72 2.061 -5.355 -11.731 1320 HG22 VAL 72 HG22 VAL 72 3.318 -6.591 -11.689 1321 HG23 VAL 72 HG23 VAL 72 1.712 -6.948 -11.054 1322 H PHE 73 H PHE 73 -0.108 -9.470 -14.071 1323 HA PHE 73 HA PHE 73 0.628 -9.451 -16.924 1324 HB2 PHE 73 HB2 PHE 73 -1.129 -11.486 -16.916 1325 HB3 PHE 73 HB3 PHE 73 0.602 -11.696 -16.721 1326 HD1 PHE 73 HD1 PHE 73 -2.631 -11.661 -14.951 1327 HD2 PHE 73 HD2 PHE 73 1.545 -12.441 -14.667 1328 HE1 PHE 73 HE1 PHE 73 -2.994 -12.821 -12.811 1329 HE2 PHE 73 HE2 PHE 73 1.188 -13.597 -12.527 1330 HZ PHE 73 HZ PHE 73 -1.079 -13.789 -11.596 1331 H THR 74 H THR 74 -1.691 -8.442 -14.607 1332 HA THR 74 HA THR 74 -3.330 -7.437 -16.852 1333 HB THR 74 HB THR 74 -5.356 -7.904 -15.888 1334 HG1 THR 74 HG1 THR 74 -5.756 -7.560 -13.839 1335 HG21 THR 74 HG21 THR 74 -5.388 -10.161 -14.959 1336 HG22 THR 74 HG22 THR 74 -3.657 -10.063 -14.632 1337 HG23 THR 74 HG23 THR 74 -4.242 -10.064 -16.297 1338 H VAL 75 H VAL 75 -3.495 -5.300 -16.908 1339 HA VAL 75 HA VAL 75 -3.411 -3.775 -14.378 1340 HB VAL 75 HB VAL 75 -2.297 -2.795 -17.022 1341 HG11 VAL 75 HG11 VAL 75 -3.100 -1.018 -15.561 1342 HG12 VAL 75 HG12 VAL 75 -1.341 -0.987 -15.675 1343 HG13 VAL 75 HG13 VAL 75 -2.119 -1.645 -14.235 1344 HG21 VAL 75 HG21 VAL 75 -0.774 -3.810 -14.611 1345 HG22 VAL 75 HG22 VAL 75 -0.064 -3.104 -16.063 1346 HG23 VAL 75 HG23 VAL 75 -0.923 -4.641 -16.160 1347 H GLU 76 H GLU 76 -5.458 -3.073 -14.069 1348 HA GLU 76 HA GLU 76 -7.131 -2.482 -16.441 1349 HB2 GLU 76 HB2 GLU 76 -7.962 -3.696 -13.792 1350 HB3 GLU 76 HB3 GLU 76 -9.024 -3.388 -15.158 1351 HG2 GLU 76 HG2 GLU 76 -8.027 -5.082 -16.456 1352 HG3 GLU 76 HG3 GLU 76 -6.639 -5.204 -15.376 1353 H ARG 77 H ARG 77 -8.959 -1.037 -16.085 1354 HA ARG 77 HA ARG 77 -8.487 0.989 -14.011 1355 HB2 ARG 77 HB2 ARG 77 -8.686 1.911 -16.230 1356 HB3 ARG 77 HB3 ARG 77 -10.178 1.027 -16.519 1357 HG2 ARG 77 HG2 ARG 77 -11.344 2.367 -14.870 1358 HG3 ARG 77 HG3 ARG 77 -9.844 3.194 -14.445 1359 HD2 ARG 77 HD2 ARG 77 -11.261 4.553 -15.915 1360 HD3 ARG 77 HD3 ARG 77 -9.716 4.164 -16.664 1361 HE ARG 77 HE ARG 77 -11.239 2.245 -17.676 1362 HH11 ARG 77 HH11 ARG 77 -12.012 5.585 -17.251 1363 HH12 ARG 77 HH12 ARG 77 -12.909 5.670 -18.729 1364 HH21 ARG 77 HH21 ARG 77 -12.418 2.378 -19.556 1365 HH22 ARG 77 HH22 ARG 77 -13.139 3.888 -20.005 1366 H LEU 78 H LEU 78 -9.992 1.449 -12.451 1367 HA LEU 78 HA LEU 78 -12.237 -0.407 -12.143 1368 HB2 LEU 78 HB2 LEU 78 -10.984 1.575 -10.232 1369 HB3 LEU 78 HB3 LEU 78 -12.365 0.566 -9.837 1370 HG LEU 78 HG LEU 78 -9.615 -0.464 -10.569 1371 HD11 LEU 78 HD11 LEU 78 -9.609 0.670 -8.404 1372 HD12 LEU 78 HD12 LEU 78 -9.397 -1.070 -8.221 1373 HD13 LEU 78 HD13 LEU 78 -10.960 -0.332 -7.868 1374 HD21 LEU 78 HD21 LEU 78 -10.473 -2.639 -9.823 1375 HD22 LEU 78 HD22 LEU 78 -11.385 -2.019 -11.198 1376 HD23 LEU 78 HD23 LEU 78 -12.068 -1.924 -9.575 1377 H SER 79 H SER 79 -14.024 0.249 -13.183 1378 HA SER 79 HA SER 79 -14.635 3.047 -13.586 1379 HB2 SER 79 HB2 SER 79 -16.588 2.215 -14.844 1380 HB3 SER 79 HB3 SER 79 -15.100 1.427 -15.365 1381 HG SER 79 HG SER 79 -17.297 0.252 -14.587 1382 H ASN 80 H ASN 80 -16.407 0.350 -12.057 1383 HA ASN 80 HA ASN 80 -18.297 2.128 -10.821 1384 HB2 ASN 80 HB2 ASN 80 -17.833 -0.828 -10.329 1385 HB3 ASN 80 HB3 ASN 80 -19.235 0.101 -9.801 1386 HD21 ASN 80 HD21 ASN 80 -17.661 -1.433 -12.468 1387 HD22 ASN 80 HD22 ASN 80 -18.961 -1.261 -13.590 1388 H LEU 81 H LEU 81 -17.442 3.473 -9.322 1389 HA LEU 81 HA LEU 81 -15.594 2.428 -7.303 1390 HB2 LEU 81 HB2 LEU 81 -16.441 5.278 -7.837 1391 HB3 LEU 81 HB3 LEU 81 -15.181 4.768 -6.729 1392 HG LEU 81 HG LEU 81 -15.144 4.576 -9.746 1393 HD11 LEU 81 HD11 LEU 81 -13.212 6.070 -9.552 1394 HD12 LEU 81 HD12 LEU 81 -13.421 6.124 -7.801 1395 HD13 LEU 81 HD13 LEU 81 -14.663 6.797 -8.860 1396 HD21 LEU 81 HD21 LEU 81 -14.127 2.566 -8.848 1397 HD22 LEU 81 HD22 LEU 81 -13.127 3.524 -7.755 1398 HD23 LEU 81 HD23 LEU 81 -12.881 3.630 -9.498 1399 H GLU 82 H GLU 82 -15.902 2.687 -5.089 1400 HA GLU 82 HA GLU 82 -18.715 2.904 -4.227 1401 HB2 GLU 82 HB2 GLU 82 -17.954 1.634 -2.236 1402 HB3 GLU 82 HB3 GLU 82 -17.644 0.776 -3.741 1403 HG2 GLU 82 HG2 GLU 82 -15.293 1.506 -3.663 1404 HG3 GLU 82 HG3 GLU 82 -15.612 2.337 -2.142 1405 H HIS 83 H HIS 83 -17.071 5.299 -4.665 1406 HA HIS 83 HA HIS 83 -16.225 6.140 -1.992 1407 HB2 HIS 83 HB2 HIS 83 -15.831 7.416 -4.704 1408 HB3 HIS 83 HB3 HIS 83 -15.254 8.114 -3.192 1409 HD1 HIS 83 HD1 HIS 83 -12.877 7.577 -2.740 1410 HD2 HIS 83 HD2 HIS 83 -14.739 4.577 -4.927 1411 HE1 HIS 83 HE1 HIS 83 -11.098 5.872 -3.201 1412 HE2 HIS 83 HE2 HIS 83 -12.327 3.952 -4.261 1413 H HIS 84 H HIS 84 -19.014 6.406 -3.841 1414 HA HIS 84 HA HIS 84 -20.094 8.180 -1.812 1415 HB2 HIS 84 HB2 HIS 84 -21.355 9.528 -3.572 1416 HB3 HIS 84 HB3 HIS 84 -19.642 9.877 -3.389 1417 HD1 HIS 84 HD1 HIS 84 -18.396 10.027 -5.500 1418 HD2 HIS 84 HD2 HIS 84 -21.810 7.697 -5.909 1419 HE1 HIS 84 HE1 HIS 84 -18.521 9.451 -7.933 1420 HE2 HIS 84 HE2 HIS 84 -20.704 8.235 -8.188 1421 H HIS 85 H HIS 85 -22.519 8.229 -1.863 1422 HA HIS 85 HA HIS 85 -23.377 5.553 -1.710 1423 HB2 HIS 85 HB2 HIS 85 -24.243 7.556 -0.394 1424 HB3 HIS 85 HB3 HIS 85 -25.210 7.957 -1.809 1425 HD1 HIS 85 HD1 HIS 85 -25.061 5.693 1.112 1426 HD2 HIS 85 HD2 HIS 85 -27.330 6.095 -2.346 1427 HE1 HIS 85 HE1 HIS 85 -27.070 4.234 1.453 1428 HE2 HIS 85 HE2 HIS 85 -28.338 4.363 -0.711 1429 H HIS 86 H HIS 86 -24.028 4.206 -3.263 1430 HA HIS 86 HA HIS 86 -25.238 5.312 -5.718 1431 HB2 HIS 86 HB2 HIS 86 -22.919 4.726 -6.189 1432 HB3 HIS 86 HB3 HIS 86 -23.162 3.113 -5.527 1433 HD1 HIS 86 HD1 HIS 86 -24.067 5.236 -8.513 1434 HD2 HIS 86 HD2 HIS 86 -24.274 1.272 -7.281 1435 HE1 HIS 86 HE1 HIS 86 -24.731 3.934 -10.547 1436 HE2 HIS 86 HE2 HIS 86 -25.074 1.588 -9.716 1437 H HIS 87 H HIS 87 -27.163 4.474 -6.189 1438 HA HIS 87 HA HIS 87 -28.274 2.274 -4.716 1439 HB2 HIS 87 HB2 HIS 87 -29.741 4.077 -5.323 1440 HB3 HIS 87 HB3 HIS 87 -29.306 3.941 -7.022 1441 HD1 HIS 87 HD1 HIS 87 -31.023 1.823 -4.360 1442 HD2 HIS 87 HD2 HIS 87 -31.078 2.460 -8.466 1443 HE1 HIS 87 HE1 HIS 87 -32.890 0.401 -5.234 1444 HE2 HIS 87 HE2 HIS 87 -32.797 0.676 -7.729 1445 H HIS 88 H HIS 88 -28.722 0.198 -5.394 1446 HA HIS 88 HA HIS 88 -27.534 -0.653 -7.958 1447 HB2 HIS 88 HB2 HIS 88 -28.241 -2.230 -5.473 1448 HB3 HIS 88 HB3 HIS 88 -27.704 -2.970 -6.977 1449 HD1 HIS 88 HD1 HIS 88 -25.234 -3.008 -7.438 1450 HD2 HIS 88 HD2 HIS 88 -26.217 -0.681 -4.139 1451 HE1 HIS 88 HE1 HIS 88 -23.051 -2.444 -6.344 1452 HE2 HIS 88 HE2 HIS 88 -23.689 -1.240 -4.232 Start of MODEL 3 1 H1 MET 1 H1 MET 1 11.403 -23.567 12.821 2 H2 MET 1 H2 MET 1 10.209 -24.069 11.737 3 H3 MET 1 H3 MET 1 9.825 -23.834 13.366 4 HA MET 1 HA MET 1 10.280 -21.480 13.177 5 HB2 MET 1 HB2 MET 1 11.967 -21.640 11.400 6 HB3 MET 1 HB3 MET 1 10.730 -22.127 10.251 7 HG2 MET 1 HG2 MET 1 9.645 -19.951 10.488 8 HG3 MET 1 HG3 MET 1 10.875 -19.463 11.653 9 HE1 MET 1 HE1 MET 1 13.469 -19.219 11.033 10 HE2 MET 1 HE2 MET 1 14.109 -19.457 9.408 11 HE3 MET 1 HE3 MET 1 13.491 -20.832 10.324 12 H THR 2 H THR 2 8.276 -20.740 13.568 13 HA THR 2 HA THR 2 6.171 -21.310 11.571 14 HB THR 2 HB THR 2 5.656 -22.723 13.425 15 HG1 THR 2 HG1 THR 2 3.618 -22.147 13.431 16 HG21 THR 2 HG21 THR 2 5.346 -21.923 15.709 17 HG22 THR 2 HG22 THR 2 5.793 -20.290 15.219 18 HG23 THR 2 HG23 THR 2 6.989 -21.586 15.163 19 H ASP 3 H ASP 3 6.600 -19.271 10.616 20 HA ASP 3 HA ASP 3 6.283 -16.800 11.988 21 HB2 ASP 3 HB2 ASP 3 5.799 -17.301 9.043 22 HB3 ASP 3 HB3 ASP 3 6.265 -15.785 9.810 23 H PHE 4 H PHE 4 4.468 -15.448 12.186 24 HA PHE 4 HA PHE 4 1.889 -16.658 11.430 25 HB2 PHE 4 HB2 PHE 4 0.883 -15.705 13.423 26 HB3 PHE 4 HB3 PHE 4 2.252 -16.711 13.875 27 HD1 PHE 4 HD1 PHE 4 0.966 -13.276 13.692 28 HD2 PHE 4 HD2 PHE 4 4.247 -15.741 14.855 29 HE1 PHE 4 HE1 PHE 4 1.918 -11.404 14.973 30 HE2 PHE 4 HE2 PHE 4 5.197 -13.871 16.138 31 HZ PHE 4 HZ PHE 4 4.036 -11.697 16.189 32 H LEU 5 H LEU 5 0.189 -15.223 10.895 33 HA LEU 5 HA LEU 5 1.052 -12.923 9.401 34 HB2 LEU 5 HB2 LEU 5 -0.655 -14.379 8.513 35 HB3 LEU 5 HB3 LEU 5 -1.652 -14.127 9.931 36 HG LEU 5 HG LEU 5 -2.000 -11.777 9.288 37 HD11 LEU 5 HD11 LEU 5 0.098 -11.350 8.138 38 HD12 LEU 5 HD12 LEU 5 -1.270 -10.970 7.091 39 HD13 LEU 5 HD13 LEU 5 -0.360 -12.461 6.846 40 HD21 LEU 5 HD21 LEU 5 -2.614 -13.723 7.063 41 HD22 LEU 5 HD22 LEU 5 -3.406 -12.170 7.334 42 HD23 LEU 5 HD23 LEU 5 -3.581 -13.465 8.517 43 H ALA 6 H ALA 6 1.620 -11.188 10.569 44 HA ALA 6 HA ALA 6 -0.013 -10.313 12.844 45 HB1 ALA 6 HB1 ALA 6 1.851 -8.795 13.324 46 HB2 ALA 6 HB2 ALA 6 2.673 -9.341 11.863 47 HB3 ALA 6 HB3 ALA 6 2.393 -10.468 13.190 48 H GLY 7 H GLY 7 -0.598 -8.021 13.027 49 HA2 GLY 7 HA2 GLY 7 -0.908 -6.650 10.427 50 HA3 GLY 7 HA3 GLY 7 -2.286 -6.869 11.491 51 H ILE 8 H ILE 8 -1.101 -4.410 10.468 52 HA ILE 8 HA ILE 8 -0.682 -3.017 13.034 53 HB ILE 8 HB ILE 8 0.906 -2.381 10.521 54 HG12 ILE 8 HG12 ILE 8 1.846 -3.740 13.070 55 HG13 ILE 8 HG13 ILE 8 1.649 -4.523 11.506 56 HG21 ILE 8 HG21 ILE 8 1.163 -1.314 13.337 57 HG22 ILE 8 HG22 ILE 8 0.451 -0.452 11.973 58 HG23 ILE 8 HG23 ILE 8 2.166 -0.863 11.958 59 HD11 ILE 8 HD11 ILE 8 3.401 -3.077 10.578 60 HD12 ILE 8 HD12 ILE 8 3.977 -4.037 11.939 61 HD13 ILE 8 HD13 ILE 8 3.604 -2.328 12.163 62 H ARG 9 H ARG 9 -1.609 -0.929 13.115 63 HA ARG 9 HA ARG 9 -3.000 -0.017 10.671 64 HB2 ARG 9 HB2 ARG 9 -4.564 -0.838 12.448 65 HB3 ARG 9 HB3 ARG 9 -3.962 0.433 13.507 66 HG2 ARG 9 HG2 ARG 9 -4.728 2.125 11.887 67 HG3 ARG 9 HG3 ARG 9 -5.363 0.838 10.862 68 HD2 ARG 9 HD2 ARG 9 -6.815 0.145 12.792 69 HD3 ARG 9 HD3 ARG 9 -6.282 1.602 13.636 70 HE ARG 9 HE ARG 9 -7.410 2.009 10.996 71 HH11 ARG 9 HH11 ARG 9 -7.916 2.076 14.404 72 HH12 ARG 9 HH12 ARG 9 -9.402 2.951 14.277 73 HH21 ARG 9 HH21 ARG 9 -9.310 3.130 10.841 74 HH22 ARG 9 HH22 ARG 9 -10.183 3.549 12.274 75 H ILE 10 H ILE 10 -2.584 1.998 10.007 76 HA ILE 10 HA ILE 10 -1.026 3.787 11.785 77 HB ILE 10 HB ILE 10 -0.893 3.682 8.762 78 HG12 ILE 10 HG12 ILE 10 1.127 2.518 10.701 79 HG13 ILE 10 HG13 ILE 10 -0.088 1.558 9.859 80 HG21 ILE 10 HG21 ILE 10 0.892 5.012 10.803 81 HG22 ILE 10 HG22 ILE 10 -0.247 5.820 9.727 82 HG23 ILE 10 HG23 ILE 10 1.163 4.997 9.060 83 HD11 ILE 10 HD11 ILE 10 2.038 1.417 8.733 84 HD12 ILE 10 HD12 ILE 10 2.103 3.173 8.577 85 HD13 ILE 10 HD13 ILE 10 0.867 2.255 7.714 86 H VAL 11 H VAL 11 -2.263 5.540 12.362 87 HA VAL 11 HA VAL 11 -3.960 6.732 10.254 88 HB VAL 11 HB VAL 11 -4.421 6.754 13.243 89 HG11 VAL 11 HG11 VAL 11 -6.428 8.091 12.785 90 HG12 VAL 11 HG12 VAL 11 -5.959 8.208 11.088 91 HG13 VAL 11 HG13 VAL 11 -4.958 8.955 12.332 92 HG21 VAL 11 HG21 VAL 11 -6.071 5.652 10.957 93 HG22 VAL 11 HG22 VAL 11 -6.515 5.613 12.666 94 HG23 VAL 11 HG23 VAL 11 -5.117 4.699 12.099 95 H GLY 12 H GLY 12 -3.193 8.517 9.458 96 HA2 GLY 12 HA2 GLY 12 -1.908 10.494 11.221 97 HA3 GLY 12 HA3 GLY 12 -1.050 9.955 9.783 98 H GLU 13 H GLU 13 -1.552 12.606 10.044 99 HA GLU 13 HA GLU 13 -4.045 13.468 9.003 100 HB2 GLU 13 HB2 GLU 13 -2.963 15.647 8.725 101 HB3 GLU 13 HB3 GLU 13 -2.611 14.944 10.299 102 HG2 GLU 13 HG2 GLU 13 -0.396 14.309 9.577 103 HG3 GLU 13 HG3 GLU 13 -0.742 14.845 7.934 104 H ASP 14 H ASP 14 -4.705 14.004 6.949 105 HA ASP 14 HA ASP 14 -3.402 12.580 4.825 106 HB2 ASP 14 HB2 ASP 14 -5.877 12.669 5.124 107 HB3 ASP 14 HB3 ASP 14 -5.838 14.377 4.700 108 H LYS 15 H LYS 15 -1.381 13.988 5.040 109 HA LYS 15 HA LYS 15 -1.476 16.430 3.487 110 HB2 LYS 15 HB2 LYS 15 0.558 14.935 5.032 111 HB3 LYS 15 HB3 LYS 15 1.168 15.845 3.659 112 HG2 LYS 15 HG2 LYS 15 0.266 17.887 4.544 113 HG3 LYS 15 HG3 LYS 15 -0.511 17.013 5.869 114 HD2 LYS 15 HD2 LYS 15 1.532 16.531 6.911 115 HD3 LYS 15 HD3 LYS 15 2.464 16.854 5.447 116 HE2 LYS 15 HE2 LYS 15 2.760 18.638 7.063 117 HE3 LYS 15 HE3 LYS 15 1.924 19.225 5.630 118 HZ1 LYS 15 HZ1 LYS 15 0.944 20.070 7.677 119 HZ2 LYS 15 HZ2 LYS 15 0.622 18.493 8.194 120 HZ3 LYS 15 HZ3 LYS 15 -0.155 19.111 6.824 121 H ASN 16 H ASN 16 -0.366 16.757 1.531 122 HA ASN 16 HA ASN 16 -0.895 15.114 -0.572 123 HB2 ASN 16 HB2 ASN 16 0.792 16.411 -1.838 124 HB3 ASN 16 HB3 ASN 16 -0.226 17.436 -0.834 125 HD21 ASN 16 HD21 ASN 16 0.666 18.515 0.889 126 HD22 ASN 16 HD22 ASN 16 2.366 18.617 1.158 127 H GLY 17 H GLY 17 2.029 15.025 1.408 128 HA2 GLY 17 HA2 GLY 17 3.139 12.907 -0.305 129 HA3 GLY 17 HA3 GLY 17 4.034 13.860 0.863 130 H MET 18 H MET 18 1.449 13.137 2.644 131 HA MET 18 HA MET 18 2.944 11.238 4.172 132 HB2 MET 18 HB2 MET 18 0.258 12.540 4.456 133 HB3 MET 18 HB3 MET 18 0.644 11.157 5.470 134 HG2 MET 18 HG2 MET 18 2.297 13.670 5.302 135 HG3 MET 18 HG3 MET 18 1.089 13.333 6.545 136 HE1 MET 18 HE1 MET 18 1.606 10.100 6.786 137 HE2 MET 18 HE2 MET 18 1.229 11.173 8.134 138 HE3 MET 18 HE3 MET 18 2.634 10.112 8.221 139 H THR 19 H THR 19 -0.186 10.909 2.442 140 HA THR 19 HA THR 19 -0.579 8.188 3.007 141 HB THR 19 HB THR 19 -2.076 8.168 1.013 142 HG1 THR 19 HG1 THR 19 -2.138 9.879 -0.349 143 HG21 THR 19 HG21 THR 19 -2.361 10.633 2.747 144 HG22 THR 19 HG22 THR 19 -2.916 9.011 3.164 145 HG23 THR 19 HG23 THR 19 -3.648 9.874 1.811 146 H ASN 20 H ASN 20 1.313 9.767 0.501 147 HA ASN 20 HA ASN 20 1.833 7.364 -0.976 148 HB2 ASN 20 HB2 ASN 20 3.237 10.053 -1.058 149 HB3 ASN 20 HB3 ASN 20 3.492 8.742 -2.205 150 HD21 ASN 20 HD21 ASN 20 2.815 9.903 -3.973 151 HD22 ASN 20 HD22 ASN 20 1.170 10.371 -4.221 152 H GLN 21 H GLN 21 3.707 9.364 1.298 153 HA GLN 21 HA GLN 21 6.058 7.807 1.111 154 HB2 GLN 21 HB2 GLN 21 6.948 9.127 2.844 155 HB3 GLN 21 HB3 GLN 21 5.910 10.196 1.925 156 HG2 GLN 21 HG2 GLN 21 4.211 10.091 3.618 157 HG3 GLN 21 HG3 GLN 21 5.098 8.847 4.496 158 HE21 GLN 21 HE21 GLN 21 4.981 12.223 3.668 159 HE22 GLN 21 HE22 GLN 21 6.107 12.753 4.864 160 H ILE 22 H ILE 22 3.261 7.637 3.238 161 HA ILE 22 HA ILE 22 4.373 5.977 5.222 162 HB ILE 22 HB ILE 22 1.572 6.603 4.353 163 HG12 ILE 22 HG12 ILE 22 2.778 8.265 5.672 164 HG13 ILE 22 HG13 ILE 22 1.464 7.584 6.625 165 HG21 ILE 22 HG21 ILE 22 0.672 5.291 6.222 166 HG22 ILE 22 HG22 ILE 22 2.279 4.625 6.524 167 HG23 ILE 22 HG23 ILE 22 1.446 4.268 5.011 168 HD11 ILE 22 HD11 ILE 22 3.474 7.855 7.955 169 HD12 ILE 22 HD12 ILE 22 4.373 6.830 6.839 170 HD13 ILE 22 HD13 ILE 22 3.055 6.149 7.796 171 H THR 23 H THR 23 2.267 5.056 2.464 172 HA THR 23 HA THR 23 2.601 2.269 2.974 173 HB THR 23 HB THR 23 1.716 3.471 0.337 174 HG1 THR 23 HG1 THR 23 0.128 4.258 1.520 175 HG21 THR 23 HG21 THR 23 1.089 0.837 1.681 176 HG22 THR 23 HG22 THR 23 2.166 1.061 0.302 177 HG23 THR 23 HG23 THR 23 0.440 1.385 0.135 178 H GLY 24 H GLY 24 4.321 4.634 1.052 179 HA2 GLY 24 HA2 GLY 24 6.000 2.910 -0.418 180 HA3 GLY 24 HA3 GLY 24 6.401 4.548 0.075 181 H VAL 25 H VAL 25 6.540 4.426 2.775 182 HA VAL 25 HA VAL 25 9.003 3.217 3.341 183 HB VAL 25 HB VAL 25 6.837 4.231 5.193 184 HG11 VAL 25 HG11 VAL 25 8.533 4.185 6.993 185 HG12 VAL 25 HG12 VAL 25 9.632 3.326 5.914 186 HG13 VAL 25 HG13 VAL 25 8.123 2.567 6.421 187 HG21 VAL 25 HG21 VAL 25 8.426 6.113 5.495 188 HG22 VAL 25 HG22 VAL 25 7.878 5.939 3.828 189 HG23 VAL 25 HG23 VAL 25 9.484 5.376 4.289 190 H ILE 26 H ILE 26 5.705 2.072 3.870 191 HA ILE 26 HA ILE 26 6.276 -0.254 5.328 192 HB ILE 26 HB ILE 26 4.049 0.312 3.362 193 HG12 ILE 26 HG12 ILE 26 4.116 0.310 6.398 194 HG13 ILE 26 HG13 ILE 26 4.119 1.746 5.379 195 HG21 ILE 26 HG21 ILE 26 4.304 -2.003 5.290 196 HG22 ILE 26 HG22 ILE 26 4.352 -2.098 3.529 197 HG23 ILE 26 HG23 ILE 26 2.868 -1.606 4.345 198 HD11 ILE 26 HD11 ILE 26 1.901 1.163 4.550 199 HD12 ILE 26 HD12 ILE 26 1.920 1.318 6.307 200 HD13 ILE 26 HD13 ILE 26 1.900 -0.280 5.565 201 H SER 27 H SER 27 6.125 0.225 1.791 202 HA SER 27 HA SER 27 6.632 -2.469 1.088 203 HB2 SER 27 HB2 SER 27 7.099 -1.676 -1.139 204 HB3 SER 27 HB3 SER 27 5.787 -0.694 -0.490 205 HG SER 27 HG SER 27 7.159 0.993 -0.237 206 H LYS 28 H LYS 28 8.712 0.066 2.181 207 HA LYS 28 HA LYS 28 11.190 -1.087 1.280 208 HB2 LYS 28 HB2 LYS 28 10.712 1.018 3.409 209 HB3 LYS 28 HB3 LYS 28 12.246 0.664 2.626 210 HG2 LYS 28 HG2 LYS 28 11.408 1.465 0.507 211 HG3 LYS 28 HG3 LYS 28 9.797 1.681 1.191 212 HD2 LYS 28 HD2 LYS 28 10.908 3.825 1.045 213 HD3 LYS 28 HD3 LYS 28 10.707 3.380 2.739 214 HE2 LYS 28 HE2 LYS 28 13.042 2.624 2.808 215 HE3 LYS 28 HE3 LYS 28 13.236 3.086 1.116 216 HZ1 LYS 28 HZ1 LYS 28 12.713 5.381 1.753 217 HZ2 LYS 28 HZ2 LYS 28 14.089 4.806 2.545 218 HZ3 LYS 28 HZ3 LYS 28 12.624 4.914 3.374 219 H PHE 29 H PHE 29 9.067 -2.045 3.661 220 HA PHE 29 HA PHE 29 10.756 -2.571 5.863 221 HB2 PHE 29 HB2 PHE 29 8.092 -3.675 5.021 222 HB3 PHE 29 HB3 PHE 29 8.933 -4.340 6.412 223 HD1 PHE 29 HD2 PHE 29 10.081 -1.362 6.977 224 HD2 PHE 29 HD1 PHE 29 6.240 -3.153 6.565 225 HE1 PHE 29 HE2 PHE 29 9.116 0.387 8.408 226 HE2 PHE 29 HE1 PHE 29 5.270 -1.402 8.000 227 HZ PHE 29 HZ PHE 29 6.711 0.368 8.922 228 H ASP 30 H ASP 30 11.203 -4.700 6.758 229 HA ASP 30 HA ASP 30 12.518 -6.441 4.846 230 HB2 ASP 30 HB2 ASP 30 13.656 -5.747 6.905 231 HB3 ASP 30 HB3 ASP 30 12.379 -6.469 7.876 232 H THR 31 H THR 31 9.599 -6.378 4.799 233 HA THR 31 HA THR 31 9.164 -9.256 4.896 234 HB THR 31 HB THR 31 8.387 -8.635 7.112 235 HG1 THR 31 HG1 THR 31 6.667 -9.858 6.892 236 HG21 THR 31 HG21 THR 31 6.536 -7.053 7.439 237 HG22 THR 31 HG22 THR 31 6.561 -6.667 5.718 238 HG23 THR 31 HG23 THR 31 7.944 -6.260 6.736 239 H ASN 32 H ASN 32 7.425 -9.963 3.546 240 HA ASN 32 HA ASN 32 6.854 -8.076 1.390 241 HB2 ASN 32 HB2 ASN 32 7.772 -10.339 0.904 242 HB3 ASN 32 HB3 ASN 32 6.291 -11.049 1.538 243 HD21 ASN 32 HD21 ASN 32 4.410 -10.919 0.321 244 HD22 ASN 32 HD22 ASN 32 4.423 -10.481 -1.348 245 H ILE 33 H ILE 33 4.921 -7.182 1.019 246 HA ILE 33 HA ILE 33 2.931 -7.198 3.010 247 HB ILE 33 HB ILE 33 2.750 -6.170 0.171 248 HG12 ILE 33 HG12 ILE 33 3.494 -4.734 2.744 249 HG13 ILE 33 HG13 ILE 33 4.619 -5.194 1.471 250 HG21 ILE 33 HG21 ILE 33 1.063 -5.495 2.587 251 HG22 ILE 33 HG22 ILE 33 0.542 -6.445 1.195 252 HG23 ILE 33 HG23 ILE 33 0.944 -4.739 0.998 253 HD11 ILE 33 HD11 ILE 33 4.083 -2.849 1.321 254 HD12 ILE 33 HD12 ILE 33 2.362 -3.220 1.221 255 HD13 ILE 33 HD13 ILE 33 3.446 -3.704 -0.085 256 H ARG 34 H ARG 34 1.339 -8.598 3.394 257 HA ARG 34 HA ARG 34 0.444 -10.413 1.267 258 HB2 ARG 34 HB2 ARG 34 -0.193 -10.433 4.232 259 HB3 ARG 34 HB3 ARG 34 -0.653 -11.676 3.072 260 HG2 ARG 34 HG2 ARG 34 2.164 -10.931 3.859 261 HG3 ARG 34 HG3 ARG 34 1.281 -12.371 4.368 262 HD2 ARG 34 HD2 ARG 34 1.257 -13.243 2.146 263 HD3 ARG 34 HD3 ARG 34 1.848 -11.721 1.475 264 HE ARG 34 HE ARG 34 3.620 -13.005 3.364 265 HH11 ARG 34 HH11 ARG 34 2.720 -12.645 0.063 266 HH12 ARG 34 HH12 ARG 34 4.261 -13.146 -0.532 267 HH21 ARG 34 HH21 ARG 34 5.607 -13.633 2.591 268 HH22 ARG 34 HH22 ARG 34 5.872 -13.700 0.881 269 H THR 35 H THR 35 -0.830 -8.018 3.543 270 HA THR 35 HA THR 35 -2.866 -7.289 1.574 271 HB THR 35 HB THR 35 -3.639 -7.767 4.464 272 HG1 THR 35 HG1 THR 35 -3.583 -9.494 2.304 273 HG21 THR 35 HG21 THR 35 -5.311 -7.132 2.024 274 HG22 THR 35 HG22 THR 35 -4.959 -6.036 3.361 275 HG23 THR 35 HG23 THR 35 -5.941 -7.476 3.635 276 H ILE 36 H ILE 36 -3.434 -5.091 1.689 277 HA ILE 36 HA ILE 36 -2.780 -3.553 4.030 278 HB ILE 36 HB ILE 36 -0.602 -3.682 2.804 279 HG12 ILE 36 HG12 ILE 36 -1.707 -0.868 2.932 280 HG13 ILE 36 HG13 ILE 36 -1.277 -1.810 4.359 281 HG21 ILE 36 HG21 ILE 36 -1.424 -3.644 0.511 282 HG22 ILE 36 HG22 ILE 36 -0.287 -2.323 0.787 283 HG23 ILE 36 HG23 ILE 36 -2.020 -1.999 0.734 284 HD11 ILE 36 HD11 ILE 36 0.495 -0.281 3.733 285 HD12 ILE 36 HD12 ILE 36 0.593 -1.031 2.139 286 HD13 ILE 36 HD13 ILE 36 1.014 -1.960 3.580 287 H VAL 37 H VAL 37 -4.136 -1.879 4.281 288 HA VAL 37 HA VAL 37 -5.631 -0.890 1.934 289 HB VAL 37 HB VAL 37 -6.891 -1.568 4.606 290 HG11 VAL 37 HG11 VAL 37 -9.019 -1.031 3.511 291 HG12 VAL 37 HG12 VAL 37 -8.148 -0.546 2.056 292 HG13 VAL 37 HG13 VAL 37 -7.940 0.363 3.553 293 HG21 VAL 37 HG21 VAL 37 -7.160 -2.956 1.933 294 HG22 VAL 37 HG22 VAL 37 -8.116 -3.318 3.373 295 HG23 VAL 37 HG23 VAL 37 -6.375 -3.599 3.375 296 H LEU 38 H LEU 38 -4.823 1.161 1.826 297 HA LEU 38 HA LEU 38 -4.972 2.841 4.251 298 HB2 LEU 38 HB2 LEU 38 -2.806 2.833 3.051 299 HB3 LEU 38 HB3 LEU 38 -3.604 3.402 1.602 300 HG LEU 38 HG LEU 38 -3.684 5.044 4.135 301 HD11 LEU 38 HD11 LEU 38 -1.323 4.575 3.727 302 HD12 LEU 38 HD12 LEU 38 -1.702 6.262 3.368 303 HD13 LEU 38 HD13 LEU 38 -1.497 5.104 2.052 304 HD21 LEU 38 HD21 LEU 38 -3.882 6.915 2.544 305 HD22 LEU 38 HD22 LEU 38 -5.180 5.741 2.341 306 HD23 LEU 38 HD23 LEU 38 -3.832 5.772 1.203 307 H ASN 39 H ASN 39 -6.847 3.929 4.467 308 HA ASN 39 HA ASN 39 -7.994 5.164 2.042 309 HB2 ASN 39 HB2 ASN 39 -10.259 4.810 2.928 310 HB3 ASN 39 HB3 ASN 39 -9.421 3.284 2.673 311 HD21 ASN 39 HD21 ASN 39 -8.737 2.097 4.486 312 HD22 ASN 39 HD22 ASN 39 -9.412 2.380 6.047 313 H ALA 40 H ALA 40 -8.252 7.295 2.148 314 HA ALA 40 HA ALA 40 -7.917 8.672 4.726 315 HB1 ALA 40 HB1 ALA 40 -7.951 9.803 1.918 316 HB2 ALA 40 HB2 ALA 40 -6.503 9.356 2.821 317 HB3 ALA 40 HB3 ALA 40 -7.529 10.672 3.395 318 H LYS 41 H LYS 41 -9.738 9.009 5.803 319 HA LYS 41 HA LYS 41 -12.116 9.994 4.359 320 HB2 LYS 41 HB2 LYS 41 -13.563 8.778 5.824 321 HB3 LYS 41 HB3 LYS 41 -12.364 7.641 5.228 322 HG2 LYS 41 HG2 LYS 41 -12.168 9.001 7.909 323 HG3 LYS 41 HG3 LYS 41 -12.951 7.443 7.661 324 HD2 LYS 41 HD2 LYS 41 -10.885 6.441 6.948 325 HD3 LYS 41 HD3 LYS 41 -10.076 8.009 6.922 326 HE2 LYS 41 HE2 LYS 41 -9.514 6.627 8.909 327 HE3 LYS 41 HE3 LYS 41 -10.218 8.191 9.315 328 HZ1 LYS 41 HZ1 LYS 41 -11.727 5.636 9.226 329 HZ2 LYS 41 HZ2 LYS 41 -12.318 7.137 9.736 330 HZ3 LYS 41 HZ3 LYS 41 -11.127 6.348 10.637 331 H ASP 42 H ASP 42 -13.166 11.753 5.231 332 HA ASP 42 HA ASP 42 -13.589 13.581 6.518 333 HB2 ASP 42 HB2 ASP 42 -12.297 12.010 8.761 334 HB3 ASP 42 HB3 ASP 42 -13.335 13.420 8.943 335 H GLY 43 H GLY 43 -10.656 12.881 5.459 336 HA2 GLY 43 HA2 GLY 43 -8.956 14.515 5.111 337 HA3 GLY 43 HA3 GLY 43 -9.431 15.299 6.607 338 H ILE 44 H ILE 44 -9.263 11.984 7.124 339 HA ILE 44 HA ILE 44 -6.370 12.016 7.748 340 HB ILE 44 HB ILE 44 -8.401 10.635 9.516 341 HG12 ILE 44 HG12 ILE 44 -7.153 13.368 9.899 342 HG13 ILE 44 HG13 ILE 44 -8.857 13.023 9.614 343 HG21 ILE 44 HG21 ILE 44 -5.505 11.392 9.974 344 HG22 ILE 44 HG22 ILE 44 -6.111 9.773 9.625 345 HG23 ILE 44 HG23 ILE 44 -6.554 10.573 11.132 346 HD11 ILE 44 HD11 ILE 44 -8.374 13.507 11.965 347 HD12 ILE 44 HD12 ILE 44 -7.285 12.119 12.010 348 HD13 ILE 44 HD13 ILE 44 -9.009 11.878 11.733 349 H PHE 45 H PHE 45 -5.341 9.934 7.611 350 HA PHE 45 HA PHE 45 -6.958 7.982 6.084 351 HB2 PHE 45 HB2 PHE 45 -5.028 7.354 4.812 352 HB3 PHE 45 HB3 PHE 45 -5.157 9.105 4.759 353 HD1 PHE 45 HD1 PHE 45 -3.239 6.267 6.078 354 HD2 PHE 45 HD2 PHE 45 -3.478 10.509 5.775 355 HE1 PHE 45 HE1 PHE 45 -0.916 6.449 6.863 356 HE2 PHE 45 HE2 PHE 45 -1.152 10.694 6.557 357 HZ PHE 45 HZ PHE 45 0.126 8.662 7.107 358 H THR 46 H THR 46 -6.797 5.823 6.523 359 HA THR 46 HA THR 46 -5.093 5.021 8.798 360 HB THR 46 HB THR 46 -7.298 4.904 9.652 361 HG1 THR 46 HG1 THR 46 -6.560 2.281 8.759 362 HG21 THR 46 HG21 THR 46 -8.565 5.071 7.587 363 HG22 THR 46 HG22 THR 46 -9.134 3.696 8.534 364 HG23 THR 46 HG23 THR 46 -8.092 3.430 7.135 365 H CYS 47 H CYS 47 -3.411 4.052 7.798 366 HA CYS 47 HA CYS 47 -3.870 2.161 5.619 367 HB2 CYS 47 HB2 CYS 47 -1.993 3.757 5.454 368 HB3 CYS 47 HB3 CYS 47 -1.266 3.050 6.890 369 HG CYS 47 HG CYS 47 -0.783 2.215 3.811 370 H ASN 48 H ASN 48 -4.449 0.170 6.156 371 HA ASN 48 HA ASN 48 -3.481 -1.066 8.635 372 HB2 ASN 48 HB2 ASN 48 -5.641 -1.894 6.680 373 HB3 ASN 48 HB3 ASN 48 -5.181 -2.833 8.095 374 HD21 ASN 48 HD21 ASN 48 -7.219 -2.661 8.982 375 HD22 ASN 48 HD22 ASN 48 -7.817 -1.192 9.658 376 H LEU 49 H LEU 49 -1.616 -2.144 8.453 377 HA LEU 49 HA LEU 49 -0.904 -3.482 5.940 378 HB2 LEU 49 HB2 LEU 49 0.782 -1.998 6.800 379 HB3 LEU 49 HB3 LEU 49 0.710 -2.746 8.384 380 HG LEU 49 HG LEU 49 1.641 -4.834 7.419 381 HD11 LEU 49 HD11 LEU 49 2.618 -4.797 5.175 382 HD12 LEU 49 HD12 LEU 49 1.927 -3.197 4.901 383 HD13 LEU 49 HD13 LEU 49 0.867 -4.588 5.129 384 HD21 LEU 49 HD21 LEU 49 3.323 -2.374 6.929 385 HD22 LEU 49 HD22 LEU 49 3.924 -4.018 7.146 386 HD23 LEU 49 HD23 LEU 49 3.114 -3.195 8.478 387 H MET 50 H MET 50 -0.669 -5.657 5.751 388 HA MET 50 HA MET 50 -0.779 -7.331 8.179 389 HB2 MET 50 HB2 MET 50 -2.222 -7.876 5.574 390 HB3 MET 50 HB3 MET 50 -2.158 -8.968 6.948 391 HG2 MET 50 HG2 MET 50 -3.446 -6.243 6.899 392 HG3 MET 50 HG3 MET 50 -4.277 -7.794 6.854 393 HE1 MET 50 HE1 MET 50 -2.093 -9.251 8.990 394 HE2 MET 50 HE2 MET 50 -3.812 -9.648 8.905 395 HE3 MET 50 HE3 MET 50 -3.091 -9.178 10.443 396 H ILE 51 H ILE 51 1.069 -8.438 8.326 397 HA ILE 51 HA ILE 51 2.245 -9.715 5.968 398 HB ILE 51 HB ILE 51 4.551 -8.869 6.661 399 HG12 ILE 51 HG12 ILE 51 4.274 -6.429 7.671 400 HG13 ILE 51 HG13 ILE 51 2.806 -7.113 8.361 401 HG21 ILE 51 HG21 ILE 51 4.342 -6.802 5.365 402 HG22 ILE 51 HG22 ILE 51 2.587 -6.887 5.518 403 HG23 ILE 51 HG23 ILE 51 3.456 -8.136 4.626 404 HD11 ILE 51 HD11 ILE 51 4.148 -8.844 9.458 405 HD12 ILE 51 HD12 ILE 51 4.639 -7.217 9.932 406 HD13 ILE 51 HD13 ILE 51 5.611 -8.129 8.777 407 H PHE 52 H PHE 52 4.016 -11.257 6.544 408 HA PHE 52 HA PHE 52 3.343 -12.636 9.027 409 HB2 PHE 52 HB2 PHE 52 4.865 -13.414 6.553 410 HB3 PHE 52 HB3 PHE 52 5.027 -14.362 8.026 411 HD1 PHE 52 HD2 PHE 52 3.130 -15.599 8.930 412 HD2 PHE 52 HD1 PHE 52 2.829 -13.470 5.252 413 HE1 PHE 52 HE2 PHE 52 1.080 -16.837 8.390 414 HE2 PHE 52 HE1 PHE 52 0.774 -14.710 4.703 415 HZ PHE 52 HZ PHE 52 -0.102 -16.397 6.270 416 H VAL 53 H VAL 53 4.680 -12.955 10.731 417 HA VAL 53 HA VAL 53 7.489 -12.064 10.557 418 HB VAL 53 HB VAL 53 7.432 -10.899 12.634 419 HG11 VAL 53 HG11 VAL 53 4.960 -10.100 11.108 420 HG12 VAL 53 HG12 VAL 53 6.609 -9.566 10.773 421 HG13 VAL 53 HG13 VAL 53 5.818 -9.101 12.281 422 HG21 VAL 53 HG21 VAL 53 4.590 -11.854 12.972 423 HG22 VAL 53 HG22 VAL 53 5.410 -10.708 14.033 424 HG23 VAL 53 HG23 VAL 53 5.995 -12.368 13.906 425 H LYS 54 H LYS 54 8.927 -13.152 11.996 426 HA LYS 54 HA LYS 54 8.027 -15.761 12.893 427 HB2 LYS 54 HB2 LYS 54 10.408 -16.106 13.514 428 HB3 LYS 54 HB3 LYS 54 10.187 -15.638 11.832 429 HG2 LYS 54 HG2 LYS 54 10.849 -13.361 12.346 430 HG3 LYS 54 HG3 LYS 54 11.000 -13.768 14.056 431 HD2 LYS 54 HD2 LYS 54 12.607 -15.058 11.848 432 HD3 LYS 54 HD3 LYS 54 13.171 -13.699 12.820 433 HE2 LYS 54 HE2 LYS 54 12.852 -15.112 14.858 434 HE3 LYS 54 HE3 LYS 54 12.470 -16.470 13.797 435 HZ1 LYS 54 HZ1 LYS 54 14.789 -16.480 14.501 436 HZ2 LYS 54 HZ2 LYS 54 15.028 -14.961 13.794 437 HZ3 LYS 54 HZ3 LYS 54 14.660 -16.296 12.826 438 H ASN 55 H ASN 55 8.844 -12.688 14.352 439 HA ASN 55 HA ASN 55 8.223 -13.761 17.034 440 HB2 ASN 55 HB2 ASN 55 10.438 -11.798 16.358 441 HB3 ASN 55 HB3 ASN 55 9.983 -12.298 17.983 442 HD21 ASN 55 HD21 ASN 55 12.515 -12.554 16.504 443 HD22 ASN 55 HD22 ASN 55 12.903 -14.237 16.562 444 H THR 56 H THR 56 7.329 -12.195 18.541 445 HA THR 56 HA THR 56 5.703 -10.163 17.331 446 HB THR 56 HB THR 56 5.064 -9.545 19.657 447 HG1 THR 56 HG1 THR 56 6.463 -10.046 21.163 448 HG21 THR 56 HG21 THR 56 3.960 -11.677 20.213 449 HG22 THR 56 HG22 THR 56 4.990 -12.507 19.046 450 HG23 THR 56 HG23 THR 56 3.828 -11.298 18.496 451 H ASP 57 H ASP 57 8.791 -10.186 18.998 452 HA ASP 57 HA ASP 57 9.079 -7.393 19.381 453 HB2 ASP 57 HB2 ASP 57 11.313 -9.355 18.792 454 HB3 ASP 57 HB3 ASP 57 11.438 -7.826 19.658 455 H LYS 58 H LYS 58 9.647 -9.527 16.683 456 HA LYS 58 HA LYS 58 10.805 -7.750 14.850 457 HB2 LYS 58 HB2 LYS 58 10.803 -10.069 14.339 458 HB3 LYS 58 HB3 LYS 58 9.067 -10.200 14.566 459 HG2 LYS 58 HG2 LYS 58 9.627 -10.347 12.223 460 HG3 LYS 58 HG3 LYS 58 8.699 -8.882 12.547 461 HD2 LYS 58 HD2 LYS 58 10.746 -7.553 12.504 462 HD3 LYS 58 HD3 LYS 58 11.708 -9.015 12.265 463 HE2 LYS 58 HE2 LYS 58 10.504 -9.402 10.131 464 HE3 LYS 58 HE3 LYS 58 9.661 -7.868 10.362 465 HZ1 LYS 58 HZ1 LYS 58 12.604 -8.183 10.159 466 HZ2 LYS 58 HZ2 LYS 58 11.759 -6.723 10.302 467 HZ3 LYS 58 HZ3 LYS 58 11.592 -7.665 8.908 468 H LEU 59 H LEU 59 7.385 -8.541 15.470 469 HA LEU 59 HA LEU 59 6.227 -6.822 13.579 470 HB2 LEU 59 HB2 LEU 59 4.945 -8.565 14.650 471 HB3 LEU 59 HB3 LEU 59 5.186 -7.837 16.226 472 HG LEU 59 HG LEU 59 3.805 -5.909 15.550 473 HD11 LEU 59 HD11 LEU 59 2.505 -5.996 13.472 474 HD12 LEU 59 HD12 LEU 59 3.376 -7.453 12.992 475 HD13 LEU 59 HD13 LEU 59 4.238 -5.924 13.158 476 HD21 LEU 59 HD21 LEU 59 2.461 -8.587 15.151 477 HD22 LEU 59 HD22 LEU 59 1.645 -7.068 15.525 478 HD23 LEU 59 HD23 LEU 59 2.752 -7.786 16.695 479 H THR 60 H THR 60 6.975 -6.236 17.026 480 HA THR 60 HA THR 60 5.907 -3.630 17.164 481 HB THR 60 HB THR 60 7.246 -3.310 19.191 482 HG1 THR 60 HG1 THR 60 8.535 -5.407 19.689 483 HG21 THR 60 HG21 THR 60 6.443 -5.245 20.487 484 HG22 THR 60 HG22 THR 60 6.113 -6.109 18.986 485 HG23 THR 60 HG23 THR 60 5.205 -4.650 19.380 486 H THR 61 H THR 61 8.955 -4.804 15.912 487 HA THR 61 HA THR 61 10.430 -2.404 16.000 488 HB THR 61 HB THR 61 10.623 -4.681 14.005 489 HG1 THR 61 HG1 THR 61 11.058 -5.035 16.359 490 HG21 THR 61 HG21 THR 61 12.576 -2.435 14.566 491 HG22 THR 61 HG22 THR 61 11.672 -2.686 13.072 492 HG23 THR 61 HG23 THR 61 12.907 -3.846 13.562 493 H LEU 62 H LEU 62 8.239 -3.705 13.526 494 HA LEU 62 HA LEU 62 8.620 -1.690 11.598 495 HB2 LEU 62 HB2 LEU 62 6.129 -3.312 12.139 496 HB3 LEU 62 HB3 LEU 62 6.468 -2.419 10.667 497 HG LEU 62 HG LEU 62 7.937 -4.864 11.680 498 HD11 LEU 62 HD11 LEU 62 6.249 -4.423 9.216 499 HD12 LEU 62 HD12 LEU 62 5.770 -5.329 10.651 500 HD13 LEU 62 HD13 LEU 62 7.095 -5.911 9.645 501 HD21 LEU 62 HD21 LEU 62 8.506 -3.162 9.250 502 HD22 LEU 62 HD22 LEU 62 9.259 -4.715 9.610 503 HD23 LEU 62 HD23 LEU 62 9.536 -3.336 10.672 504 H MET 63 H MET 63 6.373 -1.899 14.332 505 HA MET 63 HA MET 63 4.834 0.374 13.935 506 HB2 MET 63 HB2 MET 63 5.946 -0.602 16.580 507 HB3 MET 63 HB3 MET 63 4.558 0.458 16.372 508 HG2 MET 63 HG2 MET 63 3.314 -1.310 15.309 509 HG3 MET 63 HG3 MET 63 4.723 -2.375 15.362 510 HE1 MET 63 HE1 MET 63 1.965 -3.362 16.465 511 HE2 MET 63 HE2 MET 63 2.458 -4.090 17.994 512 HE3 MET 63 HE3 MET 63 3.460 -4.299 16.556 513 H ASP 64 H ASP 64 7.932 0.126 15.660 514 HA ASP 64 HA ASP 64 8.328 2.821 16.265 515 HB2 ASP 64 HB2 ASP 64 9.665 1.027 17.225 516 HB3 ASP 64 HB3 ASP 64 10.335 0.643 15.650 517 H LYS 65 H LYS 65 9.383 0.978 13.413 518 HA LYS 65 HA LYS 65 10.719 3.018 12.045 519 HB2 LYS 65 HB2 LYS 65 9.183 0.648 10.968 520 HB3 LYS 65 HB3 LYS 65 10.265 1.644 10.001 521 HG2 LYS 65 HG2 LYS 65 12.110 1.014 11.578 522 HG3 LYS 65 HG3 LYS 65 10.989 -0.109 12.346 523 HD2 LYS 65 HD2 LYS 65 12.137 -1.472 10.850 524 HD3 LYS 65 HD3 LYS 65 10.671 -1.070 9.958 525 HE2 LYS 65 HE2 LYS 65 13.341 0.315 9.644 526 HE3 LYS 65 HE3 LYS 65 12.714 -0.931 8.572 527 HZ1 LYS 65 HZ1 LYS 65 11.506 1.746 9.024 528 HZ2 LYS 65 HZ2 LYS 65 10.874 0.546 8.011 529 HZ3 LYS 65 HZ3 LYS 65 12.360 1.251 7.653 530 H LEU 66 H LEU 66 7.277 2.261 12.169 531 HA LEU 66 HA LEU 66 6.526 4.206 10.174 532 HB2 LEU 66 HB2 LEU 66 4.880 2.710 12.224 533 HB3 LEU 66 HB3 LEU 66 4.216 3.681 10.919 534 HG LEU 66 HG LEU 66 5.986 1.280 10.445 535 HD11 LEU 66 HD11 LEU 66 3.989 0.542 11.619 536 HD12 LEU 66 HD12 LEU 66 3.946 0.032 9.932 537 HD13 LEU 66 HD13 LEU 66 2.971 1.403 10.465 538 HD21 LEU 66 HD21 LEU 66 5.881 2.897 8.613 539 HD22 LEU 66 HD22 LEU 66 4.119 2.806 8.625 540 HD23 LEU 66 HD23 LEU 66 5.074 1.390 8.181 541 H ARG 67 H ARG 67 6.786 4.130 13.669 542 HA ARG 67 HA ARG 67 5.361 6.542 14.182 543 HB2 ARG 67 HB2 ARG 67 7.285 4.899 15.837 544 HB3 ARG 67 HB3 ARG 67 6.528 6.370 16.451 545 HG2 ARG 67 HG2 ARG 67 4.317 5.392 16.104 546 HG3 ARG 67 HG3 ARG 67 5.054 3.935 15.445 547 HD2 ARG 67 HD2 ARG 67 6.112 3.482 17.599 548 HD3 ARG 67 HD3 ARG 67 5.426 4.968 18.262 549 HE ARG 67 HE ARG 67 3.263 3.574 17.353 550 HH11 ARG 67 HH11 ARG 67 5.793 2.935 19.590 551 HH12 ARG 67 HH12 ARG 67 4.846 1.814 20.502 552 HH21 ARG 67 HH21 ARG 67 2.059 2.138 18.514 553 HH22 ARG 67 HH22 ARG 67 2.747 1.371 19.905 554 H LYS 68 H LYS 68 8.346 6.080 12.733 555 HA LYS 68 HA LYS 68 9.792 8.325 13.745 556 HB2 LYS 68 HB2 LYS 68 10.071 7.144 10.976 557 HB3 LYS 68 HB3 LYS 68 11.285 8.022 11.889 558 HG2 LYS 68 HG2 LYS 68 10.203 5.292 12.568 559 HG3 LYS 68 HG3 LYS 68 11.742 5.628 11.780 560 HD2 LYS 68 HD2 LYS 68 12.449 6.889 13.810 561 HD3 LYS 68 HD3 LYS 68 10.938 6.401 14.590 562 HE2 LYS 68 HE2 LYS 68 11.578 4.025 14.208 563 HE3 LYS 68 HE3 LYS 68 13.127 4.578 13.578 564 HZ1 LYS 68 HZ1 LYS 68 12.124 5.103 16.321 565 HZ2 LYS 68 HZ2 LYS 68 13.647 5.521 15.712 566 HZ3 LYS 68 HZ3 LYS 68 13.231 3.894 15.908 567 H VAL 69 H VAL 69 7.056 8.102 11.717 568 HA VAL 69 HA VAL 69 7.704 10.376 10.034 569 HB VAL 69 HB VAL 69 5.176 8.715 10.140 570 HG11 VAL 69 HG11 VAL 69 6.131 10.696 8.066 571 HG12 VAL 69 HG12 VAL 69 4.790 10.935 9.188 572 HG13 VAL 69 HG13 VAL 69 4.688 9.689 7.943 573 HG21 VAL 69 HG21 VAL 69 6.044 7.612 8.130 574 HG22 VAL 69 HG22 VAL 69 7.123 7.374 9.505 575 HG23 VAL 69 HG23 VAL 69 7.533 8.549 8.254 576 H GLN 70 H GLN 70 7.238 12.380 10.516 577 HA GLN 70 HA GLN 70 6.087 13.336 12.830 578 HB2 GLN 70 HB2 GLN 70 5.938 15.516 11.603 579 HB3 GLN 70 HB3 GLN 70 7.500 14.714 11.474 580 HG2 GLN 70 HG2 GLN 70 6.826 13.843 9.253 581 HG3 GLN 70 HG3 GLN 70 5.329 14.763 9.380 582 HE21 GLN 70 HE21 GLN 70 8.773 14.944 8.954 583 HE22 GLN 70 HE22 GLN 70 8.815 16.578 8.397 584 H GLY 71 H GLY 71 4.448 12.688 9.742 585 HA2 GLY 71 HA2 GLY 71 2.071 14.128 10.416 586 HA3 GLY 71 HA3 GLY 71 2.278 13.047 9.052 587 H VAL 72 H VAL 72 3.104 10.918 11.216 588 HA VAL 72 HA VAL 72 0.367 9.929 11.502 589 HB VAL 72 HB VAL 72 2.973 8.544 12.170 590 HG11 VAL 72 HG11 VAL 72 1.629 6.486 12.199 591 HG12 VAL 72 HG12 VAL 72 0.165 7.434 11.940 592 HG13 VAL 72 HG13 VAL 72 1.087 7.626 13.432 593 HG21 VAL 72 HG21 VAL 72 1.209 8.312 9.729 594 HG22 VAL 72 HG22 VAL 72 2.613 7.303 10.077 595 HG23 VAL 72 HG23 VAL 72 2.819 9.032 9.792 596 H PHE 73 H PHE 73 -0.702 9.613 13.406 597 HA PHE 73 HA PHE 73 0.749 10.280 15.883 598 HB2 PHE 73 HB2 PHE 73 -1.749 10.930 16.625 599 HB3 PHE 73 HB3 PHE 73 -0.624 12.068 15.910 600 HD1 PHE 73 HD1 PHE 73 -3.652 10.080 15.327 601 HD2 PHE 73 HD2 PHE 73 -0.925 12.917 13.698 602 HE1 PHE 73 HE1 PHE 73 -5.262 10.604 13.541 603 HE2 PHE 73 HE2 PHE 73 -2.529 13.439 11.914 604 HZ PHE 73 HZ PHE 73 -4.697 12.288 11.831 605 H THR 74 H THR 74 -1.088 7.875 14.289 606 HA THR 74 HA THR 74 -1.040 6.336 16.811 607 HB THR 74 HB THR 74 -3.133 5.358 16.530 608 HG1 THR 74 HG1 THR 74 -3.829 4.830 14.619 609 HG21 THR 74 HG21 THR 74 -4.769 7.154 16.200 610 HG22 THR 74 HG22 THR 74 -3.525 8.157 15.452 611 HG23 THR 74 HG23 THR 74 -3.399 7.721 17.158 612 H VAL 75 H VAL 75 0.231 4.613 16.615 613 HA VAL 75 HA VAL 75 0.079 3.006 14.147 614 HB VAL 75 HB VAL 75 2.642 3.475 15.697 615 HG11 VAL 75 HG11 VAL 75 2.132 1.980 13.121 616 HG12 VAL 75 HG12 VAL 75 2.511 1.257 14.684 617 HG13 VAL 75 HG13 VAL 75 3.712 2.250 13.858 618 HG21 VAL 75 HG21 VAL 75 2.025 5.496 14.467 619 HG22 VAL 75 HG22 VAL 75 1.831 4.550 12.989 620 HG23 VAL 75 HG23 VAL 75 3.425 4.718 13.725 621 H GLU 76 H GLU 76 -0.981 1.229 14.812 622 HA GLU 76 HA GLU 76 -0.287 0.032 17.432 623 HB2 GLU 76 HB2 GLU 76 -3.074 0.389 16.296 624 HB3 GLU 76 HB3 GLU 76 -2.678 -0.404 17.815 625 HG2 GLU 76 HG2 GLU 76 -1.942 1.655 18.784 626 HG3 GLU 76 HG3 GLU 76 -2.062 2.488 17.235 627 H ARG 77 H ARG 77 -1.213 -2.230 17.662 628 HA ARG 77 HA ARG 77 -0.713 -3.750 15.214 629 HB2 ARG 77 HB2 ARG 77 0.438 -4.620 17.117 630 HB3 ARG 77 HB3 ARG 77 -1.010 -4.556 18.112 631 HG2 ARG 77 HG2 ARG 77 -2.022 -6.321 16.692 632 HG3 ARG 77 HG3 ARG 77 -0.512 -6.421 15.787 633 HD2 ARG 77 HD2 ARG 77 0.674 -7.185 17.726 634 HD3 ARG 77 HD3 ARG 77 -0.720 -6.873 18.763 635 HE ARG 77 HE ARG 77 -1.652 -8.650 16.924 636 HH11 ARG 77 HH11 ARG 77 1.013 -8.676 19.122 637 HH12 ARG 77 HH12 ARG 77 0.969 -10.398 19.301 638 HH21 ARG 77 HH21 ARG 77 -1.689 -10.853 17.185 639 HH22 ARG 77 HH22 ARG 77 -0.518 -11.605 18.215 640 H LEU 78 H LEU 78 -2.282 -4.711 14.038 641 HA LEU 78 HA LEU 78 -5.041 -4.706 14.946 642 HB2 LEU 78 HB2 LEU 78 -3.773 -5.858 12.449 643 HB3 LEU 78 HB3 LEU 78 -5.498 -5.820 12.770 644 HG LEU 78 HG LEU 78 -3.746 -3.369 12.482 645 HD11 LEU 78 HD11 LEU 78 -5.680 -4.606 10.521 646 HD12 LEU 78 HD12 LEU 78 -3.924 -4.549 10.366 647 HD13 LEU 78 HD13 LEU 78 -4.859 -3.056 10.323 648 HD21 LEU 78 HD21 LEU 78 -5.679 -2.987 13.922 649 HD22 LEU 78 HD22 LEU 78 -6.749 -3.645 12.684 650 HD23 LEU 78 HD23 LEU 78 -5.870 -2.145 12.384 651 H SER 79 H SER 79 -5.223 -6.094 16.669 652 HA SER 79 HA SER 79 -3.960 -8.706 16.619 653 HB2 SER 79 HB2 SER 79 -4.943 -8.952 18.888 654 HB3 SER 79 HB3 SER 79 -3.999 -7.472 18.716 655 HG SER 79 HG SER 79 -5.823 -6.758 19.619 656 H ASN 80 H ASN 80 -7.321 -7.540 16.929 657 HA ASN 80 HA ASN 80 -8.481 -10.109 16.554 658 HB2 ASN 80 HB2 ASN 80 -9.543 -8.046 17.653 659 HB3 ASN 80 HB3 ASN 80 -9.860 -7.468 16.025 660 HD21 ASN 80 HD21 ASN 80 -10.476 -10.177 14.998 661 HD22 ASN 80 HD22 ASN 80 -12.025 -10.561 15.641 662 H LEU 81 H LEU 81 -7.833 -11.124 14.720 663 HA LEU 81 HA LEU 81 -8.205 -9.741 12.147 664 HB2 LEU 81 HB2 LEU 81 -6.597 -12.212 12.798 665 HB3 LEU 81 HB3 LEU 81 -6.720 -11.470 11.216 666 HG LEU 81 HG LEU 81 -5.432 -10.265 13.672 667 HD11 LEU 81 HD11 LEU 81 -4.276 -11.206 11.036 668 HD12 LEU 81 HD12 LEU 81 -4.085 -11.997 12.605 669 HD13 LEU 81 HD13 LEU 81 -3.374 -10.407 12.328 670 HD21 LEU 81 HD21 LEU 81 -4.773 -8.412 12.156 671 HD22 LEU 81 HD22 LEU 81 -6.514 -8.498 12.423 672 HD23 LEU 81 HD23 LEU 81 -5.826 -9.090 10.910 673 H GLU 82 H GLU 82 -9.244 -10.771 10.418 674 HA GLU 82 HA GLU 82 -10.883 -13.148 11.062 675 HB2 GLU 82 HB2 GLU 82 -12.740 -12.123 9.766 676 HB3 GLU 82 HB3 GLU 82 -12.327 -11.201 11.207 677 HG2 GLU 82 HG2 GLU 82 -11.218 -9.533 9.936 678 HG3 GLU 82 HG3 GLU 82 -11.264 -10.518 8.475 679 H HIS 83 H HIS 83 -8.354 -12.933 9.577 680 HA HIS 83 HA HIS 83 -8.892 -12.950 6.765 681 HB2 HIS 83 HB2 HIS 83 -6.455 -13.875 8.304 682 HB3 HIS 83 HB3 HIS 83 -6.541 -13.757 6.552 683 HD1 HIS 83 HD1 HIS 83 -5.664 -11.639 5.631 684 HD2 HIS 83 HD2 HIS 83 -7.031 -11.171 9.526 685 HE1 HIS 83 HE1 HIS 83 -5.031 -9.304 6.290 686 HE2 HIS 83 HE2 HIS 83 -6.052 -8.981 8.568 687 H HIS 84 H HIS 84 -10.469 -14.475 6.353 688 HA HIS 84 HA HIS 84 -9.637 -17.299 6.607 689 HB2 HIS 84 HB2 HIS 84 -11.396 -16.810 8.249 690 HB3 HIS 84 HB3 HIS 84 -12.432 -16.187 6.973 691 HD1 HIS 84 HD1 HIS 84 -13.751 -17.871 5.600 692 HD2 HIS 84 HD2 HIS 84 -11.099 -19.649 8.258 693 HE1 HIS 84 HE1 HIS 84 -14.340 -20.309 5.606 694 HE2 HIS 84 HE2 HIS 84 -12.775 -21.353 7.273 695 H HIS 85 H HIS 85 -8.973 -17.616 4.539 696 HA HIS 85 HA HIS 85 -10.747 -16.865 2.308 697 HB2 HIS 85 HB2 HIS 85 -8.369 -16.152 2.228 698 HB3 HIS 85 HB3 HIS 85 -7.872 -17.835 2.290 699 HD1 HIS 85 HD1 HIS 85 -9.427 -15.307 -0.025 700 HD2 HIS 85 HD2 HIS 85 -7.986 -19.201 -0.126 701 HE1 HIS 85 HE1 HIS 85 -9.256 -15.897 -2.458 702 HE2 HIS 85 HE2 HIS 85 -8.144 -18.150 -2.481 703 H HIS 86 H HIS 86 -11.417 -18.427 0.742 704 HA HIS 86 HA HIS 86 -12.044 -21.005 1.630 705 HB2 HIS 86 HB2 HIS 86 -11.851 -19.835 -1.148 706 HB3 HIS 86 HB3 HIS 86 -12.306 -21.515 -0.889 707 HD1 HIS 86 HD1 HIS 86 -14.740 -21.846 -0.862 708 HD2 HIS 86 HD2 HIS 86 -13.712 -18.065 0.525 709 HE1 HIS 86 HE1 HIS 86 -16.915 -20.694 -0.373 710 HE2 HIS 86 HE2 HIS 86 -16.263 -18.482 0.625 711 H HIS 87 H HIS 87 -10.638 -22.530 2.216 712 HA HIS 87 HA HIS 87 -8.164 -22.886 0.634 713 HB2 HIS 87 HB2 HIS 87 -6.940 -23.358 2.686 714 HB3 HIS 87 HB3 HIS 87 -7.707 -21.778 2.808 715 HD1 HIS 87 HD1 HIS 87 -7.691 -25.176 4.333 716 HD2 HIS 87 HD2 HIS 87 -9.838 -21.631 4.684 717 HE1 HIS 87 HE1 HIS 87 -9.038 -25.408 6.436 718 HE2 HIS 87 HE2 HIS 87 -10.371 -23.281 6.601 719 H HIS 88 H HIS 88 -7.122 -25.036 1.016 720 HA HIS 88 HA HIS 88 -8.903 -27.224 0.749 721 HB2 HIS 88 HB2 HIS 88 -6.705 -28.567 1.130 722 HB3 HIS 88 HB3 HIS 88 -6.850 -27.555 -0.299 723 HD1 HIS 88 HD1 HIS 88 -5.233 -25.608 -0.540 724 HD2 HIS 88 HD2 HIS 88 -4.867 -27.592 3.094 725 HE1 HIS 88 HE1 HIS 88 -3.154 -24.692 0.520 726 HE2 HIS 88 HE2 HIS 88 -2.847 -26.055 2.609 727 H1 MET 1 H1 MET 1 -8.420 20.025 -15.753 728 H2 MET 1 H2 MET 1 -8.793 20.545 -17.313 729 H3 MET 1 H3 MET 1 -9.685 19.298 -16.606 730 HA MET 1 HA MET 1 -9.599 22.113 -15.700 731 HB2 MET 1 HB2 MET 1 -11.822 20.536 -17.029 732 HB3 MET 1 HB3 MET 1 -11.971 22.178 -16.414 733 HG2 MET 1 HG2 MET 1 -10.228 22.892 -18.021 734 HG3 MET 1 HG3 MET 1 -10.209 21.261 -18.684 735 HE1 MET 1 HE1 MET 1 -13.876 20.988 -20.126 736 HE2 MET 1 HE2 MET 1 -13.354 20.525 -18.507 737 HE3 MET 1 HE3 MET 1 -12.341 20.147 -19.900 738 H THR 2 H THR 2 -11.530 19.098 -15.346 739 HA THR 2 HA THR 2 -11.587 19.618 -12.433 740 HB THR 2 HB THR 2 -13.850 18.457 -14.083 741 HG1 THR 2 HG1 THR 2 -14.635 20.563 -12.709 742 HG21 THR 2 HG21 THR 2 -13.742 17.404 -11.882 743 HG22 THR 2 HG22 THR 2 -15.123 18.499 -11.966 744 HG23 THR 2 HG23 THR 2 -13.661 18.987 -11.109 745 H ASP 3 H ASP 3 -10.302 18.147 -11.534 746 HA ASP 3 HA ASP 3 -9.646 15.643 -12.658 747 HB2 ASP 3 HB2 ASP 3 -8.652 15.201 -10.369 748 HB3 ASP 3 HB3 ASP 3 -8.089 16.661 -11.177 749 H PHE 4 H PHE 4 -10.049 13.502 -11.739 750 HA PHE 4 HA PHE 4 -12.470 13.239 -10.113 751 HB2 PHE 4 HB2 PHE 4 -13.409 11.524 -11.565 752 HB3 PHE 4 HB3 PHE 4 -13.194 13.014 -12.470 753 HD1 PHE 4 HD1 PHE 4 -11.987 9.568 -12.006 754 HD2 PHE 4 HD2 PHE 4 -11.641 13.131 -14.325 755 HE1 PHE 4 HE1 PHE 4 -10.736 8.328 -13.723 756 HE2 PHE 4 HE2 PHE 4 -10.391 11.889 -16.041 757 HZ PHE 4 HZ PHE 4 -9.929 9.488 -15.739 758 H LEU 5 H LEU 5 -12.641 11.224 -9.006 759 HA LEU 5 HA LEU 5 -10.097 10.151 -8.231 760 HB2 LEU 5 HB2 LEU 5 -11.902 10.459 -6.610 761 HB3 LEU 5 HB3 LEU 5 -12.896 9.316 -7.489 762 HG LEU 5 HG LEU 5 -11.343 7.496 -6.922 763 HD11 LEU 5 HD11 LEU 5 -9.822 9.599 -5.373 764 HD12 LEU 5 HD12 LEU 5 -9.268 8.783 -6.835 765 HD13 LEU 5 HD13 LEU 5 -9.505 7.863 -5.349 766 HD21 LEU 5 HD21 LEU 5 -12.202 9.108 -4.516 767 HD22 LEU 5 HD22 LEU 5 -11.796 7.391 -4.519 768 HD23 LEU 5 HD23 LEU 5 -13.203 7.965 -5.413 769 H ALA 6 H ALA 6 -9.075 8.870 -9.602 770 HA ALA 6 HA ALA 6 -10.528 6.950 -11.255 771 HB1 ALA 6 HB1 ALA 6 -7.611 7.727 -11.278 772 HB2 ALA 6 HB2 ALA 6 -8.868 8.410 -12.310 773 HB3 ALA 6 HB3 ALA 6 -8.430 6.709 -12.463 774 H GLY 7 H GLY 7 -9.921 4.724 -11.374 775 HA2 GLY 7 HA2 GLY 7 -8.479 3.691 -9.006 776 HA3 GLY 7 HA3 GLY 7 -10.037 3.031 -9.473 777 H ILE 8 H ILE 8 -6.962 2.242 -9.437 778 HA ILE 8 HA ILE 8 -7.012 0.831 -12.039 779 HB ILE 8 HB ILE 8 -4.565 1.523 -10.378 780 HG12 ILE 8 HG12 ILE 8 -5.572 2.772 -12.953 781 HG13 ILE 8 HG13 ILE 8 -5.572 3.539 -11.368 782 HG21 ILE 8 HG21 ILE 8 -4.790 0.318 -13.143 783 HG22 ILE 8 HG22 ILE 8 -4.270 -0.517 -11.680 784 HG23 ILE 8 HG23 ILE 8 -3.286 0.785 -12.346 785 HD11 ILE 8 HD11 ILE 8 -3.159 2.742 -12.980 786 HD12 ILE 8 HD12 ILE 8 -3.106 3.413 -11.350 787 HD13 ILE 8 HD13 ILE 8 -3.745 4.378 -12.681 788 H ARG 9 H ARG 9 -6.486 -1.375 -12.073 789 HA ARG 9 HA ARG 9 -6.230 -2.710 -9.451 790 HB2 ARG 9 HB2 ARG 9 -8.462 -3.084 -10.369 791 HB3 ARG 9 HB3 ARG 9 -7.770 -3.658 -11.881 792 HG2 ARG 9 HG2 ARG 9 -6.755 -5.551 -10.670 793 HG3 ARG 9 HG3 ARG 9 -7.517 -4.985 -9.183 794 HD2 ARG 9 HD2 ARG 9 -9.711 -5.328 -10.117 795 HD3 ARG 9 HD3 ARG 9 -9.023 -5.735 -11.690 796 HE ARG 9 HE ARG 9 -8.656 -7.380 -9.268 797 HH11 ARG 9 HH11 ARG 9 -9.186 -7.071 -12.654 798 HH12 ARG 9 HH12 ARG 9 -9.170 -8.778 -12.921 799 HH21 ARG 9 HH21 ARG 9 -8.658 -9.559 -9.613 800 HH22 ARG 9 HH22 ARG 9 -8.860 -10.178 -11.216 801 H ILE 10 H ILE 10 -4.524 -4.020 -9.234 802 HA ILE 10 HA ILE 10 -3.024 -4.849 -11.654 803 HB ILE 10 HB ILE 10 -1.853 -4.172 -8.943 804 HG12 ILE 10 HG12 ILE 10 -1.738 -2.521 -11.483 805 HG13 ILE 10 HG13 ILE 10 -2.799 -2.179 -10.120 806 HG21 ILE 10 HG21 ILE 10 -0.518 -5.788 -10.163 807 HG22 ILE 10 HG22 ILE 10 0.308 -4.231 -10.136 808 HG23 ILE 10 HG23 ILE 10 -0.530 -4.760 -11.596 809 HD11 ILE 10 HD11 ILE 10 -0.891 -0.758 -9.995 810 HD12 ILE 10 HD12 ILE 10 0.207 -2.128 -10.135 811 HD13 ILE 10 HD13 ILE 10 -0.787 -1.938 -8.689 812 H VAL 11 H VAL 11 -3.111 -7.047 -11.871 813 HA VAL 11 HA VAL 11 -2.886 -8.667 -9.403 814 HB VAL 11 HB VAL 11 -4.343 -9.380 -11.956 815 HG11 VAL 11 HG11 VAL 11 -4.886 -11.518 -10.877 816 HG12 VAL 11 HG12 VAL 11 -3.826 -11.102 -9.530 817 HG13 VAL 11 HG13 VAL 11 -3.152 -11.343 -11.142 818 HG21 VAL 11 HG21 VAL 11 -5.309 -9.030 -9.113 819 HG22 VAL 11 HG22 VAL 11 -6.303 -9.540 -10.480 820 HG23 VAL 11 HG23 VAL 11 -5.602 -7.922 -10.456 821 H GLY 12 H GLY 12 -1.021 -9.592 -9.171 822 HA2 GLY 12 HA2 GLY 12 0.346 -10.804 -11.473 823 HA3 GLY 12 HA3 GLY 12 1.228 -9.629 -10.508 824 H GLU 13 H GLU 13 2.306 -12.079 -10.728 825 HA GLU 13 HA GLU 13 1.422 -13.913 -8.730 826 HB2 GLU 13 HB2 GLU 13 3.531 -15.113 -9.213 827 HB3 GLU 13 HB3 GLU 13 2.629 -14.711 -10.669 828 HG2 GLU 13 HG2 GLU 13 4.130 -12.813 -11.073 829 HG3 GLU 13 HG3 GLU 13 5.031 -13.219 -9.615 830 H ASP 14 H ASP 14 1.795 -13.922 -6.604 831 HA ASP 14 HA ASP 14 3.254 -11.906 -5.273 832 HB2 ASP 14 HB2 ASP 14 1.452 -12.999 -4.116 833 HB3 ASP 14 HB3 ASP 14 2.209 -14.577 -4.310 834 H LYS 15 H LYS 15 5.377 -11.679 -5.239 835 HA LYS 15 HA LYS 15 7.101 -14.070 -5.218 836 HB2 LYS 15 HB2 LYS 15 7.497 -11.464 -6.690 837 HB3 LYS 15 HB3 LYS 15 8.767 -12.656 -6.481 838 HG2 LYS 15 HG2 LYS 15 7.492 -14.297 -7.680 839 HG3 LYS 15 HG3 LYS 15 6.132 -13.182 -7.829 840 HD2 LYS 15 HD2 LYS 15 7.087 -12.826 -9.877 841 HD3 LYS 15 HD3 LYS 15 8.032 -11.659 -8.951 842 HE2 LYS 15 HE2 LYS 15 9.528 -12.948 -10.318 843 HE3 LYS 15 HE3 LYS 15 9.767 -13.415 -8.632 844 HZ1 LYS 15 HZ1 LYS 15 8.112 -14.913 -10.596 845 HZ2 LYS 15 HZ2 LYS 15 8.426 -15.369 -8.999 846 HZ3 LYS 15 HZ3 LYS 15 9.685 -15.335 -10.124 847 H ASN 16 H ASN 16 9.456 -13.200 -4.777 848 HA ASN 16 HA ASN 16 9.775 -12.855 -2.109 849 HB2 ASN 16 HB2 ASN 16 12.095 -12.277 -2.621 850 HB3 ASN 16 HB3 ASN 16 11.501 -13.550 -3.691 851 HD21 ASN 16 HD21 ASN 16 11.295 -13.163 -5.857 852 HD22 ASN 16 HD22 ASN 16 11.910 -11.736 -6.619 853 H GLY 17 H GLY 17 9.244 -10.260 -4.430 854 HA2 GLY 17 HA2 GLY 17 8.680 -8.434 -2.245 855 HA3 GLY 17 HA3 GLY 17 10.087 -7.997 -3.199 856 H MET 18 H MET 18 7.202 -9.505 -4.537 857 HA MET 18 HA MET 18 7.014 -7.455 -6.537 858 HB2 MET 18 HB2 MET 18 5.681 -10.049 -5.980 859 HB3 MET 18 HB3 MET 18 4.756 -8.894 -6.923 860 HG2 MET 18 HG2 MET 18 7.542 -9.795 -7.609 861 HG3 MET 18 HG3 MET 18 6.066 -10.486 -8.282 862 HE1 MET 18 HE1 MET 18 4.553 -7.353 -10.135 863 HE2 MET 18 HE2 MET 18 4.278 -7.780 -8.447 864 HE3 MET 18 HE3 MET 18 4.292 -9.038 -9.683 865 H THR 19 H THR 19 4.838 -8.446 -3.870 866 HA THR 19 HA THR 19 2.845 -6.515 -4.292 867 HB THR 19 HB THR 19 2.246 -6.858 -1.908 868 HG1 THR 19 HG1 THR 19 3.593 -8.432 -0.761 869 HG21 THR 19 HG21 THR 19 1.482 -8.493 -3.566 870 HG22 THR 19 HG22 THR 19 1.834 -9.283 -2.029 871 HG23 THR 19 HG23 THR 19 2.977 -9.408 -3.366 872 H ASN 20 H ASN 20 5.950 -6.313 -2.668 873 HA ASN 20 HA ASN 20 5.472 -3.750 -1.468 874 HB2 ASN 20 HB2 ASN 20 8.044 -5.284 -1.926 875 HB3 ASN 20 HB3 ASN 20 7.932 -3.780 -1.016 876 HD21 ASN 20 HD21 ASN 20 8.572 -4.651 0.920 877 HD22 ASN 20 HD22 ASN 20 7.614 -5.779 1.808 878 H GLN 21 H GLN 21 7.340 -4.872 -4.297 879 HA GLN 21 HA GLN 21 8.313 -2.320 -4.994 880 HB2 GLN 21 HB2 GLN 21 9.095 -3.281 -7.001 881 HB3 GLN 21 HB3 GLN 21 9.215 -4.542 -5.793 882 HG2 GLN 21 HG2 GLN 21 7.249 -5.626 -6.660 883 HG3 GLN 21 HG3 GLN 21 6.966 -4.299 -7.787 884 HE21 GLN 21 HE21 GLN 21 8.937 -7.058 -7.058 885 HE22 GLN 21 HE22 GLN 21 9.683 -7.175 -8.608 886 H ILE 22 H ILE 22 5.410 -4.077 -5.994 887 HA ILE 22 HA ILE 22 4.540 -2.346 -8.022 888 HB ILE 22 HB ILE 22 3.126 -4.280 -6.210 889 HG12 ILE 22 HG12 ILE 22 4.499 -5.152 -8.050 890 HG13 ILE 22 HG13 ILE 22 2.793 -5.506 -8.309 891 HG21 ILE 22 HG21 ILE 22 1.762 -2.586 -8.308 892 HG22 ILE 22 HG22 ILE 22 1.500 -2.500 -6.566 893 HG23 ILE 22 HG23 ILE 22 1.042 -3.952 -7.454 894 HD11 ILE 22 HD11 ILE 22 2.637 -3.672 -9.890 895 HD12 ILE 22 HD12 ILE 22 3.904 -4.804 -10.361 896 HD13 ILE 22 HD13 ILE 22 4.328 -3.267 -9.607 897 H THR 23 H THR 23 3.541 -2.425 -4.590 898 HA THR 23 HA THR 23 1.992 -0.046 -4.814 899 HB THR 23 HB THR 23 3.099 -1.131 -2.213 900 HG1 THR 23 HG1 THR 23 2.037 -2.905 -2.749 901 HG21 THR 23 HG21 THR 23 1.939 1.024 -2.091 902 HG22 THR 23 HG22 THR 23 0.996 -0.242 -1.305 903 HG23 THR 23 HG23 THR 23 0.541 0.327 -2.912 904 H GLY 24 H GLY 24 5.340 -0.722 -4.067 905 HA2 GLY 24 HA2 GLY 24 6.154 1.807 -3.139 906 HA3 GLY 24 HA3 GLY 24 7.171 0.663 -4.005 907 H VAL 25 H VAL 25 6.208 0.527 -6.490 908 HA VAL 25 HA VAL 25 6.939 2.875 -7.804 909 HB VAL 25 HB VAL 25 5.100 0.683 -8.808 910 HG11 VAL 25 HG11 VAL 25 5.686 1.449 -11.061 911 HG12 VAL 25 HG12 VAL 25 6.614 2.781 -10.374 912 HG13 VAL 25 HG13 VAL 25 4.865 2.718 -10.151 913 HG21 VAL 25 HG21 VAL 25 7.134 -0.189 -9.904 914 HG22 VAL 25 HG22 VAL 25 7.278 -0.173 -8.147 915 HG23 VAL 25 HG23 VAL 25 8.084 1.067 -9.107 916 H ILE 26 H ILE 26 3.720 1.726 -6.868 917 HA ILE 26 HA ILE 26 2.126 3.754 -7.883 918 HB ILE 26 HB ILE 26 1.888 2.153 -5.336 919 HG12 ILE 26 HG12 ILE 26 0.426 2.002 -7.989 920 HG13 ILE 26 HG13 ILE 26 1.691 0.904 -7.448 921 HG21 ILE 26 HG21 ILE 26 0.701 4.239 -4.972 922 HG22 ILE 26 HG22 ILE 26 -0.438 2.907 -5.164 923 HG23 ILE 26 HG23 ILE 26 -0.167 4.033 -6.494 924 HD11 ILE 26 HD11 ILE 26 0.254 0.141 -5.629 925 HD12 ILE 26 HD12 ILE 26 -0.509 -0.089 -7.203 926 HD13 ILE 26 HD13 ILE 26 -1.013 1.246 -6.167 927 H SER 27 H SER 27 3.856 3.694 -4.756 928 HA SER 27 HA SER 27 2.995 6.304 -3.966 929 HB2 SER 27 HB2 SER 27 4.550 6.117 -2.128 930 HB3 SER 27 HB3 SER 27 3.779 4.548 -2.357 931 HG SER 27 HG SER 27 5.631 3.782 -3.305 932 H LYS 28 H LYS 28 5.502 5.172 -6.034 933 HA LYS 28 HA LYS 28 7.201 7.479 -5.869 934 HB2 LYS 28 HB2 LYS 28 7.013 5.278 -7.938 935 HB3 LYS 28 HB3 LYS 28 8.262 6.517 -7.925 936 HG2 LYS 28 HG2 LYS 28 9.036 5.719 -5.743 937 HG3 LYS 28 HG3 LYS 28 7.778 4.482 -5.750 938 HD2 LYS 28 HD2 LYS 28 8.768 3.456 -7.733 939 HD3 LYS 28 HD3 LYS 28 9.998 4.720 -7.791 940 HE2 LYS 28 HE2 LYS 28 10.831 3.992 -5.592 941 HE3 LYS 28 HE3 LYS 28 9.615 2.714 -5.558 942 HZ1 LYS 28 HZ1 LYS 28 11.885 2.017 -6.292 943 HZ2 LYS 28 HZ2 LYS 28 11.669 2.949 -7.688 944 HZ3 LYS 28 HZ3 LYS 28 10.649 1.637 -7.382 945 H PHE 29 H PHE 29 4.151 7.102 -7.228 946 HA PHE 29 HA PHE 29 4.475 8.576 -9.641 947 HB2 PHE 29 HB2 PHE 29 2.026 8.013 -7.968 948 HB3 PHE 29 HB3 PHE 29 1.966 8.879 -9.497 949 HD1 PHE 29 HD1 PHE 29 4.262 7.034 -10.689 950 HD2 PHE 29 HD2 PHE 29 0.508 6.326 -8.804 951 HE1 PHE 29 HE1 PHE 29 4.066 4.896 -11.885 952 HE2 PHE 29 HE2 PHE 29 0.312 4.184 -9.996 953 HZ PHE 29 HZ PHE 29 2.093 3.467 -11.538 954 H ASP 30 H ASP 30 3.222 10.607 -10.045 955 HA ASP 30 HA ASP 30 4.120 12.685 -8.236 956 HB2 ASP 30 HB2 ASP 30 2.902 14.098 -10.141 957 HB3 ASP 30 HB3 ASP 30 4.495 13.388 -10.388 958 H THR 31 H THR 31 1.101 11.167 -9.109 959 HA THR 31 HA THR 31 -0.578 13.174 -7.906 960 HB THR 31 HB THR 31 -1.517 11.886 -9.707 961 HG1 THR 31 HG1 THR 31 -3.443 11.671 -8.785 962 HG21 THR 31 HG21 THR 31 -1.073 9.442 -7.987 963 HG22 THR 31 HG22 THR 31 -0.251 9.830 -9.502 964 HG23 THR 31 HG23 THR 31 -1.977 9.471 -9.503 965 H ASN 32 H ASN 32 -2.108 12.675 -6.128 966 HA ASN 32 HA ASN 32 -0.588 11.538 -3.895 967 HB2 ASN 32 HB2 ASN 32 -1.394 13.834 -3.666 968 HB3 ASN 32 HB3 ASN 32 -3.050 13.304 -3.933 969 HD21 ASN 32 HD21 ASN 32 -0.680 11.599 -1.964 970 HD22 ASN 32 HD22 ASN 32 -1.491 11.861 -0.466 971 H ILE 33 H ILE 33 -1.071 9.634 -3.023 972 HA ILE 33 HA ILE 33 -3.180 7.988 -3.961 973 HB ILE 33 HB ILE 33 -1.447 7.651 -1.501 974 HG12 ILE 33 HG12 ILE 33 -1.122 6.526 -4.302 975 HG13 ILE 33 HG13 ILE 33 -0.156 7.822 -3.603 976 HG21 ILE 33 HG21 ILE 33 -3.475 6.271 -1.399 977 HG22 ILE 33 HG22 ILE 33 -2.034 5.279 -1.616 978 HG23 ILE 33 HG23 ILE 33 -3.098 5.596 -2.986 979 HD11 ILE 33 HD11 ILE 33 -0.257 4.971 -2.642 980 HD12 ILE 33 HD12 ILE 33 0.691 6.269 -1.914 981 HD13 ILE 33 HD13 ILE 33 1.048 5.729 -3.554 982 H ARG 34 H ARG 34 -5.278 8.307 -3.500 983 HA ARG 34 HA ARG 34 -6.070 9.466 -0.938 984 HB2 ARG 34 HB2 ARG 34 -7.095 10.055 -3.238 985 HB3 ARG 34 HB3 ARG 34 -7.951 8.526 -3.104 986 HG2 ARG 34 HG2 ARG 34 -9.486 10.074 -2.304 987 HG3 ARG 34 HG3 ARG 34 -8.776 9.420 -0.827 988 HD2 ARG 34 HD2 ARG 34 -8.005 12.018 -2.170 989 HD3 ARG 34 HD3 ARG 34 -9.015 11.866 -0.737 990 HE ARG 34 HE ARG 34 -7.014 10.954 0.401 991 HH11 ARG 34 HH11 ARG 34 -6.583 12.859 -2.440 992 HH12 ARG 34 HH12 ARG 34 -5.009 13.390 -1.972 993 HH21 ARG 34 HH21 ARG 34 -4.990 11.662 0.985 994 HH22 ARG 34 HH22 ARG 34 -4.118 12.709 -0.081 995 H THR 35 H THR 35 -6.189 6.406 -2.657 996 HA THR 35 HA THR 35 -6.537 4.976 -0.160 997 HB THR 35 HB THR 35 -8.533 4.433 -2.371 998 HG1 THR 35 HG1 THR 35 -8.715 6.059 -0.063 999 HG21 THR 35 HG21 THR 35 -8.050 2.487 -0.994 1000 HG22 THR 35 HG22 THR 35 -9.678 3.079 -0.658 1001 HG23 THR 35 HG23 THR 35 -8.365 3.419 0.471 1002 H ILE 36 H ILE 36 -5.789 2.832 -0.282 1003 HA ILE 36 HA ILE 36 -5.361 1.625 -2.894 1004 HB ILE 36 HB ILE 36 -3.234 2.824 -2.442 1005 HG12 ILE 36 HG12 ILE 36 -3.424 0.523 -3.641 1006 HG13 ILE 36 HG13 ILE 36 -1.827 1.110 -3.193 1007 HG21 ILE 36 HG21 ILE 36 -3.203 2.777 -0.028 1008 HG22 ILE 36 HG22 ILE 36 -1.731 2.032 -0.654 1009 HG23 ILE 36 HG23 ILE 36 -3.036 1.021 -0.032 1010 HD11 ILE 36 HD11 ILE 36 -3.453 -0.919 -1.674 1011 HD12 ILE 36 HD12 ILE 36 -1.830 -0.366 -1.257 1012 HD13 ILE 36 HD13 ILE 36 -2.099 -1.268 -2.748 1013 H VAL 37 H VAL 37 -5.727 -0.536 -2.870 1014 HA VAL 37 HA VAL 37 -5.789 -1.926 -0.271 1015 HB VAL 37 HB VAL 37 -7.957 -2.126 -2.381 1016 HG11 VAL 37 HG11 VAL 37 -7.712 -3.505 0.298 1017 HG12 VAL 37 HG12 VAL 37 -7.576 -4.268 -1.286 1018 HG13 VAL 37 HG13 VAL 37 -9.115 -3.579 -0.769 1019 HG21 VAL 37 HG21 VAL 37 -8.112 -0.040 -1.119 1020 HG22 VAL 37 HG22 VAL 37 -8.065 -0.938 0.399 1021 HG23 VAL 37 HG23 VAL 37 -9.435 -1.126 -0.696 1022 H LEU 38 H LEU 38 -4.156 -3.363 -0.510 1023 HA LEU 38 HA LEU 38 -4.094 -5.048 -2.943 1024 HB2 LEU 38 HB2 LEU 38 -2.076 -3.665 -2.570 1025 HB3 LEU 38 HB3 LEU 38 -1.855 -4.408 -1.001 1026 HG LEU 38 HG LEU 38 -1.799 -6.070 -3.526 1027 HD11 LEU 38 HD11 LEU 38 -0.157 -4.296 -3.843 1028 HD12 LEU 38 HD12 LEU 38 0.643 -5.840 -3.547 1029 HD13 LEU 38 HD13 LEU 38 0.542 -4.638 -2.260 1030 HD21 LEU 38 HD21 LEU 38 -0.554 -6.449 -0.792 1031 HD22 LEU 38 HD22 LEU 38 -0.387 -7.551 -2.160 1032 HD23 LEU 38 HD23 LEU 38 -1.966 -7.300 -1.420 1033 H ASN 39 H ASN 39 -4.500 -7.203 -2.711 1034 HA ASN 39 HA ASN 39 -3.842 -8.470 -0.149 1035 HB2 ASN 39 HB2 ASN 39 -5.908 -9.672 0.026 1036 HB3 ASN 39 HB3 ASN 39 -6.302 -7.970 -0.159 1037 HD21 ASN 39 HD21 ASN 39 -7.309 -7.283 -2.042 1038 HD22 ASN 39 HD22 ASN 39 -8.016 -8.389 -3.160 1039 H ALA 40 H ALA 40 -2.829 -10.362 -0.346 1040 HA ALA 40 HA ALA 40 -2.642 -11.610 -3.017 1041 HB1 ALA 40 HB1 ALA 40 -0.582 -12.641 -2.201 1042 HB2 ALA 40 HB2 ALA 40 -0.824 -11.910 -0.614 1043 HB3 ALA 40 HB3 ALA 40 -0.519 -10.888 -2.020 1044 H LYS 41 H LYS 41 -3.551 -13.499 -3.364 1045 HA LYS 41 HA LYS 41 -4.019 -15.391 -1.180 1046 HB2 LYS 41 HB2 LYS 41 -6.333 -15.708 -1.666 1047 HB3 LYS 41 HB3 LYS 41 -6.097 -13.972 -1.512 1048 HG2 LYS 41 HG2 LYS 41 -6.250 -15.461 -4.132 1049 HG3 LYS 41 HG3 LYS 41 -7.591 -14.597 -3.377 1050 HD2 LYS 41 HD2 LYS 41 -6.405 -12.495 -3.571 1051 HD3 LYS 41 HD3 LYS 41 -4.969 -13.321 -4.179 1052 HE2 LYS 41 HE2 LYS 41 -6.288 -14.068 -6.143 1053 HE3 LYS 41 HE3 LYS 41 -7.654 -13.122 -5.546 1054 HZ1 LYS 41 HZ1 LYS 41 -4.993 -12.039 -6.291 1055 HZ2 LYS 41 HZ2 LYS 41 -6.298 -11.133 -5.717 1056 HZ3 LYS 41 HZ3 LYS 41 -6.406 -11.909 -7.213 1057 H ASP 42 H ASP 42 -3.887 -17.523 -1.798 1058 HA ASP 42 HA ASP 42 -3.258 -19.320 -3.040 1059 HB2 ASP 42 HB2 ASP 42 -4.841 -17.886 -5.186 1060 HB3 ASP 42 HB3 ASP 42 -4.343 -19.576 -5.255 1061 H GLY 43 H GLY 43 -1.502 -16.937 -3.027 1062 HA2 GLY 43 HA2 GLY 43 0.695 -16.744 -3.786 1063 HA3 GLY 43 HA3 GLY 43 0.331 -17.873 -5.078 1064 H ILE 44 H ILE 44 -2.026 -15.475 -5.072 1065 HA ILE 44 HA ILE 44 -0.470 -13.743 -6.907 1066 HB ILE 44 HB ILE 44 -3.402 -14.337 -7.310 1067 HG12 ILE 44 HG12 ILE 44 -1.010 -15.709 -8.559 1068 HG13 ILE 44 HG13 ILE 44 -2.273 -16.440 -7.571 1069 HG21 ILE 44 HG21 ILE 44 -2.968 -13.447 -9.563 1070 HG22 ILE 44 HG22 ILE 44 -1.286 -13.156 -9.120 1071 HG23 ILE 44 HG23 ILE 44 -2.577 -12.270 -8.309 1072 HD11 ILE 44 HD11 ILE 44 -2.658 -15.202 -10.283 1073 HD12 ILE 44 HD12 ILE 44 -3.912 -15.970 -9.307 1074 HD13 ILE 44 HD13 ILE 44 -2.573 -16.930 -9.941 1075 H PHE 45 H PHE 45 -0.864 -11.570 -6.789 1076 HA PHE 45 HA PHE 45 -2.614 -10.731 -4.555 1077 HB2 PHE 45 HB2 PHE 45 -1.155 -8.887 -4.115 1078 HB3 PHE 45 HB3 PHE 45 -0.155 -10.328 -4.235 1079 HD1 PHE 45 HD2 PHE 45 -1.050 -7.138 -5.791 1080 HD2 PHE 45 HD1 PHE 45 1.388 -10.620 -6.086 1081 HE1 PHE 45 HE2 PHE 45 0.340 -6.018 -7.482 1082 HE2 PHE 45 HE1 PHE 45 2.781 -9.500 -7.774 1083 HZ PHE 45 HZ PHE 45 2.251 -7.199 -8.475 1084 H THR 46 H THR 46 -3.990 -9.010 -4.794 1085 HA THR 46 HA THR 46 -4.067 -7.691 -7.439 1086 HB THR 46 HB THR 46 -6.018 -9.044 -7.402 1087 HG1 THR 46 HG1 THR 46 -6.825 -6.417 -6.610 1088 HG21 THR 46 HG21 THR 46 -7.698 -8.964 -5.599 1089 HG22 THR 46 HG22 THR 46 -6.623 -7.927 -4.660 1090 HG23 THR 46 HG23 THR 46 -6.143 -9.584 -5.040 1091 H CYS 47 H CYS 47 -3.248 -5.732 -7.144 1092 HA CYS 47 HA CYS 47 -3.838 -4.230 -4.680 1093 HB2 CYS 47 HB2 CYS 47 -1.462 -4.499 -5.326 1094 HB3 CYS 47 HB3 CYS 47 -1.788 -3.677 -6.846 1095 HG CYS 47 HG CYS 47 -0.596 -2.293 -4.324 1096 H ASN 48 H ASN 48 -5.355 -2.696 -4.736 1097 HA ASN 48 HA ASN 48 -6.143 -1.533 -7.322 1098 HB2 ASN 48 HB2 ASN 48 -7.659 -1.531 -4.699 1099 HB3 ASN 48 HB3 ASN 48 -8.247 -0.891 -6.230 1100 HD21 ASN 48 HD21 ASN 48 -9.490 -2.882 -4.653 1101 HD22 ASN 48 HD22 ASN 48 -9.542 -4.332 -5.588 1102 H LEU 49 H LEU 49 -5.387 0.424 -7.763 1103 HA LEU 49 HA LEU 49 -4.523 2.197 -5.583 1104 HB2 LEU 49 HB2 LEU 49 -2.828 1.836 -7.220 1105 HB3 LEU 49 HB3 LEU 49 -3.938 2.151 -8.541 1106 HG LEU 49 HG LEU 49 -4.039 4.517 -7.939 1107 HD11 LEU 49 HD11 LEU 49 -3.791 4.411 -5.555 1108 HD12 LEU 49 HD12 LEU 49 -2.503 5.420 -6.211 1109 HD13 LEU 49 HD13 LEU 49 -2.159 3.766 -5.703 1110 HD21 LEU 49 HD21 LEU 49 -2.314 3.805 -9.504 1111 HD22 LEU 49 HD22 LEU 49 -1.203 3.496 -8.170 1112 HD23 LEU 49 HD23 LEU 49 -1.735 5.143 -8.513 1113 H MET 50 H MET 50 -5.675 3.935 -5.021 1114 HA MET 50 HA MET 50 -7.676 4.992 -6.921 1115 HB2 MET 50 HB2 MET 50 -7.823 5.077 -3.903 1116 HB3 MET 50 HB3 MET 50 -9.053 5.630 -5.030 1117 HG2 MET 50 HG2 MET 50 -8.161 2.792 -4.576 1118 HG3 MET 50 HG3 MET 50 -9.699 3.514 -4.122 1119 HE1 MET 50 HE1 MET 50 -9.969 5.350 -6.913 1120 HE2 MET 50 HE2 MET 50 -11.309 4.642 -6.008 1121 HE3 MET 50 HE3 MET 50 -11.142 4.319 -7.733 1122 H ILE 51 H ILE 51 -6.891 6.789 -7.777 1123 HA ILE 51 HA ILE 51 -5.831 8.897 -6.024 1124 HB ILE 51 HB ILE 51 -4.090 9.395 -7.862 1125 HG12 ILE 51 HG12 ILE 51 -3.298 7.046 -8.816 1126 HG13 ILE 51 HG13 ILE 51 -5.005 6.648 -8.648 1127 HG21 ILE 51 HG21 ILE 51 -3.749 7.001 -6.068 1128 HG22 ILE 51 HG22 ILE 51 -3.457 8.690 -5.651 1129 HG23 ILE 51 HG23 ILE 51 -2.438 7.891 -6.847 1130 HD11 ILE 51 HD11 ILE 51 -5.559 8.564 -10.085 1131 HD12 ILE 51 HD12 ILE 51 -4.527 7.380 -10.886 1132 HD13 ILE 51 HD13 ILE 51 -3.835 8.889 -10.288 1133 H PHE 52 H PHE 52 -5.771 11.036 -7.067 1134 HA PHE 52 HA PHE 52 -8.077 11.352 -8.831 1135 HB2 PHE 52 HB2 PHE 52 -6.537 13.213 -7.053 1136 HB3 PHE 52 HB3 PHE 52 -7.507 13.880 -8.362 1137 HD1 PHE 52 HD2 PHE 52 -9.939 13.559 -8.394 1138 HD2 PHE 52 HD1 PHE 52 -7.572 12.291 -5.086 1139 HE1 PHE 52 HE2 PHE 52 -11.966 13.400 -7.014 1140 HE2 PHE 52 HE1 PHE 52 -9.598 12.133 -3.699 1141 HZ PHE 52 HZ PHE 52 -11.796 12.685 -4.660 1142 H VAL 53 H VAL 53 -7.991 11.929 -10.910 1143 HA VAL 53 HA VAL 53 -5.412 12.841 -12.044 1144 HB VAL 53 HB VAL 53 -5.772 11.563 -14.053 1145 HG11 VAL 53 HG11 VAL 53 -4.704 10.351 -12.213 1146 HG12 VAL 53 HG12 VAL 53 -5.648 9.271 -13.241 1147 HG13 VAL 53 HG13 VAL 53 -6.285 9.777 -11.676 1148 HG21 VAL 53 HG21 VAL 53 -8.192 11.742 -14.204 1149 HG22 VAL 53 HG22 VAL 53 -8.376 10.652 -12.829 1150 HG23 VAL 53 HG23 VAL 53 -7.688 10.058 -14.342 1151 H LYS 54 H LYS 54 -5.523 14.410 -13.657 1152 HA LYS 54 HA LYS 54 -7.961 15.963 -13.778 1153 HB2 LYS 54 HB2 LYS 54 -5.308 16.339 -15.193 1154 HB3 LYS 54 HB3 LYS 54 -6.621 17.513 -15.169 1155 HG2 LYS 54 HG2 LYS 54 -6.398 17.765 -12.766 1156 HG3 LYS 54 HG3 LYS 54 -5.151 16.518 -12.727 1157 HD2 LYS 54 HD2 LYS 54 -4.927 19.132 -14.234 1158 HD3 LYS 54 HD3 LYS 54 -4.242 18.828 -12.637 1159 HE2 LYS 54 HE2 LYS 54 -2.876 17.018 -13.574 1160 HE3 LYS 54 HE3 LYS 54 -3.544 17.343 -15.173 1161 HZ1 LYS 54 HZ1 LYS 54 -2.005 19.296 -13.555 1162 HZ2 LYS 54 HZ2 LYS 54 -2.560 19.518 -15.138 1163 HZ3 LYS 54 HZ3 LYS 54 -1.364 18.370 -14.815 1164 H ASN 55 H ASN 55 -6.571 13.460 -15.634 1165 HA ASN 55 HA ASN 55 -8.698 13.536 -17.580 1166 HB2 ASN 55 HB2 ASN 55 -7.169 13.590 -19.551 1167 HB3 ASN 55 HB3 ASN 55 -7.166 15.100 -18.642 1168 HD21 ASN 55 HD21 ASN 55 -5.349 15.645 -17.431 1169 HD22 ASN 55 HD22 ASN 55 -3.825 14.876 -17.678 1170 H THR 56 H THR 56 -8.528 11.646 -19.117 1171 HA THR 56 HA THR 56 -8.014 9.273 -17.617 1172 HB THR 56 HB THR 56 -8.728 8.044 -19.628 1173 HG1 THR 56 HG1 THR 56 -8.262 9.016 -21.468 1174 HG21 THR 56 HG21 THR 56 -10.440 8.964 -18.128 1175 HG22 THR 56 HG22 THR 56 -10.994 8.970 -19.803 1176 HG23 THR 56 HG23 THR 56 -10.445 10.467 -19.049 1177 H ASP 57 H ASP 57 -6.215 10.996 -20.083 1178 HA ASP 57 HA ASP 57 -4.488 8.964 -20.940 1179 HB2 ASP 57 HB2 ASP 57 -3.911 11.927 -20.698 1180 HB3 ASP 57 HB3 ASP 57 -3.016 10.781 -21.692 1181 H LYS 58 H LYS 58 -4.145 11.239 -18.233 1182 HA LYS 58 HA LYS 58 -1.689 10.389 -17.216 1183 HB2 LYS 58 HB2 LYS 58 -2.472 12.269 -16.124 1184 HB3 LYS 58 HB3 LYS 58 -4.130 11.693 -16.093 1185 HG2 LYS 58 HG2 LYS 58 -3.263 11.838 -13.848 1186 HG3 LYS 58 HG3 LYS 58 -3.561 10.153 -14.269 1187 HD2 LYS 58 HD2 LYS 58 -1.482 10.197 -13.125 1188 HD3 LYS 58 HD3 LYS 58 -1.094 9.993 -14.833 1189 HE2 LYS 58 HE2 LYS 58 -0.665 12.425 -14.980 1190 HE3 LYS 58 HE3 LYS 58 -0.967 12.552 -13.246 1191 HZ1 LYS 58 HZ1 LYS 58 1.413 12.385 -13.886 1192 HZ2 LYS 58 HZ2 LYS 58 1.118 10.804 -14.410 1193 HZ3 LYS 58 HZ3 LYS 58 0.901 11.211 -12.783 1194 H LEU 59 H LEU 59 -4.954 9.193 -16.476 1195 HA LEU 59 HA LEU 59 -4.279 7.302 -14.548 1196 HB2 LEU 59 HB2 LEU 59 -6.553 8.057 -14.928 1197 HB3 LEU 59 HB3 LEU 59 -6.567 7.325 -16.522 1198 HG LEU 59 HG LEU 59 -6.452 5.094 -15.526 1199 HD11 LEU 59 HD11 LEU 59 -6.686 4.812 -13.089 1200 HD12 LEU 59 HD12 LEU 59 -6.470 6.551 -12.882 1201 HD13 LEU 59 HD13 LEU 59 -5.160 5.572 -13.538 1202 HD21 LEU 59 HD21 LEU 59 -8.630 6.820 -14.342 1203 HD22 LEU 59 HD22 LEU 59 -8.679 5.064 -14.500 1204 HD23 LEU 59 HD23 LEU 59 -8.637 6.076 -15.943 1205 H THR 60 H THR 60 -4.634 6.828 -18.081 1206 HA THR 60 HA THR 60 -4.049 4.026 -17.913 1207 HB THR 60 HB THR 60 -5.408 4.806 -19.743 1208 HG1 THR 60 HG1 THR 60 -4.127 2.947 -20.139 1209 HG21 THR 60 HG21 THR 60 -2.966 6.309 -20.656 1210 HG22 THR 60 HG22 THR 60 -4.471 7.007 -20.058 1211 HG23 THR 60 HG23 THR 60 -4.456 6.122 -21.583 1212 H THR 61 H THR 61 -2.079 6.886 -18.454 1213 HA THR 61 HA THR 61 0.307 5.560 -19.259 1214 HB THR 61 HB THR 61 0.021 8.131 -17.664 1215 HG1 THR 61 HG1 THR 61 -0.905 8.015 -19.874 1216 HG21 THR 61 HG21 THR 61 2.273 7.188 -17.436 1217 HG22 THR 61 HG22 THR 61 2.299 8.643 -18.431 1218 HG23 THR 61 HG23 THR 61 2.405 7.055 -19.191 1219 H LEU 62 H LEU 62 -1.119 6.166 -16.078 1220 HA LEU 62 HA LEU 62 1.026 5.151 -14.533 1221 HB2 LEU 62 HB2 LEU 62 -1.937 5.130 -13.926 1222 HB3 LEU 62 HB3 LEU 62 -0.667 4.788 -12.763 1223 HG LEU 62 HG LEU 62 -1.193 7.426 -14.141 1224 HD11 LEU 62 HD11 LEU 62 -1.664 8.234 -11.899 1225 HD12 LEU 62 HD12 LEU 62 -1.361 6.624 -11.240 1226 HD13 LEU 62 HD13 LEU 62 -2.730 6.895 -12.322 1227 HD21 LEU 62 HD21 LEU 62 1.011 6.693 -12.209 1228 HD22 LEU 62 HD22 LEU 62 0.653 8.316 -12.802 1229 HD23 LEU 62 HD23 LEU 62 1.212 7.073 -13.921 1230 H MET 63 H MET 63 -1.751 3.569 -16.086 1231 HA MET 63 HA MET 63 -1.385 0.948 -15.226 1232 HB2 MET 63 HB2 MET 63 -2.065 1.761 -18.065 1233 HB3 MET 63 HB3 MET 63 -2.428 0.223 -17.302 1234 HG2 MET 63 HG2 MET 63 -4.008 1.288 -15.819 1235 HG3 MET 63 HG3 MET 63 -3.587 2.874 -16.471 1236 HE1 MET 63 HE1 MET 63 -7.137 2.491 -17.991 1237 HE2 MET 63 HE2 MET 63 -5.980 3.644 -17.324 1238 HE3 MET 63 HE3 MET 63 -6.522 2.267 -16.353 1239 H ASP 64 H ASP 64 0.065 2.575 -18.033 1240 HA ASP 64 HA ASP 64 1.795 0.604 -18.921 1241 HB2 ASP 64 HB2 ASP 64 1.902 3.611 -18.971 1242 HB3 ASP 64 HB3 ASP 64 3.207 2.663 -19.663 1243 H LYS 65 H LYS 65 2.547 3.215 -16.603 1244 HA LYS 65 HA LYS 65 5.200 2.498 -16.095 1245 HB2 LYS 65 HB2 LYS 65 3.183 3.900 -14.343 1246 HB3 LYS 65 HB3 LYS 65 4.897 3.805 -13.962 1247 HG2 LYS 65 HG2 LYS 65 5.340 4.938 -16.167 1248 HG3 LYS 65 HG3 LYS 65 3.601 5.192 -16.302 1249 HD2 LYS 65 HD2 LYS 65 4.602 7.193 -15.409 1250 HD3 LYS 65 HD3 LYS 65 3.663 6.419 -14.133 1251 HE2 LYS 65 HE2 LYS 65 5.655 5.537 -13.117 1252 HE3 LYS 65 HE3 LYS 65 6.642 6.071 -14.478 1253 HZ1 LYS 65 HZ1 LYS 65 6.193 8.352 -13.894 1254 HZ2 LYS 65 HZ2 LYS 65 6.839 7.544 -12.561 1255 HZ3 LYS 65 HZ3 LYS 65 5.182 7.876 -12.624 1256 H LEU 66 H LEU 66 2.229 1.340 -14.587 1257 HA LEU 66 HA LEU 66 3.593 -0.290 -12.627 1258 HB2 LEU 66 HB2 LEU 66 0.693 -0.160 -13.481 1259 HB3 LEU 66 HB3 LEU 66 1.288 -1.106 -12.127 1260 HG LEU 66 HG LEU 66 1.613 1.893 -12.299 1261 HD11 LEU 66 HD11 LEU 66 -0.768 1.377 -12.308 1262 HD12 LEU 66 HD12 LEU 66 -0.276 2.087 -10.771 1263 HD13 LEU 66 HD13 LEU 66 -0.562 0.351 -10.888 1264 HD21 LEU 66 HD21 LEU 66 2.007 1.712 -9.890 1265 HD22 LEU 66 HD22 LEU 66 3.175 0.761 -10.805 1266 HD23 LEU 66 HD23 LEU 66 1.832 -0.040 -9.986 1267 H ARG 67 H ARG 67 2.403 -0.687 -15.860 1268 HA ARG 67 HA ARG 67 2.202 -3.539 -15.859 1269 HB2 ARG 67 HB2 ARG 67 1.039 -1.943 -17.435 1270 HB3 ARG 67 HB3 ARG 67 2.584 -1.710 -18.239 1271 HG2 ARG 67 HG2 ARG 67 2.617 -4.189 -18.676 1272 HG3 ARG 67 HG3 ARG 67 0.959 -4.245 -18.069 1273 HD2 ARG 67 HD2 ARG 67 1.989 -2.723 -20.467 1274 HD3 ARG 67 HD3 ARG 67 0.893 -4.102 -20.469 1275 HE ARG 67 HE ARG 67 -0.742 -2.606 -19.343 1276 HH11 ARG 67 HH11 ARG 67 1.826 -1.235 -21.186 1277 HH12 ARG 67 HH12 ARG 67 0.963 0.228 -21.509 1278 HH21 ARG 67 HH21 ARG 67 -1.855 -0.742 -19.792 1279 HH22 ARG 67 HH22 ARG 67 -1.111 0.497 -20.746 1280 H LYS 68 H LYS 68 4.873 -1.429 -15.928 1281 HA LYS 68 HA LYS 68 6.600 -2.907 -17.669 1282 HB2 LYS 68 HB2 LYS 68 7.410 -0.947 -15.509 1283 HB3 LYS 68 HB3 LYS 68 8.371 -1.447 -16.895 1284 HG2 LYS 68 HG2 LYS 68 5.875 0.240 -16.907 1285 HG3 LYS 68 HG3 LYS 68 7.516 0.739 -17.318 1286 HD2 LYS 68 HD2 LYS 68 7.479 -0.788 -19.256 1287 HD3 LYS 68 HD3 LYS 68 5.827 -1.251 -18.848 1288 HE2 LYS 68 HE2 LYS 68 5.144 1.120 -19.128 1289 HE3 LYS 68 HE3 LYS 68 6.786 1.499 -19.651 1290 HZ1 LYS 68 HZ1 LYS 68 5.360 1.175 -21.545 1291 HZ2 LYS 68 HZ2 LYS 68 4.901 -0.355 -20.998 1292 HZ3 LYS 68 HZ3 LYS 68 6.493 -0.078 -21.484 1293 H VAL 69 H VAL 69 5.432 -3.735 -14.690 1294 HA VAL 69 HA VAL 69 7.857 -4.895 -13.605 1295 HB VAL 69 HB VAL 69 4.993 -5.021 -12.631 1296 HG11 VAL 69 HG11 VAL 69 6.203 -6.965 -11.836 1297 HG12 VAL 69 HG12 VAL 69 5.966 -5.833 -10.506 1298 HG13 VAL 69 HG13 VAL 69 7.540 -5.951 -11.291 1299 HG21 VAL 69 HG21 VAL 69 5.755 -3.428 -10.920 1300 HG22 VAL 69 HG22 VAL 69 5.914 -2.772 -12.549 1301 HG23 VAL 69 HG23 VAL 69 7.340 -3.361 -11.693 1302 H GLN 70 H GLN 70 8.530 -6.894 -13.936 1303 HA GLN 70 HA GLN 70 7.469 -8.564 -15.901 1304 HB2 GLN 70 HB2 GLN 70 9.108 -10.232 -15.105 1305 HB3 GLN 70 HB3 GLN 70 9.808 -8.628 -15.285 1306 HG2 GLN 70 HG2 GLN 70 9.686 -8.274 -12.885 1307 HG3 GLN 70 HG3 GLN 70 8.902 -9.836 -12.671 1308 HE21 GLN 70 HE21 GLN 70 10.521 -10.569 -11.303 1309 HE22 GLN 70 HE22 GLN 70 12.092 -10.997 -11.873 1310 H GLY 71 H GLY 71 6.830 -8.541 -12.449 1311 HA2 GLY 71 HA2 GLY 71 5.786 -11.224 -12.370 1312 HA3 GLY 71 HA3 GLY 71 5.745 -10.051 -11.070 1313 H VAL 72 H VAL 72 4.385 -8.264 -13.355 1314 HA VAL 72 HA VAL 72 1.699 -9.009 -12.459 1315 HB VAL 72 HB VAL 72 2.585 -6.562 -14.008 1316 HG11 VAL 72 HG11 VAL 72 -0.038 -7.188 -12.635 1317 HG12 VAL 72 HG12 VAL 72 0.227 -7.059 -14.373 1318 HG13 VAL 72 HG13 VAL 72 0.394 -5.634 -13.348 1319 HG21 VAL 72 HG21 VAL 72 2.357 -5.376 -11.870 1320 HG22 VAL 72 HG22 VAL 72 3.587 -6.638 -11.783 1321 HG23 VAL 72 HG23 VAL 72 2.000 -6.904 -11.061 1322 H PHE 73 H PHE 73 0.008 -9.600 -13.786 1323 HA PHE 73 HA PHE 73 0.547 -9.731 -16.679 1324 HB2 PHE 73 HB2 PHE 73 -1.065 -11.840 -16.517 1325 HB3 PHE 73 HB3 PHE 73 0.670 -11.967 -16.313 1326 HD1 PHE 73 HD1 PHE 73 -2.558 -11.936 -14.514 1327 HD2 PHE 73 HD2 PHE 73 1.640 -12.623 -14.262 1328 HE1 PHE 73 HE1 PHE 73 -2.867 -13.034 -12.333 1329 HE2 PHE 73 HE2 PHE 73 1.334 -13.716 -12.082 1330 HZ PHE 73 HZ PHE 73 -0.919 -13.927 -11.115 1331 H THR 74 H THR 74 -1.476 -8.460 -14.327 1332 HA THR 74 HA THR 74 -3.378 -7.722 -16.457 1333 HB THR 74 HB THR 74 -5.314 -8.048 -15.211 1334 HG1 THR 74 HG1 THR 74 -5.399 -7.758 -13.112 1335 HG21 THR 74 HG21 THR 74 -4.385 -10.242 -15.792 1336 HG22 THR 74 HG22 THR 74 -5.271 -10.317 -14.270 1337 HG23 THR 74 HG23 THR 74 -3.507 -10.283 -14.262 1338 H VAL 75 H VAL 75 -3.645 -5.602 -16.631 1339 HA VAL 75 HA VAL 75 -3.502 -3.874 -14.261 1340 HB VAL 75 HB VAL 75 -2.066 -3.142 -16.834 1341 HG11 VAL 75 HG11 VAL 75 -2.923 -1.237 -15.577 1342 HG12 VAL 75 HG12 VAL 75 -1.162 -1.283 -15.513 1343 HG13 VAL 75 HG13 VAL 75 -2.108 -1.812 -14.121 1344 HG21 VAL 75 HG21 VAL 75 -0.863 -4.089 -14.225 1345 HG22 VAL 75 HG22 VAL 75 0.043 -3.438 -15.591 1346 HG23 VAL 75 HG23 VAL 75 -0.840 -4.955 -15.763 1347 H GLU 76 H GLU 76 -5.531 -2.989 -14.233 1348 HA GLU 76 HA GLU 76 -6.713 -2.041 -16.757 1349 HB2 GLU 76 HB2 GLU 76 -8.849 -3.302 -16.130 1350 HB3 GLU 76 HB3 GLU 76 -7.511 -4.272 -16.737 1351 HG2 GLU 76 HG2 GLU 76 -6.902 -4.782 -14.364 1352 HG3 GLU 76 HG3 GLU 76 -8.380 -3.957 -13.867 1353 H ARG 77 H ARG 77 -8.686 -0.768 -16.474 1354 HA ARG 77 HA ARG 77 -8.536 0.890 -14.090 1355 HB2 ARG 77 HB2 ARG 77 -8.698 1.928 -16.334 1356 HB3 ARG 77 HB3 ARG 77 -10.277 1.185 -16.554 1357 HG2 ARG 77 HG2 ARG 77 -11.153 2.455 -14.659 1358 HG3 ARG 77 HG3 ARG 77 -9.568 3.190 -14.415 1359 HD2 ARG 77 HD2 ARG 77 -10.881 4.777 -15.594 1360 HD3 ARG 77 HD3 ARG 77 -9.745 4.103 -16.759 1361 HE ARG 77 HE ARG 77 -12.174 2.664 -16.849 1362 HH11 ARG 77 HH11 ARG 77 -10.810 5.694 -17.762 1363 HH12 ARG 77 HH12 ARG 77 -11.952 5.956 -19.031 1364 HH21 ARG 77 HH21 ARG 77 -13.649 3.026 -18.480 1365 HH22 ARG 77 HH22 ARG 77 -13.557 4.483 -19.407 1366 H LEU 78 H LEU 78 -9.742 0.499 -12.365 1367 HA LEU 78 HA LEU 78 -11.825 -1.346 -12.143 1368 HB2 LEU 78 HB2 LEU 78 -11.098 1.070 -10.485 1369 HB3 LEU 78 HB3 LEU 78 -12.355 -0.066 -10.008 1370 HG LEU 78 HG LEU 78 -9.465 -0.827 -10.488 1371 HD11 LEU 78 HD11 LEU 78 -9.651 0.656 -8.560 1372 HD12 LEU 78 HD12 LEU 78 -9.257 -0.991 -8.071 1373 HD13 LEU 78 HD13 LEU 78 -10.902 -0.382 -7.873 1374 HD21 LEU 78 HD21 LEU 78 -10.088 -2.925 -9.422 1375 HD22 LEU 78 HD22 LEU 78 -11.071 -2.636 -10.858 1376 HD23 LEU 78 HD23 LEU 78 -11.752 -2.363 -9.253 1377 H SER 79 H SER 79 -11.947 2.141 -12.672 1378 HA SER 79 HA SER 79 -13.425 3.455 -13.785 1379 HB2 SER 79 HB2 SER 79 -14.815 0.862 -14.520 1380 HB3 SER 79 HB3 SER 79 -15.137 2.438 -15.243 1381 HG SER 79 HG SER 79 -12.992 0.704 -15.614 1382 H ASN 80 H ASN 80 -15.656 0.902 -12.598 1383 HA ASN 80 HA ASN 80 -17.399 2.929 -11.487 1384 HB2 ASN 80 HB2 ASN 80 -18.321 0.887 -12.571 1385 HB3 ASN 80 HB3 ASN 80 -17.617 -0.089 -11.283 1386 HD21 ASN 80 HD21 ASN 80 -19.627 -0.833 -10.598 1387 HD22 ASN 80 HD22 ASN 80 -20.757 0.180 -9.775 1388 H LEU 81 H LEU 81 -17.552 3.539 -9.374 1389 HA LEU 81 HA LEU 81 -15.779 2.169 -7.446 1390 HB2 LEU 81 HB2 LEU 81 -16.141 5.157 -7.720 1391 HB3 LEU 81 HB3 LEU 81 -15.129 4.342 -6.540 1392 HG LEU 81 HG LEU 81 -14.700 4.359 -9.536 1393 HD11 LEU 81 HD11 LEU 81 -12.725 5.695 -9.026 1394 HD12 LEU 81 HD12 LEU 81 -13.146 5.680 -7.311 1395 HD13 LEU 81 HD13 LEU 81 -14.194 6.498 -8.471 1396 HD21 LEU 81 HD21 LEU 81 -13.052 3.094 -7.338 1397 HD22 LEU 81 HD22 LEU 81 -12.577 3.217 -9.033 1398 HD23 LEU 81 HD23 LEU 81 -13.973 2.240 -8.578 1399 H GLU 82 H GLU 82 -16.448 2.024 -5.339 1400 HA GLU 82 HA GLU 82 -19.243 2.762 -4.797 1401 HB2 GLU 82 HB2 GLU 82 -19.150 1.079 -3.006 1402 HB3 GLU 82 HB3 GLU 82 -18.732 0.391 -4.568 1403 HG2 GLU 82 HG2 GLU 82 -16.339 0.540 -3.958 1404 HG3 GLU 82 HG3 GLU 82 -16.810 1.139 -2.369 1405 H HIS 83 H HIS 83 -16.817 4.521 -4.598 1406 HA HIS 83 HA HIS 83 -16.360 5.046 -1.820 1407 HB2 HIS 83 HB2 HIS 83 -15.719 6.613 -4.328 1408 HB3 HIS 83 HB3 HIS 83 -15.250 7.137 -2.716 1409 HD1 HIS 83 HD1 HIS 83 -12.887 6.594 -2.275 1410 HD2 HIS 83 HD2 HIS 83 -14.690 3.705 -4.645 1411 HE1 HIS 83 HE1 HIS 83 -11.113 4.882 -2.707 1412 HE2 HIS 83 HE2 HIS 83 -12.323 3.017 -3.873 1413 H HIS 84 H HIS 84 -16.645 7.599 -1.216 1414 HA HIS 84 HA HIS 84 -18.154 9.064 -0.337 1415 HB2 HIS 84 HB2 HIS 84 -19.668 8.492 -2.900 1416 HB3 HIS 84 HB3 HIS 84 -20.065 9.784 -1.774 1417 HD1 HIS 84 HD1 HIS 84 -19.051 9.966 -4.858 1418 HD2 HIS 84 HD2 HIS 84 -16.927 10.889 -1.411 1419 HE1 HIS 84 HE1 HIS 84 -17.262 11.568 -5.580 1420 HE2 HIS 84 HE2 HIS 84 -16.125 12.268 -3.449 1421 H HIS 85 H HIS 85 -18.347 6.262 0.359 1422 HA HIS 85 HA HIS 85 -19.604 4.895 1.658 1423 HB2 HIS 85 HB2 HIS 85 -20.224 7.017 2.810 1424 HB3 HIS 85 HB3 HIS 85 -21.613 7.166 1.739 1425 HD1 HIS 85 HD1 HIS 85 -23.713 6.032 2.470 1426 HD2 HIS 85 HD2 HIS 85 -20.391 4.680 4.564 1427 HE1 HIS 85 HE1 HIS 85 -24.621 4.564 4.284 1428 HE2 HIS 85 HE2 HIS 85 -22.588 3.588 5.390 1429 H HIS 86 H HIS 86 -20.005 5.119 -1.341 1430 HA HIS 86 HA HIS 86 -22.779 4.274 -1.691 1431 HB2 HIS 86 HB2 HIS 86 -21.627 5.898 -3.243 1432 HB3 HIS 86 HB3 HIS 86 -20.619 4.566 -3.796 1433 HD1 HIS 86 HD1 HIS 86 -24.317 5.437 -3.585 1434 HD2 HIS 86 HD2 HIS 86 -21.674 3.243 -5.925 1435 HE1 HIS 86 HE1 HIS 86 -25.672 4.600 -5.524 1436 HE2 HIS 86 HE2 HIS 86 -24.012 3.438 -7.012 1437 H HIS 87 H HIS 87 -21.376 2.463 -0.146 1438 HA HIS 87 HA HIS 87 -20.110 0.351 -1.491 1439 HB2 HIS 87 HB2 HIS 87 -19.890 0.539 0.888 1440 HB3 HIS 87 HB3 HIS 87 -21.629 0.429 1.124 1441 HD1 HIS 87 HD1 HIS 87 -18.745 -1.742 -0.066 1442 HD2 HIS 87 HD2 HIS 87 -22.530 -2.103 1.610 1443 HE1 HIS 87 HE1 HIS 87 -19.030 -4.184 0.427 1444 HE2 HIS 87 HE2 HIS 87 -21.378 -4.400 1.297 1445 H HIS 88 H HIS 88 -20.823 -1.350 -2.639 1446 HA HIS 88 HA HIS 88 -23.720 -1.660 -3.029 1447 HB2 HIS 88 HB2 HIS 88 -22.993 -3.040 -5.054 1448 HB3 HIS 88 HB3 HIS 88 -22.653 -1.315 -5.108 1449 HD1 HIS 88 HD1 HIS 88 -20.916 -4.634 -4.664 1450 HD2 HIS 88 HD2 HIS 88 -19.983 -0.645 -5.324 1451 HE1 HIS 88 HE1 HIS 88 -18.457 -4.594 -5.152 1452 HE2 HIS 88 HE2 HIS 88 -17.883 -2.152 -5.237 Start of MODEL 4 1 H1 MET 1 H1 MET 1 12.656 -19.466 9.151 2 H2 MET 1 H2 MET 1 12.689 -21.026 9.800 3 H3 MET 1 H3 MET 1 13.985 -19.973 10.070 4 HA MET 1 HA MET 1 12.635 -20.125 12.043 5 HB2 MET 1 HB2 MET 1 12.440 -17.502 10.543 6 HB3 MET 1 HB3 MET 1 12.054 -17.674 12.251 7 HG2 MET 1 HG2 MET 1 14.735 -18.324 11.040 8 HG3 MET 1 HG3 MET 1 14.326 -16.791 11.808 9 HE1 MET 1 HE1 MET 1 16.829 -18.549 12.717 10 HE2 MET 1 HE2 MET 1 16.673 -18.420 14.469 11 HE3 MET 1 HE3 MET 1 16.369 -17.013 13.452 12 H THR 2 H THR 2 10.539 -19.233 13.060 13 HA THR 2 HA THR 2 8.279 -20.080 11.370 14 HB THR 2 HB THR 2 8.304 -21.343 13.382 15 HG1 THR 2 HG1 THR 2 6.361 -19.874 14.447 16 HG21 THR 2 HG21 THR 2 8.289 -20.346 15.626 17 HG22 THR 2 HG22 THR 2 8.451 -18.739 14.913 18 HG23 THR 2 HG23 THR 2 9.752 -19.918 14.740 19 H ASP 3 H ASP 3 8.009 -18.172 10.199 20 HA ASP 3 HA ASP 3 7.489 -15.659 11.500 21 HB2 ASP 3 HB2 ASP 3 6.954 -16.493 8.633 22 HB3 ASP 3 HB3 ASP 3 6.955 -14.844 9.248 23 H PHE 4 H PHE 4 5.512 -14.691 11.904 24 HA PHE 4 HA PHE 4 3.092 -16.255 11.303 25 HB2 PHE 4 HB2 PHE 4 2.087 -15.510 13.383 26 HB3 PHE 4 HB3 PHE 4 3.613 -16.309 13.727 27 HD1 PHE 4 HD1 PHE 4 1.881 -13.054 13.604 28 HD2 PHE 4 HD2 PHE 4 5.431 -15.120 14.752 29 HE1 PHE 4 HE1 PHE 4 2.607 -11.090 14.889 30 HE2 PHE 4 HE2 PHE 4 6.154 -13.154 16.041 31 HZ PHE 4 HZ PHE 4 4.750 -11.129 16.097 32 H LEU 5 H LEU 5 1.145 -15.006 11.012 33 HA LEU 5 HA LEU 5 1.662 -12.677 9.405 34 HB2 LEU 5 HB2 LEU 5 0.048 -14.349 8.709 35 HB3 LEU 5 HB3 LEU 5 -0.883 -14.086 10.169 36 HG LEU 5 HG LEU 5 -1.450 -11.813 9.412 37 HD11 LEU 5 HD11 LEU 5 0.554 -11.319 8.114 38 HD12 LEU 5 HD12 LEU 5 -0.892 -11.096 7.131 39 HD13 LEU 5 HD13 LEU 5 0.102 -12.539 6.922 40 HD21 LEU 5 HD21 LEU 5 -2.903 -13.708 8.824 41 HD22 LEU 5 HD22 LEU 5 -2.016 -13.907 7.312 42 HD23 LEU 5 HD23 LEU 5 -2.942 -12.435 7.606 43 H ALA 6 H ALA 6 2.067 -10.824 10.427 44 HA ALA 6 HA ALA 6 0.537 -10.087 12.828 45 HB1 ALA 6 HB1 ALA 6 2.319 -8.502 13.289 46 HB2 ALA 6 HB2 ALA 6 3.095 -8.893 11.754 47 HB3 ALA 6 HB3 ALA 6 2.992 -10.110 13.025 48 H GLY 7 H GLY 7 -0.606 -8.153 12.943 49 HA2 GLY 7 HA2 GLY 7 -0.958 -6.696 10.389 50 HA3 GLY 7 HA3 GLY 7 -2.223 -6.911 11.588 51 H ILE 8 H ILE 8 -0.930 -4.487 10.348 52 HA ILE 8 HA ILE 8 -0.478 -3.019 12.869 53 HB ILE 8 HB ILE 8 0.976 -2.416 10.269 54 HG12 ILE 8 HG12 ILE 8 2.067 -3.712 12.795 55 HG13 ILE 8 HG13 ILE 8 1.807 -4.531 11.259 56 HG21 ILE 8 HG21 ILE 8 0.579 -0.459 11.662 57 HG22 ILE 8 HG22 ILE 8 2.293 -0.873 11.654 58 HG23 ILE 8 HG23 ILE 8 1.295 -1.280 13.050 59 HD11 ILE 8 HD11 ILE 8 3.502 -3.117 10.211 60 HD12 ILE 8 HD12 ILE 8 4.158 -3.983 11.599 61 HD13 ILE 8 HD13 ILE 8 3.750 -2.273 11.739 62 H ARG 9 H ARG 9 -1.450 -0.958 12.953 63 HA ARG 9 HA ARG 9 -2.854 -0.057 10.517 64 HB2 ARG 9 HB2 ARG 9 -4.475 -1.040 12.114 65 HB3 ARG 9 HB3 ARG 9 -3.961 0.125 13.330 66 HG2 ARG 9 HG2 ARG 9 -4.732 1.960 11.905 67 HG3 ARG 9 HG3 ARG 9 -5.234 0.798 10.676 68 HD2 ARG 9 HD2 ARG 9 -6.811 -0.189 12.308 69 HD3 ARG 9 HD3 ARG 9 -6.345 1.053 13.474 70 HE ARG 9 HE ARG 9 -7.247 2.122 10.967 71 HH11 ARG 9 HH11 ARG 9 -8.269 0.966 14.042 72 HH12 ARG 9 HH12 ARG 9 -9.748 1.852 14.000 73 HH21 ARG 9 HH21 ARG 9 -9.169 3.235 10.926 74 HH22 ARG 9 HH22 ARG 9 -10.249 3.120 12.271 75 H ILE 10 H ILE 10 -2.448 1.952 9.939 76 HA ILE 10 HA ILE 10 -1.087 3.763 11.850 77 HB ILE 10 HB ILE 10 -0.868 3.837 8.834 78 HG12 ILE 10 HG12 ILE 10 1.176 2.592 10.681 79 HG13 ILE 10 HG13 ILE 10 -0.072 1.644 9.877 80 HG21 ILE 10 HG21 ILE 10 -0.262 5.902 9.982 81 HG22 ILE 10 HG22 ILE 10 1.164 5.141 9.277 82 HG23 ILE 10 HG23 ILE 10 0.864 5.017 11.011 83 HD11 ILE 10 HD11 ILE 10 0.783 2.399 7.704 84 HD12 ILE 10 HD12 ILE 10 1.991 1.528 8.647 85 HD13 ILE 10 HD13 ILE 10 2.062 3.288 8.534 86 H VAL 11 H VAL 11 -2.465 5.419 12.455 87 HA VAL 11 HA VAL 11 -4.152 6.587 10.322 88 HB VAL 11 HB VAL 11 -4.712 6.483 13.291 89 HG11 VAL 11 HG11 VAL 11 -6.784 7.705 12.808 90 HG12 VAL 11 HG12 VAL 11 -6.264 7.921 11.136 91 HG13 VAL 11 HG13 VAL 11 -5.357 8.675 12.448 92 HG21 VAL 11 HG21 VAL 11 -6.232 5.371 10.926 93 HG22 VAL 11 HG22 VAL 11 -6.705 5.238 12.623 94 HG23 VAL 11 HG23 VAL 11 -5.244 4.434 12.049 95 H GLY 12 H GLY 12 -3.198 8.292 9.555 96 HA2 GLY 12 HA2 GLY 12 -2.275 10.394 11.413 97 HA3 GLY 12 HA3 GLY 12 -1.274 9.912 10.049 98 H GLU 13 H GLU 13 -2.220 12.560 10.423 99 HA GLU 13 HA GLU 13 -4.620 12.967 8.910 100 HB2 GLU 13 HB2 GLU 13 -4.099 15.364 9.116 101 HB3 GLU 13 HB3 GLU 13 -4.020 14.523 10.658 102 HG2 GLU 13 HG2 GLU 13 -1.587 14.499 10.549 103 HG3 GLU 13 HG3 GLU 13 -1.640 15.288 8.972 104 H ASP 14 H ASP 14 -4.898 13.414 6.782 105 HA ASP 14 HA ASP 14 -2.795 12.755 4.976 106 HB2 ASP 14 HB2 ASP 14 -5.152 12.234 4.506 107 HB3 ASP 14 HB3 ASP 14 -5.521 13.954 4.419 108 H LYS 15 H LYS 15 -1.113 14.096 4.704 109 HA LYS 15 HA LYS 15 -1.546 16.773 3.673 110 HB2 LYS 15 HB2 LYS 15 -0.120 17.868 5.391 111 HB3 LYS 15 HB3 LYS 15 -1.624 17.240 6.052 112 HG2 LYS 15 HG2 LYS 15 -0.460 15.313 6.962 113 HG3 LYS 15 HG3 LYS 15 1.051 15.854 6.234 114 HD2 LYS 15 HD2 LYS 15 -0.512 17.392 8.313 115 HD3 LYS 15 HD3 LYS 15 0.882 16.367 8.656 116 HE2 LYS 15 HE2 LYS 15 2.251 17.791 7.163 117 HE3 LYS 15 HE3 LYS 15 0.854 18.843 6.925 118 HZ1 LYS 15 HZ1 LYS 15 2.106 18.281 9.557 119 HZ2 LYS 15 HZ2 LYS 15 0.864 19.381 9.246 120 HZ3 LYS 15 HZ3 LYS 15 2.406 19.656 8.625 121 H ASN 16 H ASN 16 0.093 17.443 2.352 122 HA ASN 16 HA ASN 16 2.093 17.579 1.275 123 HB2 ASN 16 HB2 ASN 16 3.141 16.352 3.840 124 HB3 ASN 16 HB3 ASN 16 4.157 17.035 2.577 125 HD21 ASN 16 HD21 ASN 16 1.090 18.450 3.546 126 HD22 ASN 16 HD22 ASN 16 1.762 19.854 4.280 127 H GLY 17 H GLY 17 0.503 14.854 1.435 128 HA2 GLY 17 HA2 GLY 17 0.713 12.979 0.043 129 HA3 GLY 17 HA3 GLY 17 2.406 13.368 -0.203 130 H MET 18 H MET 18 0.853 13.055 2.950 131 HA MET 18 HA MET 18 2.796 11.335 4.002 132 HB2 MET 18 HB2 MET 18 0.023 12.070 4.888 133 HB3 MET 18 HB3 MET 18 0.931 10.836 5.752 134 HG2 MET 18 HG2 MET 18 2.759 12.505 6.057 135 HG3 MET 18 HG3 MET 18 1.693 13.719 5.362 136 HE1 MET 18 HE1 MET 18 0.364 10.771 7.523 137 HE2 MET 18 HE2 MET 18 0.520 11.397 9.163 138 HE3 MET 18 HE3 MET 18 1.963 11.011 8.225 139 H THR 19 H THR 19 -0.345 10.587 2.544 140 HA THR 19 HA THR 19 -0.490 7.853 3.052 141 HB THR 19 HB THR 19 -1.826 7.686 0.960 142 HG1 THR 19 HG1 THR 19 -2.126 9.935 -0.025 143 HG21 THR 19 HG21 THR 19 -2.917 8.477 3.002 144 HG22 THR 19 HG22 THR 19 -3.578 9.298 1.587 145 HG23 THR 19 HG23 THR 19 -2.430 10.133 2.635 146 H ASN 20 H ASN 20 1.425 9.585 0.655 147 HA ASN 20 HA ASN 20 2.191 7.245 -0.821 148 HB2 ASN 20 HB2 ASN 20 3.249 10.083 -0.813 149 HB3 ASN 20 HB3 ASN 20 3.856 8.827 -1.887 150 HD21 ASN 20 HD21 ASN 20 2.640 8.201 -3.626 151 HD22 ASN 20 HD22 ASN 20 1.215 9.038 -4.129 152 H GLN 21 H GLN 21 3.850 9.392 1.498 153 HA GLN 21 HA GLN 21 6.299 7.975 1.476 154 HB2 GLN 21 HB2 GLN 21 6.923 9.276 3.393 155 HB3 GLN 21 HB3 GLN 21 6.025 10.319 2.306 156 HG2 GLN 21 HG2 GLN 21 4.063 10.144 3.698 157 HG3 GLN 21 HG3 GLN 21 4.865 8.976 4.740 158 HE21 GLN 21 HE21 GLN 21 4.686 12.323 3.812 159 HE22 GLN 21 HE22 GLN 21 5.572 12.940 5.159 160 H ILE 22 H ILE 22 3.452 7.735 3.572 161 HA ILE 22 HA ILE 22 4.475 6.041 5.537 162 HB ILE 22 HB ILE 22 1.695 6.533 4.499 163 HG12 ILE 22 HG12 ILE 22 2.773 8.260 5.881 164 HG13 ILE 22 HG13 ILE 22 1.393 7.553 6.715 165 HG21 ILE 22 HG21 ILE 22 0.780 5.177 6.343 166 HG22 ILE 22 HG22 ILE 22 2.408 4.613 6.725 167 HG23 ILE 22 HG23 ILE 22 1.671 4.197 5.178 168 HD11 ILE 22 HD11 ILE 22 4.285 6.887 7.207 169 HD12 ILE 22 HD12 ILE 22 2.907 6.170 8.042 170 HD13 ILE 22 HD13 ILE 22 3.255 7.890 8.229 171 H THR 23 H THR 23 2.576 5.107 2.636 172 HA THR 23 HA THR 23 2.962 2.325 3.116 173 HB THR 23 HB THR 23 2.214 3.493 0.423 174 HG1 THR 23 HG1 THR 23 0.664 4.364 1.698 175 HG21 THR 23 HG21 THR 23 2.701 1.094 0.465 176 HG22 THR 23 HG22 THR 23 0.980 1.385 0.199 177 HG23 THR 23 HG23 THR 23 1.552 0.883 1.789 178 H GLY 24 H GLY 24 4.753 4.772 1.379 179 HA2 GLY 24 HA2 GLY 24 6.606 3.145 0.025 180 HA3 GLY 24 HA3 GLY 24 6.923 4.764 0.630 181 H VAL 25 H VAL 25 6.657 4.389 3.369 182 HA VAL 25 HA VAL 25 9.106 3.215 4.141 183 HB VAL 25 HB VAL 25 6.695 3.877 5.864 184 HG11 VAL 25 HG11 VAL 25 9.562 3.344 6.679 185 HG12 VAL 25 HG12 VAL 25 8.173 2.311 7.016 186 HG13 VAL 25 HG13 VAL 25 8.281 3.911 7.751 187 HG21 VAL 25 HG21 VAL 25 9.183 5.479 5.236 188 HG22 VAL 25 HG22 VAL 25 7.939 5.942 6.400 189 HG23 VAL 25 HG23 VAL 25 7.544 5.830 4.685 190 H ILE 26 H ILE 26 5.806 1.982 4.089 191 HA ILE 26 HA ILE 26 6.031 -0.395 5.473 192 HB ILE 26 HB ILE 26 4.504 0.103 2.908 193 HG12 ILE 26 HG12 ILE 26 3.868 1.633 4.718 194 HG13 ILE 26 HG13 ILE 26 2.571 0.491 4.388 195 HG21 ILE 26 HG21 ILE 26 4.748 -2.276 3.248 196 HG22 ILE 26 HG22 ILE 26 3.087 -1.798 3.595 197 HG23 ILE 26 HG23 ILE 26 4.205 -2.127 4.919 198 HD11 ILE 26 HD11 ILE 26 4.520 0.360 6.677 199 HD12 ILE 26 HD12 ILE 26 3.243 -0.812 6.349 200 HD13 ILE 26 HD13 ILE 26 2.829 0.851 6.761 201 H SER 27 H SER 27 6.883 0.189 2.053 202 HA SER 27 HA SER 27 7.615 -2.481 1.460 203 HB2 SER 27 HB2 SER 27 8.599 -1.623 -0.570 204 HB3 SER 27 HB3 SER 27 7.133 -0.698 -0.252 205 HG SER 27 HG SER 27 8.361 1.016 0.428 206 H LYS 28 H LYS 28 9.261 0.010 3.184 207 HA LYS 28 HA LYS 28 11.930 -1.082 2.771 208 HB2 LYS 28 HB2 LYS 28 11.111 1.090 4.712 209 HB3 LYS 28 HB3 LYS 28 12.718 0.777 4.064 210 HG2 LYS 28 HG2 LYS 28 11.884 1.403 1.812 211 HG3 LYS 28 HG3 LYS 28 10.326 1.805 2.538 212 HD2 LYS 28 HD2 LYS 28 11.534 3.847 2.301 213 HD3 LYS 28 HD3 LYS 28 11.542 3.439 4.018 214 HE2 LYS 28 HE2 LYS 28 13.739 4.204 3.365 215 HE3 LYS 28 HE3 LYS 28 13.813 2.482 3.740 216 HZ1 LYS 28 HZ1 LYS 28 13.567 3.575 0.993 217 HZ2 LYS 28 HZ2 LYS 28 13.836 1.962 1.420 218 HZ3 LYS 28 HZ3 LYS 28 15.033 3.124 1.702 219 H PHE 29 H PHE 29 9.688 -2.555 4.286 220 HA PHE 29 HA PHE 29 10.937 -2.872 6.920 221 HB2 PHE 29 HB2 PHE 29 8.338 -3.896 5.776 222 HB3 PHE 29 HB3 PHE 29 8.933 -4.330 7.376 223 HD1 PHE 29 HD2 PHE 29 10.157 -1.320 7.510 224 HD2 PHE 29 HD1 PHE 29 6.319 -3.081 6.983 225 HE1 PHE 29 HE2 PHE 29 9.116 0.684 8.476 226 HE2 PHE 29 HE1 PHE 29 5.268 -1.073 7.956 227 HZ PHE 29 HZ PHE 29 6.671 0.807 8.701 228 H ASP 30 H ASP 30 11.233 -4.269 3.925 229 HA ASP 30 HA ASP 30 12.395 -6.069 3.173 230 HB2 ASP 30 HB2 ASP 30 13.952 -5.550 5.012 231 HB3 ASP 30 HB3 ASP 30 13.001 -6.548 6.103 232 H THR 31 H THR 31 9.608 -6.297 4.935 233 HA THR 31 HA THR 31 9.433 -9.235 4.776 234 HB THR 31 HB THR 31 8.781 -8.340 6.921 235 HG1 THR 31 HG1 THR 31 6.900 -9.453 7.085 236 HG21 THR 31 HG21 THR 31 6.884 -6.812 7.188 237 HG22 THR 31 HG22 THR 31 6.709 -6.708 5.437 238 HG23 THR 31 HG23 THR 31 8.158 -6.074 6.218 239 H ASN 32 H ASN 32 7.531 -10.251 3.851 240 HA ASN 32 HA ASN 32 6.818 -9.035 1.324 241 HB2 ASN 32 HB2 ASN 32 7.368 -11.429 1.446 242 HB3 ASN 32 HB3 ASN 32 5.997 -11.699 2.516 243 HD21 ASN 32 HD21 ASN 32 7.000 -11.054 -0.737 244 HD22 ASN 32 HD22 ASN 32 5.481 -11.398 -1.481 245 H ILE 33 H ILE 33 5.053 -7.864 0.940 246 HA ILE 33 HA ILE 33 3.026 -7.460 2.924 247 HB ILE 33 HB ILE 33 3.160 -6.519 0.053 248 HG12 ILE 33 HG12 ILE 33 3.882 -5.092 2.635 249 HG13 ILE 33 HG13 ILE 33 5.033 -5.715 1.458 250 HG21 ILE 33 HG21 ILE 33 1.379 -5.590 2.318 251 HG22 ILE 33 HG22 ILE 33 0.864 -6.482 0.885 252 HG23 ILE 33 HG23 ILE 33 1.486 -4.840 0.723 253 HD11 ILE 33 HD11 ILE 33 4.177 -4.147 -0.204 254 HD12 ILE 33 HD12 ILE 33 4.762 -3.321 1.239 255 HD13 ILE 33 HD13 ILE 33 3.029 -3.519 0.980 256 H ARG 34 H ARG 34 1.609 -9.095 3.296 257 HA ARG 34 HA ARG 34 0.568 -10.690 1.099 258 HB2 ARG 34 HB2 ARG 34 0.897 -11.080 3.895 259 HB3 ARG 34 HB3 ARG 34 -0.831 -11.159 3.586 260 HG2 ARG 34 HG2 ARG 34 0.203 -13.366 3.487 261 HG3 ARG 34 HG3 ARG 34 -0.478 -12.905 1.925 262 HD2 ARG 34 HD2 ARG 34 1.751 -12.296 1.119 263 HD3 ARG 34 HD3 ARG 34 2.443 -12.693 2.692 264 HE ARG 34 HE ARG 34 1.356 -15.016 2.071 265 HH11 ARG 34 HH11 ARG 34 3.162 -12.884 0.046 266 HH12 ARG 34 HH12 ARG 34 3.738 -14.167 -0.962 267 HH21 ARG 34 HH21 ARG 34 2.141 -16.645 0.779 268 HH22 ARG 34 HH22 ARG 34 3.216 -16.262 -0.522 269 H THR 35 H THR 35 -0.528 -8.142 3.258 270 HA THR 35 HA THR 35 -2.671 -7.465 1.407 271 HB THR 35 HB THR 35 -3.404 -7.826 4.320 272 HG1 THR 35 HG1 THR 35 -4.656 -9.684 2.989 273 HG21 THR 35 HG21 THR 35 -5.708 -7.752 3.463 274 HG22 THR 35 HG22 THR 35 -5.089 -7.540 1.825 275 HG23 THR 35 HG23 THR 35 -4.813 -6.290 3.037 276 H ILE 36 H ILE 36 -3.242 -5.263 1.527 277 HA ILE 36 HA ILE 36 -2.637 -3.745 3.900 278 HB ILE 36 HB ILE 36 -0.457 -3.732 2.612 279 HG12 ILE 36 HG12 ILE 36 -1.695 -0.989 2.971 280 HG13 ILE 36 HG13 ILE 36 -1.180 -2.008 4.313 281 HG21 ILE 36 HG21 ILE 36 -1.290 -3.568 0.340 282 HG22 ILE 36 HG22 ILE 36 -0.275 -2.166 0.702 283 HG23 ILE 36 HG23 ILE 36 -2.032 -2.008 0.692 284 HD11 ILE 36 HD11 ILE 36 0.591 -0.954 2.122 285 HD12 ILE 36 HD12 ILE 36 1.100 -1.973 3.469 286 HD13 ILE 36 HD13 ILE 36 0.496 -0.345 3.776 287 H VAL 37 H VAL 37 -4.042 -2.088 4.179 288 HA VAL 37 HA VAL 37 -5.618 -1.154 1.865 289 HB VAL 37 HB VAL 37 -6.829 -1.957 4.525 290 HG11 VAL 37 HG11 VAL 37 -8.992 -1.499 3.418 291 HG12 VAL 37 HG12 VAL 37 -8.121 -0.875 2.016 292 HG13 VAL 37 HG13 VAL 37 -7.989 -0.058 3.574 293 HG21 VAL 37 HG21 VAL 37 -7.966 -3.740 3.281 294 HG22 VAL 37 HG22 VAL 37 -6.214 -3.916 3.192 295 HG23 VAL 37 HG23 VAL 37 -7.103 -3.271 1.813 296 H LEU 38 H LEU 38 -4.949 0.926 1.778 297 HA LEU 38 HA LEU 38 -5.107 2.570 4.228 298 HB2 LEU 38 HB2 LEU 38 -2.917 2.533 3.033 299 HB3 LEU 38 HB3 LEU 38 -3.702 3.177 1.608 300 HG LEU 38 HG LEU 38 -3.663 4.696 4.225 301 HD11 LEU 38 HD11 LEU 38 -1.348 4.225 3.611 302 HD12 LEU 38 HD12 LEU 38 -1.727 5.932 3.372 303 HD13 LEU 38 HD13 LEU 38 -1.641 4.844 1.984 304 HD21 LEU 38 HD21 LEU 38 -5.285 5.490 2.582 305 HD22 LEU 38 HD22 LEU 38 -4.023 5.583 1.353 306 HD23 LEU 38 HD23 LEU 38 -3.972 6.650 2.757 307 H ASN 39 H ASN 39 -6.949 3.728 4.408 308 HA ASN 39 HA ASN 39 -8.017 4.992 1.967 309 HB2 ASN 39 HB2 ASN 39 -10.310 4.626 2.701 310 HB3 ASN 39 HB3 ASN 39 -9.472 3.087 2.564 311 HD21 ASN 39 HD21 ASN 39 -8.987 1.936 4.457 312 HD22 ASN 39 HD22 ASN 39 -9.759 2.295 5.958 313 H ALA 40 H ALA 40 -8.410 7.122 2.117 314 HA ALA 40 HA ALA 40 -8.074 8.426 4.737 315 HB1 ALA 40 HB1 ALA 40 -7.996 9.623 1.958 316 HB2 ALA 40 HB2 ALA 40 -6.592 9.168 2.927 317 HB3 ALA 40 HB3 ALA 40 -7.652 10.470 3.468 318 H LYS 41 H LYS 41 -9.838 8.940 5.800 319 HA LYS 41 HA LYS 41 -12.061 10.240 4.407 320 HB2 LYS 41 HB2 LYS 41 -13.742 8.860 5.251 321 HB3 LYS 41 HB3 LYS 41 -12.485 7.702 4.847 322 HG2 LYS 41 HG2 LYS 41 -13.068 8.775 7.603 323 HG3 LYS 41 HG3 LYS 41 -13.553 7.198 6.984 324 HD2 LYS 41 HD2 LYS 41 -11.213 6.544 6.763 325 HD3 LYS 41 HD3 LYS 41 -10.697 8.144 7.304 326 HE2 LYS 41 HE2 LYS 41 -12.265 6.127 8.919 327 HE3 LYS 41 HE3 LYS 41 -10.567 6.546 9.137 328 HZ1 LYS 41 HZ1 LYS 41 -12.838 8.435 9.466 329 HZ2 LYS 41 HZ2 LYS 41 -11.205 8.774 9.749 330 HZ3 LYS 41 HZ3 LYS 41 -12.019 7.665 10.732 331 H ASP 42 H ASP 42 -13.368 11.588 5.852 332 HA ASP 42 HA ASP 42 -13.567 13.226 7.424 333 HB2 ASP 42 HB2 ASP 42 -11.910 11.352 9.140 334 HB3 ASP 42 HB3 ASP 42 -12.757 12.780 9.730 335 H GLY 43 H GLY 43 -11.003 12.854 5.671 336 HA2 GLY 43 HA2 GLY 43 -9.275 14.367 5.212 337 HA3 GLY 43 HA3 GLY 43 -9.513 15.104 6.786 338 H ILE 44 H ILE 44 -9.361 11.821 7.240 339 HA ILE 44 HA ILE 44 -6.437 11.846 7.723 340 HB ILE 44 HB ILE 44 -8.476 10.440 9.466 341 HG12 ILE 44 HG12 ILE 44 -7.116 13.108 9.928 342 HG13 ILE 44 HG13 ILE 44 -8.832 12.851 9.610 343 HG21 ILE 44 HG21 ILE 44 -5.551 11.062 9.902 344 HG22 ILE 44 HG22 ILE 44 -6.237 9.479 9.535 345 HG23 ILE 44 HG23 ILE 44 -6.619 10.270 11.064 346 HD11 ILE 44 HD11 ILE 44 -9.040 11.627 11.697 347 HD12 ILE 44 HD12 ILE 44 -8.396 13.245 11.972 348 HD13 ILE 44 HD13 ILE 44 -7.318 11.849 12.007 349 H PHE 45 H PHE 45 -5.375 9.784 7.525 350 HA PHE 45 HA PHE 45 -6.976 7.820 6.000 351 HB2 PHE 45 HB2 PHE 45 -5.045 7.238 4.697 352 HB3 PHE 45 HB3 PHE 45 -5.236 8.985 4.639 353 HD1 PHE 45 HD2 PHE 45 -3.632 10.450 5.727 354 HD2 PHE 45 HD1 PHE 45 -3.171 6.219 5.839 355 HE1 PHE 45 HE2 PHE 45 -1.303 10.722 6.481 356 HE2 PHE 45 HE1 PHE 45 -0.848 6.486 6.593 357 HZ PHE 45 HZ PHE 45 0.083 8.735 6.919 358 H THR 46 H THR 46 -6.809 5.684 6.450 359 HA THR 46 HA THR 46 -5.116 4.910 8.748 360 HB THR 46 HB THR 46 -7.343 4.708 9.516 361 HG1 THR 46 HG1 THR 46 -6.562 2.112 8.592 362 HG21 THR 46 HG21 THR 46 -8.032 3.241 6.964 363 HG22 THR 46 HG22 THR 46 -8.503 4.893 7.366 364 HG23 THR 46 HG23 THR 46 -9.127 3.542 8.314 365 H CYS 47 H CYS 47 -3.357 4.059 7.747 366 HA CYS 47 HA CYS 47 -3.664 2.169 5.547 367 HB2 CYS 47 HB2 CYS 47 -1.821 3.797 5.476 368 HB3 CYS 47 HB3 CYS 47 -1.151 3.116 6.952 369 HG CYS 47 HG CYS 47 -0.579 2.251 3.869 370 H ASN 48 H ASN 48 -4.311 0.182 6.084 371 HA ASN 48 HA ASN 48 -3.336 -1.112 8.520 372 HB2 ASN 48 HB2 ASN 48 -5.418 -1.952 6.487 373 HB3 ASN 48 HB3 ASN 48 -4.950 -2.930 7.874 374 HD21 ASN 48 HD21 ASN 48 -6.975 -2.888 8.777 375 HD22 ASN 48 HD22 ASN 48 -7.654 -1.469 9.483 376 H LEU 49 H LEU 49 -1.422 -2.104 8.358 377 HA LEU 49 HA LEU 49 -0.605 -3.362 5.837 378 HB2 LEU 49 HB2 LEU 49 1.036 -1.884 6.758 379 HB3 LEU 49 HB3 LEU 49 0.902 -2.620 8.345 380 HG LEU 49 HG LEU 49 1.892 -4.707 7.439 381 HD11 LEU 49 HD11 LEU 49 2.245 -3.081 4.926 382 HD12 LEU 49 HD12 LEU 49 1.257 -4.528 5.121 383 HD13 LEU 49 HD13 LEU 49 3.013 -4.636 5.243 384 HD21 LEU 49 HD21 LEU 49 3.575 -2.232 7.035 385 HD22 LEU 49 HD22 LEU 49 4.187 -3.872 7.251 386 HD23 LEU 49 HD23 LEU 49 3.313 -3.078 8.560 387 H MET 50 H MET 50 -0.443 -5.527 5.578 388 HA MET 50 HA MET 50 -0.519 -7.252 7.975 389 HB2 MET 50 HB2 MET 50 -1.950 -7.698 5.350 390 HB3 MET 50 HB3 MET 50 -1.835 -8.891 6.635 391 HG2 MET 50 HG2 MET 50 -3.206 -6.213 6.786 392 HG3 MET 50 HG3 MET 50 -3.978 -7.796 6.715 393 HE1 MET 50 HE1 MET 50 -2.552 -9.289 10.156 394 HE2 MET 50 HE2 MET 50 -1.640 -9.254 8.645 395 HE3 MET 50 HE3 MET 50 -3.345 -9.705 8.638 396 H ILE 51 H ILE 51 1.415 -8.171 8.137 397 HA ILE 51 HA ILE 51 2.653 -9.404 5.779 398 HB ILE 51 HB ILE 51 4.912 -8.456 6.600 399 HG12 ILE 51 HG12 ILE 51 4.581 -6.071 7.550 400 HG13 ILE 51 HG13 ILE 51 2.977 -6.617 8.020 401 HG21 ILE 51 HG21 ILE 51 3.925 -7.835 4.478 402 HG22 ILE 51 HG22 ILE 51 4.659 -6.425 5.241 403 HG23 ILE 51 HG23 ILE 51 2.907 -6.634 5.274 404 HD11 ILE 51 HD11 ILE 51 3.974 -8.350 9.413 405 HD12 ILE 51 HD12 ILE 51 4.549 -6.744 9.861 406 HD13 ILE 51 HD13 ILE 51 5.584 -7.819 8.921 407 H PHE 52 H PHE 52 4.586 -10.776 6.415 408 HA PHE 52 HA PHE 52 3.973 -12.206 8.900 409 HB2 PHE 52 HB2 PHE 52 5.483 -12.936 6.401 410 HB3 PHE 52 HB3 PHE 52 5.715 -13.861 7.881 411 HD1 PHE 52 HD2 PHE 52 3.899 -15.169 8.833 412 HD2 PHE 52 HD1 PHE 52 3.416 -13.088 5.145 413 HE1 PHE 52 HE2 PHE 52 1.887 -16.496 8.356 414 HE2 PHE 52 HE1 PHE 52 1.400 -14.414 4.662 415 HZ PHE 52 HZ PHE 52 0.630 -16.121 6.264 416 H VAL 53 H VAL 53 5.368 -12.409 10.590 417 HA VAL 53 HA VAL 53 8.052 -11.201 10.348 418 HB VAL 53 HB VAL 53 7.888 -10.135 12.508 419 HG11 VAL 53 HG11 VAL 53 5.485 -9.464 10.821 420 HG12 VAL 53 HG12 VAL 53 7.107 -8.784 10.664 421 HG13 VAL 53 HG13 VAL 53 6.143 -8.452 12.106 422 HG21 VAL 53 HG21 VAL 53 5.094 -11.256 12.664 423 HG22 VAL 53 HG22 VAL 53 5.800 -10.105 13.801 424 HG23 VAL 53 HG23 VAL 53 6.478 -11.726 13.654 425 H LYS 54 H LYS 54 9.677 -12.228 11.439 426 HA LYS 54 HA LYS 54 9.424 -14.902 12.249 427 HB2 LYS 54 HB2 LYS 54 11.539 -14.037 11.501 428 HB3 LYS 54 HB3 LYS 54 11.565 -12.837 12.785 429 HG2 LYS 54 HG2 LYS 54 11.799 -14.633 14.449 430 HG3 LYS 54 HG3 LYS 54 11.796 -15.827 13.148 431 HD2 LYS 54 HD2 LYS 54 14.079 -15.328 13.898 432 HD3 LYS 54 HD3 LYS 54 13.833 -14.843 12.219 433 HE2 LYS 54 HE2 LYS 54 13.472 -12.517 12.971 434 HE3 LYS 54 HE3 LYS 54 13.793 -13.021 14.631 435 HZ1 LYS 54 HZ1 LYS 54 15.734 -12.038 13.552 436 HZ2 LYS 54 HZ2 LYS 54 15.709 -13.252 12.377 437 HZ3 LYS 54 HZ3 LYS 54 16.017 -13.646 13.991 438 H ASN 55 H ASN 55 9.466 -11.919 14.160 439 HA ASN 55 HA ASN 55 8.351 -13.320 16.450 440 HB2 ASN 55 HB2 ASN 55 10.098 -12.382 17.991 441 HB3 ASN 55 HB3 ASN 55 10.700 -13.614 16.887 442 HD21 ASN 55 HD21 ASN 55 12.814 -12.922 16.929 443 HD22 ASN 55 HD22 ASN 55 13.324 -11.422 16.244 444 H THR 56 H THR 56 7.984 -11.647 18.314 445 HA THR 56 HA THR 56 6.320 -9.612 17.197 446 HB THR 56 HB THR 56 5.961 -8.950 19.634 447 HG1 THR 56 HG1 THR 56 7.592 -9.705 20.823 448 HG21 THR 56 HG21 THR 56 4.624 -10.956 20.126 449 HG22 THR 56 HG22 THR 56 5.456 -11.826 18.837 450 HG23 THR 56 HG23 THR 56 4.429 -10.444 18.448 451 H ASP 57 H ASP 57 9.576 -9.592 18.466 452 HA ASP 57 HA ASP 57 9.801 -6.796 18.923 453 HB2 ASP 57 HB2 ASP 57 11.434 -8.427 19.795 454 HB3 ASP 57 HB3 ASP 57 11.952 -8.790 18.150 455 H LYS 58 H LYS 58 10.404 -8.839 16.111 456 HA LYS 58 HA LYS 58 11.230 -6.922 14.257 457 HB2 LYS 58 HB2 LYS 58 11.418 -9.215 13.675 458 HB3 LYS 58 HB3 LYS 58 9.727 -9.529 14.023 459 HG2 LYS 58 HG2 LYS 58 10.138 -9.594 11.646 460 HG3 LYS 58 HG3 LYS 58 9.075 -8.252 12.062 461 HD2 LYS 58 HD2 LYS 58 10.989 -6.705 11.920 462 HD3 LYS 58 HD3 LYS 58 12.044 -8.059 11.501 463 HE2 LYS 58 HE2 LYS 58 10.752 -8.448 9.463 464 HE3 LYS 58 HE3 LYS 58 9.659 -7.129 9.890 465 HZ1 LYS 58 HZ1 LYS 58 11.598 -5.628 9.810 466 HZ2 LYS 58 HZ2 LYS 58 11.253 -6.343 8.316 467 HZ3 LYS 58 HZ3 LYS 58 12.547 -6.908 9.241 468 H LEU 59 H LEU 59 7.958 -7.915 15.223 469 HA LEU 59 HA LEU 59 6.533 -6.269 13.420 470 HB2 LEU 59 HB2 LEU 59 5.458 -8.118 14.546 471 HB3 LEU 59 HB3 LEU 59 5.769 -7.398 16.115 472 HG LEU 59 HG LEU 59 4.218 -5.555 15.581 473 HD11 LEU 59 HD11 LEU 59 2.755 -5.729 13.606 474 HD12 LEU 59 HD12 LEU 59 3.734 -7.074 13.019 475 HD13 LEU 59 HD13 LEU 59 4.446 -5.470 13.179 476 HD21 LEU 59 HD21 LEU 59 2.142 -6.868 15.681 477 HD22 LEU 59 HD22 LEU 59 3.378 -7.500 16.768 478 HD23 LEU 59 HD23 LEU 59 3.046 -8.318 15.240 479 H THR 60 H THR 60 7.485 -5.726 16.823 480 HA THR 60 HA THR 60 6.357 -3.135 17.026 481 HB THR 60 HB THR 60 7.769 -2.830 19.026 482 HG1 THR 60 HG1 THR 60 8.955 -5.037 19.468 483 HG21 THR 60 HG21 THR 60 6.534 -5.585 18.843 484 HG22 THR 60 HG22 THR 60 5.678 -4.092 19.229 485 HG23 THR 60 HG23 THR 60 6.902 -4.720 20.334 486 H THR 61 H THR 61 9.416 -4.290 15.772 487 HA THR 61 HA THR 61 10.795 -1.828 15.641 488 HB THR 61 HB THR 61 11.004 -4.232 13.799 489 HG1 THR 61 HG1 THR 61 11.603 -4.136 16.275 490 HG21 THR 61 HG21 THR 61 12.893 -1.893 14.148 491 HG22 THR 61 HG22 THR 61 11.936 -2.252 12.711 492 HG23 THR 61 HG23 THR 61 13.229 -3.345 13.207 493 H LEU 62 H LEU 62 8.574 -3.417 13.364 494 HA LEU 62 HA LEU 62 8.770 -1.488 11.308 495 HB2 LEU 62 HB2 LEU 62 6.380 -3.213 11.972 496 HB3 LEU 62 HB3 LEU 62 6.694 -2.413 10.443 497 HG LEU 62 HG LEU 62 8.026 -4.840 11.607 498 HD11 LEU 62 HD11 LEU 62 6.853 -4.194 8.906 499 HD12 LEU 62 HD12 LEU 62 6.092 -5.162 10.172 500 HD13 LEU 62 HD13 LEU 62 7.557 -5.742 9.378 501 HD21 LEU 62 HD21 LEU 62 9.732 -4.707 9.856 502 HD22 LEU 62 HD22 LEU 62 9.856 -3.358 10.984 503 HD23 LEU 62 HD23 LEU 62 9.131 -3.114 9.395 504 H MET 63 H MET 63 6.355 -1.852 13.919 505 HA MET 63 HA MET 63 4.871 0.447 13.314 506 HB2 MET 63 HB2 MET 63 5.278 -1.016 15.926 507 HB3 MET 63 HB3 MET 63 4.193 0.363 15.772 508 HG2 MET 63 HG2 MET 63 3.016 -0.892 13.941 509 HG3 MET 63 HG3 MET 63 3.992 -2.294 14.373 510 HE1 MET 63 HE1 MET 63 2.629 -3.405 17.769 511 HE2 MET 63 HE2 MET 63 4.149 -2.605 17.362 512 HE3 MET 63 HE3 MET 63 3.507 -3.871 16.314 513 H ASP 64 H ASP 64 7.832 0.090 15.217 514 HA ASP 64 HA ASP 64 7.977 2.743 16.178 515 HB2 ASP 64 HB2 ASP 64 9.406 0.929 17.034 516 HB3 ASP 64 HB3 ASP 64 10.227 0.837 15.482 517 H LYS 65 H LYS 65 9.357 1.252 13.253 518 HA LYS 65 HA LYS 65 10.535 3.497 12.102 519 HB2 LYS 65 HB2 LYS 65 9.231 1.093 10.806 520 HB3 LYS 65 HB3 LYS 65 10.164 2.278 9.906 521 HG2 LYS 65 HG2 LYS 65 12.113 1.754 11.387 522 HG3 LYS 65 HG3 LYS 65 11.156 0.453 12.094 523 HD2 LYS 65 HD2 LYS 65 12.595 -0.485 10.410 524 HD3 LYS 65 HD3 LYS 65 10.934 -0.544 9.816 525 HE2 LYS 65 HE2 LYS 65 11.318 1.381 8.405 526 HE3 LYS 65 HE3 LYS 65 12.922 1.618 9.098 527 HZ1 LYS 65 HZ1 LYS 65 12.028 -0.634 7.383 528 HZ2 LYS 65 HZ2 LYS 65 13.504 -0.610 8.199 529 HZ3 LYS 65 HZ3 LYS 65 13.183 0.545 7.012 530 H LEU 66 H LEU 66 7.172 2.476 12.075 531 HA LEU 66 HA LEU 66 6.274 4.527 10.262 532 HB2 LEU 66 HB2 LEU 66 4.748 2.746 12.170 533 HB3 LEU 66 HB3 LEU 66 4.017 3.760 10.937 534 HG LEU 66 HG LEU 66 5.978 1.550 10.305 535 HD11 LEU 66 HD11 LEU 66 2.963 1.449 10.319 536 HD12 LEU 66 HD12 LEU 66 4.056 0.540 11.362 537 HD13 LEU 66 HD13 LEU 66 4.021 0.218 9.630 538 HD21 LEU 66 HD21 LEU 66 5.068 1.776 8.040 539 HD22 LEU 66 HD22 LEU 66 5.786 3.285 8.602 540 HD23 LEU 66 HD23 LEU 66 4.032 3.095 8.586 541 H ARG 67 H ARG 67 6.440 4.168 13.775 542 HA ARG 67 HA ARG 67 4.800 6.388 14.439 543 HB2 ARG 67 HB2 ARG 67 6.833 4.788 15.986 544 HB3 ARG 67 HB3 ARG 67 6.026 6.180 16.705 545 HG2 ARG 67 HG2 ARG 67 3.852 5.131 16.329 546 HG3 ARG 67 HG3 ARG 67 4.642 3.748 15.574 547 HD2 ARG 67 HD2 ARG 67 5.729 3.183 17.664 548 HD3 ARG 67 HD3 ARG 67 5.067 4.628 18.434 549 HE ARG 67 HE ARG 67 2.982 3.023 17.384 550 HH11 ARG 67 HH11 ARG 67 5.246 3.073 19.975 551 HH12 ARG 67 HH12 ARG 67 4.188 2.231 21.051 552 HH21 ARG 67 HH21 ARG 67 1.655 1.911 18.753 553 HH22 ARG 67 HH22 ARG 67 2.184 1.578 20.368 554 H LYS 68 H LYS 68 7.850 6.376 13.049 555 HA LYS 68 HA LYS 68 8.948 8.699 14.321 556 HB2 LYS 68 HB2 LYS 68 9.639 7.407 11.673 557 HB3 LYS 68 HB3 LYS 68 10.581 8.671 12.455 558 HG2 LYS 68 HG2 LYS 68 10.079 5.888 13.506 559 HG3 LYS 68 HG3 LYS 68 11.595 6.514 12.853 560 HD2 LYS 68 HD2 LYS 68 11.774 8.096 14.695 561 HD3 LYS 68 HD3 LYS 68 10.203 7.587 15.317 562 HE2 LYS 68 HE2 LYS 68 11.119 5.314 15.660 563 HE3 LYS 68 HE3 LYS 68 12.697 5.898 15.131 564 HZ1 LYS 68 HZ1 LYS 68 11.186 6.891 17.487 565 HZ2 LYS 68 HZ2 LYS 68 12.699 7.453 16.985 566 HZ3 LYS 68 HZ3 LYS 68 12.530 5.867 17.539 567 H VAL 69 H VAL 69 6.435 8.341 12.075 568 HA VAL 69 HA VAL 69 6.922 10.793 10.610 569 HB VAL 69 HB VAL 69 4.481 9.004 10.634 570 HG11 VAL 69 HG11 VAL 69 3.912 11.262 9.893 571 HG12 VAL 69 HG12 VAL 69 3.878 10.144 8.529 572 HG13 VAL 69 HG13 VAL 69 5.246 11.237 8.737 573 HG21 VAL 69 HG21 VAL 69 5.370 8.158 8.490 574 HG22 VAL 69 HG22 VAL 69 6.456 7.825 9.840 575 HG23 VAL 69 HG23 VAL 69 6.819 9.138 8.719 576 H GLN 70 H GLN 70 6.516 12.723 11.427 577 HA GLN 70 HA GLN 70 5.231 13.233 13.856 578 HB2 GLN 70 HB2 GLN 70 5.355 15.625 13.184 579 HB3 GLN 70 HB3 GLN 70 6.873 14.762 12.975 580 HG2 GLN 70 HG2 GLN 70 6.399 14.539 10.573 581 HG3 GLN 70 HG3 GLN 70 4.904 15.445 10.794 582 HE21 GLN 70 HE21 GLN 70 7.230 16.054 9.147 583 HE22 GLN 70 HE22 GLN 70 7.781 17.605 9.665 584 H GLY 71 H GLY 71 3.902 13.182 10.591 585 HA2 GLY 71 HA2 GLY 71 1.434 14.475 11.268 586 HA3 GLY 71 HA3 GLY 71 1.756 13.565 9.805 587 H VAL 72 H VAL 72 2.562 11.249 11.759 588 HA VAL 72 HA VAL 72 -0.151 10.154 11.887 589 HB VAL 72 HB VAL 72 2.507 8.770 12.338 590 HG11 VAL 72 HG11 VAL 72 1.207 6.683 12.235 591 HG12 VAL 72 HG12 VAL 72 -0.286 7.617 12.128 592 HG13 VAL 72 HG13 VAL 72 0.697 7.690 13.590 593 HG21 VAL 72 HG21 VAL 72 0.622 8.704 9.971 594 HG22 VAL 72 HG22 VAL 72 2.081 7.727 10.149 595 HG23 VAL 72 HG23 VAL 72 2.202 9.481 10.017 596 H PHE 73 H PHE 73 -1.195 9.596 13.733 597 HA PHE 73 HA PHE 73 0.178 10.170 16.278 598 HB2 PHE 73 HB2 PHE 73 -2.253 10.817 17.031 599 HB3 PHE 73 HB3 PHE 73 -1.241 11.960 16.168 600 HD1 PHE 73 HD2 PHE 73 -1.721 12.604 13.893 601 HD2 PHE 73 HD1 PHE 73 -4.209 9.824 15.952 602 HE1 PHE 73 HE2 PHE 73 -3.458 12.901 12.181 603 HE2 PHE 73 HE1 PHE 73 -5.953 10.124 14.238 604 HZ PHE 73 HZ PHE 73 -5.574 11.665 12.352 605 H THR 74 H THR 74 -1.270 7.734 14.525 606 HA THR 74 HA THR 74 -1.327 6.094 16.960 607 HB THR 74 HB THR 74 -3.367 5.017 16.554 608 HG1 THR 74 HG1 THR 74 -4.553 5.375 14.570 609 HG21 THR 74 HG21 THR 74 -5.081 6.753 16.359 610 HG22 THR 74 HG22 THR 74 -3.870 7.884 15.751 611 HG23 THR 74 HG23 THR 74 -3.761 7.279 17.406 612 H VAL 75 H VAL 75 0.032 4.448 16.665 613 HA VAL 75 HA VAL 75 -0.164 2.902 14.172 614 HB VAL 75 HB VAL 75 2.493 3.447 15.527 615 HG11 VAL 75 HG11 VAL 75 2.364 1.300 14.388 616 HG12 VAL 75 HG12 VAL 75 3.453 2.391 13.533 617 HG13 VAL 75 HG13 VAL 75 1.828 2.096 12.909 618 HG21 VAL 75 HG21 VAL 75 1.652 5.508 14.468 619 HG22 VAL 75 HG22 VAL 75 1.469 4.638 12.942 620 HG23 VAL 75 HG23 VAL 75 3.073 4.875 13.635 621 H GLU 76 H GLU 76 -1.120 1.097 14.955 622 HA GLU 76 HA GLU 76 -0.014 -0.192 17.375 623 HB2 GLU 76 HB2 GLU 76 -2.969 0.139 16.778 624 HB3 GLU 76 HB3 GLU 76 -2.281 -0.673 18.174 625 HG2 GLU 76 HG2 GLU 76 -1.982 2.266 17.567 626 HG3 GLU 76 HG3 GLU 76 -3.171 1.576 18.667 627 H ARG 77 H ARG 77 -0.586 -2.509 17.562 628 HA ARG 77 HA ARG 77 -0.590 -3.884 15.052 629 HB2 ARG 77 HB2 ARG 77 0.593 -4.937 16.836 630 HB3 ARG 77 HB3 ARG 77 -0.804 -4.857 17.904 631 HG2 ARG 77 HG2 ARG 77 -1.980 -6.493 16.560 632 HG3 ARG 77 HG3 ARG 77 -0.665 -6.523 15.389 633 HD2 ARG 77 HD2 ARG 77 0.828 -7.480 17.025 634 HD3 ARG 77 HD3 ARG 77 -0.392 -7.316 18.288 635 HE ARG 77 HE ARG 77 -1.727 -8.874 16.688 636 HH11 ARG 77 HH11 ARG 77 1.638 -9.071 17.420 637 HH12 ARG 77 HH12 ARG 77 1.705 -10.774 17.129 638 HH21 ARG 77 HH21 ARG 77 -1.624 -11.038 16.328 639 HH22 ARG 77 HH22 ARG 77 -0.122 -11.876 16.499 640 H LEU 78 H LEU 78 -2.233 -5.046 14.058 641 HA LEU 78 HA LEU 78 -4.972 -4.477 14.872 642 HB2 LEU 78 HB2 LEU 78 -3.760 -5.770 12.433 643 HB3 LEU 78 HB3 LEU 78 -5.490 -5.771 12.716 644 HG LEU 78 HG LEU 78 -3.792 -3.283 12.438 645 HD11 LEU 78 HD11 LEU 78 -5.671 -4.610 10.479 646 HD12 LEU 78 HD12 LEU 78 -3.918 -4.476 10.327 647 HD13 LEU 78 HD13 LEU 78 -4.920 -3.027 10.267 648 HD21 LEU 78 HD21 LEU 78 -6.785 -3.657 12.647 649 HD22 LEU 78 HD22 LEU 78 -5.970 -2.133 12.298 650 HD23 LEU 78 HD23 LEU 78 -5.733 -2.921 13.858 651 H SER 79 H SER 79 -6.020 -5.808 16.233 652 HA SER 79 HA SER 79 -5.320 -8.649 16.380 653 HB2 SER 79 HB2 SER 79 -5.683 -7.408 18.489 654 HB3 SER 79 HB3 SER 79 -7.334 -7.047 17.993 655 HG SER 79 HG SER 79 -6.198 -9.477 18.826 656 H ASN 80 H ASN 80 -7.511 -6.634 14.768 657 HA ASN 80 HA ASN 80 -9.357 -8.870 14.201 658 HB2 ASN 80 HB2 ASN 80 -9.789 -5.881 13.909 659 HB3 ASN 80 HB3 ASN 80 -10.962 -7.121 13.472 660 HD21 ASN 80 HD21 ASN 80 -9.405 -5.455 16.098 661 HD22 ASN 80 HD22 ASN 80 -10.450 -6.046 17.337 662 H LEU 81 H LEU 81 -8.816 -9.878 12.355 663 HA LEU 81 HA LEU 81 -7.667 -8.285 10.144 664 HB2 LEU 81 HB2 LEU 81 -7.315 -11.247 10.641 665 HB3 LEU 81 HB3 LEU 81 -6.507 -10.285 9.420 666 HG LEU 81 HG LEU 81 -6.078 -10.173 12.407 667 HD11 LEU 81 HD11 LEU 81 -4.960 -12.024 11.305 668 HD12 LEU 81 HD12 LEU 81 -3.778 -10.817 11.810 669 HD13 LEU 81 HD13 LEU 81 -4.257 -10.925 10.114 670 HD21 LEU 81 HD21 LEU 81 -4.380 -8.445 11.943 671 HD22 LEU 81 HD22 LEU 81 -6.012 -7.899 11.561 672 HD23 LEU 81 HD23 LEU 81 -4.919 -8.384 10.265 673 H GLU 82 H GLU 82 -7.986 -9.407 7.938 674 HA GLU 82 HA GLU 82 -10.759 -10.394 7.707 675 HB2 GLU 82 HB2 GLU 82 -10.526 -9.314 5.322 676 HB3 GLU 82 HB3 GLU 82 -10.969 -8.347 6.719 677 HG2 GLU 82 HG2 GLU 82 -9.332 -7.229 5.323 678 HG3 GLU 82 HG3 GLU 82 -8.703 -7.536 6.928 679 H HIS 83 H HIS 83 -8.011 -11.790 7.760 680 HA HIS 83 HA HIS 83 -7.727 -12.848 5.082 681 HB2 HIS 83 HB2 HIS 83 -6.349 -13.645 7.661 682 HB3 HIS 83 HB3 HIS 83 -5.896 -14.207 6.052 683 HD1 HIS 83 HD1 HIS 83 -4.039 -12.902 5.042 684 HD2 HIS 83 HD2 HIS 83 -6.270 -10.630 7.700 685 HE1 HIS 83 HE1 HIS 83 -2.895 -10.678 5.153 686 HE2 HIS 83 HE2 HIS 83 -4.493 -9.253 6.466 687 H HIS 84 H HIS 84 -8.551 -14.706 4.292 688 HA HIS 84 HA HIS 84 -9.893 -16.528 4.080 689 HB2 HIS 84 HB2 HIS 84 -9.098 -17.118 6.947 690 HB3 HIS 84 HB3 HIS 84 -9.798 -18.264 5.808 691 HD1 HIS 84 HD1 HIS 84 -8.244 -18.843 3.682 692 HD2 HIS 84 HD2 HIS 84 -6.362 -16.946 6.864 693 HE1 HIS 84 HE1 HIS 84 -5.790 -19.208 3.325 694 HE2 HIS 84 HE2 HIS 84 -4.688 -18.198 5.342 695 H HIS 85 H HIS 85 -10.903 -13.948 5.454 696 HA HIS 85 HA HIS 85 -13.085 -14.851 7.117 697 HB2 HIS 85 HB2 HIS 85 -11.985 -12.704 7.566 698 HB3 HIS 85 HB3 HIS 85 -12.468 -12.110 5.981 699 HD1 HIS 85 HD1 HIS 85 -14.697 -10.976 5.836 700 HD2 HIS 85 HD2 HIS 85 -14.248 -13.137 9.360 701 HE1 HIS 85 HE1 HIS 85 -16.693 -10.394 7.242 702 HE2 HIS 85 HE2 HIS 85 -16.282 -11.547 9.438 703 H HIS 86 H HIS 86 -15.225 -14.996 6.591 704 HA HIS 86 HA HIS 86 -15.913 -14.770 3.732 705 HB2 HIS 86 HB2 HIS 86 -17.140 -16.471 5.914 706 HB3 HIS 86 HB3 HIS 86 -17.766 -16.360 4.272 707 HD1 HIS 86 HD1 HIS 86 -16.602 -17.730 2.477 708 HD2 HIS 86 HD2 HIS 86 -14.625 -17.822 6.133 709 HE1 HIS 86 HE1 HIS 86 -14.839 -19.502 2.248 710 HE2 HIS 86 HE2 HIS 86 -13.695 -19.584 4.484 711 H HIS 87 H HIS 87 -17.263 -13.221 3.122 712 HA HIS 87 HA HIS 87 -18.480 -11.436 4.969 713 HB2 HIS 87 HB2 HIS 87 -17.789 -10.624 2.801 714 HB3 HIS 87 HB3 HIS 87 -18.836 -11.778 1.980 715 HD1 HIS 87 HD1 HIS 87 -19.010 -8.630 4.061 716 HD2 HIS 87 HD2 HIS 87 -21.434 -10.939 1.599 717 HE1 HIS 87 HE1 HIS 87 -21.121 -7.309 3.767 718 HE2 HIS 87 HE2 HIS 87 -22.495 -8.643 2.138 719 H HIS 88 H HIS 88 -20.181 -11.935 6.182 720 HA HIS 88 HA HIS 88 -22.340 -13.596 5.062 721 HB2 HIS 88 HB2 HIS 88 -23.122 -13.790 7.441 722 HB3 HIS 88 HB3 HIS 88 -21.543 -14.494 7.131 723 HD1 HIS 88 HD1 HIS 88 -19.521 -13.440 8.318 724 HD2 HIS 88 HD2 HIS 88 -23.119 -11.541 9.151 725 HE1 HIS 88 HE1 HIS 88 -19.041 -11.907 10.245 726 HE2 HIS 88 HE2 HIS 88 -21.277 -10.931 10.851 727 H1 MET 1 H1 MET 1 -8.943 20.513 -11.908 728 H2 MET 1 H2 MET 1 -8.348 21.908 -12.651 729 H3 MET 1 H3 MET 1 -8.570 20.497 -13.557 730 HA MET 1 HA MET 1 -10.693 22.119 -12.280 731 HB2 MET 1 HB2 MET 1 -9.980 21.722 -15.198 732 HB3 MET 1 HB3 MET 1 -11.411 22.570 -14.621 733 HG2 MET 1 HG2 MET 1 -10.003 24.229 -13.526 734 HG3 MET 1 HG3 MET 1 -8.561 23.371 -14.065 735 HE1 MET 1 HE1 MET 1 -9.059 26.486 -14.579 736 HE2 MET 1 HE2 MET 1 -8.517 26.626 -16.251 737 HE3 MET 1 HE3 MET 1 -7.615 25.625 -15.113 738 H THR 2 H THR 2 -10.732 19.887 -15.089 739 HA THR 2 HA THR 2 -12.941 18.434 -13.909 740 HB THR 2 HB THR 2 -11.371 17.756 -16.419 741 HG1 THR 2 HG1 THR 2 -12.503 19.767 -16.554 742 HG21 THR 2 HG21 THR 2 -13.309 16.369 -17.007 743 HG22 THR 2 HG22 THR 2 -14.069 16.761 -15.465 744 HG23 THR 2 HG23 THR 2 -12.580 15.816 -15.498 745 H ASP 3 H ASP 3 -11.592 17.985 -11.952 746 HA ASP 3 HA ASP 3 -9.733 15.745 -12.249 747 HB2 ASP 3 HB2 ASP 3 -10.533 17.185 -9.708 748 HB3 ASP 3 HB3 ASP 3 -9.178 16.086 -9.918 749 H PHE 4 H PHE 4 -10.305 13.681 -11.881 750 HA PHE 4 HA PHE 4 -12.662 13.143 -10.209 751 HB2 PHE 4 HB2 PHE 4 -13.361 11.338 -11.690 752 HB3 PHE 4 HB3 PHE 4 -13.331 12.865 -12.558 753 HD1 PHE 4 HD1 PHE 4 -11.792 9.556 -12.220 754 HD2 PHE 4 HD2 PHE 4 -11.709 13.258 -14.332 755 HE1 PHE 4 HE1 PHE 4 -10.377 8.529 -13.952 756 HE2 PHE 4 HE2 PHE 4 -10.295 12.232 -16.069 757 HZ PHE 4 HZ PHE 4 -9.618 9.869 -15.871 758 H LEU 5 H LEU 5 -12.668 11.072 -9.196 759 HA LEU 5 HA LEU 5 -10.032 10.238 -8.362 760 HB2 LEU 5 HB2 LEU 5 -11.819 10.488 -6.731 761 HB3 LEU 5 HB3 LEU 5 -12.798 9.313 -7.585 762 HG LEU 5 HG LEU 5 -11.193 7.538 -7.007 763 HD11 LEU 5 HD11 LEU 5 -9.738 9.708 -5.493 764 HD12 LEU 5 HD12 LEU 5 -9.151 8.862 -6.926 765 HD13 LEU 5 HD13 LEU 5 -9.381 7.983 -5.415 766 HD21 LEU 5 HD21 LEU 5 -11.658 7.455 -4.601 767 HD22 LEU 5 HD22 LEU 5 -13.073 7.968 -5.517 768 HD23 LEU 5 HD23 LEU 5 -12.120 9.157 -4.630 769 H ALA 6 H ALA 6 -8.939 8.955 -9.711 770 HA ALA 6 HA ALA 6 -10.341 7.038 -11.410 771 HB1 ALA 6 HB1 ALA 6 -8.699 8.568 -12.409 772 HB2 ALA 6 HB2 ALA 6 -8.242 6.879 -12.623 773 HB3 ALA 6 HB3 ALA 6 -7.435 7.862 -11.401 774 H GLY 7 H GLY 7 -9.863 4.837 -11.491 775 HA2 GLY 7 HA2 GLY 7 -8.384 3.763 -9.159 776 HA3 GLY 7 HA3 GLY 7 -9.916 3.093 -9.690 777 H ILE 8 H ILE 8 -7.102 2.012 -9.440 778 HA ILE 8 HA ILE 8 -6.993 0.747 -12.113 779 HB ILE 8 HB ILE 8 -4.576 1.251 -10.347 780 HG12 ILE 8 HG12 ILE 8 -5.389 2.760 -12.850 781 HG13 ILE 8 HG13 ILE 8 -5.499 3.394 -11.212 782 HG21 ILE 8 HG21 ILE 8 -4.819 0.315 -13.211 783 HG22 ILE 8 HG22 ILE 8 -4.374 -0.680 -11.823 784 HG23 ILE 8 HG23 ILE 8 -3.305 0.618 -12.356 785 HD11 ILE 8 HD11 ILE 8 -3.068 3.233 -10.990 786 HD12 ILE 8 HD12 ILE 8 -3.535 4.248 -12.354 787 HD13 ILE 8 HD13 ILE 8 -2.963 2.603 -12.634 788 H ARG 9 H ARG 9 -6.843 -1.509 -12.101 789 HA ARG 9 HA ARG 9 -6.464 -2.780 -9.454 790 HB2 ARG 9 HB2 ARG 9 -8.705 -3.208 -10.474 791 HB3 ARG 9 HB3 ARG 9 -7.900 -4.005 -11.824 792 HG2 ARG 9 HG2 ARG 9 -6.909 -5.622 -10.232 793 HG3 ARG 9 HG3 ARG 9 -7.805 -4.852 -8.926 794 HD2 ARG 9 HD2 ARG 9 -9.916 -5.421 -10.111 795 HD3 ARG 9 HD3 ARG 9 -8.963 -6.294 -11.315 796 HE ARG 9 HE ARG 9 -8.701 -7.053 -8.498 797 HH11 ARG 9 HH11 ARG 9 -9.794 -7.854 -11.681 798 HH12 ARG 9 HH12 ARG 9 -10.082 -9.507 -11.269 799 HH21 ARG 9 HH21 ARG 9 -9.098 -9.183 -8.006 800 HH22 ARG 9 HH22 ARG 9 -9.692 -10.249 -9.231 801 H ILE 10 H ILE 10 -4.664 -3.864 -9.177 802 HA ILE 10 HA ILE 10 -3.123 -4.819 -11.519 803 HB ILE 10 HB ILE 10 -2.089 -4.323 -8.718 804 HG12 ILE 10 HG12 ILE 10 -1.816 -2.444 -11.078 805 HG13 ILE 10 HG13 ILE 10 -2.986 -2.225 -9.779 806 HG21 ILE 10 HG21 ILE 10 -0.723 -5.836 -10.034 807 HG22 ILE 10 HG22 ILE 10 0.113 -4.299 -9.812 808 HG23 ILE 10 HG23 ILE 10 -0.659 -4.666 -11.354 809 HD11 ILE 10 HD11 ILE 10 -1.144 -2.072 -8.167 810 HD12 ILE 10 HD12 ILE 10 -1.046 -0.834 -9.419 811 HD13 ILE 10 HD13 ILE 10 0.011 -2.244 -9.490 812 H VAL 11 H VAL 11 -3.311 -7.025 -11.780 813 HA VAL 11 HA VAL 11 -3.228 -8.663 -9.323 814 HB VAL 11 HB VAL 11 -4.699 -9.248 -11.899 815 HG11 VAL 11 HG11 VAL 11 -5.314 -11.407 -10.950 816 HG12 VAL 11 HG12 VAL 11 -4.283 -11.100 -9.553 817 HG13 VAL 11 HG13 VAL 11 -3.567 -11.288 -11.154 818 HG21 VAL 11 HG21 VAL 11 -5.651 -9.030 -9.034 819 HG22 VAL 11 HG22 VAL 11 -6.659 -9.380 -10.441 820 HG23 VAL 11 HG23 VAL 11 -5.872 -7.808 -10.290 821 H GLY 12 H GLY 12 -1.305 -9.484 -9.066 822 HA2 GLY 12 HA2 GLY 12 0.114 -10.656 -11.385 823 HA3 GLY 12 HA3 GLY 12 0.958 -9.610 -10.250 824 H GLU 13 H GLU 13 1.830 -12.205 -10.749 825 HA GLU 13 HA GLU 13 0.679 -14.135 -9.010 826 HB2 GLU 13 HB2 GLU 13 2.641 -15.512 -9.548 827 HB3 GLU 13 HB3 GLU 13 1.903 -14.817 -10.987 828 HG2 GLU 13 HG2 GLU 13 3.657 -13.155 -11.134 829 HG3 GLU 13 HG3 GLU 13 4.354 -13.707 -9.611 830 H ASP 14 H ASP 14 1.448 -15.045 -7.093 831 HA ASP 14 HA ASP 14 2.609 -13.278 -5.202 832 HB2 ASP 14 HB2 ASP 14 0.993 -15.255 -4.830 833 HB3 ASP 14 HB3 ASP 14 2.421 -16.278 -4.887 834 H LYS 15 H LYS 15 4.658 -12.628 -5.788 835 HA LYS 15 HA LYS 15 6.758 -14.669 -6.066 836 HB2 LYS 15 HB2 LYS 15 6.737 -11.703 -6.584 837 HB3 LYS 15 HB3 LYS 15 8.228 -12.622 -6.506 838 HG2 LYS 15 HG2 LYS 15 5.997 -12.971 -8.499 839 HG3 LYS 15 HG3 LYS 15 7.589 -12.265 -8.780 840 HD2 LYS 15 HD2 LYS 15 8.538 -14.524 -8.064 841 HD3 LYS 15 HD3 LYS 15 6.892 -15.140 -8.234 842 HE2 LYS 15 HE2 LYS 15 6.946 -14.171 -10.593 843 HE3 LYS 15 HE3 LYS 15 8.681 -13.971 -10.358 844 HZ1 LYS 15 HZ1 LYS 15 7.135 -16.497 -10.375 845 HZ2 LYS 15 HZ2 LYS 15 8.735 -16.405 -9.841 846 HZ3 LYS 15 HZ3 LYS 15 8.361 -16.023 -11.442 847 H ASN 16 H ASN 16 8.889 -13.820 -5.146 848 HA ASN 16 HA ASN 16 8.970 -13.861 -2.377 849 HB2 ASN 16 HB2 ASN 16 10.946 -12.676 -4.336 850 HB3 ASN 16 HB3 ASN 16 11.323 -13.204 -2.691 851 HD21 ASN 16 HD21 ASN 16 10.472 -14.210 -5.909 852 HD22 ASN 16 HD22 ASN 16 10.896 -15.872 -5.727 853 H GLY 17 H GLY 17 9.103 -11.090 -4.590 854 HA2 GLY 17 HA2 GLY 17 8.416 -9.300 -2.349 855 HA3 GLY 17 HA3 GLY 17 9.881 -8.970 -3.255 856 H MET 18 H MET 18 7.071 -10.181 -4.949 857 HA MET 18 HA MET 18 6.942 -7.883 -6.631 858 HB2 MET 18 HB2 MET 18 5.452 -10.434 -6.366 859 HB3 MET 18 HB3 MET 18 4.550 -9.113 -7.090 860 HG2 MET 18 HG2 MET 18 7.256 -10.007 -8.056 861 HG3 MET 18 HG3 MET 18 5.729 -10.602 -8.705 862 HE1 MET 18 HE1 MET 18 3.928 -8.036 -8.492 863 HE2 MET 18 HE2 MET 18 3.940 -9.038 -9.945 864 HE3 MET 18 HE3 MET 18 4.137 -7.292 -10.077 865 H THR 19 H THR 19 4.705 -9.062 -4.109 866 HA THR 19 HA THR 19 2.879 -6.958 -4.157 867 HB THR 19 HB THR 19 2.369 -7.547 -1.802 868 HG1 THR 19 HG1 THR 19 3.618 -9.139 -0.775 869 HG21 THR 19 HG21 THR 19 1.398 -8.900 -3.599 870 HG22 THR 19 HG22 THR 19 1.753 -9.897 -2.188 871 HG23 THR 19 HG23 THR 19 2.819 -9.945 -3.592 872 H ASN 20 H ASN 20 6.061 -7.150 -2.707 873 HA ASN 20 HA ASN 20 5.819 -4.802 -1.100 874 HB2 ASN 20 HB2 ASN 20 7.365 -6.708 -0.607 875 HB3 ASN 20 HB3 ASN 20 8.316 -6.259 -2.018 876 HD21 ASN 20 HD21 ASN 20 7.508 -5.508 1.239 877 HD22 ASN 20 HD22 ASN 20 8.693 -4.279 1.456 878 H GLN 21 H GLN 21 7.443 -5.572 -4.176 879 HA GLN 21 HA GLN 21 8.473 -2.969 -4.577 880 HB2 GLN 21 HB2 GLN 21 9.113 -3.696 -6.757 881 HB3 GLN 21 HB3 GLN 21 9.367 -5.034 -5.655 882 HG2 GLN 21 HG2 GLN 21 7.296 -6.069 -6.442 883 HG3 GLN 21 HG3 GLN 21 7.036 -4.713 -7.539 884 HE21 GLN 21 HE21 GLN 21 8.965 -7.528 -6.886 885 HE22 GLN 21 HE22 GLN 21 9.679 -7.638 -8.450 886 H ILE 22 H ILE 22 5.476 -4.531 -5.593 887 HA ILE 22 HA ILE 22 4.664 -2.689 -7.540 888 HB ILE 22 HB ILE 22 3.157 -4.617 -5.792 889 HG12 ILE 22 HG12 ILE 22 4.503 -5.524 -7.634 890 HG13 ILE 22 HG13 ILE 22 2.786 -5.767 -7.941 891 HG21 ILE 22 HG21 ILE 22 1.923 -2.780 -7.853 892 HG22 ILE 22 HG22 ILE 22 1.604 -2.783 -6.117 893 HG23 ILE 22 HG23 ILE 22 1.117 -4.159 -7.104 894 HD11 ILE 22 HD11 ILE 22 4.497 -3.604 -9.151 895 HD12 ILE 22 HD12 ILE 22 2.784 -3.876 -9.471 896 HD13 ILE 22 HD13 ILE 22 3.974 -5.086 -9.951 897 H THR 23 H THR 23 3.644 -2.839 -4.100 898 HA THR 23 HA THR 23 2.220 -0.379 -4.287 899 HB THR 23 HB THR 23 3.200 -1.428 -1.639 900 HG1 THR 23 HG1 THR 23 1.216 -2.582 -3.330 901 HG21 THR 23 HG21 THR 23 1.860 0.623 -1.684 902 HG22 THR 23 HG22 THR 23 0.974 -0.691 -0.912 903 HG23 THR 23 HG23 THR 23 0.588 -0.221 -2.568 904 H GLY 24 H GLY 24 5.518 -1.240 -3.542 905 HA2 GLY 24 HA2 GLY 24 6.456 1.222 -2.528 906 HA3 GLY 24 HA3 GLY 24 7.422 0.049 -3.414 907 H VAL 25 H VAL 25 6.126 0.054 -5.875 908 HA VAL 25 HA VAL 25 7.029 2.410 -7.158 909 HB VAL 25 HB VAL 25 5.060 0.325 -8.157 910 HG11 VAL 25 HG11 VAL 25 6.610 2.413 -9.704 911 HG12 VAL 25 HG12 VAL 25 4.866 2.389 -9.441 912 HG13 VAL 25 HG13 VAL 25 5.627 1.129 -10.412 913 HG21 VAL 25 HG21 VAL 25 7.247 -0.635 -7.584 914 HG22 VAL 25 HG22 VAL 25 8.048 0.559 -8.605 915 HG23 VAL 25 HG23 VAL 25 6.987 -0.651 -9.327 916 H ILE 26 H ILE 26 3.807 1.343 -6.111 917 HA ILE 26 HA ILE 26 2.245 3.435 -7.087 918 HB ILE 26 HB ILE 26 1.884 1.984 -4.450 919 HG12 ILE 26 HG12 ILE 26 2.008 0.397 -6.299 920 HG13 ILE 26 HG13 ILE 26 0.355 0.500 -5.709 921 HG21 ILE 26 HG21 ILE 26 0.527 3.986 -4.541 922 HG22 ILE 26 HG22 ILE 26 -0.499 2.562 -4.708 923 HG23 ILE 26 HG23 ILE 26 -0.096 3.528 -6.128 924 HD11 ILE 26 HD11 ILE 26 1.440 1.819 -8.185 925 HD12 ILE 26 HD12 ILE 26 -0.217 1.949 -7.593 926 HD13 ILE 26 HD13 ILE 26 0.413 0.389 -8.118 927 H SER 27 H SER 27 4.030 3.238 -4.012 928 HA SER 27 HA SER 27 3.090 5.646 -2.891 929 HB2 SER 27 HB2 SER 27 4.873 5.452 -1.288 930 HB3 SER 27 HB3 SER 27 4.302 3.824 -1.645 931 HG SER 27 HG SER 27 6.107 3.463 -2.865 932 H LYS 28 H LYS 28 5.911 4.996 -4.938 933 HA LYS 28 HA LYS 28 6.778 7.771 -4.812 934 HB2 LYS 28 HB2 LYS 28 8.674 7.043 -6.168 935 HB3 LYS 28 HB3 LYS 28 8.454 5.980 -4.785 936 HG2 LYS 28 HG2 LYS 28 7.417 4.302 -6.200 937 HG3 LYS 28 HG3 LYS 28 7.526 5.378 -7.593 938 HD2 LYS 28 HD2 LYS 28 9.317 3.738 -7.673 939 HD3 LYS 28 HD3 LYS 28 9.988 5.346 -7.399 940 HE2 LYS 28 HE2 LYS 28 10.159 4.849 -4.996 941 HE3 LYS 28 HE3 LYS 28 9.512 3.237 -5.292 942 HZ1 LYS 28 HZ1 LYS 28 11.929 3.233 -5.118 943 HZ2 LYS 28 HZ2 LYS 28 12.041 4.300 -6.426 944 HZ3 LYS 28 HZ3 LYS 28 11.429 2.743 -6.661 945 H PHE 29 H PHE 29 4.240 6.666 -6.319 946 HA PHE 29 HA PHE 29 4.584 7.269 -9.045 947 HB2 PHE 29 HB2 PHE 29 2.273 6.874 -7.246 948 HB3 PHE 29 HB3 PHE 29 1.950 7.857 -8.663 949 HD1 PHE 29 HD1 PHE 29 4.405 5.801 -9.862 950 HD2 PHE 29 HD2 PHE 29 0.375 5.600 -8.491 951 HE1 PHE 29 HE1 PHE 29 4.053 3.782 -11.205 952 HE2 PHE 29 HE2 PHE 29 0.026 3.569 -9.838 953 HZ PHE 29 HZ PHE 29 1.864 2.660 -11.194 954 H ASP 30 H ASP 30 3.465 8.971 -10.215 955 HA ASP 30 HA ASP 30 4.186 11.599 -9.226 956 HB2 ASP 30 HB2 ASP 30 3.354 12.193 -11.633 957 HB3 ASP 30 HB3 ASP 30 4.856 11.294 -11.439 958 H THR 31 H THR 31 1.933 10.263 -7.941 959 HA THR 31 HA THR 31 0.176 12.567 -7.949 960 HB THR 31 HB THR 31 -0.936 11.173 -9.628 961 HG1 THR 31 HG1 THR 31 -2.956 11.228 -8.664 962 HG21 THR 31 HG21 THR 31 -1.071 9.057 -7.470 963 HG22 THR 31 HG22 THR 31 -0.079 8.982 -8.928 964 HG23 THR 31 HG23 THR 31 -1.838 8.970 -9.056 965 H ASN 32 H ASN 32 -1.501 12.341 -6.141 966 HA ASN 32 HA ASN 32 -0.141 11.222 -3.796 967 HB2 ASN 32 HB2 ASN 32 -2.390 13.221 -4.077 968 HB3 ASN 32 HB3 ASN 32 -1.853 12.593 -2.522 969 HD21 ASN 32 HD21 ASN 32 0.933 12.500 -3.152 970 HD22 ASN 32 HD22 ASN 32 1.485 14.134 -3.232 971 H ILE 33 H ILE 33 -0.815 9.463 -2.758 972 HA ILE 33 HA ILE 33 -2.936 7.871 -3.769 973 HB ILE 33 HB ILE 33 -1.421 7.597 -1.162 974 HG12 ILE 33 HG12 ILE 33 -1.003 6.230 -3.840 975 HG13 ILE 33 HG13 ILE 33 0.016 7.503 -3.174 976 HG21 ILE 33 HG21 ILE 33 -3.529 6.383 -1.067 977 HG22 ILE 33 HG22 ILE 33 -2.184 5.251 -1.189 978 HG23 ILE 33 HG23 ILE 33 -3.172 5.599 -2.607 979 HD11 ILE 33 HD11 ILE 33 -0.384 4.761 -1.992 980 HD12 ILE 33 HD12 ILE 33 0.637 6.035 -1.323 981 HD13 ILE 33 HD13 ILE 33 1.030 5.319 -2.885 982 H ARG 34 H ARG 34 -5.063 7.920 -3.311 983 HA ARG 34 HA ARG 34 -5.952 9.333 -0.874 984 HB2 ARG 34 HB2 ARG 34 -7.711 8.447 -3.171 985 HB3 ARG 34 HB3 ARG 34 -8.092 9.611 -1.909 986 HG2 ARG 34 HG2 ARG 34 -6.256 9.944 -4.266 987 HG3 ARG 34 HG3 ARG 34 -7.692 10.878 -3.851 988 HD2 ARG 34 HD2 ARG 34 -5.065 10.878 -2.352 989 HD3 ARG 34 HD3 ARG 34 -5.652 12.149 -3.418 990 HE ARG 34 HE ARG 34 -7.565 12.272 -1.708 991 HH11 ARG 34 HH11 ARG 34 -4.338 11.385 -0.889 992 HH12 ARG 34 HH12 ARG 34 -4.395 12.166 0.654 993 HH21 ARG 34 HH21 ARG 34 -7.621 13.273 0.288 994 HH22 ARG 34 HH22 ARG 34 -6.212 13.242 1.293 995 H THR 35 H THR 35 -6.257 6.326 -2.681 996 HA THR 35 HA THR 35 -6.598 4.857 -0.196 997 HB THR 35 HB THR 35 -8.639 4.589 -2.431 998 HG1 THR 35 HG1 THR 35 -8.615 6.045 -0.102 999 HG21 THR 35 HG21 THR 35 -8.429 3.094 0.190 1000 HG22 THR 35 HG22 THR 35 -8.124 2.421 -1.411 1001 HG23 THR 35 HG23 THR 35 -9.747 2.952 -0.974 1002 H ILE 36 H ILE 36 -5.421 2.992 -0.302 1003 HA ILE 36 HA ILE 36 -4.977 1.754 -2.938 1004 HB ILE 36 HB ILE 36 -2.923 3.032 -2.393 1005 HG12 ILE 36 HG12 ILE 36 -1.305 1.136 -2.621 1006 HG13 ILE 36 HG13 ILE 36 -2.616 0.014 -2.273 1007 HG21 ILE 36 HG21 ILE 36 -1.483 2.309 -0.535 1008 HG22 ILE 36 HG22 ILE 36 -2.759 1.220 0.014 1009 HG23 ILE 36 HG23 ILE 36 -3.020 2.966 0.036 1010 HD11 ILE 36 HD11 ILE 36 -3.770 0.749 -4.295 1011 HD12 ILE 36 HD12 ILE 36 -2.156 0.132 -4.647 1012 HD13 ILE 36 HD13 ILE 36 -2.452 1.871 -4.637 1013 H VAL 37 H VAL 37 -5.265 -0.392 -2.951 1014 HA VAL 37 HA VAL 37 -5.303 -1.841 -0.376 1015 HB VAL 37 HB VAL 37 -7.202 -2.287 -2.700 1016 HG11 VAL 37 HG11 VAL 37 -6.688 -4.358 -1.525 1017 HG12 VAL 37 HG12 VAL 37 -8.349 -3.859 -1.207 1018 HG13 VAL 37 HG13 VAL 37 -7.103 -3.607 0.017 1019 HG21 VAL 37 HG21 VAL 37 -7.742 -0.226 -1.518 1020 HG22 VAL 37 HG22 VAL 37 -7.733 -1.084 0.022 1021 HG23 VAL 37 HG23 VAL 37 -8.958 -1.459 -1.190 1022 H LEU 38 H LEU 38 -4.448 -3.923 -0.402 1023 HA LEU 38 HA LEU 38 -3.803 -5.162 -2.972 1024 HB2 LEU 38 HB2 LEU 38 -1.773 -3.912 -2.229 1025 HB3 LEU 38 HB3 LEU 38 -1.753 -4.861 -0.759 1026 HG LEU 38 HG LEU 38 -1.552 -6.192 -3.462 1027 HD11 LEU 38 HD11 LEU 38 0.722 -5.062 -1.826 1028 HD12 LEU 38 HD12 LEU 38 0.212 -4.527 -3.428 1029 HD13 LEU 38 HD13 LEU 38 0.899 -6.137 -3.214 1030 HD21 LEU 38 HD21 LEU 38 -1.995 -7.647 -1.551 1031 HD22 LEU 38 HD22 LEU 38 -0.598 -6.985 -0.703 1032 HD23 LEU 38 HD23 LEU 38 -0.371 -7.924 -2.179 1033 H ASN 39 H ASN 39 -4.818 -7.070 -2.882 1034 HA ASN 39 HA ASN 39 -4.838 -8.542 -0.311 1035 HB2 ASN 39 HB2 ASN 39 -6.898 -8.669 -2.526 1036 HB3 ASN 39 HB3 ASN 39 -6.962 -9.545 -1.003 1037 HD21 ASN 39 HD21 ASN 39 -8.804 -7.628 -2.214 1038 HD22 ASN 39 HD22 ASN 39 -9.014 -6.379 -1.041 1039 H ALA 40 H ALA 40 -3.232 -10.063 -0.522 1040 HA ALA 40 HA ALA 40 -3.012 -11.638 -2.978 1041 HB1 ALA 40 HB1 ALA 40 -1.149 -12.762 -1.861 1042 HB2 ALA 40 HB2 ALA 40 -1.501 -11.890 -0.366 1043 HB3 ALA 40 HB3 ALA 40 -0.960 -11.008 -1.793 1044 H LYS 41 H LYS 41 -4.531 -13.108 -3.275 1045 HA LYS 41 HA LYS 41 -5.255 -14.908 -1.050 1046 HB2 LYS 41 HB2 LYS 41 -7.566 -14.937 -1.821 1047 HB3 LYS 41 HB3 LYS 41 -7.074 -13.286 -1.459 1048 HG2 LYS 41 HG2 LYS 41 -6.707 -12.907 -3.882 1049 HG3 LYS 41 HG3 LYS 41 -7.322 -14.534 -4.195 1050 HD2 LYS 41 HD2 LYS 41 -9.467 -13.923 -3.190 1051 HD3 LYS 41 HD3 LYS 41 -8.854 -12.304 -2.840 1052 HE2 LYS 41 HE2 LYS 41 -8.587 -11.882 -5.235 1053 HE3 LYS 41 HE3 LYS 41 -9.165 -13.510 -5.594 1054 HZ1 LYS 41 HZ1 LYS 41 -11.286 -12.924 -4.568 1055 HZ2 LYS 41 HZ2 LYS 41 -10.924 -11.898 -5.864 1056 HZ3 LYS 41 HZ3 LYS 41 -10.726 -11.355 -4.278 1057 H ASP 42 H ASP 42 -5.863 -17.049 -1.685 1058 HA ASP 42 HA ASP 42 -5.527 -19.008 -2.773 1059 HB2 ASP 42 HB2 ASP 42 -5.612 -17.387 -5.332 1060 HB3 ASP 42 HB3 ASP 42 -5.926 -19.111 -5.161 1061 H GLY 43 H GLY 43 -3.810 -16.872 -5.023 1062 HA2 GLY 43 HA2 GLY 43 -1.198 -17.425 -3.984 1063 HA3 GLY 43 HA3 GLY 43 -1.520 -18.345 -5.450 1064 H ILE 44 H ILE 44 -3.066 -15.301 -5.103 1065 HA ILE 44 HA ILE 44 -1.128 -13.902 -6.808 1066 HB ILE 44 HB ILE 44 -4.077 -13.939 -7.496 1067 HG12 ILE 44 HG12 ILE 44 -1.903 -15.645 -8.741 1068 HG13 ILE 44 HG13 ILE 44 -3.214 -16.231 -7.721 1069 HG21 ILE 44 HG21 ILE 44 -2.788 -12.040 -8.325 1070 HG22 ILE 44 HG22 ILE 44 -3.303 -13.078 -9.654 1071 HG23 ILE 44 HG23 ILE 44 -1.634 -13.140 -9.085 1072 HD11 ILE 44 HD11 ILE 44 -4.834 -15.518 -9.389 1073 HD12 ILE 44 HD12 ILE 44 -3.655 -16.635 -10.078 1074 HD13 ILE 44 HD13 ILE 44 -3.530 -14.905 -10.402 1075 H PHE 45 H PHE 45 -1.551 -11.542 -6.840 1076 HA PHE 45 HA PHE 45 -3.216 -10.693 -4.546 1077 HB2 PHE 45 HB2 PHE 45 -1.650 -8.971 -3.978 1078 HB3 PHE 45 HB3 PHE 45 -0.757 -10.478 -4.119 1079 HD1 PHE 45 HD1 PHE 45 0.808 -10.832 -5.961 1080 HD2 PHE 45 HD2 PHE 45 -1.302 -7.155 -5.530 1081 HE1 PHE 45 HE1 PHE 45 2.357 -9.755 -7.542 1082 HE2 PHE 45 HE2 PHE 45 0.241 -6.080 -7.112 1083 HZ PHE 45 HZ PHE 45 2.067 -7.380 -8.121 1084 H THR 46 H THR 46 -4.661 -9.110 -4.843 1085 HA THR 46 HA THR 46 -4.658 -7.666 -7.422 1086 HB THR 46 HB THR 46 -6.704 -8.872 -7.236 1087 HG1 THR 46 HG1 THR 46 -7.236 -6.171 -6.455 1088 HG21 THR 46 HG21 THR 46 -8.235 -8.708 -5.347 1089 HG22 THR 46 HG22 THR 46 -7.101 -7.655 -4.501 1090 HG23 THR 46 HG23 THR 46 -6.668 -9.334 -4.834 1091 H CYS 47 H CYS 47 -3.466 -5.869 -7.043 1092 HA CYS 47 HA CYS 47 -3.930 -4.254 -4.653 1093 HB2 CYS 47 HB2 CYS 47 -1.612 -4.643 -5.425 1094 HB3 CYS 47 HB3 CYS 47 -1.985 -3.821 -6.936 1095 HG CYS 47 HG CYS 47 -2.586 -2.048 -4.137 1096 H ASN 48 H ASN 48 -5.446 -2.720 -4.647 1097 HA ASN 48 HA ASN 48 -6.405 -1.627 -7.208 1098 HB2 ASN 48 HB2 ASN 48 -7.747 -1.733 -4.493 1099 HB3 ASN 48 HB3 ASN 48 -8.447 -1.001 -5.932 1100 HD21 ASN 48 HD21 ASN 48 -10.196 -2.395 -5.884 1101 HD22 ASN 48 HD22 ASN 48 -10.070 -4.057 -6.326 1102 H LEU 49 H LEU 49 -5.543 0.304 -7.697 1103 HA LEU 49 HA LEU 49 -4.746 2.141 -5.546 1104 HB2 LEU 49 HB2 LEU 49 -3.024 1.696 -7.166 1105 HB3 LEU 49 HB3 LEU 49 -4.100 2.091 -8.494 1106 HG LEU 49 HG LEU 49 -4.139 4.447 -7.778 1107 HD11 LEU 49 HD11 LEU 49 -3.817 4.163 -5.390 1108 HD12 LEU 49 HD12 LEU 49 -2.586 5.238 -6.048 1109 HD13 LEU 49 HD13 LEU 49 -2.178 3.567 -5.657 1110 HD21 LEU 49 HD21 LEU 49 -2.468 3.713 -9.407 1111 HD22 LEU 49 HD22 LEU 49 -1.339 3.359 -8.097 1112 HD23 LEU 49 HD23 LEU 49 -1.854 5.019 -8.396 1113 H MET 50 H MET 50 -5.796 3.972 -5.115 1114 HA MET 50 HA MET 50 -7.712 5.039 -7.093 1115 HB2 MET 50 HB2 MET 50 -8.061 4.995 -4.088 1116 HB3 MET 50 HB3 MET 50 -9.189 5.683 -5.250 1117 HG2 MET 50 HG2 MET 50 -8.453 2.773 -4.966 1118 HG3 MET 50 HG3 MET 50 -9.971 3.533 -4.493 1119 HE1 MET 50 HE1 MET 50 -10.009 5.604 -7.151 1120 HE2 MET 50 HE2 MET 50 -11.463 4.927 -6.413 1121 HE3 MET 50 HE3 MET 50 -11.175 4.726 -8.141 1122 H ILE 51 H ILE 51 -6.967 6.922 -7.804 1123 HA ILE 51 HA ILE 51 -5.967 8.932 -5.920 1124 HB ILE 51 HB ILE 51 -4.057 9.453 -7.529 1125 HG12 ILE 51 HG12 ILE 51 -3.265 7.154 -8.612 1126 HG13 ILE 51 HG13 ILE 51 -4.993 6.830 -8.645 1127 HG21 ILE 51 HG21 ILE 51 -3.934 6.858 -5.995 1128 HG22 ILE 51 HG22 ILE 51 -3.716 8.474 -5.323 1129 HG23 ILE 51 HG23 ILE 51 -2.554 7.842 -6.488 1130 HD11 ILE 51 HD11 ILE 51 -4.242 7.723 -10.753 1131 HD12 ILE 51 HD12 ILE 51 -3.578 9.143 -9.947 1132 HD13 ILE 51 HD13 ILE 51 -5.323 8.872 -9.964 1133 H PHE 52 H PHE 52 -5.824 11.117 -6.888 1134 HA PHE 52 HA PHE 52 -8.051 11.512 -8.721 1135 HB2 PHE 52 HB2 PHE 52 -6.525 13.296 -6.868 1136 HB3 PHE 52 HB3 PHE 52 -7.391 14.029 -8.214 1137 HD1 PHE 52 HD2 PHE 52 -9.862 13.601 -8.444 1138 HD2 PHE 52 HD1 PHE 52 -7.683 12.603 -4.922 1139 HE1 PHE 52 HE2 PHE 52 -11.967 13.493 -7.184 1140 HE2 PHE 52 HE1 PHE 52 -9.788 12.498 -3.652 1141 HZ PHE 52 HZ PHE 52 -11.934 12.942 -4.778 1142 H VAL 53 H VAL 53 -8.003 12.501 -10.682 1143 HA VAL 53 HA VAL 53 -5.414 13.219 -11.883 1144 HB VAL 53 HB VAL 53 -5.841 11.920 -13.898 1145 HG11 VAL 53 HG11 VAL 53 -4.579 10.774 -12.155 1146 HG12 VAL 53 HG12 VAL 53 -5.586 9.632 -13.052 1147 HG13 VAL 53 HG13 VAL 53 -6.081 10.173 -11.447 1148 HG21 VAL 53 HG21 VAL 53 -8.252 11.978 -13.928 1149 HG22 VAL 53 HG22 VAL 53 -8.328 10.964 -12.487 1150 HG23 VAL 53 HG23 VAL 53 -7.705 10.302 -13.998 1151 H LYS 54 H LYS 54 -5.691 14.444 -13.918 1152 HA LYS 54 HA LYS 54 -8.195 15.974 -13.927 1153 HB2 LYS 54 HB2 LYS 54 -7.017 17.687 -15.196 1154 HB3 LYS 54 HB3 LYS 54 -6.132 17.292 -13.734 1155 HG2 LYS 54 HG2 LYS 54 -5.389 15.983 -16.324 1156 HG3 LYS 54 HG3 LYS 54 -4.869 17.633 -15.989 1157 HD2 LYS 54 HD2 LYS 54 -4.260 15.200 -14.293 1158 HD3 LYS 54 HD3 LYS 54 -3.141 16.013 -15.378 1159 HE2 LYS 54 HE2 LYS 54 -4.447 17.295 -12.974 1160 HE3 LYS 54 HE3 LYS 54 -2.817 16.624 -13.002 1161 HZ1 LYS 54 HZ1 LYS 54 -2.911 19.060 -13.331 1162 HZ2 LYS 54 HZ2 LYS 54 -3.733 18.813 -14.786 1163 HZ3 LYS 54 HZ3 LYS 54 -2.153 18.241 -14.603 1164 H ASN 55 H ASN 55 -6.962 13.364 -15.497 1165 HA ASN 55 HA ASN 55 -8.942 13.306 -17.493 1166 HB2 ASN 55 HB2 ASN 55 -7.578 13.424 -19.535 1167 HB3 ASN 55 HB3 ASN 55 -7.539 14.947 -18.657 1168 HD21 ASN 55 HD21 ASN 55 -5.641 14.199 -16.694 1169 HD22 ASN 55 HD22 ASN 55 -4.116 14.041 -17.478 1170 H THR 56 H THR 56 -8.667 11.392 -18.991 1171 HA THR 56 HA THR 56 -7.955 9.124 -17.388 1172 HB THR 56 HB THR 56 -8.678 7.761 -19.332 1173 HG1 THR 56 HG1 THR 56 -9.319 8.752 -21.220 1174 HG21 THR 56 HG21 THR 56 -10.352 8.504 -17.725 1175 HG22 THR 56 HG22 THR 56 -11.030 8.510 -19.353 1176 HG23 THR 56 HG23 THR 56 -10.542 10.026 -18.596 1177 H ASP 57 H ASP 57 -6.359 10.864 -19.958 1178 HA ASP 57 HA ASP 57 -4.470 8.897 -20.720 1179 HB2 ASP 57 HB2 ASP 57 -4.855 10.895 -22.072 1180 HB3 ASP 57 HB3 ASP 57 -4.278 11.923 -20.762 1181 H LYS 58 H LYS 58 -4.480 11.365 -18.209 1182 HA LYS 58 HA LYS 58 -1.967 10.962 -17.077 1183 HB2 LYS 58 HB2 LYS 58 -3.283 12.791 -16.319 1184 HB3 LYS 58 HB3 LYS 58 -4.643 11.750 -15.924 1185 HG2 LYS 58 HG2 LYS 58 -3.570 12.521 -13.908 1186 HG3 LYS 58 HG3 LYS 58 -3.365 10.778 -14.088 1187 HD2 LYS 58 HD2 LYS 58 -1.089 11.138 -14.944 1188 HD3 LYS 58 HD3 LYS 58 -1.299 12.882 -14.768 1189 HE2 LYS 58 HE2 LYS 58 -1.644 12.543 -12.330 1190 HE3 LYS 58 HE3 LYS 58 -1.301 10.827 -12.553 1191 HZ1 LYS 58 HZ1 LYS 58 0.553 13.062 -13.138 1192 HZ2 LYS 58 HZ2 LYS 58 0.889 11.421 -13.389 1193 HZ3 LYS 58 HZ3 LYS 58 0.657 12.009 -11.820 1194 H LEU 59 H LEU 59 -5.005 9.236 -16.559 1195 HA LEU 59 HA LEU 59 -4.098 7.485 -14.526 1196 HB2 LEU 59 HB2 LEU 59 -6.455 7.971 -14.920 1197 HB3 LEU 59 HB3 LEU 59 -6.367 7.227 -16.506 1198 HG LEU 59 HG LEU 59 -5.967 5.035 -15.468 1199 HD11 LEU 59 HD11 LEU 59 -6.233 4.762 -13.042 1200 HD12 LEU 59 HD12 LEU 59 -6.274 6.515 -12.857 1201 HD13 LEU 59 HD13 LEU 59 -4.815 5.723 -13.453 1202 HD21 LEU 59 HD21 LEU 59 -8.245 5.688 -15.969 1203 HD22 LEU 59 HD22 LEU 59 -8.386 6.497 -14.408 1204 HD23 LEU 59 HD23 LEU 59 -8.204 4.744 -14.480 1205 H THR 60 H THR 60 -4.344 7.097 -18.072 1206 HA THR 60 HA THR 60 -3.545 4.392 -18.175 1207 HB THR 60 HB THR 60 -3.046 4.728 -20.541 1208 HG1 THR 60 HG1 THR 60 -3.075 6.813 -21.442 1209 HG21 THR 60 HG21 THR 60 -5.211 5.644 -21.286 1210 HG22 THR 60 HG22 THR 60 -5.496 6.267 -19.660 1211 HG23 THR 60 HG23 THR 60 -5.397 4.527 -19.933 1212 H THR 61 H THR 61 -1.674 7.340 -17.865 1213 HA THR 61 HA THR 61 0.867 6.381 -18.594 1214 HB THR 61 HB THR 61 0.213 8.416 -16.438 1215 HG1 THR 61 HG1 THR 61 -0.614 9.199 -18.341 1216 HG21 THR 61 HG21 THR 61 2.521 7.637 -16.273 1217 HG22 THR 61 HG22 THR 61 2.479 9.288 -16.893 1218 HG23 THR 61 HG23 THR 61 2.766 7.937 -17.992 1219 H LEU 62 H LEU 62 -0.774 6.398 -15.436 1220 HA LEU 62 HA LEU 62 1.298 5.149 -13.979 1221 HB2 LEU 62 HB2 LEU 62 -1.676 5.171 -13.455 1222 HB3 LEU 62 HB3 LEU 62 -0.459 4.650 -12.305 1223 HG LEU 62 HG LEU 62 -0.865 7.448 -13.375 1224 HD11 LEU 62 HD11 LEU 62 -1.293 7.973 -11.017 1225 HD12 LEU 62 HD12 LEU 62 -1.118 6.264 -10.612 1226 HD13 LEU 62 HD13 LEU 62 -2.443 6.796 -11.650 1227 HD21 LEU 62 HD21 LEU 62 1.518 7.023 -13.180 1228 HD22 LEU 62 HD22 LEU 62 1.294 6.394 -11.547 1229 HD23 LEU 62 HD23 LEU 62 0.984 8.097 -11.887 1230 H MET 63 H MET 63 -1.604 3.780 -15.545 1231 HA MET 63 HA MET 63 -1.184 1.131 -14.716 1232 HB2 MET 63 HB2 MET 63 -2.604 2.179 -17.172 1233 HB3 MET 63 HB3 MET 63 -2.640 0.496 -16.658 1234 HG2 MET 63 HG2 MET 63 -3.511 1.404 -14.419 1235 HG3 MET 63 HG3 MET 63 -3.816 2.897 -15.300 1236 HE1 MET 63 HE1 MET 63 -4.783 1.957 -18.146 1237 HE2 MET 63 HE2 MET 63 -5.616 3.172 -17.174 1238 HE3 MET 63 HE3 MET 63 -6.524 1.837 -17.880 1239 H ASP 64 H ASP 64 0.154 2.893 -17.482 1240 HA ASP 64 HA ASP 64 1.441 0.671 -18.687 1241 HB2 ASP 64 HB2 ASP 64 1.115 2.936 -19.746 1242 HB3 ASP 64 HB3 ASP 64 2.396 3.543 -18.703 1243 H LYS 65 H LYS 65 2.544 3.067 -16.296 1244 HA LYS 65 HA LYS 65 5.140 2.165 -15.851 1245 HB2 LYS 65 HB2 LYS 65 3.172 3.358 -13.878 1246 HB3 LYS 65 HB3 LYS 65 4.897 3.201 -13.582 1247 HG2 LYS 65 HG2 LYS 65 5.351 4.678 -15.495 1248 HG3 LYS 65 HG3 LYS 65 3.617 4.837 -15.769 1249 HD2 LYS 65 HD2 LYS 65 4.378 6.784 -14.575 1250 HD3 LYS 65 HD3 LYS 65 3.404 5.810 -13.481 1251 HE2 LYS 65 HE2 LYS 65 5.356 4.978 -12.371 1252 HE3 LYS 65 HE3 LYS 65 6.416 5.701 -13.583 1253 HZ1 LYS 65 HZ1 LYS 65 6.163 6.924 -11.396 1254 HZ2 LYS 65 HZ2 LYS 65 4.612 7.353 -11.919 1255 HZ3 LYS 65 HZ3 LYS 65 5.963 7.838 -12.800 1256 H LEU 66 H LEU 66 2.100 0.960 -14.556 1257 HA LEU 66 HA LEU 66 3.270 -0.957 -12.774 1258 HB2 LEU 66 HB2 LEU 66 0.479 -0.762 -13.916 1259 HB3 LEU 66 HB3 LEU 66 0.958 -1.796 -12.578 1260 HG LEU 66 HG LEU 66 1.173 1.220 -12.526 1261 HD11 LEU 66 HD11 LEU 66 -1.166 0.611 -12.698 1262 HD12 LEU 66 HD12 LEU 66 -0.803 1.166 -11.063 1263 HD13 LEU 66 HD13 LEU 66 -0.983 -0.558 -11.391 1264 HD21 LEU 66 HD21 LEU 66 1.380 -0.847 -10.333 1265 HD22 LEU 66 HD22 LEU 66 1.456 0.902 -10.119 1266 HD23 LEU 66 HD23 LEU 66 2.718 0.071 -11.026 1267 H ARG 67 H ARG 67 1.892 -1.129 -16.043 1268 HA ARG 67 HA ARG 67 2.063 -3.927 -16.378 1269 HB2 ARG 67 HB2 ARG 67 2.022 -1.651 -18.368 1270 HB3 ARG 67 HB3 ARG 67 2.030 -3.341 -18.864 1271 HG2 ARG 67 HG2 ARG 67 -0.055 -3.722 -17.659 1272 HG3 ARG 67 HG3 ARG 67 -0.059 -2.046 -17.117 1273 HD2 ARG 67 HD2 ARG 67 -0.275 -1.283 -19.423 1274 HD3 ARG 67 HD3 ARG 67 -0.194 -2.950 -19.999 1275 HE ARG 67 HE ARG 67 -2.307 -2.596 -18.127 1276 HH11 ARG 67 HH11 ARG 67 -1.462 -1.956 -21.405 1277 HH12 ARG 67 HH12 ARG 67 -3.097 -2.065 -21.953 1278 HH21 ARG 67 HH21 ARG 67 -4.399 -2.707 -18.844 1279 HH22 ARG 67 HH22 ARG 67 -4.737 -2.489 -20.528 1280 H LYS 68 H LYS 68 4.576 -1.706 -16.085 1281 HA LYS 68 HA LYS 68 6.504 -2.913 -17.813 1282 HB2 LYS 68 HB2 LYS 68 6.851 -1.131 -15.396 1283 HB3 LYS 68 HB3 LYS 68 8.155 -1.607 -16.471 1284 HG2 LYS 68 HG2 LYS 68 5.724 -0.026 -17.309 1285 HG3 LYS 68 HG3 LYS 68 7.294 0.664 -16.906 1286 HD2 LYS 68 HD2 LYS 68 7.518 0.544 -19.180 1287 HD3 LYS 68 HD3 LYS 68 8.124 -1.054 -18.758 1288 HE2 LYS 68 HE2 LYS 68 6.573 -1.177 -20.634 1289 HE3 LYS 68 HE3 LYS 68 5.909 -2.009 -19.230 1290 HZ1 LYS 68 HZ1 LYS 68 4.247 -0.649 -20.327 1291 HZ2 LYS 68 HZ2 LYS 68 5.190 0.735 -20.112 1292 HZ3 LYS 68 HZ3 LYS 68 4.550 -0.068 -18.771 1293 H VAL 69 H VAL 69 5.168 -3.946 -14.844 1294 HA VAL 69 HA VAL 69 7.557 -5.406 -14.009 1295 HB VAL 69 HB VAL 69 4.793 -5.379 -12.771 1296 HG11 VAL 69 HG11 VAL 69 5.968 -7.436 -12.219 1297 HG12 VAL 69 HG12 VAL 69 5.927 -6.382 -10.806 1298 HG13 VAL 69 HG13 VAL 69 7.406 -6.523 -11.756 1299 HG21 VAL 69 HG21 VAL 69 7.317 -3.911 -11.974 1300 HG22 VAL 69 HG22 VAL 69 5.812 -3.934 -11.054 1301 HG23 VAL 69 HG23 VAL 69 5.858 -3.187 -12.651 1302 H GLN 70 H GLN 70 8.010 -7.375 -14.718 1303 HA GLN 70 HA GLN 70 6.448 -8.907 -16.443 1304 HB2 GLN 70 HB2 GLN 70 8.044 -10.741 -15.978 1305 HB3 GLN 70 HB3 GLN 70 8.848 -9.208 -16.284 1306 HG2 GLN 70 HG2 GLN 70 9.263 -8.893 -13.927 1307 HG3 GLN 70 HG3 GLN 70 8.327 -10.335 -13.533 1308 HE21 GLN 70 HE21 GLN 70 11.117 -9.690 -12.944 1309 HE22 GLN 70 HE22 GLN 70 12.045 -10.971 -13.632 1310 H GLY 71 H GLY 71 6.597 -8.979 -12.923 1311 HA2 GLY 71 HA2 GLY 71 5.342 -11.466 -12.491 1312 HA3 GLY 71 HA3 GLY 71 5.428 -10.151 -11.337 1313 H VAL 72 H VAL 72 3.963 -8.365 -13.305 1314 HA VAL 72 HA VAL 72 1.284 -9.156 -12.441 1315 HB VAL 72 HB VAL 72 2.170 -6.620 -13.846 1316 HG11 VAL 72 HG11 VAL 72 -0.429 -7.322 -12.470 1317 HG12 VAL 72 HG12 VAL 72 -0.189 -7.049 -14.197 1318 HG13 VAL 72 HG13 VAL 72 0.008 -5.717 -13.060 1319 HG21 VAL 72 HG21 VAL 72 2.007 -5.556 -11.641 1320 HG22 VAL 72 HG22 VAL 72 3.226 -6.831 -11.657 1321 HG23 VAL 72 HG23 VAL 72 1.655 -7.124 -10.909 1322 H PHE 73 H PHE 73 -0.398 -9.694 -13.797 1323 HA PHE 73 HA PHE 73 0.184 -9.707 -16.689 1324 HB2 PHE 73 HB2 PHE 73 -1.690 -11.622 -16.587 1325 HB3 PHE 73 HB3 PHE 73 0.026 -11.947 -16.426 1326 HD1 PHE 73 HD2 PHE 73 1.004 -12.462 -14.254 1327 HD2 PHE 73 HD1 PHE 73 -3.195 -11.919 -14.714 1328 HE1 PHE 73 HE2 PHE 73 0.633 -13.570 -12.095 1329 HE2 PHE 73 HE1 PHE 73 -3.572 -13.034 -12.549 1330 HZ PHE 73 HZ PHE 73 -1.653 -13.862 -11.238 1331 H THR 74 H THR 74 -2.081 -8.729 -14.239 1332 HA THR 74 HA THR 74 -3.742 -7.584 -16.407 1333 HB THR 74 HB THR 74 -5.728 -7.841 -15.228 1334 HG1 THR 74 HG1 THR 74 -5.310 -7.098 -13.214 1335 HG21 THR 74 HG21 THR 74 -5.870 -10.179 -14.516 1336 HG22 THR 74 HG22 THR 74 -4.110 -10.264 -14.423 1337 HG23 THR 74 HG23 THR 74 -4.901 -10.028 -15.983 1338 H VAL 75 H VAL 75 -3.418 -5.476 -16.550 1339 HA VAL 75 HA VAL 75 -3.688 -3.886 -14.080 1340 HB VAL 75 HB VAL 75 -1.903 -3.089 -16.398 1341 HG11 VAL 75 HG11 VAL 75 -2.911 -1.200 -15.218 1342 HG12 VAL 75 HG12 VAL 75 -1.176 -1.278 -14.918 1343 HG13 VAL 75 HG13 VAL 75 -2.309 -1.826 -13.682 1344 HG21 VAL 75 HG21 VAL 75 -0.888 -4.954 -15.200 1345 HG22 VAL 75 HG22 VAL 75 -1.114 -4.111 -13.665 1346 HG23 VAL 75 HG23 VAL 75 -0.008 -3.458 -14.875 1347 H GLU 76 H GLU 76 -5.699 -3.082 -14.295 1348 HA GLU 76 HA GLU 76 -6.469 -1.849 -16.850 1349 HB2 GLU 76 HB2 GLU 76 -8.703 -2.943 -16.705 1350 HB3 GLU 76 HB3 GLU 76 -7.383 -4.073 -16.979 1351 HG2 GLU 76 HG2 GLU 76 -7.407 -4.670 -14.598 1352 HG3 GLU 76 HG3 GLU 76 -8.744 -3.549 -14.337 1353 H ARG 77 H ARG 77 -8.449 -0.533 -16.688 1354 HA ARG 77 HA ARG 77 -8.289 1.133 -14.322 1355 HB2 ARG 77 HB2 ARG 77 -8.280 2.261 -16.437 1356 HB3 ARG 77 HB3 ARG 77 -9.740 1.426 -16.952 1357 HG2 ARG 77 HG2 ARG 77 -10.989 2.601 -15.154 1358 HG3 ARG 77 HG3 ARG 77 -9.522 3.508 -14.779 1359 HD2 ARG 77 HD2 ARG 77 -10.983 4.820 -16.200 1360 HD3 ARG 77 HD3 ARG 77 -9.508 4.399 -17.068 1361 HE ARG 77 HE ARG 77 -10.993 2.504 -18.004 1362 HH11 ARG 77 HH11 ARG 77 -12.118 5.666 -17.210 1363 HH12 ARG 77 HH12 ARG 77 -13.345 5.648 -18.432 1364 HH21 ARG 77 HH21 ARG 77 -12.577 2.496 -19.556 1365 HH22 ARG 77 HH22 ARG 77 -13.609 3.873 -19.733 1366 H LEU 78 H LEU 78 -9.751 1.252 -12.729 1367 HA LEU 78 HA LEU 78 -12.103 -0.446 -12.760 1368 HB2 LEU 78 HB2 LEU 78 -11.009 1.423 -10.650 1369 HB3 LEU 78 HB3 LEU 78 -12.404 0.384 -10.428 1370 HG LEU 78 HG LEU 78 -9.577 -0.565 -10.946 1371 HD11 LEU 78 HD11 LEU 78 -11.233 -0.629 -8.422 1372 HD12 LEU 78 HD12 LEU 78 -9.836 0.406 -8.722 1373 HD13 LEU 78 HD13 LEU 78 -9.633 -1.344 -8.631 1374 HD21 LEU 78 HD21 LEU 78 -11.207 -2.108 -11.884 1375 HD22 LEU 78 HD22 LEU 78 -12.101 -2.124 -10.363 1376 HD23 LEU 78 HD23 LEU 78 -10.474 -2.800 -10.438 1377 H SER 79 H SER 79 -13.874 0.266 -13.775 1378 HA SER 79 HA SER 79 -14.472 3.074 -14.094 1379 HB2 SER 79 HB2 SER 79 -16.485 2.259 -15.304 1380 HB3 SER 79 HB3 SER 79 -15.004 1.507 -15.901 1381 HG SER 79 HG SER 79 -16.765 0.015 -15.547 1382 H ASN 80 H ASN 80 -16.475 0.411 -12.813 1383 HA ASN 80 HA ASN 80 -18.138 2.178 -11.302 1384 HB2 ASN 80 HB2 ASN 80 -17.892 -0.838 -11.133 1385 HB3 ASN 80 HB3 ASN 80 -19.210 0.131 -10.477 1386 HD21 ASN 80 HD21 ASN 80 -19.184 -2.007 -12.500 1387 HD22 ASN 80 HD22 ASN 80 -19.925 -1.319 -13.899 1388 H LEU 81 H LEU 81 -17.249 3.260 -9.629 1389 HA LEU 81 HA LEU 81 -15.281 1.949 -7.918 1390 HB2 LEU 81 HB2 LEU 81 -16.305 4.792 -7.885 1391 HB3 LEU 81 HB3 LEU 81 -14.986 4.173 -6.908 1392 HG LEU 81 HG LEU 81 -15.034 4.536 -9.905 1393 HD11 LEU 81 HD11 LEU 81 -13.158 6.045 -9.476 1394 HD12 LEU 81 HD12 LEU 81 -13.297 5.741 -7.742 1395 HD13 LEU 81 HD13 LEU 81 -14.603 6.559 -8.605 1396 HD21 LEU 81 HD21 LEU 81 -13.919 2.428 -9.416 1397 HD22 LEU 81 HD22 LEU 81 -12.902 3.221 -8.213 1398 HD23 LEU 81 HD23 LEU 81 -12.747 3.645 -9.918 1399 H GLU 82 H GLU 82 -15.493 1.579 -5.749 1400 HA GLU 82 HA GLU 82 -18.178 1.363 -4.661 1401 HB2 GLU 82 HB2 GLU 82 -16.993 0.335 -2.713 1402 HB3 GLU 82 HB3 GLU 82 -16.633 -0.455 -4.246 1403 HG2 GLU 82 HG2 GLU 82 -14.487 0.547 -4.369 1404 HG3 GLU 82 HG3 GLU 82 -14.855 1.667 -3.060 1405 H HIS 83 H HIS 83 -16.304 3.926 -4.984 1406 HA HIS 83 HA HIS 83 -15.976 4.860 -2.298 1407 HB2 HIS 83 HB2 HIS 83 -15.643 6.243 -4.962 1408 HB3 HIS 83 HB3 HIS 83 -15.182 6.943 -3.410 1409 HD1 HIS 83 HD1 HIS 83 -12.808 6.525 -2.755 1410 HD2 HIS 83 HD2 HIS 83 -14.238 3.649 -5.387 1411 HE1 HIS 83 HE1 HIS 83 -10.864 5.029 -3.243 1412 HE2 HIS 83 HE2 HIS 83 -11.836 3.154 -4.608 1413 H HIS 84 H HIS 84 -18.420 5.343 -4.795 1414 HA HIS 84 HA HIS 84 -19.859 7.298 -3.229 1415 HB2 HIS 84 HB2 HIS 84 -20.684 5.629 -5.620 1416 HB3 HIS 84 HB3 HIS 84 -21.752 6.783 -4.832 1417 HD1 HIS 84 HD1 HIS 84 -19.892 6.621 -7.738 1418 HD2 HIS 84 HD2 HIS 84 -20.096 9.453 -4.700 1419 HE1 HIS 84 HE1 HIS 84 -19.069 8.760 -8.756 1420 HE2 HIS 84 HE2 HIS 84 -19.423 10.493 -6.971 1421 H HIS 85 H HIS 85 -19.980 6.259 -1.179 1422 HA HIS 85 HA HIS 85 -21.148 3.657 -0.884 1423 HB2 HIS 85 HB2 HIS 85 -20.652 5.809 1.192 1424 HB3 HIS 85 HB3 HIS 85 -21.138 4.157 1.549 1425 HD1 HIS 85 HD1 HIS 85 -18.235 6.128 1.618 1426 HD2 HIS 85 HD2 HIS 85 -19.056 2.304 0.210 1427 HE1 HIS 85 HE1 HIS 85 -16.021 4.962 1.514 1428 HE2 HIS 85 HE2 HIS 85 -16.568 2.601 0.853 1429 H HIS 86 H HIS 86 -23.034 4.185 -2.249 1430 HA HIS 86 HA HIS 86 -25.240 5.272 -0.636 1431 HB2 HIS 86 HB2 HIS 86 -24.582 7.035 -2.170 1432 HB3 HIS 86 HB3 HIS 86 -24.659 5.925 -3.534 1433 HD1 HIS 86 HD1 HIS 86 -26.777 5.978 -4.809 1434 HD2 HIS 86 HD2 HIS 86 -27.278 7.391 -0.935 1435 HE1 HIS 86 HE1 HIS 86 -29.149 6.779 -4.687 1436 HE2 HIS 86 HE2 HIS 86 -29.485 7.414 -2.282 1437 H HIS 87 H HIS 87 -25.575 2.954 -0.262 1438 HA HIS 87 HA HIS 87 -27.393 1.896 -2.341 1439 HB2 HIS 87 HB2 HIS 87 -25.511 0.381 -0.522 1440 HB3 HIS 87 HB3 HIS 87 -26.881 -0.396 -1.306 1441 HD1 HIS 87 HD1 HIS 87 -26.276 -1.512 -3.424 1442 HD2 HIS 87 HD2 HIS 87 -23.806 1.736 -2.645 1443 HE1 HIS 87 HE1 HIS 87 -24.646 -1.436 -5.329 1444 HE2 HIS 87 HE2 HIS 87 -23.313 0.663 -4.945 1445 H HIS 88 H HIS 88 -27.653 3.666 0.072 1446 HA HIS 88 HA HIS 88 -30.142 2.840 1.059 1447 HB2 HIS 88 HB2 HIS 88 -29.064 1.125 2.324 1448 HB3 HIS 88 HB3 HIS 88 -27.773 2.207 2.828 1449 HD1 HIS 88 HD1 HIS 88 -31.573 2.500 3.177 1450 HD2 HIS 88 HD2 HIS 88 -28.104 2.620 5.469 1451 HE1 HIS 88 HE1 HIS 88 -32.324 3.017 5.511 1452 HE2 HIS 88 HE2 HIS 88 -30.228 2.964 6.903 Start of MODEL 5 1 H1 MET 1 H1 MET 1 7.438 -23.109 17.152 2 H2 MET 1 H2 MET 1 7.514 -23.677 15.562 3 H3 MET 1 H3 MET 1 6.525 -22.360 15.945 4 HA MET 1 HA MET 1 8.413 -21.007 16.478 5 HB2 MET 1 HB2 MET 1 9.884 -22.760 17.319 6 HB3 MET 1 HB3 MET 1 10.008 -23.466 15.713 7 HG2 MET 1 HG2 MET 1 11.171 -21.496 14.904 8 HG3 MET 1 HG3 MET 1 10.985 -20.718 16.475 9 HE1 MET 1 HE1 MET 1 12.754 -23.633 14.476 10 HE2 MET 1 HE2 MET 1 11.824 -24.492 15.703 11 HE3 MET 1 HE3 MET 1 13.586 -24.476 15.781 12 H THR 2 H THR 2 7.688 -19.740 14.833 13 HA THR 2 HA THR 2 9.025 -19.765 12.345 14 HB THR 2 HB THR 2 7.550 -21.645 11.776 15 HG1 THR 2 HG1 THR 2 6.452 -19.452 10.371 16 HG21 THR 2 HG21 THR 2 5.277 -19.728 12.343 17 HG22 THR 2 HG22 THR 2 5.682 -21.167 13.280 18 HG23 THR 2 HG23 THR 2 5.112 -21.328 11.618 19 H ASP 3 H ASP 3 7.998 -18.132 10.782 20 HA ASP 3 HA ASP 3 7.315 -15.756 12.211 21 HB2 ASP 3 HB2 ASP 3 7.129 -14.742 9.940 22 HB3 ASP 3 HB3 ASP 3 8.652 -15.581 10.210 23 H PHE 4 H PHE 4 5.345 -14.680 12.371 24 HA PHE 4 HA PHE 4 2.981 -16.228 11.535 25 HB2 PHE 4 HB2 PHE 4 1.821 -15.445 13.522 26 HB3 PHE 4 HB3 PHE 4 3.323 -16.232 13.986 27 HD1 PHE 4 HD1 PHE 4 1.549 -13.025 13.754 28 HD2 PHE 4 HD2 PHE 4 5.120 -14.980 15.028 29 HE1 PHE 4 HE1 PHE 4 2.181 -11.028 15.042 30 HE2 PHE 4 HE2 PHE 4 5.748 -12.982 16.320 31 HZ PHE 4 HZ PHE 4 4.285 -10.997 16.317 32 H LEU 5 H LEU 5 1.101 -15.058 10.952 33 HA LEU 5 HA LEU 5 1.648 -12.688 9.440 34 HB2 LEU 5 HB2 LEU 5 0.129 -14.336 8.572 35 HB3 LEU 5 HB3 LEU 5 -0.872 -14.229 10.003 36 HG LEU 5 HG LEU 5 -1.555 -11.945 9.374 37 HD11 LEU 5 HD11 LEU 5 0.434 -11.219 8.190 38 HD12 LEU 5 HD12 LEU 5 -0.979 -11.064 7.148 39 HD13 LEU 5 HD13 LEU 5 0.145 -12.406 6.917 40 HD21 LEU 5 HD21 LEU 5 -1.924 -13.981 7.175 41 HD22 LEU 5 HD22 LEU 5 -2.908 -12.538 7.417 42 HD23 LEU 5 HD23 LEU 5 -2.911 -13.818 8.628 43 H ALA 6 H ALA 6 1.998 -10.871 10.556 44 HA ALA 6 HA ALA 6 0.242 -10.140 12.794 45 HB1 ALA 6 HB1 ALA 6 2.665 -10.092 13.186 46 HB2 ALA 6 HB2 ALA 6 1.937 -8.495 13.366 47 HB3 ALA 6 HB3 ALA 6 2.845 -8.891 11.906 48 H GLY 7 H GLY 7 -0.568 -7.931 12.931 49 HA2 GLY 7 HA2 GLY 7 -0.885 -6.592 10.312 50 HA3 GLY 7 HA3 GLY 7 -2.249 -6.830 11.394 51 H ILE 8 H ILE 8 -0.900 -4.365 10.301 52 HA ILE 8 HA ILE 8 -0.598 -2.961 12.882 53 HB ILE 8 HB ILE 8 1.073 -2.329 10.430 54 HG12 ILE 8 HG12 ILE 8 1.942 -3.733 12.977 55 HG13 ILE 8 HG13 ILE 8 1.730 -4.515 11.416 56 HG21 ILE 8 HG21 ILE 8 2.328 -0.880 11.959 57 HG22 ILE 8 HG22 ILE 8 1.238 -1.319 13.274 58 HG23 ILE 8 HG23 ILE 8 0.627 -0.414 11.888 59 HD11 ILE 8 HD11 ILE 8 3.736 -2.364 12.058 60 HD12 ILE 8 HD12 ILE 8 3.517 -3.130 10.484 61 HD13 ILE 8 HD13 ILE 8 4.070 -4.084 11.860 62 H ARG 9 H ARG 9 -1.645 -0.987 12.991 63 HA ARG 9 HA ARG 9 -2.865 0.034 10.506 64 HB2 ARG 9 HB2 ARG 9 -4.484 -0.841 12.246 65 HB3 ARG 9 HB3 ARG 9 -3.957 0.471 13.296 66 HG2 ARG 9 HG2 ARG 9 -4.681 2.099 11.597 67 HG3 ARG 9 HG3 ARG 9 -5.247 0.771 10.584 68 HD2 ARG 9 HD2 ARG 9 -7.160 1.603 11.685 69 HD3 ARG 9 HD3 ARG 9 -6.742 0.111 12.526 70 HE ARG 9 HE ARG 9 -5.486 2.142 13.893 71 HH11 ARG 9 HH11 ARG 9 -8.728 1.375 13.068 72 HH12 ARG 9 HH12 ARG 9 -9.378 2.040 14.520 73 HH21 ARG 9 HH21 ARG 9 -6.324 2.999 15.767 74 HH22 ARG 9 HH22 ARG 9 -8.034 2.963 16.026 75 H ILE 10 H ILE 10 -2.250 1.985 9.875 76 HA ILE 10 HA ILE 10 -0.811 3.740 11.777 77 HB ILE 10 HB ILE 10 -0.645 3.779 8.752 78 HG12 ILE 10 HG12 ILE 10 1.347 2.485 10.634 79 HG13 ILE 10 HG13 ILE 10 0.111 1.584 9.759 80 HG21 ILE 10 HG21 ILE 10 1.443 5.026 9.150 81 HG22 ILE 10 HG22 ILE 10 1.127 4.977 10.885 82 HG23 ILE 10 HG23 ILE 10 0.032 5.852 9.814 83 HD11 ILE 10 HD11 ILE 10 1.075 2.350 7.640 84 HD12 ILE 10 HD12 ILE 10 2.229 1.444 8.618 85 HD13 ILE 10 HD13 ILE 10 2.334 3.203 8.534 86 H VAL 11 H VAL 11 -2.085 5.454 12.414 87 HA VAL 11 HA VAL 11 -3.887 6.621 10.378 88 HB VAL 11 HB VAL 11 -4.249 6.518 13.377 89 HG11 VAL 11 HG11 VAL 11 -6.320 7.789 13.050 90 HG12 VAL 11 HG12 VAL 11 -5.926 7.994 11.344 91 HG13 VAL 11 HG13 VAL 11 -4.908 8.734 12.578 92 HG21 VAL 11 HG21 VAL 11 -6.319 5.323 12.808 93 HG22 VAL 11 HG22 VAL 11 -4.901 4.487 12.173 94 HG23 VAL 11 HG23 VAL 11 -5.918 5.447 11.094 95 H GLY 12 H GLY 12 -3.147 8.409 9.570 96 HA2 GLY 12 HA2 GLY 12 -1.977 10.452 11.353 97 HA3 GLY 12 HA3 GLY 12 -1.146 10.001 9.871 98 H GLU 13 H GLU 13 -1.736 12.587 10.117 99 HA GLU 13 HA GLU 13 -4.321 13.347 9.226 100 HB2 GLU 13 HB2 GLU 13 -3.209 15.568 8.772 101 HB3 GLU 13 HB3 GLU 13 -3.040 14.949 10.412 102 HG2 GLU 13 HG2 GLU 13 -0.774 14.134 9.837 103 HG3 GLU 13 HG3 GLU 13 -0.949 14.848 8.235 104 H ASP 14 H ASP 14 -5.207 13.285 7.275 105 HA ASP 14 HA ASP 14 -3.905 12.275 4.982 106 HB2 ASP 14 HB2 ASP 14 -6.243 11.918 5.182 107 HB3 ASP 14 HB3 ASP 14 -6.564 13.630 5.425 108 H LYS 15 H LYS 15 -2.255 13.379 4.100 109 HA LYS 15 HA LYS 15 -2.774 16.118 3.159 110 HB2 LYS 15 HB2 LYS 15 -0.402 15.068 4.640 111 HB3 LYS 15 HB3 LYS 15 -0.167 16.347 3.455 112 HG2 LYS 15 HG2 LYS 15 -1.682 17.790 4.625 113 HG3 LYS 15 HG3 LYS 15 -2.093 16.502 5.764 114 HD2 LYS 15 HD2 LYS 15 0.189 16.485 6.611 115 HD3 LYS 15 HD3 LYS 15 0.663 17.705 5.424 116 HE2 LYS 15 HE2 LYS 15 -0.841 19.310 6.425 117 HE3 LYS 15 HE3 LYS 15 -1.426 18.095 7.560 118 HZ1 LYS 15 HZ1 LYS 15 1.370 19.090 7.433 119 HZ2 LYS 15 HZ2 LYS 15 0.751 17.991 8.557 120 HZ3 LYS 15 HZ3 LYS 15 0.210 19.591 8.556 121 H ASN 16 H ASN 16 -0.905 16.769 1.618 122 HA ASN 16 HA ASN 16 -1.329 15.157 -0.715 123 HB2 ASN 16 HB2 ASN 16 -0.149 17.041 -1.843 124 HB3 ASN 16 HB3 ASN 16 -1.500 17.549 -0.835 125 HD21 ASN 16 HD21 ASN 16 -1.104 18.706 1.051 126 HD22 ASN 16 HD22 ASN 16 0.435 19.408 1.389 127 H GLY 17 H GLY 17 0.141 13.578 0.901 128 HA2 GLY 17 HA2 GLY 17 2.202 12.592 -0.589 129 HA3 GLY 17 HA3 GLY 17 2.980 13.808 0.410 130 H MET 18 H MET 18 1.146 13.270 2.690 131 HA MET 18 HA MET 18 2.668 11.488 4.162 132 HB2 MET 18 HB2 MET 18 -0.193 12.406 4.431 133 HB3 MET 18 HB3 MET 18 0.507 11.290 5.595 134 HG2 MET 18 HG2 MET 18 1.669 13.988 4.946 135 HG3 MET 18 HG3 MET 18 0.556 13.681 6.281 136 HE1 MET 18 HE1 MET 18 1.058 11.879 8.179 137 HE2 MET 18 HE2 MET 18 2.614 11.075 8.388 138 HE3 MET 18 HE3 MET 18 1.588 10.664 7.015 139 H THR 19 H THR 19 -0.451 10.729 2.564 140 HA THR 19 HA THR 19 -0.543 8.009 3.254 141 HB THR 19 HB THR 19 -2.072 7.749 1.309 142 HG1 THR 19 HG1 THR 19 -2.531 9.757 0.143 143 HG21 THR 19 HG21 THR 19 -3.790 9.316 2.071 144 HG22 THR 19 HG22 THR 19 -2.568 10.259 2.923 145 HG23 THR 19 HG23 THR 19 -2.933 8.616 3.446 146 H ASN 20 H ASN 20 1.228 9.670 0.744 147 HA ASN 20 HA ASN 20 1.926 7.322 -0.760 148 HB2 ASN 20 HB2 ASN 20 3.137 10.103 -0.754 149 HB3 ASN 20 HB3 ASN 20 3.488 8.846 -1.938 150 HD21 ASN 20 HD21 ASN 20 2.052 8.461 -3.565 151 HD22 ASN 20 HD22 ASN 20 0.660 9.441 -3.855 152 H GLN 21 H GLN 21 3.628 9.424 1.556 153 HA GLN 21 HA GLN 21 6.086 8.052 1.409 154 HB2 GLN 21 HB2 GLN 21 6.817 9.393 3.225 155 HB3 GLN 21 HB3 GLN 21 5.778 10.398 2.240 156 HG2 GLN 21 HG2 GLN 21 3.983 10.191 3.828 157 HG3 GLN 21 HG3 GLN 21 4.901 9.018 4.770 158 HE21 GLN 21 HE21 GLN 21 4.663 12.383 3.857 159 HE22 GLN 21 HE22 GLN 21 5.673 12.980 5.123 160 H ILE 22 H ILE 22 3.288 7.676 3.497 161 HA ILE 22 HA ILE 22 4.435 6.083 5.500 162 HB ILE 22 HB ILE 22 1.628 6.495 4.527 163 HG12 ILE 22 HG12 ILE 22 2.647 8.251 5.873 164 HG13 ILE 22 HG13 ILE 22 1.372 7.465 6.796 165 HG21 ILE 22 HG21 ILE 22 2.420 4.580 6.723 166 HG22 ILE 22 HG22 ILE 22 1.644 4.163 5.194 167 HG23 ILE 22 HG23 ILE 22 0.776 5.128 6.388 168 HD11 ILE 22 HD11 ILE 22 3.300 7.898 8.188 169 HD12 ILE 22 HD12 ILE 22 4.326 6.979 7.088 170 HD13 ILE 22 HD13 ILE 22 3.057 6.162 7.999 171 H THR 23 H THR 23 2.491 4.984 2.678 172 HA THR 23 HA THR 23 3.138 2.240 3.182 173 HB THR 23 HB THR 23 2.122 3.296 0.531 174 HG1 THR 23 HG1 THR 23 0.358 3.863 1.559 175 HG21 THR 23 HG21 THR 23 2.803 0.938 0.592 176 HG22 THR 23 HG22 THR 23 1.055 1.088 0.410 177 HG23 THR 23 HG23 THR 23 1.745 0.665 1.976 178 H GLY 24 H GLY 24 4.531 4.821 1.289 179 HA2 GLY 24 HA2 GLY 24 6.412 3.444 -0.241 180 HA3 GLY 24 HA3 GLY 24 6.651 5.047 0.441 181 H VAL 25 H VAL 25 6.620 4.447 3.179 182 HA VAL 25 HA VAL 25 9.211 3.373 3.644 183 HB VAL 25 HB VAL 25 6.948 3.931 5.585 184 HG11 VAL 25 HG11 VAL 25 9.838 3.266 6.182 185 HG12 VAL 25 HG12 VAL 25 8.436 2.260 6.548 186 HG13 VAL 25 HG13 VAL 25 8.644 3.807 7.365 187 HG21 VAL 25 HG21 VAL 25 7.804 5.919 4.449 188 HG22 VAL 25 HG22 VAL 25 9.449 5.500 4.929 189 HG23 VAL 25 HG23 VAL 25 8.254 5.929 6.154 190 H ILE 26 H ILE 26 5.951 2.039 3.977 191 HA ILE 26 HA ILE 26 6.546 -0.396 5.198 192 HB ILE 26 HB ILE 26 4.378 0.284 3.203 193 HG12 ILE 26 HG12 ILE 26 4.350 0.042 6.229 194 HG13 ILE 26 HG13 ILE 26 4.302 1.547 5.316 195 HG21 ILE 26 HG21 ILE 26 4.640 -2.184 4.922 196 HG22 ILE 26 HG22 ILE 26 4.732 -2.117 3.162 197 HG23 ILE 26 HG23 ILE 26 3.217 -1.741 3.980 198 HD11 ILE 26 HD11 ILE 26 2.190 -0.598 5.312 199 HD12 ILE 26 HD12 ILE 26 2.140 0.899 4.378 200 HD13 ILE 26 HD13 ILE 26 2.106 0.957 6.140 201 H SER 27 H SER 27 6.588 0.422 1.727 202 HA SER 27 HA SER 27 7.128 -2.169 0.749 203 HB2 SER 27 HB2 SER 27 7.777 -1.136 -1.322 204 HB3 SER 27 HB3 SER 27 6.447 -0.190 -0.658 205 HG SER 27 HG SER 27 7.968 1.332 0.073 206 H LYS 28 H LYS 28 9.171 0.065 2.396 207 HA LYS 28 HA LYS 28 11.677 -0.953 1.387 208 HB2 LYS 28 HB2 LYS 28 11.211 0.758 3.839 209 HB3 LYS 28 HB3 LYS 28 12.715 0.569 2.946 210 HG2 LYS 28 HG2 LYS 28 11.666 1.664 0.996 211 HG3 LYS 28 HG3 LYS 28 10.195 1.893 1.944 212 HD2 LYS 28 HD2 LYS 28 11.482 3.940 1.948 213 HD3 LYS 28 HD3 LYS 28 11.483 3.243 3.569 214 HE2 LYS 28 HE2 LYS 28 13.700 4.080 2.938 215 HE3 LYS 28 HE3 LYS 28 13.720 2.335 3.192 216 HZ1 LYS 28 HZ1 LYS 28 13.665 1.997 0.823 217 HZ2 LYS 28 HZ2 LYS 28 14.950 3.024 1.203 218 HZ3 LYS 28 HZ3 LYS 28 13.531 3.657 0.538 219 H PHE 29 H PHE 29 9.472 -2.342 3.393 220 HA PHE 29 HA PHE 29 11.164 -3.218 5.535 221 HB2 PHE 29 HB2 PHE 29 8.411 -4.090 4.659 222 HB3 PHE 29 HB3 PHE 29 9.241 -4.781 6.050 223 HD1 PHE 29 HD2 PHE 29 10.433 -1.667 6.331 224 HD2 PHE 29 HD1 PHE 29 6.660 -3.646 6.481 225 HE1 PHE 29 HE2 PHE 29 9.547 0.131 7.755 226 HE2 PHE 29 HE1 PHE 29 5.776 -1.848 7.906 227 HZ PHE 29 HZ PHE 29 7.219 0.045 8.544 228 H ASP 30 H ASP 30 11.391 -5.519 6.084 229 HA ASP 30 HA ASP 30 12.841 -6.875 3.994 230 HB2 ASP 30 HB2 ASP 30 12.366 -8.187 6.637 231 HB3 ASP 30 HB3 ASP 30 13.856 -8.038 5.711 232 H THR 31 H THR 31 9.746 -7.178 5.528 233 HA THR 31 HA THR 31 9.334 -9.952 4.759 234 HB THR 31 HB THR 31 8.485 -9.247 6.915 235 HG1 THR 31 HG1 THR 31 6.767 -10.461 6.671 236 HG21 THR 31 HG21 THR 31 6.667 -7.614 7.131 237 HG22 THR 31 HG22 THR 31 6.739 -7.301 5.397 238 HG23 THR 31 HG23 THR 31 8.106 -6.876 6.426 239 H ASN 32 H ASN 32 7.118 -10.497 3.781 240 HA ASN 32 HA ASN 32 6.792 -8.881 1.348 241 HB2 ASN 32 HB2 ASN 32 7.336 -11.185 0.900 242 HB3 ASN 32 HB3 ASN 32 6.047 -11.749 1.959 243 HD21 ASN 32 HD21 ASN 32 6.720 -10.067 -1.040 244 HD22 ASN 32 HD22 ASN 32 5.211 -10.439 -1.792 245 H ILE 33 H ILE 33 4.869 -7.982 0.763 246 HA ILE 33 HA ILE 33 2.939 -7.586 2.872 247 HB ILE 33 HB ILE 33 2.989 -6.518 0.038 248 HG12 ILE 33 HG12 ILE 33 3.746 -5.230 2.681 249 HG13 ILE 33 HG13 ILE 33 4.866 -5.723 1.417 250 HG21 ILE 33 HG21 ILE 33 1.231 -5.726 2.368 251 HG22 ILE 33 HG22 ILE 33 0.710 -6.566 0.906 252 HG23 ILE 33 HG23 ILE 33 1.299 -4.907 0.807 253 HD11 ILE 33 HD11 ILE 33 3.887 -4.061 -0.087 254 HD12 ILE 33 HD12 ILE 33 4.513 -3.328 1.389 255 HD13 ILE 33 HD13 ILE 33 2.777 -3.565 1.192 256 H ARG 34 H ARG 34 1.645 -9.334 3.227 257 HA ARG 34 HA ARG 34 0.392 -10.832 1.118 258 HB2 ARG 34 HB2 ARG 34 -0.126 -10.685 4.097 259 HB3 ARG 34 HB3 ARG 34 -0.987 -11.774 3.017 260 HG2 ARG 34 HG2 ARG 34 1.991 -11.867 2.992 261 HG3 ARG 34 HG3 ARG 34 1.155 -12.532 4.394 262 HD2 ARG 34 HD2 ARG 34 1.556 -14.297 2.803 263 HD3 ARG 34 HD3 ARG 34 -0.172 -13.976 2.884 264 HE ARG 34 HE ARG 34 1.328 -12.695 0.735 265 HH11 ARG 34 HH11 ARG 34 -0.772 -15.249 1.721 266 HH12 ARG 34 HH12 ARG 34 -1.286 -15.600 0.110 267 HH21 ARG 34 HH21 ARG 34 0.714 -13.201 -1.333 268 HH22 ARG 34 HH22 ARG 34 -0.430 -14.469 -1.596 269 H THR 35 H THR 35 -0.515 -8.122 3.182 270 HA THR 35 HA THR 35 -2.578 -7.347 1.306 271 HB THR 35 HB THR 35 -3.383 -7.913 4.175 272 HG1 THR 35 HG1 THR 35 -3.612 -9.387 1.819 273 HG21 THR 35 HG21 THR 35 -5.639 -7.308 3.457 274 HG22 THR 35 HG22 THR 35 -5.041 -6.943 1.839 275 HG23 THR 35 HG23 THR 35 -4.527 -5.961 3.211 276 H ILE 36 H ILE 36 -2.649 -5.161 1.154 277 HA ILE 36 HA ILE 36 -2.106 -3.553 3.564 278 HB ILE 36 HB ILE 36 -0.049 -3.478 2.193 279 HG12 ILE 36 HG12 ILE 36 0.095 -0.981 1.940 280 HG13 ILE 36 HG13 ILE 36 -1.633 -0.895 2.264 281 HG21 ILE 36 HG21 ILE 36 -1.825 -2.324 0.050 282 HG22 ILE 36 HG22 ILE 36 -0.957 -3.859 -0.012 283 HG23 ILE 36 HG23 ILE 36 -0.061 -2.337 0.004 284 HD11 ILE 36 HD11 ILE 36 -1.281 -1.819 4.475 285 HD12 ILE 36 HD12 ILE 36 -0.296 -0.377 4.229 286 HD13 ILE 36 HD13 ILE 36 0.446 -1.974 4.149 287 H VAL 37 H VAL 37 -3.706 -2.121 3.951 288 HA VAL 37 HA VAL 37 -5.332 -1.149 1.686 289 HB VAL 37 HB VAL 37 -6.478 -2.148 4.308 290 HG11 VAL 37 HG11 VAL 37 -7.868 -1.017 1.873 291 HG12 VAL 37 HG12 VAL 37 -7.731 -0.242 3.450 292 HG13 VAL 37 HG13 VAL 37 -8.672 -1.722 3.276 293 HG21 VAL 37 HG21 VAL 37 -7.542 -3.903 2.970 294 HG22 VAL 37 HG22 VAL 37 -5.784 -3.990 2.860 295 HG23 VAL 37 HG23 VAL 37 -6.717 -3.307 1.528 296 H LEU 38 H LEU 38 -4.761 0.968 1.695 297 HA LEU 38 HA LEU 38 -4.933 2.472 4.235 298 HB2 LEU 38 HB2 LEU 38 -2.777 2.594 3.001 299 HB3 LEU 38 HB3 LEU 38 -3.616 3.262 1.619 300 HG LEU 38 HG LEU 38 -3.610 4.678 4.291 301 HD11 LEU 38 HD11 LEU 38 -1.727 6.023 3.480 302 HD12 LEU 38 HD12 LEU 38 -1.590 4.980 2.063 303 HD13 LEU 38 HD13 LEU 38 -1.280 4.328 3.673 304 HD21 LEU 38 HD21 LEU 38 -5.261 5.457 2.660 305 HD22 LEU 38 HD22 LEU 38 -3.990 5.670 1.457 306 HD23 LEU 38 HD23 LEU 38 -4.006 6.669 2.912 307 H ASN 39 H ASN 39 -6.717 3.693 4.536 308 HA ASN 39 HA ASN 39 -7.973 4.897 2.156 309 HB2 ASN 39 HB2 ASN 39 -10.199 4.505 3.015 310 HB3 ASN 39 HB3 ASN 39 -9.344 2.971 2.917 311 HD21 ASN 39 HD21 ASN 39 -8.683 1.970 4.869 312 HD22 ASN 39 HD22 ASN 39 -9.432 2.379 6.369 313 H ALA 40 H ALA 40 -8.076 7.023 2.261 314 HA ALA 40 HA ALA 40 -7.847 8.412 4.847 315 HB1 ALA 40 HB1 ALA 40 -7.652 9.497 2.024 316 HB2 ALA 40 HB2 ALA 40 -6.288 9.047 3.048 317 HB3 ALA 40 HB3 ALA 40 -7.332 10.393 3.511 318 H LYS 41 H LYS 41 -9.636 9.052 5.796 319 HA LYS 41 HA LYS 41 -11.889 10.081 4.250 320 HB2 LYS 41 HB2 LYS 41 -13.514 8.671 5.308 321 HB3 LYS 41 HB3 LYS 41 -12.271 7.629 4.635 322 HG2 LYS 41 HG2 LYS 41 -12.514 8.416 7.537 323 HG3 LYS 41 HG3 LYS 41 -13.020 6.877 6.841 324 HD2 LYS 41 HD2 LYS 41 -10.618 6.556 6.104 325 HD3 LYS 41 HD3 LYS 41 -10.213 7.968 7.082 326 HE2 LYS 41 HE2 LYS 41 -9.766 6.003 8.378 327 HE3 LYS 41 HE3 LYS 41 -11.189 6.791 9.059 328 HZ1 LYS 41 HZ1 LYS 41 -12.573 5.204 7.838 329 HZ2 LYS 41 HZ2 LYS 41 -11.528 4.423 8.911 330 HZ3 LYS 41 HZ3 LYS 41 -11.185 4.431 7.255 331 H ASP 42 H ASP 42 -13.176 11.567 5.364 332 HA ASP 42 HA ASP 42 -13.765 13.129 6.910 333 HB2 ASP 42 HB2 ASP 42 -13.997 11.057 8.346 334 HB3 ASP 42 HB3 ASP 42 -12.389 11.391 8.975 335 H GLY 43 H GLY 43 -10.751 12.754 5.863 336 HA2 GLY 43 HA2 GLY 43 -9.229 14.607 5.743 337 HA3 GLY 43 HA3 GLY 43 -9.751 15.104 7.344 338 H ILE 44 H ILE 44 -9.405 11.865 7.584 339 HA ILE 44 HA ILE 44 -6.510 11.967 8.221 340 HB ILE 44 HB ILE 44 -8.417 10.129 9.668 341 HG12 ILE 44 HG12 ILE 44 -7.757 12.976 10.466 342 HG13 ILE 44 HG13 ILE 44 -9.335 12.371 9.962 343 HG21 ILE 44 HG21 ILE 44 -6.019 9.705 9.887 344 HG22 ILE 44 HG22 ILE 44 -6.709 10.221 11.425 345 HG23 ILE 44 HG23 ILE 44 -5.769 11.356 10.457 346 HD11 ILE 44 HD11 ILE 44 -7.825 11.552 12.436 347 HD12 ILE 44 HD12 ILE 44 -9.394 10.919 11.933 348 HD13 ILE 44 HD13 ILE 44 -9.227 12.621 12.369 349 H PHE 45 H PHE 45 -5.476 9.731 8.121 350 HA PHE 45 HA PHE 45 -6.967 7.902 6.346 351 HB2 PHE 45 HB2 PHE 45 -5.094 7.510 4.930 352 HB3 PHE 45 HB3 PHE 45 -5.261 9.257 5.056 353 HD1 PHE 45 HD1 PHE 45 -3.228 6.346 5.977 354 HD2 PHE 45 HD2 PHE 45 -3.562 10.591 6.162 355 HE1 PHE 45 HE1 PHE 45 -0.876 6.496 6.671 356 HE2 PHE 45 HE2 PHE 45 -1.206 10.743 6.859 357 HZ PHE 45 HZ PHE 45 0.132 8.695 7.115 358 H THR 46 H THR 46 -6.735 5.737 6.736 359 HA THR 46 HA THR 46 -4.766 4.946 8.792 360 HB THR 46 HB THR 46 -6.863 4.603 9.829 361 HG1 THR 46 HG1 THR 46 -6.242 2.045 8.738 362 HG21 THR 46 HG21 THR 46 -8.333 4.747 7.890 363 HG22 THR 46 HG22 THR 46 -8.689 3.305 8.842 364 HG23 THR 46 HG23 THR 46 -7.779 3.166 7.338 365 H CYS 47 H CYS 47 -3.145 3.904 7.879 366 HA CYS 47 HA CYS 47 -3.569 2.190 5.545 367 HB2 CYS 47 HB2 CYS 47 -1.650 3.759 5.573 368 HB3 CYS 47 HB3 CYS 47 -0.997 2.919 6.974 369 HG CYS 47 HG CYS 47 -0.237 2.373 3.947 370 H ASN 48 H ASN 48 -4.030 0.102 5.821 371 HA ASN 48 HA ASN 48 -3.366 -1.224 8.361 372 HB2 ASN 48 HB2 ASN 48 -5.363 -1.942 6.195 373 HB3 ASN 48 HB3 ASN 48 -5.035 -2.945 7.605 374 HD21 ASN 48 HD21 ASN 48 -7.129 -2.783 8.340 375 HD22 ASN 48 HD22 ASN 48 -7.765 -1.334 9.024 376 H LEU 49 H LEU 49 -1.431 -2.209 8.261 377 HA LEU 49 HA LEU 49 -0.582 -3.536 5.786 378 HB2 LEU 49 HB2 LEU 49 0.994 -1.970 6.756 379 HB3 LEU 49 HB3 LEU 49 0.940 -2.811 8.295 380 HG LEU 49 HG LEU 49 1.986 -4.788 7.248 381 HD11 LEU 49 HD11 LEU 49 2.118 -3.051 4.782 382 HD12 LEU 49 HD12 LEU 49 1.190 -4.538 4.978 383 HD13 LEU 49 HD13 LEU 49 2.952 -4.592 4.988 384 HD21 LEU 49 HD21 LEU 49 3.395 -3.125 8.342 385 HD22 LEU 49 HD22 LEU 49 3.519 -2.216 6.836 386 HD23 LEU 49 HD23 LEU 49 4.222 -3.830 6.954 387 H MET 50 H MET 50 -0.610 -5.674 5.569 388 HA MET 50 HA MET 50 -0.658 -7.381 7.981 389 HB2 MET 50 HB2 MET 50 -1.992 -7.906 5.316 390 HB3 MET 50 HB3 MET 50 -1.953 -9.029 6.669 391 HG2 MET 50 HG2 MET 50 -3.309 -6.344 6.582 392 HG3 MET 50 HG3 MET 50 -4.079 -7.928 6.602 393 HE1 MET 50 HE1 MET 50 -3.616 -9.672 8.695 394 HE2 MET 50 HE2 MET 50 -2.887 -9.155 10.214 395 HE3 MET 50 HE3 MET 50 -1.898 -9.270 8.759 396 H ILE 51 H ILE 51 1.303 -8.241 8.182 397 HA ILE 51 HA ILE 51 2.580 -9.527 5.876 398 HB ILE 51 HB ILE 51 4.811 -8.503 6.644 399 HG12 ILE 51 HG12 ILE 51 4.342 -6.054 7.498 400 HG13 ILE 51 HG13 ILE 51 2.844 -6.751 8.105 401 HG21 ILE 51 HG21 ILE 51 4.530 -6.546 5.211 402 HG22 ILE 51 HG22 ILE 51 2.778 -6.741 5.282 403 HG23 ILE 51 HG23 ILE 51 3.772 -7.979 4.515 404 HD11 ILE 51 HD11 ILE 51 4.552 -6.672 9.821 405 HD12 ILE 51 HD12 ILE 51 5.630 -7.643 8.819 406 HD13 ILE 51 HD13 ILE 51 4.131 -8.341 9.435 407 H PHE 52 H PHE 52 4.502 -10.851 6.530 408 HA PHE 52 HA PHE 52 3.919 -12.232 9.039 409 HB2 PHE 52 HB2 PHE 52 5.506 -12.938 6.586 410 HB3 PHE 52 HB3 PHE 52 5.746 -13.832 8.083 411 HD1 PHE 52 HD2 PHE 52 3.931 -15.150 9.048 412 HD2 PHE 52 HD1 PHE 52 3.499 -13.223 5.275 413 HE1 PHE 52 HE2 PHE 52 1.980 -16.567 8.549 414 HE2 PHE 52 HE1 PHE 52 1.551 -14.636 4.774 415 HZ PHE 52 HZ PHE 52 0.787 -16.311 6.408 416 H VAL 53 H VAL 53 5.221 -12.278 10.784 417 HA VAL 53 HA VAL 53 7.851 -10.926 10.618 418 HB VAL 53 HB VAL 53 7.543 -10.013 12.855 419 HG11 VAL 53 HG11 VAL 53 5.184 -9.357 11.090 420 HG12 VAL 53 HG12 VAL 53 6.789 -8.625 10.996 421 HG13 VAL 53 HG13 VAL 53 5.783 -8.372 12.426 422 HG21 VAL 53 HG21 VAL 53 4.798 -11.257 12.759 423 HG22 VAL 53 HG22 VAL 53 5.390 -10.166 14.012 424 HG23 VAL 53 HG23 VAL 53 6.135 -11.749 13.799 425 H LYS 54 H LYS 54 9.530 -11.843 11.721 426 HA LYS 54 HA LYS 54 9.474 -14.592 12.309 427 HB2 LYS 54 HB2 LYS 54 11.776 -14.233 13.156 428 HB3 LYS 54 HB3 LYS 54 11.500 -13.497 11.583 429 HG2 LYS 54 HG2 LYS 54 11.115 -11.317 12.776 430 HG3 LYS 54 HG3 LYS 54 11.667 -12.110 14.253 431 HD2 LYS 54 HD2 LYS 54 13.255 -11.793 11.699 432 HD3 LYS 54 HD3 LYS 54 13.480 -10.859 13.179 433 HE2 LYS 54 HE2 LYS 54 14.074 -12.923 14.377 434 HE3 LYS 54 HE3 LYS 54 13.867 -13.842 12.885 435 HZ1 LYS 54 HZ1 LYS 54 16.185 -13.343 13.282 436 HZ2 LYS 54 HZ2 LYS 54 15.859 -11.688 13.337 437 HZ3 LYS 54 HZ3 LYS 54 15.656 -12.538 11.890 438 H ASN 55 H ASN 55 8.962 -11.810 14.366 439 HA ASN 55 HA ASN 55 7.959 -13.414 16.500 440 HB2 ASN 55 HB2 ASN 55 9.630 -12.657 18.226 441 HB3 ASN 55 HB3 ASN 55 10.274 -13.795 17.046 442 HD21 ASN 55 HD21 ASN 55 12.399 -13.072 17.438 443 HD22 ASN 55 HD22 ASN 55 12.956 -11.549 16.840 444 H THR 56 H THR 56 7.615 -11.931 18.542 445 HA THR 56 HA THR 56 5.980 -9.755 17.782 446 HB THR 56 HB THR 56 5.842 -9.251 20.211 447 HG1 THR 56 HG1 THR 56 7.193 -10.190 21.623 448 HG21 THR 56 HG21 THR 56 4.864 -11.408 20.903 449 HG22 THR 56 HG22 THR 56 5.638 -12.194 19.525 450 HG23 THR 56 HG23 THR 56 4.389 -10.977 19.259 451 H ASP 57 H ASP 57 9.306 -9.910 18.898 452 HA ASP 57 HA ASP 57 9.758 -7.197 19.489 453 HB2 ASP 57 HB2 ASP 57 11.291 -9.023 20.124 454 HB3 ASP 57 HB3 ASP 57 11.687 -9.291 18.430 455 H LYS 58 H LYS 58 10.114 -9.041 16.528 456 HA LYS 58 HA LYS 58 11.060 -7.057 14.806 457 HB2 LYS 58 HB2 LYS 58 11.177 -9.330 14.128 458 HB3 LYS 58 HB3 LYS 58 9.463 -9.586 14.415 459 HG2 LYS 58 HG2 LYS 58 9.976 -9.526 12.041 460 HG3 LYS 58 HG3 LYS 58 8.910 -8.205 12.522 461 HD2 LYS 58 HD2 LYS 58 10.823 -6.665 12.550 462 HD3 LYS 58 HD3 LYS 58 11.902 -7.987 12.104 463 HE2 LYS 58 HE2 LYS 58 10.698 -8.239 9.978 464 HE3 LYS 58 HE3 LYS 58 9.629 -6.909 10.431 465 HZ1 LYS 58 HZ1 LYS 58 11.552 -5.442 10.491 466 HZ2 LYS 58 HZ2 LYS 58 11.395 -6.159 8.971 467 HZ3 LYS 58 HZ3 LYS 58 12.567 -6.717 10.048 468 H LEU 59 H LEU 59 7.752 -8.023 15.641 469 HA LEU 59 HA LEU 59 6.393 -6.300 13.874 470 HB2 LEU 59 HB2 LEU 59 5.319 -8.201 14.967 471 HB3 LEU 59 HB3 LEU 59 5.515 -7.437 16.534 472 HG LEU 59 HG LEU 59 3.965 -5.652 15.876 473 HD11 LEU 59 HD11 LEU 59 2.678 -5.827 13.791 474 HD12 LEU 59 HD12 LEU 59 3.694 -7.178 13.285 475 HD13 LEU 59 HD13 LEU 59 4.397 -5.574 13.491 476 HD21 LEU 59 HD21 LEU 59 2.839 -8.416 15.405 477 HD22 LEU 59 HD22 LEU 59 1.918 -6.978 15.847 478 HD23 LEU 59 HD23 LEU 59 3.089 -7.653 16.977 479 H THR 60 H THR 60 7.286 -5.845 17.310 480 HA THR 60 HA THR 60 6.184 -3.257 17.588 481 HB THR 60 HB THR 60 7.599 -2.979 19.557 482 HG1 THR 60 HG1 THR 60 9.562 -3.802 19.001 483 HG21 THR 60 HG21 THR 60 5.622 -4.434 19.766 484 HG22 THR 60 HG22 THR 60 6.925 -4.953 20.834 485 HG23 THR 60 HG23 THR 60 6.609 -5.831 19.337 486 H THR 61 H THR 61 9.223 -4.371 16.252 487 HA THR 61 HA THR 61 10.571 -1.875 16.218 488 HB THR 61 HB THR 61 10.971 -4.235 14.355 489 HG1 THR 61 HG1 THR 61 11.292 -4.304 16.858 490 HG21 THR 61 HG21 THR 61 12.823 -1.934 15.020 491 HG22 THR 61 HG22 THR 61 11.981 -2.162 13.487 492 HG23 THR 61 HG23 THR 61 13.217 -3.315 13.997 493 H LEU 62 H LEU 62 8.512 -3.512 13.824 494 HA LEU 62 HA LEU 62 8.789 -1.609 11.762 495 HB2 LEU 62 HB2 LEU 62 6.439 -3.398 12.405 496 HB3 LEU 62 HB3 LEU 62 6.647 -2.517 10.901 497 HG LEU 62 HG LEU 62 8.418 -4.745 11.924 498 HD11 LEU 62 HD11 LEU 62 7.581 -5.995 10.016 499 HD12 LEU 62 HD12 LEU 62 6.557 -4.636 9.552 500 HD13 LEU 62 HD13 LEU 62 6.251 -5.497 11.061 501 HD21 LEU 62 HD21 LEU 62 9.741 -3.075 10.732 502 HD22 LEU 62 HD22 LEU 62 8.623 -3.144 9.369 503 HD23 LEU 62 HD23 LEU 62 9.596 -4.556 9.786 504 H MET 63 H MET 63 6.585 -1.757 14.526 505 HA MET 63 HA MET 63 4.948 0.435 13.935 506 HB2 MET 63 HB2 MET 63 5.941 -0.402 16.668 507 HB3 MET 63 HB3 MET 63 4.521 0.580 16.337 508 HG2 MET 63 HG2 MET 63 3.458 -1.306 15.229 509 HG3 MET 63 HG3 MET 63 4.895 -2.291 15.509 510 HE1 MET 63 HE1 MET 63 2.158 -3.443 16.397 511 HE2 MET 63 HE2 MET 63 2.546 -4.005 18.023 512 HE3 MET 63 HE3 MET 63 3.720 -4.203 16.720 513 H ASP 64 H ASP 64 8.091 0.319 15.588 514 HA ASP 64 HA ASP 64 8.278 3.059 16.229 515 HB2 ASP 64 HB2 ASP 64 9.685 1.238 17.200 516 HB3 ASP 64 HB3 ASP 64 10.535 1.123 15.664 517 H LYS 65 H LYS 65 9.449 1.219 13.408 518 HA LYS 65 HA LYS 65 10.655 3.275 11.962 519 HB2 LYS 65 HB2 LYS 65 9.208 0.774 11.112 520 HB3 LYS 65 HB3 LYS 65 9.853 1.884 9.915 521 HG2 LYS 65 HG2 LYS 65 12.101 1.598 10.913 522 HG3 LYS 65 HG3 LYS 65 11.421 0.402 12.019 523 HD2 LYS 65 HD2 LYS 65 10.930 -1.102 10.266 524 HD3 LYS 65 HD3 LYS 65 11.128 0.140 9.030 525 HE2 LYS 65 HE2 LYS 65 13.018 -1.372 8.999 526 HE3 LYS 65 HE3 LYS 65 13.535 0.230 9.526 527 HZ1 LYS 65 HZ1 LYS 65 12.969 -2.057 11.336 528 HZ2 LYS 65 HZ2 LYS 65 13.552 -0.534 11.795 529 HZ3 LYS 65 HZ3 LYS 65 14.510 -1.556 10.850 530 H LEU 66 H LEU 66 7.263 2.227 11.903 531 HA LEU 66 HA LEU 66 6.411 4.171 9.995 532 HB2 LEU 66 HB2 LEU 66 4.808 2.550 11.982 533 HB3 LEU 66 HB3 LEU 66 4.147 3.413 10.601 534 HG LEU 66 HG LEU 66 6.151 1.159 10.360 535 HD11 LEU 66 HD11 LEU 66 4.119 0.287 11.357 536 HD12 LEU 66 HD12 LEU 66 4.270 -0.257 9.687 537 HD13 LEU 66 HD13 LEU 66 3.148 1.043 10.092 538 HD21 LEU 66 HD21 LEU 66 6.125 2.693 8.463 539 HD22 LEU 66 HD22 LEU 66 4.380 2.494 8.308 540 HD23 LEU 66 HD23 LEU 66 5.453 1.126 8.013 541 H ARG 67 H ARG 67 6.769 4.191 13.456 542 HA ARG 67 HA ARG 67 5.091 6.491 13.894 543 HB2 ARG 67 HB2 ARG 67 5.491 4.674 15.587 544 HB3 ARG 67 HB3 ARG 67 7.125 5.297 15.788 545 HG2 ARG 67 HG2 ARG 67 6.259 7.415 16.581 546 HG3 ARG 67 HG3 ARG 67 4.605 6.886 16.272 547 HD2 ARG 67 HD2 ARG 67 6.522 5.665 18.260 548 HD3 ARG 67 HD3 ARG 67 5.165 6.720 18.647 549 HE ARG 67 HE ARG 67 5.023 3.932 17.776 550 HH11 ARG 67 HH11 ARG 67 3.342 6.811 18.666 551 HH12 ARG 67 HH12 ARG 67 1.885 5.965 19.050 552 HH21 ARG 67 HH21 ARG 67 3.141 2.865 18.272 553 HH22 ARG 67 HH22 ARG 67 1.773 3.761 18.838 554 H LYS 68 H LYS 68 8.169 6.146 12.613 555 HA LYS 68 HA LYS 68 9.479 8.435 13.706 556 HB2 LYS 68 HB2 LYS 68 9.910 7.005 11.069 557 HB3 LYS 68 HB3 LYS 68 10.985 8.229 11.731 558 HG2 LYS 68 HG2 LYS 68 10.360 5.593 13.052 559 HG3 LYS 68 HG3 LYS 68 11.783 5.915 12.062 560 HD2 LYS 68 HD2 LYS 68 12.410 7.728 13.659 561 HD3 LYS 68 HD3 LYS 68 11.051 7.243 14.678 562 HE2 LYS 68 HE2 LYS 68 12.021 5.025 14.952 563 HE3 LYS 68 HE3 LYS 68 13.349 5.454 13.876 564 HZ1 LYS 68 HZ1 LYS 68 13.996 7.177 15.481 565 HZ2 LYS 68 HZ2 LYS 68 14.052 5.624 16.147 566 HZ3 LYS 68 HZ3 LYS 68 12.772 6.658 16.527 567 H VAL 69 H VAL 69 6.792 8.240 11.722 568 HA VAL 69 HA VAL 69 7.377 10.657 10.184 569 HB VAL 69 HB VAL 69 4.922 8.884 10.139 570 HG11 VAL 69 HG11 VAL 69 4.435 11.155 9.389 571 HG12 VAL 69 HG12 VAL 69 4.396 10.032 8.030 572 HG13 VAL 69 HG13 VAL 69 5.789 11.089 8.259 573 HG21 VAL 69 HG21 VAL 69 7.293 8.983 8.266 574 HG22 VAL 69 HG22 VAL 69 5.842 8.009 8.035 575 HG23 VAL 69 HG23 VAL 69 6.913 7.685 9.399 576 H GLN 70 H GLN 70 6.937 12.581 11.023 577 HA GLN 70 HA GLN 70 5.705 13.027 13.488 578 HB2 GLN 70 HB2 GLN 70 5.787 15.419 12.908 579 HB3 GLN 70 HB3 GLN 70 7.287 14.596 12.496 580 HG2 GLN 70 HG2 GLN 70 6.596 14.501 10.151 581 HG3 GLN 70 HG3 GLN 70 5.089 15.318 10.559 582 HE21 GLN 70 HE21 GLN 70 5.545 17.024 9.175 583 HE22 GLN 70 HE22 GLN 70 6.738 18.216 9.548 584 H GLY 71 H GLY 71 4.272 12.915 10.291 585 HA2 GLY 71 HA2 GLY 71 1.847 14.276 11.006 586 HA3 GLY 71 HA3 GLY 71 2.137 13.368 9.535 587 H VAL 72 H VAL 72 2.921 11.123 11.696 588 HA VAL 72 HA VAL 72 0.174 10.066 11.811 589 HB VAL 72 HB VAL 72 2.806 8.612 12.162 590 HG11 VAL 72 HG11 VAL 72 1.452 6.557 12.111 591 HG12 VAL 72 HG12 VAL 72 -0.021 7.526 12.060 592 HG13 VAL 72 HG13 VAL 72 1.016 7.575 13.485 593 HG21 VAL 72 HG21 VAL 72 0.829 8.605 9.872 594 HG22 VAL 72 HG22 VAL 72 2.265 7.587 9.994 595 HG23 VAL 72 HG23 VAL 72 2.435 9.337 9.862 596 H PHE 73 H PHE 73 -0.882 9.850 13.670 597 HA PHE 73 HA PHE 73 0.595 10.367 16.161 598 HB2 PHE 73 HB2 PHE 73 -2.005 10.697 16.895 599 HB3 PHE 73 HB3 PHE 73 -0.953 11.983 16.331 600 HD1 PHE 73 HD2 PHE 73 -1.132 12.839 14.043 601 HD2 PHE 73 HD1 PHE 73 -3.863 9.939 15.557 602 HE1 PHE 73 HE2 PHE 73 -2.685 13.354 12.213 603 HE2 PHE 73 HE1 PHE 73 -5.423 10.457 13.725 604 HZ PHE 73 HZ PHE 73 -4.831 12.169 12.049 605 H THR 74 H THR 74 -1.266 7.923 14.541 606 HA THR 74 HA THR 74 -1.045 6.271 16.988 607 HB THR 74 HB THR 74 -3.089 5.261 16.730 608 HG1 THR 74 HG1 THR 74 -3.823 4.647 14.851 609 HG21 THR 74 HG21 THR 74 -3.606 7.961 15.475 610 HG22 THR 74 HG22 THR 74 -3.492 7.639 17.206 611 HG23 THR 74 HG23 THR 74 -4.808 6.937 16.264 612 H VAL 75 H VAL 75 0.262 4.618 16.774 613 HA VAL 75 HA VAL 75 0.267 3.094 14.250 614 HB VAL 75 HB VAL 75 2.750 3.516 15.940 615 HG11 VAL 75 HG11 VAL 75 2.366 2.256 13.219 616 HG12 VAL 75 HG12 VAL 75 2.708 1.403 14.725 617 HG13 VAL 75 HG13 VAL 75 3.913 2.490 14.035 618 HG21 VAL 75 HG21 VAL 75 2.164 5.634 14.884 619 HG22 VAL 75 HG22 VAL 75 2.018 4.837 13.317 620 HG23 VAL 75 HG23 VAL 75 3.589 4.941 14.111 621 H GLU 76 H GLU 76 -0.738 1.239 14.790 622 HA GLU 76 HA GLU 76 -0.164 -0.022 17.399 623 HB2 GLU 76 HB2 GLU 76 -2.673 -0.344 17.654 624 HB3 GLU 76 HB3 GLU 76 -2.095 1.307 17.848 625 HG2 GLU 76 HG2 GLU 76 -2.724 1.725 15.462 626 HG3 GLU 76 HG3 GLU 76 -3.463 0.125 15.433 627 H ARG 77 H ARG 77 -0.914 -2.270 17.570 628 HA ARG 77 HA ARG 77 -0.707 -3.693 15.049 629 HB2 ARG 77 HB2 ARG 77 0.456 -4.709 16.891 630 HB3 ARG 77 HB3 ARG 77 -0.988 -4.668 17.903 631 HG2 ARG 77 HG2 ARG 77 -2.074 -6.221 16.243 632 HG3 ARG 77 HG3 ARG 77 -0.501 -6.381 15.466 633 HD2 ARG 77 HD2 ARG 77 0.421 -7.481 17.332 634 HD3 ARG 77 HD3 ARG 77 -0.905 -6.984 18.390 635 HE ARG 77 HE ARG 77 -1.892 -8.543 16.246 636 HH11 ARG 77 HH11 ARG 77 -0.052 -8.924 19.137 637 HH12 ARG 77 HH12 ARG 77 -0.696 -10.497 19.460 638 HH21 ARG 77 HH21 ARG 77 -2.671 -10.570 16.656 639 HH22 ARG 77 HH22 ARG 77 -2.147 -11.427 18.059 640 H LEU 78 H LEU 78 -2.333 -4.573 13.908 641 HA LEU 78 HA LEU 78 -5.071 -4.426 14.824 642 HB2 LEU 78 HB2 LEU 78 -3.819 -5.603 12.335 643 HB3 LEU 78 HB3 LEU 78 -5.545 -5.608 12.647 644 HG LEU 78 HG LEU 78 -3.855 -3.110 12.406 645 HD11 LEU 78 HD11 LEU 78 -5.752 -4.338 10.403 646 HD12 LEU 78 HD12 LEU 78 -3.993 -4.304 10.274 647 HD13 LEU 78 HD13 LEU 78 -4.907 -2.798 10.236 648 HD21 LEU 78 HD21 LEU 78 -6.849 -3.491 12.583 649 HD22 LEU 78 HD22 LEU 78 -6.023 -1.959 12.296 650 HD23 LEU 78 HD23 LEU 78 -5.807 -2.801 13.829 651 H SER 79 H SER 79 -5.353 -5.773 16.554 652 HA SER 79 HA SER 79 -4.372 -8.472 16.632 653 HB2 SER 79 HB2 SER 79 -5.719 -8.663 18.703 654 HB3 SER 79 HB3 SER 79 -4.723 -7.208 18.706 655 HG SER 79 HG SER 79 -6.497 -6.142 18.994 656 H ASN 80 H ASN 80 -7.700 -7.193 16.593 657 HA ASN 80 HA ASN 80 -8.880 -9.663 15.854 658 HB2 ASN 80 HB2 ASN 80 -10.123 -7.900 17.026 659 HB3 ASN 80 HB3 ASN 80 -9.972 -6.847 15.623 660 HD21 ASN 80 HD21 ASN 80 -12.206 -6.688 15.428 661 HD22 ASN 80 HD22 ASN 80 -13.167 -7.988 14.824 662 H LEU 81 H LEU 81 -8.347 -10.616 13.984 663 HA LEU 81 HA LEU 81 -8.221 -8.999 11.517 664 HB2 LEU 81 HB2 LEU 81 -6.990 -11.692 12.129 665 HB3 LEU 81 HB3 LEU 81 -6.870 -10.858 10.595 666 HG LEU 81 HG LEU 81 -5.690 -9.954 13.226 667 HD11 LEU 81 HD11 LEU 81 -4.369 -10.876 10.665 668 HD12 LEU 81 HD12 LEU 81 -4.484 -11.802 12.165 669 HD13 LEU 81 HD13 LEU 81 -3.541 -10.312 12.120 670 HD21 LEU 81 HD21 LEU 81 -4.686 -8.111 11.943 671 HD22 LEU 81 HD22 LEU 81 -6.445 -8.018 11.958 672 HD23 LEU 81 HD23 LEU 81 -5.608 -8.604 10.521 673 H GLU 82 H GLU 82 -9.157 -9.805 9.601 674 HA GLU 82 HA GLU 82 -11.427 -11.614 10.025 675 HB2 GLU 82 HB2 GLU 82 -11.907 -10.748 7.558 676 HB3 GLU 82 HB3 GLU 82 -12.361 -9.827 8.982 677 HG2 GLU 82 HG2 GLU 82 -11.303 -8.512 7.170 678 HG3 GLU 82 HG3 GLU 82 -10.528 -8.354 8.734 679 H HIS 83 H HIS 83 -8.399 -12.179 9.346 680 HA HIS 83 HA HIS 83 -8.480 -13.481 6.806 681 HB2 HIS 83 HB2 HIS 83 -6.445 -13.654 9.040 682 HB3 HIS 83 HB3 HIS 83 -6.219 -14.319 7.426 683 HD1 HIS 83 HD1 HIS 83 -5.046 -12.803 5.844 684 HD2 HIS 83 HD2 HIS 83 -6.941 -10.707 8.874 685 HE1 HIS 83 HE1 HIS 83 -4.358 -10.409 5.539 686 HE2 HIS 83 HE2 HIS 83 -5.771 -9.153 7.198 687 H HIS 84 H HIS 84 -9.910 -15.150 6.658 688 HA HIS 84 HA HIS 84 -10.326 -17.094 8.711 689 HB2 HIS 84 HB2 HIS 84 -11.048 -17.196 5.768 690 HB3 HIS 84 HB3 HIS 84 -11.640 -18.308 6.999 691 HD1 HIS 84 HD1 HIS 84 -13.611 -17.553 8.404 692 HD2 HIS 84 HD2 HIS 84 -12.090 -14.529 5.992 693 HE1 HIS 84 HE1 HIS 84 -15.267 -15.677 8.551 694 HE2 HIS 84 HE2 HIS 84 -14.274 -13.820 7.179 695 H HIS 85 H HIS 85 -8.502 -17.102 5.665 696 HA HIS 85 HA HIS 85 -7.141 -19.582 6.538 697 HB2 HIS 85 HB2 HIS 85 -7.327 -18.511 3.707 698 HB3 HIS 85 HB3 HIS 85 -6.718 -20.085 4.213 699 HD1 HIS 85 HD1 HIS 85 -8.546 -21.806 5.115 700 HD2 HIS 85 HD2 HIS 85 -10.054 -18.376 3.309 701 HE1 HIS 85 HE1 HIS 85 -10.961 -22.296 4.647 702 HE2 HIS 85 HE2 HIS 85 -11.884 -20.168 3.672 703 H HIS 86 H HIS 86 -5.045 -19.361 7.118 704 HA HIS 86 HA HIS 86 -3.966 -16.649 6.988 705 HB2 HIS 86 HB2 HIS 86 -3.035 -19.039 8.594 706 HB3 HIS 86 HB3 HIS 86 -2.457 -17.384 8.775 707 HD1 HIS 86 HD1 HIS 86 -5.132 -19.669 9.843 708 HD2 HIS 86 HD2 HIS 86 -4.468 -15.566 9.816 709 HE1 HIS 86 HE1 HIS 86 -6.857 -18.700 11.382 710 HE2 HIS 86 HE2 HIS 86 -6.545 -16.211 11.211 711 H HIS 87 H HIS 87 -3.464 -19.568 5.332 712 HA HIS 87 HA HIS 87 -1.071 -18.430 4.069 713 HB2 HIS 87 HB2 HIS 87 -1.246 -21.206 5.245 714 HB3 HIS 87 HB3 HIS 87 -0.096 -20.806 3.976 715 HD1 HIS 87 HD1 HIS 87 1.871 -19.253 4.601 716 HD2 HIS 87 HD2 HIS 87 -0.609 -20.204 7.797 717 HE1 HIS 87 HE1 HIS 87 3.142 -18.589 6.655 718 HE2 HIS 87 HE2 HIS 87 1.670 -19.257 8.578 719 H HIS 88 H HIS 88 -1.542 -18.219 1.980 720 HA HIS 88 HA HIS 88 -2.150 -20.387 0.303 721 HB2 HIS 88 HB2 HIS 88 -4.394 -20.107 1.444 722 HB3 HIS 88 HB3 HIS 88 -4.532 -18.547 0.643 723 HD1 HIS 88 HD1 HIS 88 -3.622 -22.038 -0.595 724 HD2 HIS 88 HD2 HIS 88 -6.136 -18.860 -1.518 725 HE1 HIS 88 HE1 HIS 88 -4.857 -22.735 -2.660 726 HE2 HIS 88 HE2 HIS 88 -6.399 -20.823 -3.185 727 H1 MET 1 H1 MET 1 -10.547 22.038 -9.702 728 H2 MET 1 H2 MET 1 -11.706 22.436 -8.541 729 H3 MET 1 H3 MET 1 -11.773 23.141 -10.075 730 HA MET 1 HA MET 1 -12.126 20.264 -9.476 731 HB2 MET 1 HB2 MET 1 -14.014 21.580 -8.671 732 HB3 MET 1 HB3 MET 1 -14.152 22.388 -10.227 733 HG2 MET 1 HG2 MET 1 -15.849 20.637 -9.894 734 HG3 MET 1 HG3 MET 1 -14.816 20.330 -11.291 735 HE1 MET 1 HE1 MET 1 -15.637 16.729 -9.928 736 HE2 MET 1 HE2 MET 1 -15.705 17.804 -11.326 737 HE3 MET 1 HE3 MET 1 -16.706 18.131 -9.911 738 H THR 2 H THR 2 -10.973 19.358 -11.108 739 HA THR 2 HA THR 2 -12.104 19.477 -13.753 740 HB THR 2 HB THR 2 -10.546 21.407 -13.874 741 HG1 THR 2 HG1 THR 2 -9.875 19.111 -15.446 742 HG21 THR 2 HG21 THR 2 -8.374 19.351 -13.409 743 HG22 THR 2 HG22 THR 2 -8.840 20.629 -12.286 744 HG23 THR 2 HG23 THR 2 -8.122 21.041 -13.844 745 H ASP 3 H ASP 3 -9.503 18.350 -11.661 746 HA ASP 3 HA ASP 3 -9.026 15.915 -13.083 747 HB2 ASP 3 HB2 ASP 3 -7.885 15.272 -10.887 748 HB3 ASP 3 HB3 ASP 3 -7.255 16.699 -11.705 749 H PHE 4 H PHE 4 -9.533 13.744 -12.232 750 HA PHE 4 HA PHE 4 -12.039 13.673 -10.690 751 HB2 PHE 4 HB2 PHE 4 -12.910 11.934 -12.189 752 HB3 PHE 4 HB3 PHE 4 -12.609 13.434 -13.057 753 HD1 PHE 4 HD2 PHE 4 -10.824 13.582 -14.714 754 HD2 PHE 4 HD1 PHE 4 -11.585 9.946 -12.621 755 HE1 PHE 4 HE2 PHE 4 -9.452 12.354 -16.347 756 HE2 PHE 4 HE1 PHE 4 -10.207 8.719 -14.247 757 HZ PHE 4 HZ PHE 4 -9.128 9.923 -16.106 758 H LEU 5 H LEU 5 -12.501 11.618 -9.695 759 HA LEU 5 HA LEU 5 -10.159 10.402 -8.558 760 HB2 LEU 5 HB2 LEU 5 -12.170 10.826 -7.224 761 HB3 LEU 5 HB3 LEU 5 -13.088 9.758 -8.263 762 HG LEU 5 HG LEU 5 -11.795 7.832 -7.484 763 HD11 LEU 5 HD11 LEU 5 -10.333 9.808 -5.723 764 HD12 LEU 5 HD12 LEU 5 -9.649 8.943 -7.101 765 HD13 LEU 5 HD13 LEU 5 -10.166 8.052 -5.671 766 HD21 LEU 5 HD21 LEU 5 -12.597 7.774 -5.183 767 HD22 LEU 5 HD22 LEU 5 -13.801 8.493 -6.250 768 HD23 LEU 5 HD23 LEU 5 -12.823 9.524 -5.205 769 H ALA 6 H ALA 6 -9.031 9.007 -9.751 770 HA ALA 6 HA ALA 6 -10.411 7.192 -11.604 771 HB1 ALA 6 HB1 ALA 6 -8.246 6.917 -12.668 772 HB2 ALA 6 HB2 ALA 6 -7.482 7.896 -11.416 773 HB3 ALA 6 HB3 ALA 6 -8.647 8.628 -12.520 774 H GLY 7 H GLY 7 -9.823 4.955 -11.715 775 HA2 GLY 7 HA2 GLY 7 -8.531 3.859 -9.291 776 HA3 GLY 7 HA3 GLY 7 -10.048 3.207 -9.885 777 H ILE 8 H ILE 8 -7.261 2.055 -9.544 778 HA ILE 8 HA ILE 8 -7.024 0.922 -12.269 779 HB ILE 8 HB ILE 8 -4.700 1.456 -10.399 780 HG12 ILE 8 HG12 ILE 8 -5.504 2.855 -12.971 781 HG13 ILE 8 HG13 ILE 8 -5.554 3.548 -11.353 782 HG21 ILE 8 HG21 ILE 8 -4.729 0.407 -13.235 783 HG22 ILE 8 HG22 ILE 8 -4.370 -0.534 -11.787 784 HG23 ILE 8 HG23 ILE 8 -3.288 0.768 -12.282 785 HD11 ILE 8 HD11 ILE 8 -3.122 3.391 -11.209 786 HD12 ILE 8 HD12 ILE 8 -3.634 4.350 -12.597 787 HD13 ILE 8 HD13 ILE 8 -3.071 2.696 -12.830 788 H ARG 9 H ARG 9 -6.595 -1.277 -12.427 789 HA ARG 9 HA ARG 9 -6.642 -2.836 -9.918 790 HB2 ARG 9 HB2 ARG 9 -8.745 -3.116 -11.050 791 HB3 ARG 9 HB3 ARG 9 -7.944 -3.421 -12.583 792 HG2 ARG 9 HG2 ARG 9 -8.854 -5.464 -11.588 793 HG3 ARG 9 HG3 ARG 9 -7.101 -5.541 -11.767 794 HD2 ARG 9 HD2 ARG 9 -7.910 -6.452 -9.606 795 HD3 ARG 9 HD3 ARG 9 -6.787 -5.109 -9.417 796 HE ARG 9 HE ARG 9 -8.424 -3.992 -8.316 797 HH11 ARG 9 HH11 ARG 9 -9.952 -6.350 -10.299 798 HH12 ARG 9 HH12 ARG 9 -11.529 -6.016 -9.684 799 HH21 ARG 9 HH21 ARG 9 -10.443 -3.576 -7.520 800 HH22 ARG 9 HH22 ARG 9 -11.806 -4.466 -8.102 801 H ILE 10 H ILE 10 -4.857 -3.985 -9.570 802 HA ILE 10 HA ILE 10 -3.203 -4.850 -11.875 803 HB ILE 10 HB ILE 10 -2.241 -4.290 -9.058 804 HG12 ILE 10 HG12 ILE 10 -1.895 -2.520 -11.495 805 HG13 ILE 10 HG13 ILE 10 -3.072 -2.225 -10.217 806 HG21 ILE 10 HG21 ILE 10 -0.005 -4.345 -10.072 807 HG22 ILE 10 HG22 ILE 10 -0.727 -4.751 -11.629 808 HG23 ILE 10 HG23 ILE 10 -0.858 -5.876 -10.277 809 HD11 ILE 10 HD11 ILE 10 -1.100 -0.856 -9.912 810 HD12 ILE 10 HD12 ILE 10 -0.080 -2.294 -9.887 811 HD13 ILE 10 HD13 ILE 10 -1.253 -2.021 -8.597 812 H VAL 11 H VAL 11 -3.346 -7.056 -12.141 813 HA VAL 11 HA VAL 11 -3.281 -8.700 -9.680 814 HB VAL 11 HB VAL 11 -4.636 -9.368 -12.300 815 HG11 VAL 11 HG11 VAL 11 -4.245 -11.102 -9.856 816 HG12 VAL 11 HG12 VAL 11 -3.544 -11.370 -11.453 817 HG13 VAL 11 HG13 VAL 11 -5.289 -11.491 -11.223 818 HG21 VAL 11 HG21 VAL 11 -5.741 -9.049 -9.497 819 HG22 VAL 11 HG22 VAL 11 -6.671 -9.449 -10.945 820 HG23 VAL 11 HG23 VAL 11 -5.901 -7.869 -10.803 821 H GLY 12 H GLY 12 -1.434 -9.677 -9.373 822 HA2 GLY 12 HA2 GLY 12 0.054 -10.804 -11.640 823 HA3 GLY 12 HA3 GLY 12 0.871 -9.621 -10.630 824 H GLU 13 H GLU 13 2.059 -11.995 -10.824 825 HA GLU 13 HA GLU 13 1.160 -13.957 -8.960 826 HB2 GLU 13 HB2 GLU 13 3.403 -14.989 -9.375 827 HB3 GLU 13 HB3 GLU 13 2.463 -14.664 -10.829 828 HG2 GLU 13 HG2 GLU 13 3.784 -12.584 -11.156 829 HG3 GLU 13 HG3 GLU 13 4.776 -13.041 -9.773 830 H ASP 14 H ASP 14 1.775 -14.400 -6.909 831 HA ASP 14 HA ASP 14 2.797 -12.219 -5.342 832 HB2 ASP 14 HB2 ASP 14 0.922 -13.538 -4.527 833 HB3 ASP 14 HB3 ASP 14 1.895 -15.003 -4.565 834 H LYS 15 H LYS 15 4.990 -12.142 -6.214 835 HA LYS 15 HA LYS 15 6.784 -14.168 -5.130 836 HB2 LYS 15 HB2 LYS 15 7.052 -11.940 -7.081 837 HB3 LYS 15 HB3 LYS 15 8.493 -12.422 -6.195 838 HG2 LYS 15 HG2 LYS 15 8.357 -14.644 -7.014 839 HG3 LYS 15 HG3 LYS 15 6.763 -14.350 -7.720 840 HD2 LYS 15 HD2 LYS 15 7.680 -12.877 -9.360 841 HD3 LYS 15 HD3 LYS 15 9.254 -12.867 -8.557 842 HE2 LYS 15 HE2 LYS 15 9.266 -14.298 -10.529 843 HE3 LYS 15 HE3 LYS 15 9.537 -15.222 -9.054 844 HZ1 LYS 15 HZ1 LYS 15 7.978 -16.274 -10.645 845 HZ2 LYS 15 HZ2 LYS 15 6.905 -14.996 -10.392 846 HZ3 LYS 15 HZ3 LYS 15 7.311 -16.021 -9.112 847 H ASN 16 H ASN 16 8.702 -13.501 -3.990 848 HA ASN 16 HA ASN 16 8.168 -12.569 -1.485 849 HB2 ASN 16 HB2 ASN 16 10.878 -12.278 -2.778 850 HB3 ASN 16 HB3 ASN 16 10.516 -12.632 -1.087 851 HD21 ASN 16 HD21 ASN 16 10.778 -13.899 -4.289 852 HD22 ASN 16 HD22 ASN 16 10.652 -15.568 -3.859 853 H GLY 17 H GLY 17 9.302 -10.640 -4.225 854 HA2 GLY 17 HA2 GLY 17 9.122 -8.219 -2.520 855 HA3 GLY 17 HA3 GLY 17 10.212 -8.383 -3.883 856 H MET 18 H MET 18 7.349 -9.755 -4.864 857 HA MET 18 HA MET 18 6.851 -7.621 -6.693 858 HB2 MET 18 HB2 MET 18 5.666 -10.301 -6.157 859 HB3 MET 18 HB3 MET 18 4.652 -9.153 -7.017 860 HG2 MET 18 HG2 MET 18 7.426 -9.954 -7.867 861 HG3 MET 18 HG3 MET 18 5.932 -10.643 -8.504 862 HE1 MET 18 HE1 MET 18 4.278 -7.462 -10.138 863 HE2 MET 18 HE2 MET 18 4.111 -7.914 -8.442 864 HE3 MET 18 HE3 MET 18 4.052 -9.153 -9.696 865 H THR 19 H THR 19 4.832 -8.879 -4.004 866 HA THR 19 HA THR 19 2.784 -6.958 -4.283 867 HB THR 19 HB THR 19 2.148 -7.563 -1.952 868 HG1 THR 19 HG1 THR 19 3.436 -9.204 -0.926 869 HG21 THR 19 HG21 THR 19 2.870 -9.931 -3.695 870 HG22 THR 19 HG22 THR 19 1.399 -8.966 -3.823 871 HG23 THR 19 HG23 THR 19 1.695 -9.936 -2.380 872 H ASN 20 H ASN 20 5.883 -6.866 -2.701 873 HA ASN 20 HA ASN 20 5.395 -4.494 -1.165 874 HB2 ASN 20 HB2 ASN 20 8.027 -5.754 -1.990 875 HB3 ASN 20 HB3 ASN 20 7.804 -4.554 -0.720 876 HD21 ASN 20 HD21 ASN 20 7.025 -5.200 1.258 877 HD22 ASN 20 HD22 ASN 20 6.837 -6.858 1.694 878 H GLN 21 H GLN 21 7.138 -5.206 -4.184 879 HA GLN 21 HA GLN 21 7.998 -2.556 -4.640 880 HB2 GLN 21 HB2 GLN 21 8.717 -3.287 -6.789 881 HB3 GLN 21 HB3 GLN 21 9.029 -4.589 -5.662 882 HG2 GLN 21 HG2 GLN 21 7.044 -5.762 -6.458 883 HG3 GLN 21 HG3 GLN 21 6.701 -4.439 -7.572 884 HE21 GLN 21 HE21 GLN 21 8.809 -7.103 -6.867 885 HE22 GLN 21 HE22 GLN 21 9.551 -7.184 -8.419 886 H ILE 22 H ILE 22 5.134 -4.342 -5.667 887 HA ILE 22 HA ILE 22 4.215 -2.555 -7.626 888 HB ILE 22 HB ILE 22 2.848 -4.612 -5.911 889 HG12 ILE 22 HG12 ILE 22 4.259 -5.385 -7.755 890 HG13 ILE 22 HG13 ILE 22 2.568 -5.734 -8.100 891 HG21 ILE 22 HG21 ILE 22 1.465 -2.855 -7.951 892 HG22 ILE 22 HG22 ILE 22 1.163 -2.879 -6.213 893 HG23 ILE 22 HG23 ILE 22 0.770 -4.291 -7.193 894 HD11 ILE 22 HD11 ILE 22 3.722 -4.924 -10.072 895 HD12 ILE 22 HD12 ILE 22 4.163 -3.442 -9.224 896 HD13 ILE 22 HD13 ILE 22 2.469 -3.788 -9.572 897 H THR 23 H THR 23 3.167 -2.804 -4.205 898 HA THR 23 HA THR 23 1.623 -0.414 -4.349 899 HB THR 23 HB THR 23 2.697 -1.613 -1.784 900 HG1 THR 23 HG1 THR 23 0.734 -2.545 -3.560 901 HG21 THR 23 HG21 THR 23 0.591 -0.737 -0.854 902 HG22 THR 23 HG22 THR 23 0.168 -0.081 -2.436 903 HG23 THR 23 HG23 THR 23 1.567 0.548 -1.564 904 H GLY 24 H GLY 24 4.958 -1.127 -3.602 905 HA2 GLY 24 HA2 GLY 24 5.777 1.336 -2.533 906 HA3 GLY 24 HA3 GLY 24 6.789 0.255 -3.483 907 H VAL 25 H VAL 25 5.781 0.291 -5.957 908 HA VAL 25 HA VAL 25 6.585 2.707 -7.103 909 HB VAL 25 HB VAL 25 4.754 0.598 -8.285 910 HG11 VAL 25 HG11 VAL 25 6.298 2.805 -9.659 911 HG12 VAL 25 HG12 VAL 25 4.545 2.678 -9.527 912 HG13 VAL 25 HG13 VAL 25 5.443 1.496 -10.478 913 HG21 VAL 25 HG21 VAL 25 6.779 -0.277 -9.349 914 HG22 VAL 25 HG22 VAL 25 6.946 -0.275 -7.594 915 HG23 VAL 25 HG23 VAL 25 7.746 0.968 -8.554 916 H ILE 26 H ILE 26 3.327 1.578 -6.242 917 HA ILE 26 HA ILE 26 1.759 3.655 -7.193 918 HB ILE 26 HB ILE 26 1.481 2.289 -4.506 919 HG12 ILE 26 HG12 ILE 26 1.537 0.637 -6.281 920 HG13 ILE 26 HG13 ILE 26 -0.107 0.780 -5.672 921 HG21 ILE 26 HG21 ILE 26 -0.577 3.766 -6.144 922 HG22 ILE 26 HG22 ILE 26 0.130 4.303 -4.621 923 HG23 ILE 26 HG23 ILE 26 -0.897 2.870 -4.660 924 HD11 ILE 26 HD11 ILE 26 0.950 2.008 -8.209 925 HD12 ILE 26 HD12 ILE 26 -0.702 2.140 -7.604 926 HD13 ILE 26 HD13 ILE 26 -0.062 0.569 -8.085 927 H SER 27 H SER 27 3.518 3.489 -4.114 928 HA SER 27 HA SER 27 2.827 6.008 -3.076 929 HB2 SER 27 HB2 SER 27 5.488 4.631 -2.632 930 HB3 SER 27 HB3 SER 27 4.626 5.697 -1.524 931 HG SER 27 HG SER 27 4.182 3.011 -2.147 932 H LYS 28 H LYS 28 5.173 5.073 -5.472 933 HA LYS 28 HA LYS 28 6.794 7.450 -5.216 934 HB2 LYS 28 HB2 LYS 28 6.883 5.341 -7.381 935 HB3 LYS 28 HB3 LYS 28 8.155 6.478 -6.956 936 HG2 LYS 28 HG2 LYS 28 8.436 5.374 -4.788 937 HG3 LYS 28 HG3 LYS 28 7.120 4.275 -5.175 938 HD2 LYS 28 HD2 LYS 28 9.279 3.195 -5.542 939 HD3 LYS 28 HD3 LYS 28 8.390 3.368 -7.055 940 HE2 LYS 28 HE2 LYS 28 9.738 5.391 -7.560 941 HE3 LYS 28 HE3 LYS 28 10.672 5.097 -6.092 942 HZ1 LYS 28 HZ1 LYS 28 11.781 4.224 -8.060 943 HZ2 LYS 28 HZ2 LYS 28 10.454 3.233 -8.395 944 HZ3 LYS 28 HZ3 LYS 28 11.369 2.974 -6.997 945 H PHE 29 H PHE 29 3.822 7.008 -6.597 946 HA PHE 29 HA PHE 29 4.186 8.340 -9.100 947 HB2 PHE 29 HB2 PHE 29 1.713 7.773 -7.464 948 HB3 PHE 29 HB3 PHE 29 1.659 8.609 -9.012 949 HD1 PHE 29 HD1 PHE 29 3.973 6.860 -10.222 950 HD2 PHE 29 HD2 PHE 29 0.316 5.969 -8.219 951 HE1 PHE 29 HE1 PHE 29 3.854 4.704 -11.398 952 HE2 PHE 29 HE2 PHE 29 0.200 3.808 -9.392 953 HZ PHE 29 HZ PHE 29 1.969 3.176 -10.983 954 H ASP 30 H ASP 30 2.904 10.341 -9.637 955 HA ASP 30 HA ASP 30 3.904 12.532 -8.082 956 HB2 ASP 30 HB2 ASP 30 1.862 12.825 -10.272 957 HB3 ASP 30 HB3 ASP 30 3.208 13.886 -9.864 958 H THR 31 H THR 31 0.906 10.822 -8.249 959 HA THR 31 HA THR 31 -0.715 13.029 -7.273 960 HB THR 31 HB THR 31 -1.668 11.592 -8.983 961 HG1 THR 31 HG1 THR 31 -3.593 11.705 -8.076 962 HG21 THR 31 HG21 THR 31 -0.496 9.508 -8.426 963 HG22 THR 31 HG22 THR 31 -2.237 9.255 -8.541 964 HG23 THR 31 HG23 THR 31 -1.463 9.354 -6.959 965 H ASN 32 H ASN 32 -2.351 12.514 -5.518 966 HA ASN 32 HA ASN 32 -0.896 11.463 -3.190 967 HB2 ASN 32 HB2 ASN 32 -1.729 13.810 -3.135 968 HB3 ASN 32 HB3 ASN 32 -3.376 13.206 -3.284 969 HD21 ASN 32 HD21 ASN 32 -0.832 11.702 -1.367 970 HD22 ASN 32 HD22 ASN 32 -1.579 12.010 0.160 971 H ILE 33 H ILE 33 -1.555 9.656 -2.149 972 HA ILE 33 HA ILE 33 -3.571 8.030 -3.387 973 HB ILE 33 HB ILE 33 -1.938 7.492 -0.898 974 HG12 ILE 33 HG12 ILE 33 -1.501 6.605 -3.768 975 HG13 ILE 33 HG13 ILE 33 -0.562 7.834 -2.926 976 HG21 ILE 33 HG21 ILE 33 -2.512 5.123 -1.292 977 HG22 ILE 33 HG22 ILE 33 -3.572 5.612 -2.614 978 HG23 ILE 33 HG23 ILE 33 -3.940 6.105 -0.961 979 HD11 ILE 33 HD11 ILE 33 -0.711 4.917 -2.196 980 HD12 ILE 33 HD12 ILE 33 0.229 6.146 -1.349 981 HD13 ILE 33 HD13 ILE 33 0.626 5.724 -3.014 982 H ARG 34 H ARG 34 -5.691 8.406 -2.999 983 HA ARG 34 HA ARG 34 -6.638 9.123 -0.349 984 HB2 ARG 34 HB2 ARG 34 -8.024 8.589 -2.973 985 HB3 ARG 34 HB3 ARG 34 -8.937 8.744 -1.480 986 HG2 ARG 34 HG2 ARG 34 -7.125 10.852 -2.649 987 HG3 ARG 34 HG3 ARG 34 -8.885 10.832 -2.751 988 HD2 ARG 34 HD2 ARG 34 -7.188 11.119 -0.270 989 HD3 ARG 34 HD3 ARG 34 -8.258 12.326 -0.979 990 HE ARG 34 HE ARG 34 -9.022 10.039 0.650 991 HH11 ARG 34 HH11 ARG 34 -10.102 12.607 -1.392 992 HH12 ARG 34 HH12 ARG 34 -11.700 12.604 -0.728 993 HH21 ARG 34 HH21 ARG 34 -11.064 10.075 1.513 994 HH22 ARG 34 HH22 ARG 34 -12.226 11.206 0.915 995 H THR 35 H THR 35 -6.692 6.270 -2.456 996 HA THR 35 HA THR 35 -6.945 4.570 -0.107 997 HB THR 35 HB THR 35 -8.946 4.290 -2.370 998 HG1 THR 35 HG1 THR 35 -9.081 5.553 0.139 999 HG21 THR 35 HG21 THR 35 -8.366 2.150 -1.348 1000 HG22 THR 35 HG22 THR 35 -10.001 2.618 -0.884 1001 HG23 THR 35 HG23 THR 35 -8.671 2.812 0.259 1002 H ILE 36 H ILE 36 -5.745 2.766 -0.319 1003 HA ILE 36 HA ILE 36 -5.278 1.646 -2.998 1004 HB ILE 36 HB ILE 36 -3.263 2.977 -2.456 1005 HG12 ILE 36 HG12 ILE 36 -1.581 1.155 -2.744 1006 HG13 ILE 36 HG13 ILE 36 -2.831 -0.028 -2.378 1007 HG21 ILE 36 HG21 ILE 36 -2.965 1.130 -0.088 1008 HG22 ILE 36 HG22 ILE 36 -3.377 2.844 -0.017 1009 HG23 ILE 36 HG23 ILE 36 -1.796 2.342 -0.614 1010 HD11 ILE 36 HD11 ILE 36 -2.416 0.151 -4.766 1011 HD12 ILE 36 HD12 ILE 36 -2.843 1.861 -4.721 1012 HD13 ILE 36 HD13 ILE 36 -4.062 0.636 -4.363 1013 H VAL 37 H VAL 37 -5.538 -0.507 -3.058 1014 HA VAL 37 HA VAL 37 -5.465 -2.031 -0.522 1015 HB VAL 37 HB VAL 37 -7.411 -2.410 -2.817 1016 HG11 VAL 37 HG11 VAL 37 -6.786 -4.565 -1.840 1017 HG12 VAL 37 HG12 VAL 37 -8.450 -4.157 -1.428 1018 HG13 VAL 37 HG13 VAL 37 -7.172 -3.962 -0.227 1019 HG21 VAL 37 HG21 VAL 37 -7.951 -0.476 -1.408 1020 HG22 VAL 37 HG22 VAL 37 -7.913 -1.506 0.023 1021 HG23 VAL 37 HG23 VAL 37 -9.141 -1.764 -1.216 1022 H LEU 38 H LEU 38 -4.373 -3.946 -0.574 1023 HA LEU 38 HA LEU 38 -4.010 -5.310 -3.135 1024 HB2 LEU 38 HB2 LEU 38 -1.940 -3.981 -2.750 1025 HB3 LEU 38 HB3 LEU 38 -1.704 -4.818 -1.229 1026 HG LEU 38 HG LEU 38 -1.822 -6.360 -3.823 1027 HD11 LEU 38 HD11 LEU 38 -0.131 -4.646 -4.163 1028 HD12 LEU 38 HD12 LEU 38 0.627 -6.224 -3.949 1029 HD13 LEU 38 HD13 LEU 38 0.628 -5.059 -2.625 1030 HD21 LEU 38 HD21 LEU 38 -0.483 -6.889 -1.163 1031 HD22 LEU 38 HD22 LEU 38 -0.394 -7.938 -2.578 1032 HD23 LEU 38 HD23 LEU 38 -1.941 -7.671 -1.774 1033 H ASN 39 H ASN 39 -5.010 -7.180 -2.790 1034 HA ASN 39 HA ASN 39 -4.420 -8.644 -0.297 1035 HB2 ASN 39 HB2 ASN 39 -6.770 -9.666 -0.625 1036 HB3 ASN 39 HB3 ASN 39 -6.659 -8.032 0.015 1037 HD21 ASN 39 HD21 ASN 39 -8.884 -9.284 -1.330 1038 HD22 ASN 39 HD22 ASN 39 -9.219 -8.311 -2.713 1039 H ALA 40 H ALA 40 -3.306 -10.418 -0.665 1040 HA ALA 40 HA ALA 40 -3.323 -11.607 -3.363 1041 HB1 ALA 40 HB1 ALA 40 -1.132 -12.489 -2.809 1042 HB2 ALA 40 HB2 ALA 40 -1.272 -11.868 -1.164 1043 HB3 ALA 40 HB3 ALA 40 -1.183 -10.749 -2.525 1044 H LYS 41 H LYS 41 -4.072 -13.564 -3.731 1045 HA LYS 41 HA LYS 41 -4.098 -15.605 -1.636 1046 HB2 LYS 41 HB2 LYS 41 -6.398 -16.203 -1.944 1047 HB3 LYS 41 HB3 LYS 41 -6.347 -14.478 -1.614 1048 HG2 LYS 41 HG2 LYS 41 -6.569 -15.657 -4.381 1049 HG3 LYS 41 HG3 LYS 41 -7.951 -15.172 -3.400 1050 HD2 LYS 41 HD2 LYS 41 -7.222 -12.871 -3.412 1051 HD3 LYS 41 HD3 LYS 41 -5.711 -13.309 -4.212 1052 HE2 LYS 41 HE2 LYS 41 -7.325 -12.330 -5.783 1053 HE3 LYS 41 HE3 LYS 41 -6.934 -13.997 -6.200 1054 HZ1 LYS 41 HZ1 LYS 41 -9.288 -13.611 -6.407 1055 HZ2 LYS 41 HZ2 LYS 41 -9.390 -13.065 -4.811 1056 HZ3 LYS 41 HZ3 LYS 41 -9.014 -14.681 -5.127 1057 H ASP 42 H ASP 42 -4.116 -17.757 -2.447 1058 HA ASP 42 HA ASP 42 -3.773 -19.484 -3.901 1059 HB2 ASP 42 HB2 ASP 42 -4.948 -17.517 -5.873 1060 HB3 ASP 42 HB3 ASP 42 -4.466 -19.146 -6.333 1061 H GLY 43 H GLY 43 -1.828 -17.038 -3.617 1062 HA2 GLY 43 HA2 GLY 43 0.420 -16.836 -4.255 1063 HA3 GLY 43 HA3 GLY 43 0.140 -17.999 -5.543 1064 H ILE 44 H ILE 44 -2.191 -15.522 -5.419 1065 HA ILE 44 HA ILE 44 -0.721 -13.790 -7.316 1066 HB ILE 44 HB ILE 44 -3.697 -14.272 -7.553 1067 HG12 ILE 44 HG12 ILE 44 -1.508 -15.780 -9.010 1068 HG13 ILE 44 HG13 ILE 44 -2.639 -16.449 -7.833 1069 HG21 ILE 44 HG21 ILE 44 -2.822 -12.274 -8.643 1070 HG22 ILE 44 HG22 ILE 44 -3.357 -13.447 -9.846 1071 HG23 ILE 44 HG23 ILE 44 -1.637 -13.246 -9.517 1072 HD11 ILE 44 HD11 ILE 44 -3.268 -16.987 -10.133 1073 HD12 ILE 44 HD12 ILE 44 -3.393 -15.264 -10.495 1074 HD13 ILE 44 HD13 ILE 44 -4.491 -16.003 -9.329 1075 H PHE 45 H PHE 45 -1.575 -11.535 -7.343 1076 HA PHE 45 HA PHE 45 -3.163 -10.862 -4.947 1077 HB2 PHE 45 HB2 PHE 45 -1.788 -8.936 -4.466 1078 HB3 PHE 45 HB3 PHE 45 -0.757 -10.359 -4.543 1079 HD1 PHE 45 HD2 PHE 45 -1.727 -7.250 -6.249 1080 HD2 PHE 45 HD1 PHE 45 0.939 -10.575 -6.232 1081 HE1 PHE 45 HE2 PHE 45 -0.299 -6.110 -7.892 1082 HE2 PHE 45 HE1 PHE 45 2.371 -9.433 -7.873 1083 HZ PHE 45 HZ PHE 45 1.748 -7.202 -8.706 1084 H THR 46 H THR 46 -4.563 -9.116 -5.103 1085 HA THR 46 HA THR 46 -4.768 -7.832 -7.760 1086 HB THR 46 HB THR 46 -6.698 -9.163 -7.669 1087 HG1 THR 46 HG1 THR 46 -7.515 -6.618 -6.660 1088 HG21 THR 46 HG21 THR 46 -7.194 -8.193 -4.855 1089 HG22 THR 46 HG22 THR 46 -6.599 -9.791 -5.305 1090 HG23 THR 46 HG23 THR 46 -8.225 -9.293 -5.772 1091 H CYS 47 H CYS 47 -3.802 -5.919 -7.416 1092 HA CYS 47 HA CYS 47 -4.307 -4.370 -5.011 1093 HB2 CYS 47 HB2 CYS 47 -2.031 -4.472 -5.944 1094 HB3 CYS 47 HB3 CYS 47 -2.603 -3.720 -7.429 1095 HG CYS 47 HG CYS 47 -2.961 -2.104 -4.454 1096 H ASN 48 H ASN 48 -5.676 -2.697 -4.827 1097 HA ASN 48 HA ASN 48 -7.004 -1.643 -7.250 1098 HB2 ASN 48 HB2 ASN 48 -8.019 -1.788 -4.392 1099 HB3 ASN 48 HB3 ASN 48 -8.873 -1.013 -5.720 1100 HD21 ASN 48 HD21 ASN 48 -10.626 -2.411 -5.386 1101 HD22 ASN 48 HD22 ASN 48 -10.577 -4.071 -5.873 1102 H LEU 49 H LEU 49 -6.039 0.247 -7.782 1103 HA LEU 49 HA LEU 49 -5.100 2.046 -5.655 1104 HB2 LEU 49 HB2 LEU 49 -3.454 1.582 -7.330 1105 HB3 LEU 49 HB3 LEU 49 -4.573 1.962 -8.625 1106 HG LEU 49 HG LEU 49 -4.549 4.328 -7.986 1107 HD11 LEU 49 HD11 LEU 49 -2.579 3.488 -5.860 1108 HD12 LEU 49 HD12 LEU 49 -4.208 4.112 -5.596 1109 HD13 LEU 49 HD13 LEU 49 -2.969 5.151 -6.297 1110 HD21 LEU 49 HD21 LEU 49 -2.905 3.525 -9.612 1111 HD22 LEU 49 HD22 LEU 49 -1.767 3.193 -8.306 1112 HD23 LEU 49 HD23 LEU 49 -2.258 4.852 -8.647 1113 H MET 50 H MET 50 -6.155 3.854 -5.121 1114 HA MET 50 HA MET 50 -8.094 5.001 -7.034 1115 HB2 MET 50 HB2 MET 50 -8.376 4.852 -4.021 1116 HB3 MET 50 HB3 MET 50 -9.490 5.671 -5.109 1117 HG2 MET 50 HG2 MET 50 -8.932 2.717 -4.975 1118 HG3 MET 50 HG3 MET 50 -10.403 3.553 -4.491 1119 HE1 MET 50 HE1 MET 50 -10.219 5.719 -7.077 1120 HE2 MET 50 HE2 MET 50 -11.738 5.147 -6.386 1121 HE3 MET 50 HE3 MET 50 -11.433 4.977 -8.116 1122 H ILE 51 H ILE 51 -7.185 6.810 -7.773 1123 HA ILE 51 HA ILE 51 -6.263 8.846 -5.888 1124 HB ILE 51 HB ILE 51 -4.212 9.257 -7.387 1125 HG12 ILE 51 HG12 ILE 51 -3.333 6.936 -8.249 1126 HG13 ILE 51 HG13 ILE 51 -5.039 6.512 -8.303 1127 HG21 ILE 51 HG21 ILE 51 -4.034 8.500 -5.096 1128 HG22 ILE 51 HG22 ILE 51 -2.828 7.700 -6.102 1129 HG23 ILE 51 HG23 ILE 51 -4.278 6.828 -5.601 1130 HD11 ILE 51 HD11 ILE 51 -5.443 8.353 -9.845 1131 HD12 ILE 51 HD12 ILE 51 -4.218 7.248 -10.465 1132 HD13 ILE 51 HD13 ILE 51 -3.737 8.795 -9.770 1133 H PHE 52 H PHE 52 -5.946 10.972 -6.891 1134 HA PHE 52 HA PHE 52 -7.954 11.421 -8.948 1135 HB2 PHE 52 HB2 PHE 52 -6.459 13.217 -7.053 1136 HB3 PHE 52 HB3 PHE 52 -7.297 13.902 -8.443 1137 HD1 PHE 52 HD2 PHE 52 -9.733 13.617 -8.681 1138 HD2 PHE 52 HD1 PHE 52 -7.677 12.465 -5.131 1139 HE1 PHE 52 HE2 PHE 52 -11.871 13.585 -7.462 1140 HE2 PHE 52 HE1 PHE 52 -9.811 12.428 -3.906 1141 HZ PHE 52 HZ PHE 52 -11.911 12.992 -5.068 1142 H VAL 53 H VAL 53 -7.579 11.933 -11.021 1143 HA VAL 53 HA VAL 53 -4.797 12.538 -11.838 1144 HB VAL 53 HB VAL 53 -5.129 11.343 -13.920 1145 HG11 VAL 53 HG11 VAL 53 -5.937 9.635 -11.570 1146 HG12 VAL 53 HG12 VAL 53 -4.284 10.042 -12.039 1147 HG13 VAL 53 HG13 VAL 53 -5.285 9.046 -13.099 1148 HG21 VAL 53 HG21 VAL 53 -7.505 11.738 -14.232 1149 HG22 VAL 53 HG22 VAL 53 -7.877 10.665 -12.883 1150 HG23 VAL 53 HG23 VAL 53 -7.140 10.016 -14.348 1151 H LYS 54 H LYS 54 -4.473 14.138 -13.323 1152 HA LYS 54 HA LYS 54 -6.479 16.115 -13.661 1153 HB2 LYS 54 HB2 LYS 54 -4.782 17.231 -15.125 1154 HB3 LYS 54 HB3 LYS 54 -4.201 16.808 -13.521 1155 HG2 LYS 54 HG2 LYS 54 -3.063 14.850 -14.429 1156 HG3 LYS 54 HG3 LYS 54 -3.671 15.238 -16.039 1157 HD2 LYS 54 HD2 LYS 54 -1.380 15.999 -15.829 1158 HD3 LYS 54 HD3 LYS 54 -2.459 17.389 -15.951 1159 HE2 LYS 54 HE2 LYS 54 -2.353 17.684 -13.522 1160 HE3 LYS 54 HE3 LYS 54 -1.289 16.283 -13.392 1161 HZ1 LYS 54 HZ1 LYS 54 0.362 17.451 -14.700 1162 HZ2 LYS 54 HZ2 LYS 54 -0.059 18.365 -13.341 1163 HZ3 LYS 54 HZ3 LYS 54 -0.663 18.788 -14.863 1164 H ASN 55 H ASN 55 -5.501 13.418 -15.651 1165 HA ASN 55 HA ASN 55 -7.788 13.817 -17.357 1166 HB2 ASN 55 HB2 ASN 55 -6.515 13.787 -19.492 1167 HB3 ASN 55 HB3 ASN 55 -6.229 15.245 -18.548 1168 HD21 ASN 55 HD21 ASN 55 -4.203 15.645 -17.763 1169 HD22 ASN 55 HD22 ASN 55 -2.823 14.685 -18.162 1170 H THR 56 H THR 56 -7.857 12.028 -19.107 1171 HA THR 56 HA THR 56 -7.753 9.545 -17.715 1172 HB THR 56 HB THR 56 -8.587 8.519 -19.787 1173 HG1 THR 56 HG1 THR 56 -8.965 10.682 -21.310 1174 HG21 THR 56 HG21 THR 56 -10.198 9.639 -18.327 1175 HG22 THR 56 HG22 THR 56 -10.663 9.823 -20.018 1176 HG23 THR 56 HG23 THR 56 -9.913 11.169 -19.160 1177 H ASP 57 H ASP 57 -5.723 10.968 -20.228 1178 HA ASP 57 HA ASP 57 -4.252 8.633 -20.869 1179 HB2 ASP 57 HB2 ASP 57 -4.301 10.595 -22.343 1180 HB3 ASP 57 HB3 ASP 57 -3.466 11.550 -21.120 1181 H LYS 58 H LYS 58 -3.832 11.169 -18.470 1182 HA LYS 58 HA LYS 58 -1.389 10.407 -17.356 1183 HB2 LYS 58 HB2 LYS 58 -2.350 12.453 -16.633 1184 HB3 LYS 58 HB3 LYS 58 -3.872 11.685 -16.205 1185 HG2 LYS 58 HG2 LYS 58 -2.614 12.326 -14.224 1186 HG3 LYS 58 HG3 LYS 58 -2.810 10.574 -14.331 1187 HD2 LYS 58 HD2 LYS 58 -0.517 10.386 -15.226 1188 HD3 LYS 58 HD3 LYS 58 -0.332 12.137 -15.108 1189 HE2 LYS 58 HE2 LYS 58 -0.582 12.015 -12.684 1190 HE3 LYS 58 HE3 LYS 58 -0.839 10.272 -12.786 1191 HZ1 LYS 58 HZ1 LYS 58 1.449 10.867 -12.168 1192 HZ2 LYS 58 HZ2 LYS 58 1.639 11.668 -13.641 1193 HZ3 LYS 58 HZ3 LYS 58 1.385 9.998 -13.615 1194 H LEU 59 H LEU 59 -4.673 9.242 -16.680 1195 HA LEU 59 HA LEU 59 -4.013 7.392 -14.657 1196 HB2 LEU 59 HB2 LEU 59 -6.290 8.141 -15.013 1197 HB3 LEU 59 HB3 LEU 59 -6.307 7.444 -16.623 1198 HG LEU 59 HG LEU 59 -6.143 5.184 -15.643 1199 HD11 LEU 59 HD11 LEU 59 -4.951 5.681 -13.607 1200 HD12 LEU 59 HD12 LEU 59 -6.483 4.901 -13.214 1201 HD13 LEU 59 HD13 LEU 59 -6.301 6.644 -13.007 1202 HD21 LEU 59 HD21 LEU 59 -8.417 6.838 -14.537 1203 HD22 LEU 59 HD22 LEU 59 -8.410 5.085 -14.734 1204 HD23 LEU 59 HD23 LEU 59 -8.337 6.131 -16.151 1205 H THR 60 H THR 60 -4.423 6.947 -18.181 1206 HA THR 60 HA THR 60 -3.854 4.166 -18.182 1207 HB THR 60 HB THR 60 -3.550 4.351 -20.597 1208 HG1 THR 60 HG1 THR 60 -3.892 6.646 -21.409 1209 HG21 THR 60 HG21 THR 60 -5.817 6.101 -19.616 1210 HG22 THR 60 HG22 THR 60 -5.848 4.341 -19.742 1211 HG23 THR 60 HG23 THR 60 -5.723 5.325 -21.199 1212 H THR 61 H THR 61 -1.803 7.009 -18.319 1213 HA THR 61 HA THR 61 0.605 5.772 -19.078 1214 HB THR 61 HB THR 61 0.152 8.192 -17.315 1215 HG1 THR 61 HG1 THR 61 -0.402 8.212 -19.653 1216 HG21 THR 61 HG21 THR 61 2.343 7.258 -16.776 1217 HG22 THR 61 HG22 THR 61 2.525 8.745 -17.705 1218 HG23 THR 61 HG23 THR 61 2.750 7.182 -18.492 1219 H LEU 62 H LEU 62 -0.840 6.238 -15.854 1220 HA LEU 62 HA LEU 62 1.202 5.045 -14.347 1221 HB2 LEU 62 HB2 LEU 62 -1.777 5.004 -13.825 1222 HB3 LEU 62 HB3 LEU 62 -0.540 4.595 -12.649 1223 HG LEU 62 HG LEU 62 -1.050 7.313 -13.871 1224 HD11 LEU 62 HD11 LEU 62 -1.256 6.306 -11.035 1225 HD12 LEU 62 HD12 LEU 62 -2.609 6.668 -12.108 1226 HD13 LEU 62 HD13 LEU 62 -1.541 7.964 -11.569 1227 HD21 LEU 62 HD21 LEU 62 0.766 8.125 -12.437 1228 HD22 LEU 62 HD22 LEU 62 1.351 6.980 -13.642 1229 HD23 LEU 62 HD23 LEU 62 1.139 6.466 -11.968 1230 H MET 63 H MET 63 -1.589 3.583 -15.984 1231 HA MET 63 HA MET 63 -1.277 0.920 -15.251 1232 HB2 MET 63 HB2 MET 63 -2.001 1.946 -18.007 1233 HB3 MET 63 HB3 MET 63 -2.358 0.348 -17.369 1234 HG2 MET 63 HG2 MET 63 -3.896 1.257 -15.779 1235 HG3 MET 63 HG3 MET 63 -3.434 2.905 -16.210 1236 HE1 MET 63 HE1 MET 63 -7.043 2.749 -17.652 1237 HE2 MET 63 HE2 MET 63 -5.912 3.622 -16.615 1238 HE3 MET 63 HE3 MET 63 -6.474 2.010 -16.156 1239 H ASP 64 H ASP 64 0.191 2.612 -18.013 1240 HA ASP 64 HA ASP 64 1.723 0.503 -19.016 1241 HB2 ASP 64 HB2 ASP 64 1.227 2.717 -20.130 1242 HB3 ASP 64 HB3 ASP 64 2.464 3.440 -19.106 1243 H LYS 65 H LYS 65 2.586 3.015 -16.641 1244 HA LYS 65 HA LYS 65 5.240 2.285 -16.152 1245 HB2 LYS 65 HB2 LYS 65 3.183 3.455 -14.262 1246 HB3 LYS 65 HB3 LYS 65 4.898 3.353 -13.900 1247 HG2 LYS 65 HG2 LYS 65 5.300 4.739 -15.974 1248 HG3 LYS 65 HG3 LYS 65 3.555 4.991 -16.036 1249 HD2 LYS 65 HD2 LYS 65 4.576 6.875 -14.922 1250 HD3 LYS 65 HD3 LYS 65 3.662 5.942 -13.737 1251 HE2 LYS 65 HE2 LYS 65 5.658 4.964 -12.854 1252 HE3 LYS 65 HE3 LYS 65 6.630 5.615 -14.173 1253 HZ1 LYS 65 HZ1 LYS 65 6.264 7.827 -13.353 1254 HZ2 LYS 65 HZ2 LYS 65 6.870 6.871 -12.094 1255 HZ3 LYS 65 HZ3 LYS 65 5.225 7.265 -12.143 1256 H LEU 66 H LEU 66 2.273 1.119 -14.606 1257 HA LEU 66 HA LEU 66 3.613 -0.668 -12.799 1258 HB2 LEU 66 HB2 LEU 66 0.710 -0.488 -13.639 1259 HB3 LEU 66 HB3 LEU 66 1.312 -1.457 -12.304 1260 HG LEU 66 HG LEU 66 1.675 1.539 -12.407 1261 HD11 LEU 66 HD11 LEU 66 -0.259 1.700 -10.894 1262 HD12 LEU 66 HD12 LEU 66 -0.594 -0.011 -11.161 1263 HD13 LEU 66 HD13 LEU 66 -0.704 1.129 -12.501 1264 HD21 LEU 66 HD21 LEU 66 3.156 0.314 -10.893 1265 HD22 LEU 66 HD22 LEU 66 1.758 -0.440 -10.126 1266 HD23 LEU 66 HD23 LEU 66 2.001 1.303 -10.001 1267 H ARG 67 H ARG 67 2.397 -0.905 -16.037 1268 HA ARG 67 HA ARG 67 2.105 -3.753 -16.107 1269 HB2 ARG 67 HB2 ARG 67 0.850 -2.159 -17.548 1270 HB3 ARG 67 HB3 ARG 67 2.343 -1.797 -18.402 1271 HG2 ARG 67 HG2 ARG 67 2.466 -4.038 -19.262 1272 HG3 ARG 67 HG3 ARG 67 1.100 -4.542 -18.261 1273 HD2 ARG 67 HD2 ARG 67 0.966 -2.449 -20.439 1274 HD3 ARG 67 HD3 ARG 67 0.482 -4.133 -20.633 1275 HE ARG 67 HE ARG 67 -1.126 -3.577 -18.716 1276 HH11 ARG 67 HH11 ARG 67 -0.159 -1.313 -21.123 1277 HH12 ARG 67 HH12 ARG 67 -1.655 -0.450 -21.069 1278 HH21 ARG 67 HH21 ARG 67 -3.054 -2.459 -18.656 1279 HH22 ARG 67 HH22 ARG 67 -3.278 -1.094 -19.692 1280 H LYS 68 H LYS 68 4.835 -1.789 -16.114 1281 HA LYS 68 HA LYS 68 6.513 -3.267 -17.901 1282 HB2 LYS 68 HB2 LYS 68 7.381 -1.545 -15.566 1283 HB3 LYS 68 HB3 LYS 68 8.356 -2.013 -16.951 1284 HG2 LYS 68 HG2 LYS 68 5.961 -0.184 -16.975 1285 HG3 LYS 68 HG3 LYS 68 7.652 0.287 -17.157 1286 HD2 LYS 68 HD2 LYS 68 7.794 -0.953 -19.255 1287 HD3 LYS 68 HD3 LYS 68 6.128 -1.505 -19.060 1288 HE2 LYS 68 HE2 LYS 68 5.414 0.892 -19.071 1289 HE3 LYS 68 HE3 LYS 68 7.076 1.333 -19.463 1290 HZ1 LYS 68 HZ1 LYS 68 6.925 0.215 -21.526 1291 HZ2 LYS 68 HZ2 LYS 68 5.530 1.163 -21.389 1292 HZ3 LYS 68 HZ3 LYS 68 5.450 -0.504 -21.120 1293 H VAL 69 H VAL 69 5.370 -3.898 -14.743 1294 HA VAL 69 HA VAL 69 7.666 -5.304 -13.755 1295 HB VAL 69 HB VAL 69 4.826 -5.356 -12.706 1296 HG11 VAL 69 HG11 VAL 69 7.447 -6.074 -11.380 1297 HG12 VAL 69 HG12 VAL 69 6.185 -7.205 -11.873 1298 HG13 VAL 69 HG13 VAL 69 5.872 -6.037 -10.589 1299 HG21 VAL 69 HG21 VAL 69 7.142 -3.558 -11.954 1300 HG22 VAL 69 HG22 VAL 69 5.594 -3.632 -11.113 1301 HG23 VAL 69 HG23 VAL 69 5.664 -3.068 -12.783 1302 H GLN 70 H GLN 70 8.259 -7.280 -14.263 1303 HA GLN 70 HA GLN 70 7.023 -8.951 -16.077 1304 HB2 GLN 70 HB2 GLN 70 8.608 -10.699 -15.280 1305 HB3 GLN 70 HB3 GLN 70 9.364 -9.147 -15.602 1306 HG2 GLN 70 HG2 GLN 70 10.372 -9.862 -13.629 1307 HG3 GLN 70 HG3 GLN 70 9.157 -8.709 -13.090 1308 HE21 GLN 70 HE21 GLN 70 8.460 -12.012 -14.091 1309 HE22 GLN 70 HE22 GLN 70 7.975 -12.568 -12.529 1310 H GLY 71 H GLY 71 6.539 -8.846 -12.606 1311 HA2 GLY 71 HA2 GLY 71 5.337 -11.431 -12.386 1312 HA3 GLY 71 HA3 GLY 71 5.326 -10.170 -11.165 1313 H VAL 72 H VAL 72 4.084 -8.285 -13.212 1314 HA VAL 72 HA VAL 72 1.343 -9.039 -12.569 1315 HB VAL 72 HB VAL 72 2.347 -6.539 -13.945 1316 HG11 VAL 72 HG11 VAL 72 -0.344 -7.178 -12.714 1317 HG12 VAL 72 HG12 VAL 72 -0.002 -6.993 -14.435 1318 HG13 VAL 72 HG13 VAL 72 0.145 -5.609 -13.353 1319 HG21 VAL 72 HG21 VAL 72 3.252 -6.733 -11.688 1320 HG22 VAL 72 HG22 VAL 72 1.632 -7.009 -11.047 1321 HG23 VAL 72 HG23 VAL 72 2.044 -5.451 -11.766 1322 H PHE 73 H PHE 73 -0.198 -9.687 -13.996 1323 HA PHE 73 HA PHE 73 0.521 -9.710 -16.858 1324 HB2 PHE 73 HB2 PHE 73 -1.168 -11.799 -16.784 1325 HB3 PHE 73 HB3 PHE 73 0.566 -11.954 -16.559 1326 HD1 PHE 73 HD1 PHE 73 -2.678 -11.846 -14.783 1327 HD2 PHE 73 HD2 PHE 73 1.492 -12.684 -14.521 1328 HE1 PHE 73 HE1 PHE 73 -3.032 -12.942 -12.606 1329 HE2 PHE 73 HE2 PHE 73 1.141 -13.775 -12.351 1330 HZ PHE 73 HZ PHE 73 -1.116 -13.908 -11.391 1331 H THR 74 H THR 74 -1.669 -8.525 -14.593 1332 HA THR 74 HA THR 74 -3.371 -7.631 -16.822 1333 HB THR 74 HB THR 74 -5.415 -8.013 -15.788 1334 HG1 THR 74 HG1 THR 74 -5.699 -8.315 -13.596 1335 HG21 THR 74 HG21 THR 74 -3.739 -10.334 -14.815 1336 HG22 THR 74 HG22 THR 74 -4.411 -10.162 -16.440 1337 HG23 THR 74 HG23 THR 74 -5.487 -10.342 -15.053 1338 H VAL 75 H VAL 75 -3.315 -5.483 -16.915 1339 HA VAL 75 HA VAL 75 -3.497 -3.937 -14.404 1340 HB VAL 75 HB VAL 75 -1.899 -3.038 -16.819 1341 HG11 VAL 75 HG11 VAL 75 -2.160 -1.863 -14.045 1342 HG12 VAL 75 HG12 VAL 75 -2.861 -1.206 -15.526 1343 HG13 VAL 75 HG13 VAL 75 -1.109 -1.254 -15.325 1344 HG21 VAL 75 HG21 VAL 75 -0.892 -4.121 -14.182 1345 HG22 VAL 75 HG22 VAL 75 0.111 -3.399 -15.439 1346 HG23 VAL 75 HG23 VAL 75 -0.751 -4.907 -15.756 1347 H GLU 76 H GLU 76 -5.544 -3.165 -14.463 1348 HA GLU 76 HA GLU 76 -6.582 -2.094 -17.020 1349 HB2 GLU 76 HB2 GLU 76 -8.150 -3.736 -15.014 1350 HB3 GLU 76 HB3 GLU 76 -8.769 -3.066 -16.519 1351 HG2 GLU 76 HG2 GLU 76 -7.240 -4.506 -17.785 1352 HG3 GLU 76 HG3 GLU 76 -6.630 -5.180 -16.274 1353 H ARG 77 H ARG 77 -8.706 -0.857 -16.629 1354 HA ARG 77 HA ARG 77 -8.332 1.009 -14.398 1355 HB2 ARG 77 HB2 ARG 77 -8.532 1.992 -16.616 1356 HB3 ARG 77 HB3 ARG 77 -10.055 1.158 -16.883 1357 HG2 ARG 77 HG2 ARG 77 -11.101 2.468 -15.112 1358 HG3 ARG 77 HG3 ARG 77 -9.572 3.289 -14.802 1359 HD2 ARG 77 HD2 ARG 77 -11.074 4.656 -16.176 1360 HD3 ARG 77 HD3 ARG 77 -9.600 4.233 -17.049 1361 HE ARG 77 HE ARG 77 -11.277 2.301 -17.842 1362 HH11 ARG 77 HH11 ARG 77 -11.676 5.723 -17.700 1363 HH12 ARG 77 HH12 ARG 77 -12.771 5.757 -19.033 1364 HH21 ARG 77 HH21 ARG 77 -12.713 2.364 -19.516 1365 HH22 ARG 77 HH22 ARG 77 -13.377 3.880 -20.024 1366 H LEU 78 H LEU 78 -9.853 1.329 -12.809 1367 HA LEU 78 HA LEU 78 -12.122 -0.523 -12.691 1368 HB2 LEU 78 HB2 LEU 78 -10.953 1.353 -10.626 1369 HB3 LEU 78 HB3 LEU 78 -12.355 0.334 -10.350 1370 HG LEU 78 HG LEU 78 -9.555 -0.650 -10.951 1371 HD11 LEU 78 HD11 LEU 78 -9.749 0.322 -8.717 1372 HD12 LEU 78 HD12 LEU 78 -9.558 -1.429 -8.634 1373 HD13 LEU 78 HD13 LEU 78 -11.146 -0.705 -8.383 1374 HD21 LEU 78 HD21 LEU 78 -11.242 -2.162 -11.846 1375 HD22 LEU 78 HD22 LEU 78 -12.078 -2.180 -10.293 1376 HD23 LEU 78 HD23 LEU 78 -10.463 -2.877 -10.433 1377 H SER 79 H SER 79 -14.093 0.128 -13.317 1378 HA SER 79 HA SER 79 -14.621 3.012 -13.576 1379 HB2 SER 79 HB2 SER 79 -14.975 1.618 -15.585 1380 HB3 SER 79 HB3 SER 79 -16.179 0.671 -14.712 1381 HG SER 79 HG SER 79 -16.349 3.226 -15.792 1382 H ASN 80 H ASN 80 -16.021 0.068 -12.145 1383 HA ASN 80 HA ASN 80 -18.086 1.595 -10.797 1384 HB2 ASN 80 HB2 ASN 80 -18.665 -0.609 -9.732 1385 HB3 ASN 80 HB3 ASN 80 -18.733 -0.606 -11.489 1386 HD21 ASN 80 HD21 ASN 80 -18.330 -2.766 -9.486 1387 HD22 ASN 80 HD22 ASN 80 -16.905 -3.585 -10.014 1388 H LEU 81 H LEU 81 -16.814 3.042 -9.604 1389 HA LEU 81 HA LEU 81 -14.915 2.058 -7.645 1390 HB2 LEU 81 HB2 LEU 81 -15.930 4.867 -8.061 1391 HB3 LEU 81 HB3 LEU 81 -14.502 4.391 -7.166 1392 HG LEU 81 HG LEU 81 -14.903 4.215 -10.153 1393 HD11 LEU 81 HD11 LEU 81 -13.095 5.919 -8.424 1394 HD12 LEU 81 HD12 LEU 81 -14.493 6.467 -9.352 1395 HD13 LEU 81 HD13 LEU 81 -13.063 5.864 -10.190 1396 HD21 LEU 81 HD21 LEU 81 -13.602 2.298 -9.400 1397 HD22 LEU 81 HD22 LEU 81 -12.532 3.356 -8.481 1398 HD23 LEU 81 HD23 LEU 81 -12.565 3.448 -10.241 1399 H GLU 82 H GLU 82 -18.182 3.117 -7.689 1400 HA GLU 82 HA GLU 82 -19.781 3.565 -6.247 1401 HB2 GLU 82 HB2 GLU 82 -19.934 2.295 -4.099 1402 HB3 GLU 82 HB3 GLU 82 -19.769 1.306 -5.533 1403 HG2 GLU 82 HG2 GLU 82 -17.442 0.871 -4.999 1404 HG3 GLU 82 HG3 GLU 82 -17.541 1.942 -3.605 1405 H HIS 83 H HIS 83 -17.519 3.358 -3.503 1406 HA HIS 83 HA HIS 83 -16.512 4.978 -2.270 1407 HB2 HIS 83 HB2 HIS 83 -16.797 6.291 -4.920 1408 HB3 HIS 83 HB3 HIS 83 -16.355 7.299 -3.571 1409 HD1 HIS 83 HD1 HIS 83 -13.943 7.239 -2.826 1410 HD2 HIS 83 HD2 HIS 83 -14.928 4.174 -5.445 1411 HE1 HIS 83 HE1 HIS 83 -11.762 6.130 -3.416 1412 HE2 HIS 83 HE2 HIS 83 -12.412 4.162 -4.842 1413 H HIS 84 H HIS 84 -19.671 5.771 -3.566 1414 HA HIS 84 HA HIS 84 -20.388 6.915 -0.970 1415 HB2 HIS 84 HB2 HIS 84 -21.208 8.168 -3.611 1416 HB3 HIS 84 HB3 HIS 84 -21.698 8.708 -2.012 1417 HD1 HIS 84 HD1 HIS 84 -19.356 9.468 -4.586 1418 HD2 HIS 84 HD2 HIS 84 -19.266 9.565 -0.437 1419 HE1 HIS 84 HE1 HIS 84 -17.441 10.974 -3.995 1420 HE2 HIS 84 HE2 HIS 84 -17.555 11.189 -1.497 1421 H HIS 85 H HIS 85 -21.713 5.265 -0.324 1422 HA HIS 85 HA HIS 85 -23.186 3.648 -2.142 1423 HB2 HIS 85 HB2 HIS 85 -23.191 3.841 0.868 1424 HB3 HIS 85 HB3 HIS 85 -24.235 2.724 0.000 1425 HD1 HIS 85 HD1 HIS 85 -23.235 0.479 0.311 1426 HD2 HIS 85 HD2 HIS 85 -20.344 3.347 -0.512 1427 HE1 HIS 85 HE1 HIS 85 -21.076 -0.776 0.134 1428 HE2 HIS 85 HE2 HIS 85 -19.394 0.942 -0.582 1429 H HIS 86 H HIS 86 -24.672 4.760 -3.328 1430 HA HIS 86 HA HIS 86 -26.988 5.845 -1.842 1431 HB2 HIS 86 HB2 HIS 86 -27.515 7.110 -3.953 1432 HB3 HIS 86 HB3 HIS 86 -26.033 7.607 -3.148 1433 HD1 HIS 86 HD1 HIS 86 -23.883 7.443 -4.463 1434 HD2 HIS 86 HD2 HIS 86 -27.094 5.651 -6.402 1435 HE1 HIS 86 HE1 HIS 86 -23.061 6.904 -6.769 1436 HE2 HIS 86 HE2 HIS 86 -25.074 6.009 -7.974 1437 H HIS 87 H HIS 87 -25.954 3.241 -3.650 1438 HA HIS 87 HA HIS 87 -28.677 2.231 -3.846 1439 HB2 HIS 87 HB2 HIS 87 -28.355 3.248 -6.052 1440 HB3 HIS 87 HB3 HIS 87 -26.850 2.360 -6.265 1441 HD1 HIS 87 HD1 HIS 87 -30.568 1.940 -6.377 1442 HD2 HIS 87 HD2 HIS 87 -27.149 -0.343 -6.986 1443 HE1 HIS 87 HE1 HIS 87 -31.356 -0.173 -7.467 1444 HE2 HIS 87 HE2 HIS 87 -29.263 -1.475 -7.952 1445 H HIS 88 H HIS 88 -28.703 0.206 -3.069 1446 HA HIS 88 HA HIS 88 -26.432 -1.579 -3.583 1447 HB2 HIS 88 HB2 HIS 88 -26.290 -2.314 -1.265 1448 HB3 HIS 88 HB3 HIS 88 -26.011 -0.581 -1.364 1449 HD1 HIS 88 HD1 HIS 88 -28.223 0.913 -0.712 1450 HD2 HIS 88 HD2 HIS 88 -28.155 -3.034 0.584 1451 HE1 HIS 88 HE1 HIS 88 -29.897 0.790 1.147 1452 HE2 HIS 88 HE2 HIS 88 -29.822 -1.589 1.943 Start of MODEL 6 1 H1 MET 1 H1 MET 1 8.747 -22.259 8.177 2 H2 MET 1 H2 MET 1 9.227 -21.125 9.334 3 H3 MET 1 H3 MET 1 7.647 -21.098 8.735 4 HA MET 1 HA MET 1 7.201 -23.256 9.722 5 HB2 MET 1 HB2 MET 1 9.973 -22.957 10.920 6 HB3 MET 1 HB3 MET 1 8.831 -24.242 11.288 7 HG2 MET 1 HG2 MET 1 10.506 -25.053 9.764 8 HG3 MET 1 HG3 MET 1 8.947 -24.984 8.943 9 HE1 MET 1 HE1 MET 1 12.519 -23.437 9.297 10 HE2 MET 1 HE2 MET 1 11.508 -22.082 9.800 11 HE3 MET 1 HE3 MET 1 12.408 -22.001 8.284 12 H THR 2 H THR 2 9.369 -21.356 11.826 13 HA THR 2 HA THR 2 7.135 -20.800 13.615 14 HB THR 2 HB THR 2 10.054 -20.014 13.904 15 HG1 THR 2 HG1 THR 2 9.353 -21.819 15.701 16 HG21 THR 2 HG21 THR 2 8.583 -18.555 15.212 17 HG22 THR 2 HG22 THR 2 9.481 -19.637 16.277 18 HG23 THR 2 HG23 THR 2 7.787 -19.964 15.916 19 H ASP 3 H ASP 3 5.962 -19.446 12.162 20 HA ASP 3 HA ASP 3 6.582 -16.657 12.443 21 HB2 ASP 3 HB2 ASP 3 6.505 -16.183 9.971 22 HB3 ASP 3 HB3 ASP 3 7.955 -17.021 10.510 23 H PHE 4 H PHE 4 4.796 -15.275 11.870 24 HA PHE 4 HA PHE 4 2.284 -16.594 11.164 25 HB2 PHE 4 HB2 PHE 4 1.081 -15.627 13.057 26 HB3 PHE 4 HB3 PHE 4 2.376 -16.669 13.629 27 HD1 PHE 4 HD1 PHE 4 1.162 -13.215 13.400 28 HD2 PHE 4 HD2 PHE 4 4.316 -15.729 14.793 29 HE1 PHE 4 HE1 PHE 4 2.009 -11.380 14.802 30 HE2 PHE 4 HE2 PHE 4 5.158 -13.885 16.196 31 HZ PHE 4 HZ PHE 4 4.006 -11.711 16.197 32 H LEU 5 H LEU 5 0.528 -15.023 10.734 33 HA LEU 5 HA LEU 5 1.557 -12.752 9.249 34 HB2 LEU 5 HB2 LEU 5 -0.138 -14.162 8.235 35 HB3 LEU 5 HB3 LEU 5 -1.228 -13.862 9.574 36 HG LEU 5 HG LEU 5 -1.402 -11.494 8.915 37 HD11 LEU 5 HD11 LEU 5 0.804 -11.200 7.929 38 HD12 LEU 5 HD12 LEU 5 -0.455 -10.728 6.788 39 HD13 LEU 5 HD13 LEU 5 0.372 -12.275 6.601 40 HD21 LEU 5 HD21 LEU 5 -1.944 -13.409 6.646 41 HD22 LEU 5 HD22 LEU 5 -2.681 -11.820 6.859 42 HD23 LEU 5 HD23 LEU 5 -3.004 -13.105 8.022 43 H ALA 6 H ALA 6 2.044 -11.014 10.427 44 HA ALA 6 HA ALA 6 0.351 -10.201 12.675 45 HB1 ALA 6 HB1 ALA 6 2.789 -10.367 13.002 46 HB2 ALA 6 HB2 ALA 6 2.179 -8.737 13.290 47 HB3 ALA 6 HB3 ALA 6 3.022 -9.109 11.785 48 H GLY 7 H GLY 7 -0.180 -7.882 12.917 49 HA2 GLY 7 HA2 GLY 7 -0.435 -6.431 10.365 50 HA3 GLY 7 HA3 GLY 7 -1.873 -6.738 11.323 51 H ILE 8 H ILE 8 -0.528 -4.215 10.483 52 HA ILE 8 HA ILE 8 -0.428 -2.944 13.151 53 HB ILE 8 HB ILE 8 1.419 -2.188 10.865 54 HG12 ILE 8 HG12 ILE 8 2.105 -3.628 13.449 55 HG13 ILE 8 HG13 ILE 8 2.064 -4.370 11.852 56 HG21 ILE 8 HG21 ILE 8 0.813 -0.310 12.286 57 HG22 ILE 8 HG22 ILE 8 2.501 -0.746 12.543 58 HG23 ILE 8 HG23 ILE 8 1.280 -1.219 13.724 59 HD11 ILE 8 HD11 ILE 8 3.922 -2.163 12.719 60 HD12 ILE 8 HD12 ILE 8 3.891 -2.927 11.129 61 HD13 ILE 8 HD13 ILE 8 4.339 -3.867 12.552 62 H ARG 9 H ARG 9 -1.822 -1.222 13.274 63 HA ARG 9 HA ARG 9 -2.921 -0.180 10.746 64 HB2 ARG 9 HB2 ARG 9 -4.527 -1.109 12.419 65 HB3 ARG 9 HB3 ARG 9 -4.056 0.171 13.532 66 HG2 ARG 9 HG2 ARG 9 -4.930 1.857 12.085 67 HG3 ARG 9 HG3 ARG 9 -5.195 0.690 10.789 68 HD2 ARG 9 HD2 ARG 9 -6.783 -0.496 12.393 69 HD3 ARG 9 HD3 ARG 9 -6.674 0.952 13.399 70 HE ARG 9 HE ARG 9 -7.534 2.197 11.436 71 HH11 ARG 9 HH11 ARG 9 -8.113 -1.192 11.663 72 HH12 ARG 9 HH12 ARG 9 -9.490 -1.145 10.624 73 HH21 ARG 9 HH21 ARG 9 -9.283 2.251 10.084 74 HH22 ARG 9 HH22 ARG 9 -10.132 0.788 9.714 75 H ILE 10 H ILE 10 -2.489 1.793 10.073 76 HA ILE 10 HA ILE 10 -1.124 3.697 11.886 77 HB ILE 10 HB ILE 10 -0.915 3.573 8.867 78 HG12 ILE 10 HG12 ILE 10 1.127 2.554 10.859 79 HG13 ILE 10 HG13 ILE 10 0.004 1.513 9.985 80 HG21 ILE 10 HG21 ILE 10 1.049 5.009 9.187 81 HG22 ILE 10 HG22 ILE 10 0.746 5.031 10.925 82 HG23 ILE 10 HG23 ILE 10 -0.419 5.756 9.818 83 HD11 ILE 10 HD11 ILE 10 2.106 3.283 8.747 84 HD12 ILE 10 HD12 ILE 10 0.974 2.252 7.868 85 HD13 ILE 10 HD13 ILE 10 2.184 1.530 8.927 86 H VAL 11 H VAL 11 -2.469 5.392 12.413 87 HA VAL 11 HA VAL 11 -4.103 6.525 10.224 88 HB VAL 11 HB VAL 11 -4.752 6.474 13.175 89 HG11 VAL 11 HG11 VAL 11 -6.171 7.965 10.962 90 HG12 VAL 11 HG12 VAL 11 -5.278 8.689 12.299 91 HG13 VAL 11 HG13 VAL 11 -6.756 7.783 12.617 92 HG21 VAL 11 HG21 VAL 11 -5.328 4.442 11.923 93 HG22 VAL 11 HG22 VAL 11 -6.234 5.414 10.760 94 HG23 VAL 11 HG23 VAL 11 -6.776 5.308 12.436 95 H GLY 12 H GLY 12 -3.313 8.320 9.485 96 HA2 GLY 12 HA2 GLY 12 -2.210 10.329 11.334 97 HA3 GLY 12 HA3 GLY 12 -1.234 9.802 9.971 98 H GLU 13 H GLU 13 -1.759 12.429 10.130 99 HA GLU 13 HA GLU 13 -4.218 13.164 8.847 100 HB2 GLU 13 HB2 GLU 13 -3.284 15.452 8.879 101 HB3 GLU 13 HB3 GLU 13 -3.207 14.668 10.449 102 HG2 GLU 13 HG2 GLU 13 -0.822 14.175 10.069 103 HG3 GLU 13 HG3 GLU 13 -0.913 15.008 8.516 104 H ASP 14 H ASP 14 -4.647 13.372 6.746 105 HA ASP 14 HA ASP 14 -2.735 12.679 4.738 106 HB2 ASP 14 HB2 ASP 14 -5.017 12.074 4.351 107 HB3 ASP 14 HB3 ASP 14 -5.571 13.724 4.619 108 H LYS 15 H LYS 15 -1.213 14.000 3.967 109 HA LYS 15 HA LYS 15 -1.798 16.676 3.114 110 HB2 LYS 15 HB2 LYS 15 -0.154 17.806 4.591 111 HB3 LYS 15 HB3 LYS 15 -1.532 17.153 5.468 112 HG2 LYS 15 HG2 LYS 15 -0.157 15.190 6.095 113 HG3 LYS 15 HG3 LYS 15 1.226 15.947 5.304 114 HD2 LYS 15 HD2 LYS 15 -0.317 17.065 7.652 115 HD3 LYS 15 HD3 LYS 15 1.275 16.310 7.724 116 HE2 LYS 15 HE2 LYS 15 2.166 18.096 6.278 117 HE3 LYS 15 HE3 LYS 15 0.573 18.856 6.256 118 HZ1 LYS 15 HZ1 LYS 15 0.726 19.101 8.667 119 HZ2 LYS 15 HZ2 LYS 15 1.988 19.903 7.885 120 HZ3 LYS 15 HZ3 LYS 15 2.272 18.424 8.650 121 H ASN 16 H ASN 16 -0.519 17.272 1.503 122 HA ASN 16 HA ASN 16 1.007 17.165 -0.174 123 HB2 ASN 16 HB2 ASN 16 3.285 17.697 0.554 124 HB3 ASN 16 HB3 ASN 16 2.072 18.628 1.418 125 HD21 ASN 16 HD21 ASN 16 1.796 18.300 3.610 126 HD22 ASN 16 HD22 ASN 16 2.915 17.388 4.556 127 H GLY 17 H GLY 17 0.303 14.396 0.866 128 HA2 GLY 17 HA2 GLY 17 0.864 12.476 -0.487 129 HA3 GLY 17 HA3 GLY 17 2.518 13.054 -0.560 130 H MET 18 H MET 18 0.939 13.105 2.527 131 HA MET 18 HA MET 18 2.737 11.462 3.860 132 HB2 MET 18 HB2 MET 18 0.009 12.497 4.409 133 HB3 MET 18 HB3 MET 18 0.494 11.109 5.368 134 HG2 MET 18 HG2 MET 18 2.093 13.647 5.148 135 HG3 MET 18 HG3 MET 18 0.939 13.304 6.436 136 HE1 MET 18 HE1 MET 18 1.183 11.165 8.069 137 HE2 MET 18 HE2 MET 18 2.573 10.079 8.034 138 HE3 MET 18 HE3 MET 18 1.442 10.108 6.681 139 H THR 19 H THR 19 -0.367 10.557 2.402 140 HA THR 19 HA THR 19 -0.419 7.853 3.144 141 HB THR 19 HB THR 19 -1.924 7.543 1.176 142 HG1 THR 19 HG1 THR 19 -2.186 9.146 -0.288 143 HG21 THR 19 HG21 THR 19 -3.666 9.116 1.898 144 HG22 THR 19 HG22 THR 19 -2.462 10.056 2.779 145 HG23 THR 19 HG23 THR 19 -2.840 8.408 3.284 146 H ASN 20 H ASN 20 1.345 9.490 0.593 147 HA ASN 20 HA ASN 20 2.093 7.096 -0.821 148 HB2 ASN 20 HB2 ASN 20 3.185 9.921 -0.933 149 HB3 ASN 20 HB3 ASN 20 3.686 8.623 -2.011 150 HD21 ASN 20 HD21 ASN 20 2.398 8.067 -3.702 151 HD22 ASN 20 HD22 ASN 20 0.962 8.924 -4.132 152 H GLN 21 H GLN 21 3.749 9.334 1.407 153 HA GLN 21 HA GLN 21 6.250 8.029 1.327 154 HB2 GLN 21 HB2 GLN 21 6.908 9.420 3.145 155 HB3 GLN 21 HB3 GLN 21 5.866 10.382 2.116 156 HG2 GLN 21 HG2 GLN 21 4.035 10.140 3.659 157 HG3 GLN 21 HG3 GLN 21 4.963 9.009 4.641 158 HE21 GLN 21 HE21 GLN 21 4.623 12.352 3.690 159 HE22 GLN 21 HE22 GLN 21 5.554 13.001 4.989 160 H ILE 22 H ILE 22 3.488 7.679 3.496 161 HA ILE 22 HA ILE 22 4.643 6.131 5.499 162 HB ILE 22 HB ILE 22 1.834 6.394 4.471 163 HG12 ILE 22 HG12 ILE 22 2.758 8.238 5.770 164 HG13 ILE 22 HG13 ILE 22 1.489 7.433 6.688 165 HG21 ILE 22 HG21 ILE 22 2.651 4.605 6.765 166 HG22 ILE 22 HG22 ILE 22 1.974 4.080 5.223 167 HG23 ILE 22 HG23 ILE 22 0.996 5.042 6.329 168 HD11 ILE 22 HD11 ILE 22 3.374 8.002 8.100 169 HD12 ILE 22 HD12 ILE 22 4.451 7.061 7.069 170 HD13 ILE 22 HD13 ILE 22 3.182 6.252 7.990 171 H THR 23 H THR 23 2.834 4.931 2.645 172 HA THR 23 HA THR 23 3.459 2.207 3.259 173 HB THR 23 HB THR 23 2.473 3.248 0.589 174 HG1 THR 23 HG1 THR 23 0.739 3.783 1.704 175 HG21 THR 23 HG21 THR 23 3.242 0.929 0.559 176 HG22 THR 23 HG22 THR 23 1.486 0.995 0.417 177 HG23 THR 23 HG23 THR 23 2.229 0.562 1.956 178 H GLY 24 H GLY 24 4.941 4.713 1.309 179 HA2 GLY 24 HA2 GLY 24 6.793 3.183 -0.145 180 HA3 GLY 24 HA3 GLY 24 7.044 4.838 0.390 181 H VAL 25 H VAL 25 7.029 4.514 3.154 182 HA VAL 25 HA VAL 25 9.602 3.451 3.721 183 HB VAL 25 HB VAL 25 7.364 4.171 5.637 184 HG11 VAL 25 HG11 VAL 25 8.963 2.693 6.725 185 HG12 VAL 25 HG12 VAL 25 9.136 4.335 7.346 186 HG13 VAL 25 HG13 VAL 25 10.302 3.704 6.181 187 HG21 VAL 25 HG21 VAL 25 9.737 5.760 4.643 188 HG22 VAL 25 HG22 VAL 25 8.643 6.276 5.930 189 HG23 VAL 25 HG23 VAL 25 8.038 6.067 4.288 190 H ILE 26 H ILE 26 6.329 2.180 4.173 191 HA ILE 26 HA ILE 26 6.839 -0.094 5.666 192 HB ILE 26 HB ILE 26 4.802 0.402 3.501 193 HG12 ILE 26 HG12 ILE 26 4.586 0.300 6.526 194 HG13 ILE 26 HG13 ILE 26 4.601 1.762 5.547 195 HG21 ILE 26 HG21 ILE 26 5.170 -2.000 3.598 196 HG22 ILE 26 HG22 ILE 26 3.598 -1.588 4.282 197 HG23 ILE 26 HG23 ILE 26 4.948 -1.981 5.348 198 HD11 ILE 26 HD11 ILE 26 2.499 1.068 4.500 199 HD12 ILE 26 HD12 ILE 26 2.355 1.225 6.249 200 HD13 ILE 26 HD13 ILE 26 2.479 -0.375 5.515 201 H SER 27 H SER 27 7.058 0.250 2.120 202 HA SER 27 HA SER 27 7.613 -2.436 1.512 203 HB2 SER 27 HB2 SER 27 8.453 -1.648 -0.629 204 HB3 SER 27 HB3 SER 27 7.032 -0.708 -0.185 205 HG SER 27 HG SER 27 8.557 0.895 0.634 206 H LYS 28 H LYS 28 9.643 -0.070 2.995 207 HA LYS 28 HA LYS 28 12.154 -1.210 2.135 208 HB2 LYS 28 HB2 LYS 28 11.661 0.802 4.339 209 HB3 LYS 28 HB3 LYS 28 13.190 0.473 3.536 210 HG2 LYS 28 HG2 LYS 28 12.184 1.299 1.410 211 HG3 LYS 28 HG3 LYS 28 10.738 1.747 2.323 212 HD2 LYS 28 HD2 LYS 28 12.113 3.227 3.740 213 HD3 LYS 28 HD3 LYS 28 13.534 2.812 2.779 214 HE2 LYS 28 HE2 LYS 28 12.441 3.745 0.784 215 HE3 LYS 28 HE3 LYS 28 11.038 4.174 1.762 216 HZ1 LYS 28 HZ1 LYS 28 12.497 5.610 3.093 217 HZ2 LYS 28 HZ2 LYS 28 12.444 6.080 1.475 218 HZ3 LYS 28 HZ3 LYS 28 13.788 5.248 2.067 219 H PHE 29 H PHE 29 9.930 -2.238 4.395 220 HA PHE 29 HA PHE 29 11.568 -2.802 6.644 221 HB2 PHE 29 HB2 PHE 29 8.936 -3.998 5.764 222 HB3 PHE 29 HB3 PHE 29 9.708 -4.363 7.302 223 HD1 PHE 29 HD2 PHE 29 10.678 -1.205 7.203 224 HD2 PHE 29 HD1 PHE 29 6.999 -3.358 7.249 225 HE1 PHE 29 HE2 PHE 29 9.560 0.735 8.218 226 HE2 PHE 29 HE1 PHE 29 5.879 -1.413 8.269 227 HZ PHE 29 HZ PHE 29 7.162 0.634 8.752 228 H ASP 30 H ASP 30 11.684 -5.149 7.499 229 HA ASP 30 HA ASP 30 13.411 -6.609 5.698 230 HB2 ASP 30 HB2 ASP 30 12.563 -7.650 8.387 231 HB3 ASP 30 HB3 ASP 30 14.125 -7.785 7.586 232 H THR 31 H THR 31 10.220 -6.546 5.595 233 HA THR 31 HA THR 31 9.887 -9.456 5.262 234 HB THR 31 HB THR 31 9.005 -8.974 7.460 235 HG1 THR 31 HG1 THR 31 7.255 -10.140 7.108 236 HG21 THR 31 HG21 THR 31 7.162 -7.403 7.823 237 HG22 THR 31 HG22 THR 31 7.238 -6.916 6.128 238 HG23 THR 31 HG23 THR 31 8.593 -6.577 7.206 239 H ASN 32 H ASN 32 7.709 -9.975 4.200 240 HA ASN 32 HA ASN 32 7.381 -8.110 1.943 241 HB2 ASN 32 HB2 ASN 32 6.859 -11.090 2.083 242 HB3 ASN 32 HB3 ASN 32 6.570 -10.077 0.667 243 HD21 ASN 32 HD21 ASN 32 8.383 -9.103 -0.358 244 HD22 ASN 32 HD22 ASN 32 9.958 -9.792 -0.200 245 H ILE 33 H ILE 33 5.505 -7.145 1.582 246 HA ILE 33 HA ILE 33 3.369 -7.352 3.464 247 HB ILE 33 HB ILE 33 3.570 -5.840 0.847 248 HG12 ILE 33 HG12 ILE 33 3.616 -3.849 2.463 249 HG13 ILE 33 HG13 ILE 33 3.891 -5.019 3.745 250 HG21 ILE 33 HG21 ILE 33 1.568 -4.592 1.576 251 HG22 ILE 33 HG22 ILE 33 1.382 -5.712 2.926 252 HG23 ILE 33 HG23 ILE 33 1.231 -6.295 1.269 253 HD11 ILE 33 HD11 ILE 33 5.677 -4.533 1.375 254 HD12 ILE 33 HD12 ILE 33 5.954 -5.726 2.645 255 HD13 ILE 33 HD13 ILE 33 5.959 -4.008 3.035 256 H ARG 34 H ARG 34 1.763 -8.814 3.453 257 HA ARG 34 HA ARG 34 1.088 -10.189 0.941 258 HB2 ARG 34 HB2 ARG 34 0.970 -10.891 3.789 259 HB3 ARG 34 HB3 ARG 34 -0.475 -11.354 2.905 260 HG2 ARG 34 HG2 ARG 34 1.153 -13.170 3.000 261 HG3 ARG 34 HG3 ARG 34 0.847 -12.654 1.344 262 HD2 ARG 34 HD2 ARG 34 3.187 -11.581 2.902 263 HD3 ARG 34 HD3 ARG 34 3.281 -13.132 2.072 264 HE ARG 34 HE ARG 34 2.843 -10.531 0.743 265 HH11 ARG 34 HH11 ARG 34 3.911 -13.794 0.678 266 HH12 ARG 34 HH12 ARG 34 4.587 -13.671 -0.903 267 HH21 ARG 34 HH21 ARG 34 3.717 -10.365 -1.305 268 HH22 ARG 34 HH22 ARG 34 4.471 -11.751 -2.018 269 H THR 35 H THR 35 -0.153 -7.849 3.147 270 HA THR 35 HA THR 35 -2.334 -7.255 1.328 271 HB THR 35 HB THR 35 -2.954 -7.920 4.223 272 HG1 THR 35 HG1 THR 35 -3.123 -9.378 1.869 273 HG21 THR 35 HG21 THR 35 -4.796 -7.047 1.989 274 HG22 THR 35 HG22 THR 35 -4.331 -6.071 3.385 275 HG23 THR 35 HG23 THR 35 -5.295 -7.531 3.610 276 H ILE 36 H ILE 36 -2.631 -5.077 1.229 277 HA ILE 36 HA ILE 36 -2.043 -3.454 3.608 278 HB ILE 36 HB ILE 36 -0.041 -3.342 2.108 279 HG12 ILE 36 HG12 ILE 36 0.066 -0.823 2.026 280 HG13 ILE 36 HG13 ILE 36 -1.632 -0.790 2.491 281 HG21 ILE 36 HG21 ILE 36 -1.942 -2.032 0.165 282 HG22 ILE 36 HG22 ILE 36 -1.110 -3.573 -0.056 283 HG23 ILE 36 HG23 ILE 36 -0.185 -2.071 0.004 284 HD11 ILE 36 HD11 ILE 36 -0.167 -0.407 4.389 285 HD12 ILE 36 HD12 ILE 36 0.616 -1.963 4.115 286 HD13 ILE 36 HD13 ILE 36 -1.083 -1.900 4.586 287 H VAL 37 H VAL 37 -3.674 -2.106 4.056 288 HA VAL 37 HA VAL 37 -5.453 -1.243 1.852 289 HB VAL 37 HB VAL 37 -6.301 -2.010 4.659 290 HG11 VAL 37 HG11 VAL 37 -8.595 -1.562 3.899 291 HG12 VAL 37 HG12 VAL 37 -7.968 -0.964 2.364 292 HG13 VAL 37 HG13 VAL 37 -7.600 -0.107 3.861 293 HG21 VAL 37 HG21 VAL 37 -7.577 -3.798 3.558 294 HG22 VAL 37 HG22 VAL 37 -5.847 -3.950 3.246 295 HG23 VAL 37 HG23 VAL 37 -6.914 -3.308 1.997 296 H LEU 38 H LEU 38 -4.858 0.848 1.587 297 HA LEU 38 HA LEU 38 -4.848 2.580 3.985 298 HB2 LEU 38 HB2 LEU 38 -2.669 2.427 2.773 299 HB3 LEU 38 HB3 LEU 38 -3.447 3.071 1.342 300 HG LEU 38 HG LEU 38 -3.403 4.643 3.923 301 HD11 LEU 38 HD11 LEU 38 -1.082 4.101 3.443 302 HD12 LEU 38 HD12 LEU 38 -1.396 5.801 3.089 303 HD13 LEU 38 HD13 LEU 38 -1.279 4.632 1.771 304 HD21 LEU 38 HD21 LEU 38 -4.933 5.420 2.170 305 HD22 LEU 38 HD22 LEU 38 -3.596 5.479 1.021 306 HD23 LEU 38 HD23 LEU 38 -3.611 6.562 2.413 307 H ASN 39 H ASN 39 -6.689 3.670 4.142 308 HA ASN 39 HA ASN 39 -7.806 4.895 1.708 309 HB2 ASN 39 HB2 ASN 39 -10.105 4.538 2.807 310 HB3 ASN 39 HB3 ASN 39 -9.325 3.140 2.079 311 HD21 ASN 39 HD21 ASN 39 -11.363 3.126 4.070 312 HD22 ASN 39 HD22 ASN 39 -10.702 2.351 5.466 313 H ALA 40 H ALA 40 -7.856 7.009 1.825 314 HA ALA 40 HA ALA 40 -7.747 8.357 4.440 315 HB1 ALA 40 HB1 ALA 40 -7.215 9.476 1.678 316 HB2 ALA 40 HB2 ALA 40 -5.984 8.872 2.787 317 HB3 ALA 40 HB3 ALA 40 -6.936 10.292 3.218 318 H LYS 41 H LYS 41 -9.496 9.293 5.233 319 HA LYS 41 HA LYS 41 -11.497 10.470 3.434 320 HB2 LYS 41 HB2 LYS 41 -13.344 9.570 4.726 321 HB3 LYS 41 HB3 LYS 41 -12.355 8.253 4.119 322 HG2 LYS 41 HG2 LYS 41 -12.067 9.348 6.908 323 HG3 LYS 41 HG3 LYS 41 -13.183 8.044 6.502 324 HD2 LYS 41 HD2 LYS 41 -11.337 6.660 5.727 325 HD3 LYS 41 HD3 LYS 41 -10.196 7.973 6.022 326 HE2 LYS 41 HE2 LYS 41 -10.159 6.279 7.811 327 HE3 LYS 41 HE3 LYS 41 -10.637 7.867 8.406 328 HZ1 LYS 41 HZ1 LYS 41 -12.909 7.184 8.460 329 HZ2 LYS 41 HZ2 LYS 41 -11.998 6.016 9.276 330 HZ3 LYS 41 HZ3 LYS 41 -12.554 5.708 7.710 331 H ASP 42 H ASP 42 -12.493 12.304 4.211 332 HA ASP 42 HA ASP 42 -12.819 14.184 5.423 333 HB2 ASP 42 HB2 ASP 42 -12.417 12.324 7.773 334 HB3 ASP 42 HB3 ASP 42 -13.148 13.924 7.851 335 H GLY 43 H GLY 43 -9.942 13.290 4.814 336 HA2 GLY 43 HA2 GLY 43 -8.095 14.780 4.875 337 HA3 GLY 43 HA3 GLY 43 -8.705 15.450 6.376 338 H ILE 44 H ILE 44 -8.902 12.176 6.727 339 HA ILE 44 HA ILE 44 -6.117 11.898 7.710 340 HB ILE 44 HB ILE 44 -8.434 10.438 8.980 341 HG12 ILE 44 HG12 ILE 44 -7.392 13.165 9.793 342 HG13 ILE 44 HG13 ILE 44 -8.998 12.797 9.168 343 HG21 ILE 44 HG21 ILE 44 -5.710 11.220 10.038 344 HG22 ILE 44 HG22 ILE 44 -6.169 9.625 9.441 345 HG23 ILE 44 HG23 ILE 44 -6.925 10.271 10.896 346 HD11 ILE 44 HD11 ILE 44 -7.853 11.787 11.763 347 HD12 ILE 44 HD12 ILE 44 -9.468 11.453 11.140 348 HD13 ILE 44 HD13 ILE 44 -9.020 13.100 11.585 349 H PHE 45 H PHE 45 -5.325 9.638 7.719 350 HA PHE 45 HA PHE 45 -6.843 7.862 5.909 351 HB2 PHE 45 HB2 PHE 45 -4.830 7.144 4.799 352 HB3 PHE 45 HB3 PHE 45 -4.899 8.899 4.728 353 HD1 PHE 45 HD1 PHE 45 -3.190 6.005 6.214 354 HD2 PHE 45 HD2 PHE 45 -3.262 10.257 5.875 355 HE1 PHE 45 HE1 PHE 45 -0.932 6.119 7.180 356 HE2 PHE 45 HE2 PHE 45 -1.005 10.368 6.843 357 HZ PHE 45 HZ PHE 45 0.158 8.297 7.499 358 H THR 46 H THR 46 -6.809 5.677 6.358 359 HA THR 46 HA THR 46 -5.314 4.835 8.766 360 HB THR 46 HB THR 46 -7.584 4.792 9.440 361 HG1 THR 46 HG1 THR 46 -6.987 2.129 8.597 362 HG21 THR 46 HG21 THR 46 -8.255 3.308 6.896 363 HG22 THR 46 HG22 THR 46 -8.649 4.992 7.246 364 HG23 THR 46 HG23 THR 46 -9.382 3.699 8.195 365 H CYS 47 H CYS 47 -3.585 3.838 7.877 366 HA CYS 47 HA CYS 47 -3.955 1.968 5.647 367 HB2 CYS 47 HB2 CYS 47 -2.171 3.644 5.432 368 HB3 CYS 47 HB3 CYS 47 -1.416 3.045 6.904 369 HG CYS 47 HG CYS 47 -0.599 2.220 3.976 370 H ASN 48 H ASN 48 -4.232 -0.134 6.080 371 HA ASN 48 HA ASN 48 -3.246 -1.254 8.610 372 HB2 ASN 48 HB2 ASN 48 -5.154 -2.451 6.579 373 HB3 ASN 48 HB3 ASN 48 -4.709 -3.180 8.119 374 HD21 ASN 48 HD21 ASN 48 -7.336 -2.593 7.317 375 HD22 ASN 48 HD22 ASN 48 -7.963 -1.384 8.376 376 H LEU 49 H LEU 49 -1.290 -2.116 8.525 377 HA LEU 49 HA LEU 49 -0.258 -3.241 6.025 378 HB2 LEU 49 HB2 LEU 49 1.202 -1.646 7.031 379 HB3 LEU 49 HB3 LEU 49 1.054 -2.400 8.610 380 HG LEU 49 HG LEU 49 2.312 -4.358 7.809 381 HD11 LEU 49 HD11 LEU 49 3.433 -4.275 5.612 382 HD12 LEU 49 HD12 LEU 49 2.513 -2.823 5.219 383 HD13 LEU 49 HD13 LEU 49 1.675 -4.353 5.480 384 HD21 LEU 49 HD21 LEU 49 3.716 -1.735 7.278 385 HD22 LEU 49 HD22 LEU 49 4.499 -3.283 7.597 386 HD23 LEU 49 HD23 LEU 49 3.525 -2.514 8.850 387 H MET 50 H MET 50 -0.199 -5.374 5.703 388 HA MET 50 HA MET 50 -0.265 -7.174 8.048 389 HB2 MET 50 HB2 MET 50 -1.385 -7.723 5.293 390 HB3 MET 50 HB3 MET 50 -1.537 -8.748 6.715 391 HG2 MET 50 HG2 MET 50 -2.767 -6.029 6.301 392 HG3 MET 50 HG3 MET 50 -3.597 -7.580 6.351 393 HE1 MET 50 HE1 MET 50 -3.434 -9.180 8.600 394 HE2 MET 50 HE2 MET 50 -2.807 -8.581 10.134 395 HE3 MET 50 HE3 MET 50 -1.711 -8.838 8.778 396 H ILE 51 H ILE 51 1.633 -8.124 8.324 397 HA ILE 51 HA ILE 51 3.090 -9.205 6.020 398 HB ILE 51 HB ILE 51 5.262 -8.346 7.098 399 HG12 ILE 51 HG12 ILE 51 4.772 -5.976 8.141 400 HG13 ILE 51 HG13 ILE 51 3.214 -6.682 8.552 401 HG21 ILE 51 HG21 ILE 51 4.463 -7.573 4.947 402 HG22 ILE 51 HG22 ILE 51 5.152 -6.230 5.859 403 HG23 ILE 51 HG23 ILE 51 3.401 -6.404 5.732 404 HD11 ILE 51 HD11 ILE 51 4.378 -8.441 9.813 405 HD12 ILE 51 HD12 ILE 51 4.746 -6.823 10.413 406 HD13 ILE 51 HD13 ILE 51 5.923 -7.682 9.419 407 H PHE 52 H PHE 52 4.766 -10.757 6.606 408 HA PHE 52 HA PHE 52 3.917 -12.348 8.908 409 HB2 PHE 52 HB2 PHE 52 5.464 -12.942 6.408 410 HB3 PHE 52 HB3 PHE 52 5.645 -14.003 7.800 411 HD1 PHE 52 HD2 PHE 52 3.765 -15.298 8.637 412 HD2 PHE 52 HD1 PHE 52 3.409 -12.920 5.122 413 HE1 PHE 52 HE2 PHE 52 1.714 -16.508 8.037 414 HE2 PHE 52 HE1 PHE 52 1.352 -14.130 4.514 415 HZ PHE 52 HZ PHE 52 0.504 -15.928 5.967 416 H VAL 53 H VAL 53 5.097 -12.708 10.692 417 HA VAL 53 HA VAL 53 7.927 -11.866 10.731 418 HB VAL 53 HB VAL 53 7.755 -10.745 12.789 419 HG11 VAL 53 HG11 VAL 53 5.259 -10.003 11.268 420 HG12 VAL 53 HG12 VAL 53 6.888 -9.396 10.960 421 HG13 VAL 53 HG13 VAL 53 6.071 -9.005 12.476 422 HG21 VAL 53 HG21 VAL 53 4.942 -11.794 13.090 423 HG22 VAL 53 HG22 VAL 53 5.761 -10.699 14.205 424 HG23 VAL 53 HG23 VAL 53 6.363 -12.341 13.983 425 H LYS 54 H LYS 54 9.277 -13.011 12.195 426 HA LYS 54 HA LYS 54 8.312 -15.624 13.029 427 HB2 LYS 54 HB2 LYS 54 11.025 -14.336 13.414 428 HB3 LYS 54 HB3 LYS 54 10.631 -16.014 13.756 429 HG2 LYS 54 HG2 LYS 54 10.100 -16.312 11.331 430 HG3 LYS 54 HG3 LYS 54 10.702 -14.676 11.054 431 HD2 LYS 54 HD2 LYS 54 12.271 -16.993 12.200 432 HD3 LYS 54 HD3 LYS 54 12.446 -16.314 10.581 433 HE2 LYS 54 HE2 LYS 54 13.329 -14.281 11.429 434 HE3 LYS 54 HE3 LYS 54 12.860 -14.681 13.080 435 HZ1 LYS 54 HZ1 LYS 54 14.948 -16.059 11.477 436 HZ2 LYS 54 HZ2 LYS 54 14.468 -16.497 13.040 437 HZ3 LYS 54 HZ3 LYS 54 15.211 -15.003 12.774 438 H ASN 55 H ASN 55 9.114 -12.532 14.449 439 HA ASN 55 HA ASN 55 8.162 -13.490 17.062 440 HB2 ASN 55 HB2 ASN 55 9.980 -12.080 18.128 441 HB3 ASN 55 HB3 ASN 55 10.524 -13.555 17.330 442 HD21 ASN 55 HD21 ASN 55 11.719 -13.406 15.442 443 HD22 ASN 55 HD22 ASN 55 12.426 -11.921 14.909 444 H THR 56 H THR 56 7.158 -11.940 18.365 445 HA THR 56 HA THR 56 5.813 -9.823 17.058 446 HB THR 56 HB THR 56 5.010 -9.145 19.285 447 HG1 THR 56 HG1 THR 56 6.252 -11.203 20.653 448 HG21 THR 56 HG21 THR 56 5.048 -12.150 18.931 449 HG22 THR 56 HG22 THR 56 3.908 -11.036 18.175 450 HG23 THR 56 HG23 THR 56 3.911 -11.243 19.926 451 H ASP 57 H ASP 57 8.898 -9.988 18.567 452 HA ASP 57 HA ASP 57 9.314 -7.343 19.377 453 HB2 ASP 57 HB2 ASP 57 10.785 -9.287 19.910 454 HB3 ASP 57 HB3 ASP 57 11.366 -9.267 18.248 455 H LYS 58 H LYS 58 10.124 -8.894 16.253 456 HA LYS 58 HA LYS 58 11.044 -6.556 14.986 457 HB2 LYS 58 HB2 LYS 58 11.440 -7.940 13.238 458 HB3 LYS 58 HB3 LYS 58 10.938 -9.217 14.319 459 HG2 LYS 58 HG2 LYS 58 9.754 -9.674 12.396 460 HG3 LYS 58 HG3 LYS 58 8.575 -8.802 13.369 461 HD2 LYS 58 HD2 LYS 58 8.445 -8.005 11.106 462 HD3 LYS 58 HD3 LYS 58 9.131 -6.728 12.106 463 HE2 LYS 58 HE2 LYS 58 10.861 -8.625 10.528 464 HE3 LYS 58 HE3 LYS 58 10.198 -7.157 9.813 465 HZ1 LYS 58 HZ1 LYS 58 12.096 -7.366 12.084 466 HZ2 LYS 58 HZ2 LYS 58 11.303 -5.934 11.682 467 HZ3 LYS 58 HZ3 LYS 58 12.358 -6.651 10.576 468 H LEU 59 H LEU 59 7.838 -7.858 15.460 469 HA LEU 59 HA LEU 59 6.409 -6.180 13.690 470 HB2 LEU 59 HB2 LEU 59 5.451 -8.210 14.616 471 HB3 LEU 59 HB3 LEU 59 5.567 -7.563 16.239 472 HG LEU 59 HG LEU 59 3.886 -5.836 15.656 473 HD11 LEU 59 HD11 LEU 59 3.718 -7.324 13.037 474 HD12 LEU 59 HD12 LEU 59 4.287 -5.671 13.271 475 HD13 LEU 59 HD13 LEU 59 2.596 -6.073 13.577 476 HD21 LEU 59 HD21 LEU 59 3.006 -8.684 15.148 477 HD22 LEU 59 HD22 LEU 59 1.952 -7.342 15.596 478 HD23 LEU 59 HD23 LEU 59 3.179 -7.911 16.726 479 H THR 60 H THR 60 7.092 -5.858 17.193 480 HA THR 60 HA THR 60 5.815 -3.326 17.469 481 HB THR 60 HB THR 60 7.009 -3.143 19.627 482 HG1 THR 60 HG1 THR 60 8.411 -4.877 20.233 483 HG21 THR 60 HG21 THR 60 6.067 -5.132 20.706 484 HG22 THR 60 HG22 THR 60 5.880 -5.907 19.133 485 HG23 THR 60 HG23 THR 60 4.940 -4.466 19.524 486 H THR 61 H THR 61 9.054 -4.315 16.573 487 HA THR 61 HA THR 61 10.362 -1.834 16.776 488 HB THR 61 HB THR 61 10.872 -4.058 14.780 489 HG1 THR 61 HG1 THR 61 11.079 -4.375 17.220 490 HG21 THR 61 HG21 THR 61 12.664 -1.765 15.611 491 HG22 THR 61 HG22 THR 61 11.895 -1.962 14.035 492 HG23 THR 61 HG23 THR 61 13.127 -3.107 14.564 493 H LEU 62 H LEU 62 8.513 -3.257 14.089 494 HA LEU 62 HA LEU 62 8.916 -1.215 12.207 495 HB2 LEU 62 HB2 LEU 62 6.454 -2.932 12.562 496 HB3 LEU 62 HB3 LEU 62 6.868 -2.021 11.121 497 HG LEU 62 HG LEU 62 8.329 -4.424 12.230 498 HD11 LEU 62 HD11 LEU 62 6.263 -4.934 11.035 499 HD12 LEU 62 HD12 LEU 62 7.677 -5.473 10.132 500 HD13 LEU 62 HD13 LEU 62 6.830 -4.003 9.647 501 HD21 LEU 62 HD21 LEU 62 9.031 -2.702 9.853 502 HD22 LEU 62 HD22 LEU 62 9.806 -4.227 10.286 503 HD23 LEU 62 HD23 LEU 62 9.948 -2.830 11.354 504 H MET 63 H MET 63 6.538 -1.513 14.804 505 HA MET 63 HA MET 63 4.879 0.641 14.237 506 HB2 MET 63 HB2 MET 63 5.816 -0.258 16.972 507 HB3 MET 63 HB3 MET 63 4.386 0.709 16.640 508 HG2 MET 63 HG2 MET 63 3.361 -1.135 15.464 509 HG3 MET 63 HG3 MET 63 4.822 -2.104 15.666 510 HE1 MET 63 HE1 MET 63 1.931 -3.163 16.515 511 HE2 MET 63 HE2 MET 63 2.367 -3.945 18.035 512 HE3 MET 63 HE3 MET 63 3.445 -4.063 16.644 513 H ASP 64 H ASP 64 7.855 0.632 16.199 514 HA ASP 64 HA ASP 64 7.931 3.351 16.826 515 HB2 ASP 64 HB2 ASP 64 9.398 1.552 17.801 516 HB3 ASP 64 HB3 ASP 64 10.340 1.587 16.313 517 H LYS 65 H LYS 65 9.288 1.627 14.036 518 HA LYS 65 HA LYS 65 10.536 3.763 12.730 519 HB2 LYS 65 HB2 LYS 65 9.171 1.328 11.553 520 HB3 LYS 65 HB3 LYS 65 10.264 2.384 10.668 521 HG2 LYS 65 HG2 LYS 65 12.057 1.807 12.292 522 HG3 LYS 65 HG3 LYS 65 10.947 0.663 13.050 523 HD2 LYS 65 HD2 LYS 65 12.414 -0.525 11.530 524 HD3 LYS 65 HD3 LYS 65 10.771 -0.543 10.883 525 HE2 LYS 65 HE2 LYS 65 12.458 -0.087 9.147 526 HE3 LYS 65 HE3 LYS 65 11.326 1.249 9.345 527 HZ1 LYS 65 HZ1 LYS 65 13.662 1.955 9.137 528 HZ2 LYS 65 HZ2 LYS 65 14.024 1.153 10.580 529 HZ3 LYS 65 HZ3 LYS 65 12.954 2.458 10.582 530 H LEU 66 H LEU 66 7.198 2.585 12.452 531 HA LEU 66 HA LEU 66 6.343 4.513 10.548 532 HB2 LEU 66 HB2 LEU 66 4.740 2.921 12.557 533 HB3 LEU 66 HB3 LEU 66 4.071 3.782 11.183 534 HG LEU 66 HG LEU 66 6.041 1.501 10.938 535 HD11 LEU 66 HD11 LEU 66 4.137 0.117 10.277 536 HD12 LEU 66 HD12 LEU 66 3.037 1.444 10.653 537 HD13 LEU 66 HD13 LEU 66 3.979 0.688 11.938 538 HD21 LEU 66 HD21 LEU 66 6.063 3.008 9.032 539 HD22 LEU 66 HD22 LEU 66 4.308 2.898 8.894 540 HD23 LEU 66 HD23 LEU 66 5.308 1.478 8.587 541 H ARG 67 H ARG 67 6.499 4.498 14.053 542 HA ARG 67 HA ARG 67 4.944 6.879 14.438 543 HB2 ARG 67 HB2 ARG 67 6.847 5.397 16.264 544 HB3 ARG 67 HB3 ARG 67 5.878 6.779 16.768 545 HG2 ARG 67 HG2 ARG 67 3.840 5.569 16.362 546 HG3 ARG 67 HG3 ARG 67 4.733 4.218 15.664 547 HD2 ARG 67 HD2 ARG 67 5.799 3.808 17.838 548 HD3 ARG 67 HD3 ARG 67 4.899 5.161 18.529 549 HE ARG 67 HE ARG 67 2.891 3.701 17.671 550 HH11 ARG 67 HH11 ARG 67 5.769 2.660 19.253 551 HH12 ARG 67 HH12 ARG 67 5.014 1.279 19.960 552 HH21 ARG 67 HH21 ARG 67 1.923 1.926 18.570 553 HH22 ARG 67 HH22 ARG 67 2.836 0.875 19.594 554 H LYS 68 H LYS 68 8.075 6.387 13.273 555 HA LYS 68 HA LYS 68 9.322 8.758 14.278 556 HB2 LYS 68 HB2 LYS 68 9.927 7.090 11.832 557 HB3 LYS 68 HB3 LYS 68 10.940 8.402 12.414 558 HG2 LYS 68 HG2 LYS 68 10.283 5.944 14.031 559 HG3 LYS 68 HG3 LYS 68 11.719 6.111 13.027 560 HD2 LYS 68 HD2 LYS 68 12.575 6.740 15.062 561 HD3 LYS 68 HD3 LYS 68 12.073 8.308 14.452 562 HE2 LYS 68 HE2 LYS 68 11.431 8.039 16.784 563 HE3 LYS 68 HE3 LYS 68 10.000 8.139 15.766 564 HZ1 LYS 68 HZ1 LYS 68 9.789 5.743 15.879 565 HZ2 LYS 68 HZ2 LYS 68 9.795 6.407 17.431 566 HZ3 LYS 68 HZ3 LYS 68 11.176 5.630 16.840 567 H VAL 69 H VAL 69 6.836 8.272 12.019 568 HA VAL 69 HA VAL 69 7.456 10.575 10.360 569 HB VAL 69 HB VAL 69 5.004 8.793 10.387 570 HG11 VAL 69 HG11 VAL 69 4.525 9.765 8.178 571 HG12 VAL 69 HG12 VAL 69 5.884 10.872 8.374 572 HG13 VAL 69 HG13 VAL 69 4.493 10.981 9.455 573 HG21 VAL 69 HG21 VAL 69 7.444 8.765 8.597 574 HG22 VAL 69 HG22 VAL 69 5.991 7.797 8.348 575 HG23 VAL 69 HG23 VAL 69 6.987 7.538 9.779 576 H GLN 70 H GLN 70 6.855 12.579 10.816 577 HA GLN 70 HA GLN 70 5.492 13.367 13.122 578 HB2 GLN 70 HB2 GLN 70 5.427 15.617 12.044 579 HB3 GLN 70 HB3 GLN 70 7.013 14.860 12.018 580 HG2 GLN 70 HG2 GLN 70 6.633 14.175 9.684 581 HG3 GLN 70 HG3 GLN 70 5.068 14.985 9.717 582 HE21 GLN 70 HE21 GLN 70 5.686 16.353 8.031 583 HE22 GLN 70 HE22 GLN 70 6.789 17.660 8.270 584 H GLY 71 H GLY 71 4.247 12.736 9.881 585 HA2 GLY 71 HA2 GLY 71 1.745 14.040 10.215 586 HA3 GLY 71 HA3 GLY 71 2.134 12.854 8.985 587 H VAL 72 H VAL 72 2.827 10.938 11.356 588 HA VAL 72 HA VAL 72 0.083 9.919 11.543 589 HB VAL 72 HB VAL 72 2.666 8.567 12.357 590 HG11 VAL 72 HG11 VAL 72 -0.135 7.465 12.041 591 HG12 VAL 72 HG12 VAL 72 0.754 7.653 13.553 592 HG13 VAL 72 HG13 VAL 72 1.310 6.498 12.342 593 HG21 VAL 72 HG21 VAL 72 1.031 8.255 9.835 594 HG22 VAL 72 HG22 VAL 72 2.428 7.276 10.283 595 HG23 VAL 72 HG23 VAL 72 2.627 8.998 9.960 596 H PHE 73 H PHE 73 -0.986 9.479 13.464 597 HA PHE 73 HA PHE 73 0.382 10.254 15.954 598 HB2 PHE 73 HB2 PHE 73 -2.083 10.936 16.670 599 HB3 PHE 73 HB3 PHE 73 -1.000 12.047 15.856 600 HD1 PHE 73 HD1 PHE 73 -3.965 9.906 15.425 601 HD2 PHE 73 HD2 PHE 73 -1.442 12.848 13.663 602 HE1 PHE 73 HE1 PHE 73 -5.648 10.301 13.672 603 HE2 PHE 73 HE2 PHE 73 -3.119 13.247 11.910 604 HZ PHE 73 HZ PHE 73 -5.224 11.974 11.911 605 H THR 74 H THR 74 -1.364 7.802 14.351 606 HA THR 74 HA THR 74 -1.391 6.307 16.899 607 HB THR 74 HB THR 74 -3.462 5.291 16.561 608 HG1 THR 74 HG1 THR 74 -3.251 4.736 14.366 609 HG21 THR 74 HG21 THR 74 -5.105 7.074 16.155 610 HG22 THR 74 HG22 THR 74 -3.828 8.094 15.490 611 HG23 THR 74 HG23 THR 74 -3.791 7.631 17.192 612 H VAL 75 H VAL 75 -0.149 4.559 16.783 613 HA VAL 75 HA VAL 75 -0.162 2.929 14.326 614 HB VAL 75 HB VAL 75 2.329 3.499 15.962 615 HG11 VAL 75 HG11 VAL 75 3.501 2.250 14.205 616 HG12 VAL 75 HG12 VAL 75 1.960 1.914 13.414 617 HG13 VAL 75 HG13 VAL 75 2.294 1.249 15.013 618 HG21 VAL 75 HG21 VAL 75 3.154 4.718 14.004 619 HG22 VAL 75 HG22 VAL 75 1.677 5.457 14.626 620 HG23 VAL 75 HG23 VAL 75 1.619 4.451 13.179 621 H GLU 76 H GLU 76 -1.159 1.090 14.963 622 HA GLU 76 HA GLU 76 -0.600 0.003 17.664 623 HB2 GLU 76 HB2 GLU 76 -3.296 0.218 16.296 624 HB3 GLU 76 HB3 GLU 76 -3.006 -0.557 17.848 625 HG2 GLU 76 HG2 GLU 76 -2.727 1.435 18.953 626 HG3 GLU 76 HG3 GLU 76 -2.193 2.290 17.508 627 H ARG 77 H ARG 77 -1.177 -2.282 17.943 628 HA ARG 77 HA ARG 77 -0.543 -3.882 15.609 629 HB2 ARG 77 HB2 ARG 77 0.413 -4.403 17.840 630 HB3 ARG 77 HB3 ARG 77 -1.205 -4.745 18.437 631 HG2 ARG 77 HG2 ARG 77 -1.399 -6.580 16.806 632 HG3 ARG 77 HG3 ARG 77 0.245 -6.252 16.262 633 HD2 ARG 77 HD2 ARG 77 0.320 -8.088 17.800 634 HD3 ARG 77 HD3 ARG 77 1.032 -6.681 18.588 635 HE ARG 77 HE ARG 77 -1.783 -7.197 19.115 636 HH11 ARG 77 HH11 ARG 77 1.479 -7.457 20.209 637 HH12 ARG 77 HH12 ARG 77 1.011 -7.743 21.849 638 HH21 ARG 77 HH21 ARG 77 -2.354 -7.604 21.225 639 HH22 ARG 77 HH22 ARG 77 -1.114 -7.822 22.412 640 H LEU 78 H LEU 78 -1.899 -5.295 14.549 641 HA LEU 78 HA LEU 78 -4.763 -5.210 15.239 642 HB2 LEU 78 HB2 LEU 78 -3.380 -6.002 12.671 643 HB3 LEU 78 HB3 LEU 78 -5.112 -6.084 12.931 644 HG LEU 78 HG LEU 78 -3.470 -3.540 12.974 645 HD11 LEU 78 HD11 LEU 78 -4.594 -3.026 10.856 646 HD12 LEU 78 HD12 LEU 78 -5.349 -4.620 10.871 647 HD13 LEU 78 HD13 LEU 78 -3.596 -4.476 10.731 648 HD21 LEU 78 HD21 LEU 78 -6.454 -3.982 13.136 649 HD22 LEU 78 HD22 LEU 78 -5.659 -2.415 12.985 650 HD23 LEU 78 HD23 LEU 78 -5.410 -3.394 14.432 651 H SER 79 H SER 79 -5.063 -6.824 16.718 652 HA SER 79 HA SER 79 -3.868 -9.440 16.426 653 HB2 SER 79 HB2 SER 79 -5.279 -10.016 18.408 654 HB3 SER 79 HB3 SER 79 -4.273 -8.591 18.666 655 HG SER 79 HG SER 79 -6.030 -7.530 19.052 656 H ASN 80 H ASN 80 -7.274 -8.374 16.567 657 HA ASN 80 HA ASN 80 -8.266 -10.743 15.303 658 HB2 ASN 80 HB2 ASN 80 -9.652 -9.427 16.858 659 HB3 ASN 80 HB3 ASN 80 -9.618 -8.064 15.741 660 HD21 ASN 80 HD21 ASN 80 -10.882 -11.242 16.336 661 HD22 ASN 80 HD22 ASN 80 -12.099 -11.199 15.113 662 H LEU 81 H LEU 81 -8.208 -11.199 13.185 663 HA LEU 81 HA LEU 81 -7.914 -8.964 11.277 664 HB2 LEU 81 HB2 LEU 81 -6.597 -11.681 11.163 665 HB3 LEU 81 HB3 LEU 81 -6.467 -10.439 9.930 666 HG LEU 81 HG LEU 81 -5.454 -10.202 12.772 667 HD11 LEU 81 HD11 LEU 81 -3.958 -10.564 10.175 668 HD12 LEU 81 HD12 LEU 81 -4.115 -11.752 11.471 669 HD13 LEU 81 HD13 LEU 81 -3.225 -10.257 11.752 670 HD21 LEU 81 HD21 LEU 81 -5.230 -8.296 10.438 671 HD22 LEU 81 HD22 LEU 81 -4.396 -8.123 11.984 672 HD23 LEU 81 HD23 LEU 81 -6.156 -8.041 11.919 673 H GLU 82 H GLU 82 -8.835 -9.162 9.236 674 HA GLU 82 HA GLU 82 -11.130 -10.971 9.082 675 HB2 GLU 82 HB2 GLU 82 -11.801 -9.527 7.156 676 HB3 GLU 82 HB3 GLU 82 -11.603 -8.637 8.660 677 HG2 GLU 82 HG2 GLU 82 -9.493 -7.756 7.943 678 HG3 GLU 82 HG3 GLU 82 -9.493 -8.787 6.512 679 H HIS 83 H HIS 83 -8.396 -11.940 8.691 680 HA HIS 83 HA HIS 83 -8.163 -12.450 5.825 681 HB2 HIS 83 HB2 HIS 83 -6.330 -13.018 8.158 682 HB3 HIS 83 HB3 HIS 83 -5.993 -13.537 6.514 683 HD1 HIS 83 HD1 HIS 83 -4.593 -11.973 5.222 684 HD2 HIS 83 HD2 HIS 83 -6.700 -10.021 8.220 685 HE1 HIS 83 HE1 HIS 83 -3.824 -9.593 5.141 686 HE2 HIS 83 HE2 HIS 83 -5.247 -8.395 6.833 687 H HIS 84 H HIS 84 -7.609 -14.691 5.115 688 HA HIS 84 HA HIS 84 -9.268 -16.658 6.574 689 HB2 HIS 84 HB2 HIS 84 -8.862 -16.495 3.575 690 HB3 HIS 84 HB3 HIS 84 -9.952 -17.577 4.435 691 HD1 HIS 84 HD1 HIS 84 -9.649 -14.087 3.171 692 HD2 HIS 84 HD2 HIS 84 -12.317 -16.347 5.418 693 HE1 HIS 84 HE1 HIS 84 -11.763 -12.740 3.261 694 HE2 HIS 84 HE2 HIS 84 -13.269 -14.022 4.809 695 H HIS 85 H HIS 85 -7.639 -17.758 7.672 696 HA HIS 85 HA HIS 85 -5.307 -18.785 6.300 697 HB2 HIS 85 HB2 HIS 85 -6.454 -19.274 9.051 698 HB3 HIS 85 HB3 HIS 85 -5.045 -20.140 8.458 699 HD1 HIS 85 HD1 HIS 85 -6.008 -17.133 10.213 700 HD2 HIS 85 HD2 HIS 85 -2.807 -18.328 7.850 701 HE1 HIS 85 HE1 HIS 85 -4.139 -15.556 10.767 702 HE2 HIS 85 HE2 HIS 85 -2.153 -16.468 9.522 703 H HIS 86 H HIS 86 -8.544 -19.762 6.502 704 HA HIS 86 HA HIS 86 -9.699 -21.701 6.177 705 HB2 HIS 86 HB2 HIS 86 -7.197 -22.660 4.747 706 HB3 HIS 86 HB3 HIS 86 -8.824 -23.306 4.559 707 HD1 HIS 86 HD1 HIS 86 -6.519 -20.940 3.092 708 HD2 HIS 86 HD2 HIS 86 -10.654 -21.289 3.368 709 HE1 HIS 86 HE1 HIS 86 -7.444 -19.430 1.311 710 HE2 HIS 86 HE2 HIS 86 -9.931 -19.782 1.394 711 H HIS 87 H HIS 87 -9.599 -22.068 8.481 712 HA HIS 87 HA HIS 87 -7.494 -23.138 9.895 713 HB2 HIS 87 HB2 HIS 87 -9.308 -23.927 11.542 714 HB3 HIS 87 HB3 HIS 87 -9.187 -22.210 11.188 715 HD1 HIS 87 HD1 HIS 87 -11.296 -21.089 10.540 716 HD2 HIS 87 HD2 HIS 87 -11.503 -25.207 10.016 717 HE1 HIS 87 HE1 HIS 87 -13.655 -21.559 9.842 718 HE2 HIS 87 HE2 HIS 87 -13.807 -24.065 9.762 719 H HIS 88 H HIS 88 -6.410 -24.911 9.575 720 HA HIS 88 HA HIS 88 -7.830 -27.489 9.425 721 HB2 HIS 88 HB2 HIS 88 -5.446 -26.660 7.750 722 HB3 HIS 88 HB3 HIS 88 -6.003 -28.322 7.905 723 HD1 HIS 88 HD1 HIS 88 -6.423 -25.385 5.861 724 HD2 HIS 88 HD2 HIS 88 -8.797 -28.613 6.946 725 HE1 HIS 88 HE1 HIS 88 -8.256 -25.473 4.152 726 HE2 HIS 88 HE2 HIS 88 -9.779 -27.310 4.941 727 H1 MET 1 H1 MET 1 -9.929 20.293 -10.515 728 H2 MET 1 H2 MET 1 -9.621 21.945 -10.335 729 H3 MET 1 H3 MET 1 -8.998 21.115 -11.668 730 HA MET 1 HA MET 1 -11.871 21.555 -11.090 731 HB2 MET 1 HB2 MET 1 -10.072 22.864 -13.143 732 HB3 MET 1 HB3 MET 1 -11.818 23.063 -13.064 733 HG2 MET 1 HG2 MET 1 -9.775 23.961 -11.052 734 HG3 MET 1 HG3 MET 1 -10.836 24.966 -12.041 735 HE1 MET 1 HE1 MET 1 -14.356 24.112 -10.466 736 HE2 MET 1 HE2 MET 1 -13.578 23.270 -11.807 737 HE3 MET 1 HE3 MET 1 -13.512 25.030 -11.712 738 H THR 2 H THR 2 -9.525 20.524 -13.610 739 HA THR 2 HA THR 2 -11.623 19.006 -14.972 740 HB THR 2 HB THR 2 -9.970 20.218 -16.346 741 HG1 THR 2 HG1 THR 2 -9.500 17.431 -16.689 742 HG21 THR 2 HG21 THR 2 -7.957 18.314 -15.131 743 HG22 THR 2 HG22 THR 2 -8.014 20.063 -14.906 744 HG23 THR 2 HG23 THR 2 -7.644 19.389 -16.493 745 H ASP 3 H ASP 3 -10.311 18.378 -12.248 746 HA ASP 3 HA ASP 3 -9.040 15.807 -12.746 747 HB2 ASP 3 HB2 ASP 3 -8.902 16.086 -10.055 748 HB3 ASP 3 HB3 ASP 3 -7.727 16.783 -11.167 749 H PHE 4 H PHE 4 -9.659 13.876 -11.688 750 HA PHE 4 HA PHE 4 -12.170 13.759 -10.240 751 HB2 PHE 4 HB2 PHE 4 -13.170 12.056 -11.691 752 HB3 PHE 4 HB3 PHE 4 -12.926 13.562 -12.566 753 HD1 PHE 4 HD1 PHE 4 -11.890 10.063 -12.235 754 HD2 PHE 4 HD2 PHE 4 -11.286 13.710 -14.358 755 HE1 PHE 4 HE1 PHE 4 -10.644 8.845 -13.969 756 HE2 PHE 4 HE2 PHE 4 -10.048 12.489 -16.096 757 HZ PHE 4 HZ PHE 4 -9.709 10.054 -15.895 758 H LEU 5 H LEU 5 -12.542 11.689 -9.230 759 HA LEU 5 HA LEU 5 -10.111 10.418 -8.371 760 HB2 LEU 5 HB2 LEU 5 -11.923 10.815 -6.805 761 HB3 LEU 5 HB3 LEU 5 -13.010 9.834 -7.768 762 HG LEU 5 HG LEU 5 -11.694 7.826 -7.239 763 HD11 LEU 5 HD11 LEU 5 -10.018 9.651 -5.510 764 HD12 LEU 5 HD12 LEU 5 -9.492 8.871 -7.001 765 HD13 LEU 5 HD13 LEU 5 -9.898 7.894 -5.593 766 HD21 LEU 5 HD21 LEU 5 -12.476 9.411 -4.788 767 HD22 LEU 5 HD22 LEU 5 -12.284 7.659 -4.875 768 HD23 LEU 5 HD23 LEU 5 -13.563 8.451 -5.792 769 H ALA 6 H ALA 6 -9.120 9.012 -9.644 770 HA ALA 6 HA ALA 6 -10.670 7.222 -11.385 771 HB1 ALA 6 HB1 ALA 6 -7.737 7.931 -11.460 772 HB2 ALA 6 HB2 ALA 6 -8.998 8.641 -12.470 773 HB3 ALA 6 HB3 ALA 6 -8.596 6.931 -12.631 774 H GLY 7 H GLY 7 -9.946 4.982 -11.623 775 HA2 GLY 7 HA2 GLY 7 -8.562 3.891 -9.253 776 HA3 GLY 7 HA3 GLY 7 -10.115 3.241 -9.747 777 H ILE 8 H ILE 8 -7.218 2.228 -9.598 778 HA ILE 8 HA ILE 8 -7.155 0.984 -12.278 779 HB ILE 8 HB ILE 8 -4.749 1.501 -10.501 780 HG12 ILE 8 HG12 ILE 8 -5.618 2.940 -13.028 781 HG13 ILE 8 HG13 ILE 8 -5.657 3.611 -11.399 782 HG21 ILE 8 HG21 ILE 8 -4.935 0.513 -13.355 783 HG22 ILE 8 HG22 ILE 8 -4.533 -0.470 -11.947 784 HG23 ILE 8 HG23 ILE 8 -3.442 0.816 -12.463 785 HD11 ILE 8 HD11 ILE 8 -3.224 3.453 -11.279 786 HD12 ILE 8 HD12 ILE 8 -3.751 4.433 -12.648 787 HD13 ILE 8 HD13 ILE 8 -3.189 2.783 -12.912 788 H ARG 9 H ARG 9 -6.661 -1.229 -12.368 789 HA ARG 9 HA ARG 9 -6.755 -2.688 -9.800 790 HB2 ARG 9 HB2 ARG 9 -8.800 -2.642 -11.515 791 HB3 ARG 9 HB3 ARG 9 -7.860 -3.892 -12.311 792 HG2 ARG 9 HG2 ARG 9 -8.835 -3.976 -9.456 793 HG3 ARG 9 HG3 ARG 9 -9.571 -4.808 -10.820 794 HD2 ARG 9 HD2 ARG 9 -6.907 -5.328 -9.534 795 HD3 ARG 9 HD3 ARG 9 -8.279 -6.421 -9.688 796 HE ARG 9 HE ARG 9 -6.196 -6.084 -11.540 797 HH11 ARG 9 HH11 ARG 9 -9.596 -6.650 -11.411 798 HH12 ARG 9 HH12 ARG 9 -9.652 -7.331 -13.002 799 HH21 ARG 9 HH21 ARG 9 -6.286 -6.965 -13.579 800 HH22 ARG 9 HH22 ARG 9 -7.807 -7.508 -14.202 801 H ILE 10 H ILE 10 -4.943 -3.834 -9.462 802 HA ILE 10 HA ILE 10 -3.277 -4.649 -11.782 803 HB ILE 10 HB ILE 10 -2.330 -4.173 -8.946 804 HG12 ILE 10 HG12 ILE 10 -2.030 -2.278 -11.294 805 HG13 ILE 10 HG13 ILE 10 -3.231 -2.083 -10.020 806 HG21 ILE 10 HG21 ILE 10 -0.096 -4.119 -9.964 807 HG22 ILE 10 HG22 ILE 10 -0.809 -4.465 -11.540 808 HG23 ILE 10 HG23 ILE 10 -0.911 -5.658 -10.245 809 HD11 ILE 10 HD11 ILE 10 -1.438 -1.899 -8.368 810 HD12 ILE 10 HD12 ILE 10 -1.313 -0.666 -9.622 811 HD13 ILE 10 HD13 ILE 10 -0.243 -2.069 -9.653 812 H VAL 11 H VAL 11 -3.312 -6.862 -12.108 813 HA VAL 11 HA VAL 11 -3.346 -8.563 -9.685 814 HB VAL 11 HB VAL 11 -4.595 -9.118 -12.379 815 HG11 VAL 11 HG11 VAL 11 -5.185 -11.343 -11.511 816 HG12 VAL 11 HG12 VAL 11 -4.192 -11.041 -10.085 817 HG13 VAL 11 HG13 VAL 11 -3.441 -11.144 -11.678 818 HG21 VAL 11 HG21 VAL 11 -5.759 -9.106 -9.589 819 HG22 VAL 11 HG22 VAL 11 -6.643 -9.390 -11.090 820 HG23 VAL 11 HG23 VAL 11 -5.931 -7.808 -10.772 821 H GLY 12 H GLY 12 -1.545 -9.618 -9.313 822 HA2 GLY 12 HA2 GLY 12 0.022 -10.761 -11.512 823 HA3 GLY 12 HA3 GLY 12 0.837 -9.606 -10.468 824 H GLU 13 H GLU 13 1.906 -12.077 -10.635 825 HA GLU 13 HA GLU 13 0.901 -14.011 -8.830 826 HB2 GLU 13 HB2 GLU 13 3.246 -14.957 -8.980 827 HB3 GLU 13 HB3 GLU 13 2.407 -14.729 -10.510 828 HG2 GLU 13 HG2 GLU 13 3.646 -12.603 -10.820 829 HG3 GLU 13 HG3 GLU 13 4.549 -12.953 -9.346 830 H ASP 14 H ASP 14 1.357 -14.487 -6.679 831 HA ASP 14 HA ASP 14 1.836 -12.119 -5.092 832 HB2 ASP 14 HB2 ASP 14 0.974 -13.415 -3.250 833 HB3 ASP 14 HB3 ASP 14 -0.020 -13.736 -4.661 834 H LYS 15 H LYS 15 4.248 -12.715 -6.258 835 HA LYS 15 HA LYS 15 5.901 -14.473 -4.874 836 HB2 LYS 15 HB2 LYS 15 6.248 -12.365 -6.869 837 HB3 LYS 15 HB3 LYS 15 7.651 -12.590 -5.833 838 HG2 LYS 15 HG2 LYS 15 7.584 -15.009 -6.356 839 HG3 LYS 15 HG3 LYS 15 6.293 -14.677 -7.514 840 HD2 LYS 15 HD2 LYS 15 7.731 -13.357 -8.868 841 HD3 LYS 15 HD3 LYS 15 8.984 -13.324 -7.621 842 HE2 LYS 15 HE2 LYS 15 9.539 -14.895 -9.408 843 HE3 LYS 15 HE3 LYS 15 9.313 -15.712 -7.862 844 HZ1 LYS 15 HZ1 LYS 15 8.249 -16.857 -9.767 845 HZ2 LYS 15 HZ2 LYS 15 7.225 -15.528 -9.963 846 HZ3 LYS 15 HZ3 LYS 15 7.159 -16.443 -8.543 847 H ASN 16 H ASN 16 7.650 -14.188 -3.573 848 HA ASN 16 HA ASN 16 7.460 -12.489 -1.329 849 HB2 ASN 16 HB2 ASN 16 9.957 -13.309 -1.093 850 HB3 ASN 16 HB3 ASN 16 8.624 -14.443 -0.906 851 HD21 ASN 16 HD21 ASN 16 11.027 -13.267 -3.200 852 HD22 ASN 16 HD22 ASN 16 11.080 -14.709 -4.142 853 H GLY 17 H GLY 17 7.171 -10.553 -2.910 854 HA2 GLY 17 HA2 GLY 17 8.961 -8.594 -2.387 855 HA3 GLY 17 HA3 GLY 17 9.656 -9.338 -3.816 856 H MET 18 H MET 18 7.212 -9.948 -5.128 857 HA MET 18 HA MET 18 6.796 -7.710 -6.694 858 HB2 MET 18 HB2 MET 18 5.318 -10.256 -6.213 859 HB3 MET 18 HB3 MET 18 4.465 -8.995 -7.092 860 HG2 MET 18 HG2 MET 18 7.162 -10.082 -7.873 861 HG3 MET 18 HG3 MET 18 5.624 -10.636 -8.540 862 HE1 MET 18 HE1 MET 18 4.288 -7.241 -10.073 863 HE2 MET 18 HE2 MET 18 4.109 -7.738 -8.391 864 HE3 MET 18 HE3 MET 18 3.878 -8.910 -9.687 865 H THR 19 H THR 19 4.656 -8.842 -4.069 866 HA THR 19 HA THR 19 2.735 -6.833 -4.213 867 HB THR 19 HB THR 19 2.363 -7.342 -1.752 868 HG1 THR 19 HG1 THR 19 4.087 -8.156 -0.814 869 HG21 THR 19 HG21 THR 19 1.186 -8.584 -3.503 870 HG22 THR 19 HG22 THR 19 1.603 -9.649 -2.161 871 HG23 THR 19 HG23 THR 19 2.549 -9.693 -3.650 872 H ASN 20 H ASN 20 5.938 -6.759 -2.743 873 HA ASN 20 HA ASN 20 5.504 -4.299 -1.312 874 HB2 ASN 20 HB2 ASN 20 8.100 -5.693 -2.027 875 HB3 ASN 20 HB3 ASN 20 7.944 -4.342 -0.910 876 HD21 ASN 20 HD21 ASN 20 8.618 -5.332 0.909 877 HD22 ASN 20 HD22 ASN 20 7.824 -6.671 1.644 878 H GLN 21 H GLN 21 7.212 -5.224 -4.297 879 HA GLN 21 HA GLN 21 8.196 -2.644 -4.879 880 HB2 GLN 21 HB2 GLN 21 8.878 -3.500 -6.981 881 HB3 GLN 21 HB3 GLN 21 9.067 -4.807 -5.826 882 HG2 GLN 21 HG2 GLN 21 7.061 -5.869 -6.633 883 HG3 GLN 21 HG3 GLN 21 6.717 -4.505 -7.690 884 HE21 GLN 21 HE21 GLN 21 8.813 -7.246 -7.166 885 HE22 GLN 21 HE22 GLN 21 9.437 -7.305 -8.771 886 H ILE 22 H ILE 22 5.188 -4.261 -5.693 887 HA ILE 22 HA ILE 22 4.337 -2.554 -7.755 888 HB ILE 22 HB ILE 22 2.905 -4.416 -5.885 889 HG12 ILE 22 HG12 ILE 22 4.172 -5.374 -7.741 890 HG13 ILE 22 HG13 ILE 22 2.447 -5.619 -7.995 891 HG21 ILE 22 HG21 ILE 22 1.551 -2.658 -7.931 892 HG22 ILE 22 HG22 ILE 22 1.316 -2.615 -6.183 893 HG23 ILE 22 HG23 ILE 22 0.803 -4.026 -7.106 894 HD11 ILE 22 HD11 ILE 22 4.129 -3.492 -9.299 895 HD12 ILE 22 HD12 ILE 22 2.406 -3.761 -9.565 896 HD13 ILE 22 HD13 ILE 22 3.576 -4.988 -10.050 897 H THR 23 H THR 23 3.404 -2.493 -4.289 898 HA THR 23 HA THR 23 2.085 0.033 -4.578 899 HB THR 23 HB THR 23 3.038 -1.090 -1.936 900 HG1 THR 23 HG1 THR 23 0.984 -1.986 -3.644 901 HG21 THR 23 HG21 THR 23 1.010 0.014 -1.097 902 HG22 THR 23 HG22 THR 23 0.634 0.567 -2.729 903 HG23 THR 23 HG23 THR 23 2.075 1.166 -1.904 904 H GLY 24 H GLY 24 5.340 -0.990 -3.798 905 HA2 GLY 24 HA2 GLY 24 6.425 1.394 -2.805 906 HA3 GLY 24 HA3 GLY 24 7.312 0.194 -3.733 907 H VAL 25 H VAL 25 6.202 0.318 -6.222 908 HA VAL 25 HA VAL 25 7.197 2.721 -7.334 909 HB VAL 25 HB VAL 25 5.355 0.646 -8.555 910 HG11 VAL 25 HG11 VAL 25 6.009 1.573 -10.735 911 HG12 VAL 25 HG12 VAL 25 6.888 2.867 -9.919 912 HG13 VAL 25 HG13 VAL 25 5.135 2.756 -9.765 913 HG21 VAL 25 HG21 VAL 25 7.410 -0.157 -9.653 914 HG22 VAL 25 HG22 VAL 25 7.540 -0.229 -7.894 915 HG23 VAL 25 HG23 VAL 25 8.340 1.067 -8.784 916 H ILE 26 H ILE 26 3.930 1.706 -6.431 917 HA ILE 26 HA ILE 26 2.517 3.901 -7.491 918 HB ILE 26 HB ILE 26 1.885 2.155 -5.105 919 HG12 ILE 26 HG12 ILE 26 0.846 2.126 -7.957 920 HG13 ILE 26 HG13 ILE 26 2.020 0.997 -7.291 921 HG21 ILE 26 HG21 ILE 26 -0.428 2.975 -5.306 922 HG22 ILE 26 HG22 ILE 26 0.097 4.128 -6.532 923 HG23 ILE 26 HG23 ILE 26 0.695 4.266 -4.878 924 HD11 ILE 26 HD11 ILE 26 -0.851 1.297 -6.434 925 HD12 ILE 26 HD12 ILE 26 0.320 0.193 -5.713 926 HD13 ILE 26 HD13 ILE 26 -0.166 -0.012 -7.395 927 H SER 27 H SER 27 4.194 3.527 -4.371 928 HA SER 27 HA SER 27 3.353 6.053 -3.332 929 HB2 SER 27 HB2 SER 27 5.016 5.749 -1.606 930 HB3 SER 27 HB3 SER 27 4.253 4.190 -1.912 931 HG SER 27 HG SER 27 6.066 3.587 -3.109 932 H LYS 28 H LYS 28 5.801 5.079 -5.573 933 HA LYS 28 HA LYS 28 7.302 7.551 -5.469 934 HB2 LYS 28 HB2 LYS 28 7.318 5.347 -7.549 935 HB3 LYS 28 HB3 LYS 28 8.476 6.664 -7.445 936 HG2 LYS 28 HG2 LYS 28 9.252 5.803 -5.278 937 HG3 LYS 28 HG3 LYS 28 8.094 4.473 -5.407 938 HD2 LYS 28 HD2 LYS 28 10.364 3.797 -6.100 939 HD3 LYS 28 HD3 LYS 28 9.194 3.661 -7.414 940 HE2 LYS 28 HE2 LYS 28 9.976 5.839 -8.294 941 HE3 LYS 28 HE3 LYS 28 11.179 5.904 -7.008 942 HZ1 LYS 28 HZ1 LYS 28 11.022 3.802 -9.097 943 HZ2 LYS 28 HZ2 LYS 28 12.200 3.917 -7.891 944 HZ3 LYS 28 HZ3 LYS 28 12.106 5.099 -9.097 945 H PHE 29 H PHE 29 4.289 6.822 -6.649 946 HA PHE 29 HA PHE 29 4.371 7.810 -9.286 947 HB2 PHE 29 HB2 PHE 29 2.207 7.097 -7.380 948 HB3 PHE 29 HB3 PHE 29 1.770 8.141 -8.725 949 HD1 PHE 29 HD1 PHE 29 4.382 6.221 -9.950 950 HD2 PHE 29 HD2 PHE 29 0.286 5.877 -8.819 951 HE1 PHE 29 HE1 PHE 29 4.143 4.289 -11.437 952 HE2 PHE 29 HE2 PHE 29 0.048 3.924 -10.298 953 HZ PHE 29 HZ PHE 29 1.976 3.128 -11.607 954 H ASP 30 H ASP 30 3.264 9.559 -10.163 955 HA ASP 30 HA ASP 30 4.040 12.083 -9.195 956 HB2 ASP 30 HB2 ASP 30 2.382 12.785 -11.118 957 HB3 ASP 30 HB3 ASP 30 3.883 11.948 -11.505 958 H THR 31 H THR 31 1.117 10.238 -8.756 959 HA THR 31 HA THR 31 -0.309 12.583 -7.679 960 HB THR 31 HB THR 31 -1.545 11.480 -9.430 961 HG1 THR 31 HG1 THR 31 -3.360 11.631 -8.338 962 HG21 THR 31 HG21 THR 31 -1.301 8.961 -7.780 963 HG22 THR 31 HG22 THR 31 -0.531 9.272 -9.337 964 HG23 THR 31 HG23 THR 31 -2.286 9.143 -9.232 965 H ASN 32 H ASN 32 -1.914 11.986 -5.857 966 HA ASN 32 HA ASN 32 -0.306 10.712 -3.752 967 HB2 ASN 32 HB2 ASN 32 -2.614 12.662 -3.584 968 HB3 ASN 32 HB3 ASN 32 -1.851 11.924 -2.180 969 HD21 ASN 32 HD21 ASN 32 0.831 12.021 -3.291 970 HD22 ASN 32 HD22 ASN 32 1.309 13.683 -3.253 971 H ILE 33 H ILE 33 -0.901 8.883 -2.772 972 HA ILE 33 HA ILE 33 -2.983 7.267 -3.789 973 HB ILE 33 HB ILE 33 -1.493 6.951 -1.168 974 HG12 ILE 33 HG12 ILE 33 -0.876 5.789 -3.905 975 HG13 ILE 33 HG13 ILE 33 0.015 7.095 -3.132 976 HG21 ILE 33 HG21 ILE 33 -3.517 5.587 -1.258 977 HG22 ILE 33 HG22 ILE 33 -2.080 4.570 -1.362 978 HG23 ILE 33 HG23 ILE 33 -3.019 4.923 -2.815 979 HD11 ILE 33 HD11 ILE 33 -0.205 4.269 -2.118 980 HD12 ILE 33 HD12 ILE 33 0.686 5.579 -1.340 981 HD13 ILE 33 HD13 ILE 33 1.191 4.987 -2.923 982 H ARG 34 H ARG 34 -5.079 7.936 -3.560 983 HA ARG 34 HA ARG 34 -5.996 9.145 -1.093 984 HB2 ARG 34 HB2 ARG 34 -6.795 9.563 -3.596 985 HB3 ARG 34 HB3 ARG 34 -7.903 8.248 -3.227 986 HG2 ARG 34 HG2 ARG 34 -8.955 10.403 -2.821 987 HG3 ARG 34 HG3 ARG 34 -8.761 9.515 -1.305 988 HD2 ARG 34 HD2 ARG 34 -6.730 10.811 -0.816 989 HD3 ARG 34 HD3 ARG 34 -6.939 11.702 -2.322 990 HE ARG 34 HE ARG 34 -9.264 12.148 -1.020 991 HH11 ARG 34 HH11 ARG 34 -5.962 12.448 -0.113 992 HH12 ARG 34 HH12 ARG 34 -6.249 13.774 0.949 993 HH21 ARG 34 HH21 ARG 34 -9.631 13.880 0.335 994 HH22 ARG 34 HH22 ARG 34 -8.305 14.591 1.184 995 H THR 35 H THR 35 -6.377 6.084 -2.794 996 HA THR 35 HA THR 35 -6.855 4.705 -0.287 997 HB THR 35 HB THR 35 -8.877 4.366 -2.520 998 HG1 THR 35 HG1 THR 35 -8.828 6.121 -0.395 999 HG21 THR 35 HG21 THR 35 -8.792 3.245 0.284 1000 HG22 THR 35 HG22 THR 35 -8.532 2.343 -1.208 1001 HG23 THR 35 HG23 THR 35 -10.117 3.034 -0.861 1002 H ILE 36 H ILE 36 -6.420 2.414 -0.471 1003 HA ILE 36 HA ILE 36 -5.974 1.236 -3.045 1004 HB ILE 36 HB ILE 36 -3.879 2.559 -2.724 1005 HG12 ILE 36 HG12 ILE 36 -3.372 -0.425 -2.718 1006 HG13 ILE 36 HG13 ILE 36 -4.034 0.445 -4.100 1007 HG21 ILE 36 HG21 ILE 36 -3.375 0.632 -0.453 1008 HG22 ILE 36 HG22 ILE 36 -3.638 2.370 -0.309 1009 HG23 ILE 36 HG23 ILE 36 -2.195 1.760 -1.122 1010 HD11 ILE 36 HD11 ILE 36 -2.018 1.827 -4.170 1011 HD12 ILE 36 HD12 ILE 36 -1.669 0.109 -4.373 1012 HD13 ILE 36 HD13 ILE 36 -1.349 0.898 -2.828 1013 H VAL 37 H VAL 37 -6.163 -0.929 -2.995 1014 HA VAL 37 HA VAL 37 -6.010 -2.325 -0.392 1015 HB VAL 37 HB VAL 37 -8.150 -2.766 -2.498 1016 HG11 VAL 37 HG11 VAL 37 -7.538 -4.851 -1.389 1017 HG12 VAL 37 HG12 VAL 37 -9.140 -4.330 -0.870 1018 HG13 VAL 37 HG13 VAL 37 -7.750 -4.095 0.190 1019 HG21 VAL 37 HG21 VAL 37 -9.724 -1.931 -0.801 1020 HG22 VAL 37 HG22 VAL 37 -8.545 -0.703 -1.262 1021 HG23 VAL 37 HG23 VAL 37 -8.367 -1.564 0.268 1022 H LEU 38 H LEU 38 -4.274 -3.651 -0.635 1023 HA LEU 38 HA LEU 38 -4.098 -5.282 -3.093 1024 HB2 LEU 38 HB2 LEU 38 -2.117 -3.869 -2.553 1025 HB3 LEU 38 HB3 LEU 38 -1.933 -4.738 -1.044 1026 HG LEU 38 HG LEU 38 -1.833 -6.210 -3.677 1027 HD11 LEU 38 HD11 LEU 38 -0.212 -4.397 -3.865 1028 HD12 LEU 38 HD12 LEU 38 0.602 -5.953 -3.685 1029 HD13 LEU 38 HD13 LEU 38 0.494 -4.849 -2.312 1030 HD21 LEU 38 HD21 LEU 38 -0.428 -7.766 -2.402 1031 HD22 LEU 38 HD22 LEU 38 -2.007 -7.561 -1.646 1032 HD23 LEU 38 HD23 LEU 38 -0.596 -6.751 -0.968 1033 H ASN 39 H ASN 39 -5.048 -7.188 -2.834 1034 HA ASN 39 HA ASN 39 -4.501 -8.728 -0.378 1035 HB2 ASN 39 HB2 ASN 39 -6.847 -9.679 -0.619 1036 HB3 ASN 39 HB3 ASN 39 -6.741 -8.012 -0.068 1037 HD21 ASN 39 HD21 ASN 39 -8.929 -9.448 -1.417 1038 HD22 ASN 39 HD22 ASN 39 -9.286 -8.504 -2.823 1039 H ALA 40 H ALA 40 -3.958 -10.833 -0.648 1040 HA ALA 40 HA ALA 40 -3.732 -11.817 -3.428 1041 HB1 ALA 40 HB1 ALA 40 -1.835 -13.136 -2.675 1042 HB2 ALA 40 HB2 ALA 40 -2.087 -12.592 -1.015 1043 HB3 ALA 40 HB3 ALA 40 -1.600 -11.438 -2.255 1044 H LYS 41 H LYS 41 -4.821 -13.553 -4.023 1045 HA LYS 41 HA LYS 41 -5.394 -15.691 -2.116 1046 HB2 LYS 41 HB2 LYS 41 -7.713 -15.831 -2.535 1047 HB3 LYS 41 HB3 LYS 41 -7.411 -14.127 -2.238 1048 HG2 LYS 41 HG2 LYS 41 -7.675 -15.363 -4.975 1049 HG3 LYS 41 HG3 LYS 41 -8.986 -14.577 -4.100 1050 HD2 LYS 41 HD2 LYS 41 -7.650 -12.480 -4.070 1051 HD3 LYS 41 HD3 LYS 41 -6.418 -13.289 -5.042 1052 HE2 LYS 41 HE2 LYS 41 -7.968 -13.581 -6.863 1053 HE3 LYS 41 HE3 LYS 41 -9.300 -12.964 -5.888 1054 HZ1 LYS 41 HZ1 LYS 41 -8.588 -11.239 -7.316 1055 HZ2 LYS 41 HZ2 LYS 41 -6.966 -11.458 -6.912 1056 HZ3 LYS 41 HZ3 LYS 41 -8.045 -10.832 -5.766 1057 H ASP 42 H ASP 42 -5.772 -17.743 -3.123 1058 HA ASP 42 HA ASP 42 -5.340 -19.391 -4.629 1059 HB2 ASP 42 HB2 ASP 42 -5.993 -17.289 -6.715 1060 HB3 ASP 42 HB3 ASP 42 -5.959 -19.031 -6.975 1061 H GLY 43 H GLY 43 -3.246 -17.209 -3.948 1062 HA2 GLY 43 HA2 GLY 43 -0.953 -17.127 -4.295 1063 HA3 GLY 43 HA3 GLY 43 -1.131 -18.223 -5.652 1064 H ILE 44 H ILE 44 -3.203 -15.487 -5.676 1065 HA ILE 44 HA ILE 44 -1.297 -13.885 -7.261 1066 HB ILE 44 HB ILE 44 -4.216 -14.038 -8.027 1067 HG12 ILE 44 HG12 ILE 44 -1.945 -15.708 -9.142 1068 HG13 ILE 44 HG13 ILE 44 -3.345 -16.299 -8.251 1069 HG21 ILE 44 HG21 ILE 44 -3.396 -13.145 -10.158 1070 HG22 ILE 44 HG22 ILE 44 -1.745 -13.173 -9.540 1071 HG23 ILE 44 HG23 ILE 44 -2.942 -12.104 -8.808 1072 HD11 ILE 44 HD11 ILE 44 -3.399 -14.954 -10.937 1073 HD12 ILE 44 HD12 ILE 44 -4.804 -15.546 -10.050 1074 HD13 ILE 44 HD13 ILE 44 -3.587 -16.682 -10.633 1075 H PHE 45 H PHE 45 -1.595 -11.634 -7.085 1076 HA PHE 45 HA PHE 45 -3.454 -10.840 -4.923 1077 HB2 PHE 45 HB2 PHE 45 -1.903 -9.203 -4.140 1078 HB3 PHE 45 HB3 PHE 45 -1.009 -10.704 -4.328 1079 HD1 PHE 45 HD1 PHE 45 0.670 -10.946 -6.073 1080 HD2 PHE 45 HD2 PHE 45 -1.462 -7.294 -5.555 1081 HE1 PHE 45 HE1 PHE 45 2.331 -9.775 -7.465 1082 HE2 PHE 45 HE2 PHE 45 0.189 -6.125 -6.950 1083 HZ PHE 45 HZ PHE 45 2.087 -7.367 -7.906 1084 H THR 46 H THR 46 -4.673 -9.010 -5.146 1085 HA THR 46 HA THR 46 -4.461 -7.579 -7.720 1086 HB THR 46 HB THR 46 -6.536 -8.714 -7.800 1087 HG1 THR 46 HG1 THR 46 -7.267 -6.127 -6.859 1088 HG21 THR 46 HG21 THR 46 -7.142 -7.638 -5.052 1089 HG22 THR 46 HG22 THR 46 -6.768 -9.315 -5.457 1090 HG23 THR 46 HG23 THR 46 -8.247 -8.567 -6.062 1091 H CYS 47 H CYS 47 -3.449 -5.725 -7.332 1092 HA CYS 47 HA CYS 47 -3.946 -4.237 -4.861 1093 HB2 CYS 47 HB2 CYS 47 -1.612 -4.560 -5.587 1094 HB3 CYS 47 HB3 CYS 47 -1.960 -3.712 -7.090 1095 HG CYS 47 HG CYS 47 -2.690 -1.322 -5.588 1096 H ASN 48 H ASN 48 -5.921 -3.263 -5.091 1097 HA ASN 48 HA ASN 48 -6.611 -1.769 -7.481 1098 HB2 ASN 48 HB2 ASN 48 -8.024 -2.097 -4.821 1099 HB3 ASN 48 HB3 ASN 48 -8.675 -1.174 -6.174 1100 HD21 ASN 48 HD21 ASN 48 -10.453 -2.502 -6.387 1101 HD22 ASN 48 HD22 ASN 48 -10.346 -4.099 -7.027 1102 H LEU 49 H LEU 49 -5.739 0.174 -7.833 1103 HA LEU 49 HA LEU 49 -4.989 1.883 -5.559 1104 HB2 LEU 49 HB2 LEU 49 -3.210 1.449 -7.132 1105 HB3 LEU 49 HB3 LEU 49 -4.213 1.960 -8.478 1106 HG LEU 49 HG LEU 49 -4.204 4.268 -7.618 1107 HD11 LEU 49 HD11 LEU 49 -2.724 4.912 -5.787 1108 HD12 LEU 49 HD12 LEU 49 -2.329 3.217 -5.499 1109 HD13 LEU 49 HD13 LEU 49 -3.975 3.795 -5.239 1110 HD21 LEU 49 HD21 LEU 49 -2.518 3.623 -9.242 1111 HD22 LEU 49 HD22 LEU 49 -1.456 3.056 -7.953 1112 HD23 LEU 49 HD23 LEU 49 -1.839 4.772 -8.090 1113 H MET 50 H MET 50 -6.055 3.709 -5.092 1114 HA MET 50 HA MET 50 -7.899 4.851 -7.103 1115 HB2 MET 50 HB2 MET 50 -8.219 4.840 -4.096 1116 HB3 MET 50 HB3 MET 50 -9.311 5.615 -5.232 1117 HG2 MET 50 HG2 MET 50 -8.779 2.661 -4.997 1118 HG3 MET 50 HG3 MET 50 -10.228 3.513 -4.472 1119 HE1 MET 50 HE1 MET 50 -11.457 4.830 -8.061 1120 HE2 MET 50 HE2 MET 50 -10.202 5.621 -7.106 1121 HE3 MET 50 HE3 MET 50 -11.665 5.025 -6.320 1122 H ILE 51 H ILE 51 -7.151 6.728 -7.832 1123 HA ILE 51 HA ILE 51 -5.989 8.684 -5.992 1124 HB ILE 51 HB ILE 51 -4.132 9.089 -7.759 1125 HG12 ILE 51 HG12 ILE 51 -3.389 6.843 -8.784 1126 HG13 ILE 51 HG13 ILE 51 -5.033 6.292 -8.481 1127 HG21 ILE 51 HG21 ILE 51 -3.712 8.298 -5.486 1128 HG22 ILE 51 HG22 ILE 51 -2.625 7.533 -6.643 1129 HG23 ILE 51 HG23 ILE 51 -4.003 6.637 -6.002 1130 HD11 ILE 51 HD11 ILE 51 -4.724 7.020 -10.774 1131 HD12 ILE 51 HD12 ILE 51 -4.245 8.623 -10.212 1132 HD13 ILE 51 HD13 ILE 51 -5.890 8.045 -9.935 1133 H PHE 52 H PHE 52 -5.726 10.855 -7.009 1134 HA PHE 52 HA PHE 52 -7.937 11.364 -8.845 1135 HB2 PHE 52 HB2 PHE 52 -6.290 13.096 -7.030 1136 HB3 PHE 52 HB3 PHE 52 -7.182 13.836 -8.355 1137 HD1 PHE 52 HD2 PHE 52 -9.621 13.772 -8.408 1138 HD2 PHE 52 HD1 PHE 52 -7.441 12.186 -5.109 1139 HE1 PHE 52 HE2 PHE 52 -11.677 13.765 -7.066 1140 HE2 PHE 52 HE1 PHE 52 -9.499 12.175 -3.755 1141 HZ PHE 52 HZ PHE 52 -11.617 12.967 -4.732 1142 H VAL 53 H VAL 53 -7.759 12.046 -10.906 1143 HA VAL 53 HA VAL 53 -5.078 12.713 -11.970 1144 HB VAL 53 HB VAL 53 -5.497 11.497 -14.007 1145 HG11 VAL 53 HG11 VAL 53 -5.628 9.175 -13.212 1146 HG12 VAL 53 HG12 VAL 53 -6.170 9.753 -11.637 1147 HG13 VAL 53 HG13 VAL 53 -4.550 10.155 -12.212 1148 HG21 VAL 53 HG21 VAL 53 -8.196 10.808 -12.851 1149 HG22 VAL 53 HG22 VAL 53 -7.527 10.156 -14.347 1150 HG23 VAL 53 HG23 VAL 53 -7.881 11.879 -14.219 1151 H LYS 54 H LYS 54 -5.152 14.006 -13.978 1152 HA LYS 54 HA LYS 54 -7.292 15.980 -13.878 1153 HB2 LYS 54 HB2 LYS 54 -4.744 15.905 -15.510 1154 HB3 LYS 54 HB3 LYS 54 -5.853 17.267 -15.423 1155 HG2 LYS 54 HG2 LYS 54 -5.369 17.589 -13.088 1156 HG3 LYS 54 HG3 LYS 54 -4.390 16.121 -13.045 1157 HD2 LYS 54 HD2 LYS 54 -3.777 18.591 -14.682 1158 HD3 LYS 54 HD3 LYS 54 -3.013 18.164 -13.149 1159 HE2 LYS 54 HE2 LYS 54 -2.162 16.090 -14.168 1160 HE3 LYS 54 HE3 LYS 54 -2.902 16.549 -15.702 1161 HZ1 LYS 54 HZ1 LYS 54 -1.482 18.505 -15.750 1162 HZ2 LYS 54 HZ2 LYS 54 -0.559 17.093 -15.659 1163 HZ3 LYS 54 HZ3 LYS 54 -0.770 18.054 -14.287 1164 H ASN 55 H ASN 55 -6.636 13.178 -15.629 1165 HA ASN 55 HA ASN 55 -8.879 13.367 -17.310 1166 HB2 ASN 55 HB2 ASN 55 -7.674 13.420 -19.531 1167 HB3 ASN 55 HB3 ASN 55 -7.661 14.947 -18.655 1168 HD21 ASN 55 HD21 ASN 55 -5.735 15.726 -17.837 1169 HD22 ASN 55 HD22 ASN 55 -4.201 15.061 -18.273 1170 H THR 56 H THR 56 -8.983 11.474 -18.876 1171 HA THR 56 HA THR 56 -8.272 9.112 -17.488 1172 HB THR 56 HB THR 56 -9.070 7.893 -19.526 1173 HG1 THR 56 HG1 THR 56 -10.220 9.601 -20.979 1174 HG21 THR 56 HG21 THR 56 -11.402 8.588 -19.298 1175 HG22 THR 56 HG22 THR 56 -10.894 10.098 -18.539 1176 HG23 THR 56 HG23 THR 56 -10.613 8.561 -17.721 1177 H ASP 57 H ASP 57 -6.652 10.819 -20.096 1178 HA ASP 57 HA ASP 57 -4.876 8.725 -20.860 1179 HB2 ASP 57 HB2 ASP 57 -4.347 11.701 -21.041 1180 HB3 ASP 57 HB3 ASP 57 -3.661 10.428 -22.048 1181 H LYS 58 H LYS 58 -4.734 11.324 -18.498 1182 HA LYS 58 HA LYS 58 -2.175 10.864 -17.444 1183 HB2 LYS 58 HB2 LYS 58 -3.334 12.868 -16.855 1184 HB3 LYS 58 HB3 LYS 58 -4.721 11.975 -16.253 1185 HG2 LYS 58 HG2 LYS 58 -3.471 12.869 -14.406 1186 HG3 LYS 58 HG3 LYS 58 -3.349 11.107 -14.420 1187 HD2 LYS 58 HD2 LYS 58 -1.140 11.399 -15.646 1188 HD3 LYS 58 HD3 LYS 58 -1.266 13.121 -15.281 1189 HE2 LYS 58 HE2 LYS 58 0.133 12.060 -13.628 1190 HE3 LYS 58 HE3 LYS 58 -1.380 12.554 -12.869 1191 HZ1 LYS 58 HZ1 LYS 58 -0.590 10.289 -12.269 1192 HZ2 LYS 58 HZ2 LYS 58 -0.873 9.810 -13.869 1193 HZ3 LYS 58 HZ3 LYS 58 -2.158 10.330 -12.904 1194 H LEU 59 H LEU 59 -5.217 9.214 -16.989 1195 HA LEU 59 HA LEU 59 -4.397 7.638 -14.728 1196 HB2 LEU 59 HB2 LEU 59 -6.740 8.159 -15.085 1197 HB3 LEU 59 HB3 LEU 59 -6.712 7.378 -16.653 1198 HG LEU 59 HG LEU 59 -6.373 5.194 -15.573 1199 HD11 LEU 59 HD11 LEU 59 -6.571 6.746 -12.994 1200 HD12 LEU 59 HD12 LEU 59 -5.160 5.876 -13.598 1201 HD13 LEU 59 HD13 LEU 59 -6.612 4.988 -13.134 1202 HD21 LEU 59 HD21 LEU 59 -8.604 4.993 -14.560 1203 HD22 LEU 59 HD22 LEU 59 -8.643 5.933 -16.050 1204 HD23 LEU 59 HD23 LEU 59 -8.728 6.754 -14.491 1205 H THR 60 H THR 60 -4.824 6.961 -18.218 1206 HA THR 60 HA THR 60 -4.072 4.259 -18.205 1207 HB THR 60 HB THR 60 -3.574 4.513 -20.601 1208 HG1 THR 60 HG1 THR 60 -3.864 6.742 -21.447 1209 HG21 THR 60 HG21 THR 60 -5.748 5.388 -21.334 1210 HG22 THR 60 HG22 THR 60 -5.998 6.113 -19.746 1211 HG23 THR 60 HG23 THR 60 -5.925 4.358 -19.913 1212 H THR 61 H THR 61 -2.106 7.181 -18.461 1213 HA THR 61 HA THR 61 0.391 6.138 -18.999 1214 HB THR 61 HB THR 61 -0.362 8.451 -17.199 1215 HG1 THR 61 HG1 THR 61 -0.856 8.812 -19.363 1216 HG21 THR 61 HG21 THR 61 1.979 9.214 -17.409 1217 HG22 THR 61 HG22 THR 61 2.391 7.699 -18.214 1218 HG23 THR 61 HG23 THR 61 1.863 7.689 -16.531 1219 H LEU 62 H LEU 62 -1.260 6.248 -15.860 1220 HA LEU 62 HA LEU 62 0.944 5.240 -14.358 1221 HB2 LEU 62 HB2 LEU 62 -2.011 5.173 -13.716 1222 HB3 LEU 62 HB3 LEU 62 -0.717 4.841 -12.579 1223 HG LEU 62 HG LEU 62 -1.261 7.493 -13.927 1224 HD11 LEU 62 HD11 LEU 62 -1.563 6.645 -11.048 1225 HD12 LEU 62 HD12 LEU 62 -2.878 6.942 -12.186 1226 HD13 LEU 62 HD13 LEU 62 -1.827 8.268 -11.688 1227 HD21 LEU 62 HD21 LEU 62 0.864 6.751 -11.911 1228 HD22 LEU 62 HD22 LEU 62 0.520 8.380 -12.496 1229 HD23 LEU 62 HD23 LEU 62 1.134 7.155 -13.606 1230 H MET 63 H MET 63 -1.734 3.730 -16.079 1231 HA MET 63 HA MET 63 -1.421 1.081 -15.154 1232 HB2 MET 63 HB2 MET 63 -2.265 1.942 -17.930 1233 HB3 MET 63 HB3 MET 63 -2.612 0.400 -17.160 1234 HG2 MET 63 HG2 MET 63 -4.043 1.481 -15.549 1235 HG3 MET 63 HG3 MET 63 -3.620 3.067 -16.198 1236 HE1 MET 63 HE1 MET 63 -6.023 3.856 -16.643 1237 HE2 MET 63 HE2 MET 63 -6.618 2.387 -15.862 1238 HE3 MET 63 HE3 MET 63 -7.265 2.878 -17.427 1239 H ASP 64 H ASP 64 -0.006 2.749 -17.965 1240 HA ASP 64 HA ASP 64 1.580 0.665 -18.939 1241 HB2 ASP 64 HB2 ASP 64 1.188 2.736 -20.178 1242 HB3 ASP 64 HB3 ASP 64 2.092 3.643 -18.975 1243 H LYS 65 H LYS 65 2.389 3.189 -16.548 1244 HA LYS 65 HA LYS 65 4.988 2.456 -15.903 1245 HB2 LYS 65 HB2 LYS 65 2.756 3.682 -14.306 1246 HB3 LYS 65 HB3 LYS 65 4.277 3.290 -13.521 1247 HG2 LYS 65 HG2 LYS 65 5.475 4.754 -15.029 1248 HG3 LYS 65 HG3 LYS 65 3.985 5.106 -15.909 1249 HD2 LYS 65 HD2 LYS 65 3.104 6.379 -14.166 1250 HD3 LYS 65 HD3 LYS 65 4.138 5.619 -12.955 1251 HE2 LYS 65 HE2 LYS 65 6.069 6.766 -13.808 1252 HE3 LYS 65 HE3 LYS 65 5.128 7.457 -15.133 1253 HZ1 LYS 65 HZ1 LYS 65 4.888 8.066 -12.240 1254 HZ2 LYS 65 HZ2 LYS 65 3.767 8.598 -13.387 1255 HZ3 LYS 65 HZ3 LYS 65 5.373 9.113 -13.473 1256 H LEU 66 H LEU 66 1.982 1.249 -14.451 1257 HA LEU 66 HA LEU 66 3.243 -0.585 -12.675 1258 HB2 LEU 66 HB2 LEU 66 0.401 -0.456 -13.694 1259 HB3 LEU 66 HB3 LEU 66 0.942 -1.448 -12.348 1260 HG LEU 66 HG LEU 66 1.230 1.560 -12.359 1261 HD11 LEU 66 HD11 LEU 66 -0.785 1.652 -10.971 1262 HD12 LEU 66 HD12 LEU 66 -1.051 -0.069 -11.241 1263 HD13 LEU 66 HD13 LEU 66 -1.133 1.058 -12.595 1264 HD21 LEU 66 HD21 LEU 66 2.667 0.361 -10.796 1265 HD22 LEU 66 HD22 LEU 66 1.269 -0.488 -10.136 1266 HD23 LEU 66 HD23 LEU 66 1.418 1.258 -9.935 1267 H ARG 67 H ARG 67 2.148 -0.809 -15.991 1268 HA ARG 67 HA ARG 67 2.069 -3.676 -16.060 1269 HB2 ARG 67 HB2 ARG 67 0.902 -1.805 -17.585 1270 HB3 ARG 67 HB3 ARG 67 2.317 -2.107 -18.586 1271 HG2 ARG 67 HG2 ARG 67 1.755 -4.471 -18.721 1272 HG3 ARG 67 HG3 ARG 67 0.378 -4.226 -17.644 1273 HD2 ARG 67 HD2 ARG 67 0.755 -3.150 -20.434 1274 HD3 ARG 67 HD3 ARG 67 -0.449 -4.314 -19.884 1275 HE ARG 67 HE ARG 67 -0.432 -1.444 -19.266 1276 HH11 ARG 67 HH11 ARG 67 -2.110 -4.444 -19.315 1277 HH12 ARG 67 HH12 ARG 67 -3.663 -3.693 -19.149 1278 HH21 ARG 67 HH21 ARG 67 -2.426 -0.500 -19.084 1279 HH22 ARG 67 HH22 ARG 67 -3.838 -1.494 -19.026 1280 H LYS 68 H LYS 68 4.621 -1.479 -16.063 1281 HA LYS 68 HA LYS 68 6.456 -2.867 -17.780 1282 HB2 LYS 68 HB2 LYS 68 7.096 -0.998 -15.485 1283 HB3 LYS 68 HB3 LYS 68 8.179 -1.457 -16.790 1284 HG2 LYS 68 HG2 LYS 68 5.699 0.239 -16.989 1285 HG3 LYS 68 HG3 LYS 68 7.372 0.765 -17.166 1286 HD2 LYS 68 HD2 LYS 68 7.530 -0.781 -19.160 1287 HD3 LYS 68 HD3 LYS 68 5.781 -1.002 -19.030 1288 HE2 LYS 68 HE2 LYS 68 5.599 1.531 -19.145 1289 HE3 LYS 68 HE3 LYS 68 7.301 1.537 -19.608 1290 HZ1 LYS 68 HZ1 LYS 68 6.072 1.581 -21.586 1291 HZ2 LYS 68 HZ2 LYS 68 5.012 0.375 -21.073 1292 HZ3 LYS 68 HZ3 LYS 68 6.614 -0.015 -21.450 1293 H VAL 69 H VAL 69 5.123 -3.774 -14.871 1294 HA VAL 69 HA VAL 69 7.504 -4.919 -13.669 1295 HB VAL 69 HB VAL 69 4.606 -5.086 -12.813 1296 HG11 VAL 69 HG11 VAL 69 7.133 -5.878 -11.362 1297 HG12 VAL 69 HG12 VAL 69 5.849 -6.952 -11.915 1298 HG13 VAL 69 HG13 VAL 69 5.532 -5.792 -10.628 1299 HG21 VAL 69 HG21 VAL 69 5.421 -2.797 -12.754 1300 HG22 VAL 69 HG22 VAL 69 6.848 -3.301 -11.848 1301 HG23 VAL 69 HG23 VAL 69 5.250 -3.416 -11.112 1302 H GLN 70 H GLN 70 8.170 -6.959 -13.879 1303 HA GLN 70 HA GLN 70 7.113 -8.666 -15.865 1304 HB2 GLN 70 HB2 GLN 70 8.786 -10.309 -15.063 1305 HB3 GLN 70 HB3 GLN 70 9.471 -8.708 -15.318 1306 HG2 GLN 70 HG2 GLN 70 9.513 -8.277 -12.959 1307 HG3 GLN 70 HG3 GLN 70 8.618 -9.759 -12.625 1308 HE21 GLN 70 HE21 GLN 70 10.226 -10.509 -11.261 1309 HE22 GLN 70 HE22 GLN 70 11.735 -11.105 -11.847 1310 H GLY 71 H GLY 71 6.534 -8.547 -12.405 1311 HA2 GLY 71 HA2 GLY 71 5.458 -11.219 -12.245 1312 HA3 GLY 71 HA3 GLY 71 5.444 -10.011 -10.976 1313 H VAL 72 H VAL 72 4.102 -8.165 -13.121 1314 HA VAL 72 HA VAL 72 1.379 -9.053 -12.470 1315 HB VAL 72 HB VAL 72 2.286 -6.400 -13.620 1316 HG11 VAL 72 HG11 VAL 72 -0.415 -7.280 -12.569 1317 HG12 VAL 72 HG12 VAL 72 -0.014 -6.921 -14.249 1318 HG13 VAL 72 HG13 VAL 72 0.008 -5.634 -13.043 1319 HG21 VAL 72 HG21 VAL 72 3.110 -6.682 -11.363 1320 HG22 VAL 72 HG22 VAL 72 1.509 -7.165 -10.804 1321 HG23 VAL 72 HG23 VAL 72 1.787 -5.517 -11.367 1322 H PHE 73 H PHE 73 -0.155 -9.529 -13.986 1323 HA PHE 73 HA PHE 73 0.709 -9.472 -16.807 1324 HB2 PHE 73 HB2 PHE 73 -1.266 -11.375 -16.788 1325 HB3 PHE 73 HB3 PHE 73 0.457 -11.693 -16.707 1326 HD1 PHE 73 HD2 PHE 73 1.516 -12.383 -14.645 1327 HD2 PHE 73 HD1 PHE 73 -2.672 -11.617 -14.811 1328 HE1 PHE 73 HE2 PHE 73 1.225 -13.536 -12.491 1329 HE2 PHE 73 HE1 PHE 73 -2.965 -12.774 -12.661 1330 HZ PHE 73 HZ PHE 73 -1.018 -13.734 -11.501 1331 H THR 74 H THR 74 -1.718 -8.430 -14.585 1332 HA THR 74 HA THR 74 -3.227 -7.294 -16.859 1333 HB THR 74 HB THR 74 -5.311 -7.838 -16.039 1334 HG1 THR 74 HG1 THR 74 -5.183 -8.754 -13.629 1335 HG21 THR 74 HG21 THR 74 -5.360 -10.175 -15.360 1336 HG22 THR 74 HG22 THR 74 -3.654 -10.100 -14.915 1337 HG23 THR 74 HG23 THR 74 -4.135 -9.932 -16.607 1338 H VAL 75 H VAL 75 -3.046 -5.132 -16.792 1339 HA VAL 75 HA VAL 75 -3.592 -3.809 -14.203 1340 HB VAL 75 HB VAL 75 -1.753 -2.667 -16.323 1341 HG11 VAL 75 HG11 VAL 75 -2.287 -1.816 -13.474 1342 HG12 VAL 75 HG12 VAL 75 -2.870 -1.003 -14.927 1343 HG13 VAL 75 HG13 VAL 75 -1.141 -1.059 -14.581 1344 HG21 VAL 75 HG21 VAL 75 -0.999 -4.051 -13.743 1345 HG22 VAL 75 HG22 VAL 75 0.115 -3.179 -14.797 1346 HG23 VAL 75 HG23 VAL 75 -0.688 -4.640 -15.378 1347 H GLU 76 H GLU 76 -5.666 -3.114 -14.476 1348 HA GLU 76 HA GLU 76 -6.346 -1.737 -17.007 1349 HB2 GLU 76 HB2 GLU 76 -8.141 -3.688 -15.537 1350 HB3 GLU 76 HB3 GLU 76 -8.546 -2.817 -17.008 1351 HG2 GLU 76 HG2 GLU 76 -6.390 -4.909 -16.731 1352 HG3 GLU 76 HG3 GLU 76 -7.984 -5.157 -17.438 1353 H ARG 77 H ARG 77 -8.653 -0.692 -16.720 1354 HA ARG 77 HA ARG 77 -8.488 1.033 -14.373 1355 HB2 ARG 77 HB2 ARG 77 -8.751 2.106 -16.539 1356 HB3 ARG 77 HB3 ARG 77 -10.203 1.172 -16.865 1357 HG2 ARG 77 HG2 ARG 77 -11.354 2.306 -15.023 1358 HG3 ARG 77 HG3 ARG 77 -9.897 3.244 -14.688 1359 HD2 ARG 77 HD2 ARG 77 -11.576 4.492 -16.014 1360 HD3 ARG 77 HD3 ARG 77 -10.030 4.315 -16.845 1361 HE ARG 77 HE ARG 77 -11.183 2.370 -18.010 1362 HH11 ARG 77 HH11 ARG 77 -12.899 5.171 -16.949 1363 HH12 ARG 77 HH12 ARG 77 -14.106 5.017 -18.177 1364 HH21 ARG 77 HH21 ARG 77 -12.734 2.188 -19.558 1365 HH22 ARG 77 HH22 ARG 77 -14.022 3.344 -19.624 1366 H LEU 78 H LEU 78 -10.063 1.247 -12.822 1367 HA LEU 78 HA LEU 78 -12.222 -0.726 -12.755 1368 HB2 LEU 78 HB2 LEU 78 -11.186 1.253 -10.718 1369 HB3 LEU 78 HB3 LEU 78 -12.608 0.257 -10.451 1370 HG LEU 78 HG LEU 78 -9.839 -0.843 -10.997 1371 HD11 LEU 78 HD11 LEU 78 -9.865 0.315 -8.857 1372 HD12 LEU 78 HD12 LEU 78 -9.784 -1.429 -8.620 1373 HD13 LEU 78 HD13 LEU 78 -11.309 -0.576 -8.371 1374 HD21 LEU 78 HD21 LEU 78 -12.378 -2.196 -10.067 1375 HD22 LEU 78 HD22 LEU 78 -10.802 -2.967 -10.262 1376 HD23 LEU 78 HD23 LEU 78 -11.654 -2.337 -11.671 1377 H SER 79 H SER 79 -13.870 -0.120 -14.044 1378 HA SER 79 HA SER 79 -14.529 2.662 -14.476 1379 HB2 SER 79 HB2 SER 79 -14.616 1.043 -16.338 1380 HB3 SER 79 HB3 SER 79 -15.904 0.164 -15.515 1381 HG SER 79 HG SER 79 -16.650 1.659 -17.141 1382 H ASN 80 H ASN 80 -15.670 0.163 -12.386 1383 HA ASN 80 HA ASN 80 -18.059 1.771 -11.725 1384 HB2 ASN 80 HB2 ASN 80 -18.567 -0.508 -12.519 1385 HB3 ASN 80 HB3 ASN 80 -17.561 -1.180 -11.240 1386 HD21 ASN 80 HD21 ASN 80 -18.307 -1.129 -9.121 1387 HD22 ASN 80 HD22 ASN 80 -19.965 -0.829 -8.742 1388 H LEU 81 H LEU 81 -17.636 3.048 -10.032 1389 HA LEU 81 HA LEU 81 -16.002 1.999 -7.808 1390 HB2 LEU 81 HB2 LEU 81 -16.627 4.871 -8.517 1391 HB3 LEU 81 HB3 LEU 81 -15.617 4.344 -7.185 1392 HG LEU 81 HG LEU 81 -15.018 4.071 -10.135 1393 HD11 LEU 81 HD11 LEU 81 -13.091 5.517 -9.560 1394 HD12 LEU 81 HD12 LEU 81 -13.723 5.670 -7.919 1395 HD13 LEU 81 HD13 LEU 81 -14.647 6.302 -9.282 1396 HD21 LEU 81 HD21 LEU 81 -13.449 3.038 -7.763 1397 HD22 LEU 81 HD22 LEU 81 -12.861 3.095 -9.425 1398 HD23 LEU 81 HD23 LEU 81 -14.234 2.069 -9.013 1399 H GLU 82 H GLU 82 -16.594 2.912 -5.622 1400 HA GLU 82 HA GLU 82 -19.487 3.277 -5.265 1401 HB2 GLU 82 HB2 GLU 82 -19.216 1.596 -3.295 1402 HB3 GLU 82 HB3 GLU 82 -19.415 0.993 -4.934 1403 HG2 GLU 82 HG2 GLU 82 -17.692 -0.221 -3.723 1404 HG3 GLU 82 HG3 GLU 82 -17.035 0.601 -5.125 1405 H HIS 83 H HIS 83 -16.888 4.902 -4.834 1406 HA HIS 83 HA HIS 83 -16.341 5.096 -2.085 1407 HB2 HIS 83 HB2 HIS 83 -15.906 7.070 -4.329 1408 HB3 HIS 83 HB3 HIS 83 -15.298 7.316 -2.695 1409 HD1 HIS 83 HD1 HIS 83 -12.866 6.831 -2.750 1410 HD2 HIS 83 HD2 HIS 83 -15.043 4.060 -4.953 1411 HE1 HIS 83 HE1 HIS 83 -11.197 5.133 -3.528 1412 HE2 HIS 83 HE2 HIS 83 -12.579 3.358 -4.643 1413 H HIS 84 H HIS 84 -18.758 6.820 -4.036 1414 HA HIS 84 HA HIS 84 -19.920 7.834 -1.544 1415 HB2 HIS 84 HB2 HIS 84 -20.750 8.137 -4.439 1416 HB3 HIS 84 HB3 HIS 84 -21.764 8.667 -3.099 1417 HD1 HIS 84 HD1 HIS 84 -19.808 10.212 -5.424 1418 HD2 HIS 84 HD2 HIS 84 -19.710 10.277 -1.271 1419 HE1 HIS 84 HE1 HIS 84 -18.587 12.318 -4.812 1420 HE2 HIS 84 HE2 HIS 84 -18.377 12.235 -2.306 1421 H HIS 85 H HIS 85 -20.701 6.208 -0.377 1422 HA HIS 85 HA HIS 85 -21.512 3.734 -1.541 1423 HB2 HIS 85 HB2 HIS 85 -20.304 3.911 0.608 1424 HB3 HIS 85 HB3 HIS 85 -21.716 4.667 1.333 1425 HD1 HIS 85 HD1 HIS 85 -23.713 3.147 1.904 1426 HD2 HIS 85 HD2 HIS 85 -20.477 1.132 0.246 1427 HE1 HIS 85 HE1 HIS 85 -24.171 0.709 2.285 1428 HE2 HIS 85 HE2 HIS 85 -22.272 -0.493 1.160 1429 H HIS 86 H HIS 86 -23.283 4.762 -2.862 1430 HA HIS 86 HA HIS 86 -25.795 5.211 -1.483 1431 HB2 HIS 86 HB2 HIS 86 -26.690 5.170 -3.916 1432 HB3 HIS 86 HB3 HIS 86 -25.630 6.490 -3.438 1433 HD1 HIS 86 HD1 HIS 86 -23.450 6.751 -4.687 1434 HD2 HIS 86 HD2 HIS 86 -25.443 3.237 -5.656 1435 HE1 HIS 86 HE1 HIS 86 -22.219 5.802 -6.656 1436 HE2 HIS 86 HE2 HIS 86 -23.365 3.619 -7.148 1437 H HIS 87 H HIS 87 -26.363 3.352 -0.389 1438 HA HIS 87 HA HIS 87 -26.057 0.749 -1.517 1439 HB2 HIS 87 HB2 HIS 87 -25.993 1.182 0.932 1440 HB3 HIS 87 HB3 HIS 87 -27.714 1.559 0.888 1441 HD1 HIS 87 HD1 HIS 87 -29.331 -0.485 0.252 1442 HD2 HIS 87 HD2 HIS 87 -25.387 -1.493 1.098 1443 HE1 HIS 87 HE1 HIS 87 -29.333 -2.965 0.622 1444 HE2 HIS 87 HE2 HIS 87 -26.930 -3.565 1.039 1445 H HIS 88 H HIS 88 -27.360 -0.329 -2.840 1446 HA HIS 88 HA HIS 88 -30.219 0.406 -2.960 1447 HB2 HIS 88 HB2 HIS 88 -30.108 -0.445 -5.373 1448 HB3 HIS 88 HB3 HIS 88 -29.353 1.106 -5.036 1449 HD1 HIS 88 HD1 HIS 88 -28.438 -2.505 -5.720 1450 HD2 HIS 88 HD2 HIS 88 -26.671 1.256 -5.633 1451 HE1 HIS 88 HE1 HIS 88 -26.154 -2.809 -6.716 1452 HE2 HIS 88 HE2 HIS 88 -25.181 -0.496 -6.810 Start of MODEL 7 1 H1 MET 1 H1 MET 1 12.805 -22.632 13.424 2 H2 MET 1 H2 MET 1 13.094 -22.035 14.980 3 H3 MET 1 H3 MET 1 14.279 -21.880 13.782 4 HA MET 1 HA MET 1 13.130 -19.788 14.191 5 HB2 MET 1 HB2 MET 1 12.638 -19.246 11.860 6 HB3 MET 1 HB3 MET 1 14.066 -20.268 11.950 7 HG2 MET 1 HG2 MET 1 12.854 -22.171 11.192 8 HG3 MET 1 HG3 MET 1 11.312 -21.336 11.364 9 HE1 MET 1 HE1 MET 1 14.670 -19.912 9.875 10 HE2 MET 1 HE2 MET 1 14.464 -20.274 8.161 11 HE3 MET 1 HE3 MET 1 14.656 -21.586 9.325 12 H THR 2 H THR 2 11.076 -18.598 13.238 13 HA THR 2 HA THR 2 8.661 -20.089 12.935 14 HB THR 2 HB THR 2 8.822 -20.218 15.407 15 HG1 THR 2 HG1 THR 2 6.727 -20.218 15.025 16 HG21 THR 2 HG21 THR 2 8.628 -17.198 15.300 17 HG22 THR 2 HG22 THR 2 10.036 -18.124 15.821 18 HG23 THR 2 HG23 THR 2 8.544 -18.187 16.758 19 H ASP 3 H ASP 3 6.765 -18.662 12.612 20 HA ASP 3 HA ASP 3 7.166 -15.829 12.351 21 HB2 ASP 3 HB2 ASP 3 6.682 -15.770 9.889 22 HB3 ASP 3 HB3 ASP 3 8.254 -16.444 10.298 23 H PHE 4 H PHE 4 5.232 -14.671 11.934 24 HA PHE 4 HA PHE 4 2.766 -16.167 11.535 25 HB2 PHE 4 HB2 PHE 4 1.641 -15.173 13.472 26 HB3 PHE 4 HB3 PHE 4 3.013 -16.146 13.982 27 HD1 PHE 4 HD2 PHE 4 5.008 -15.083 14.937 28 HD2 PHE 4 HD1 PHE 4 1.607 -12.780 13.789 29 HE1 PHE 4 HE2 PHE 4 5.861 -13.173 16.235 30 HE2 PHE 4 HE1 PHE 4 2.460 -10.872 15.083 31 HZ PHE 4 HZ PHE 4 4.595 -11.057 16.296 32 H LEU 5 H LEU 5 0.945 -14.784 11.000 33 HA LEU 5 HA LEU 5 1.758 -12.520 9.404 34 HB2 LEU 5 HB2 LEU 5 0.088 -14.111 8.580 35 HB3 LEU 5 HB3 LEU 5 -0.965 -13.723 9.924 36 HG LEU 5 HG LEU 5 -1.244 -11.433 9.060 37 HD11 LEU 5 HD11 LEU 5 0.922 -11.162 7.969 38 HD12 LEU 5 HD12 LEU 5 -0.391 -10.832 6.842 39 HD13 LEU 5 HD13 LEU 5 0.481 -12.365 6.757 40 HD21 LEU 5 HD21 LEU 5 -2.812 -13.174 8.374 41 HD22 LEU 5 HD22 LEU 5 -1.790 -13.561 6.989 42 HD23 LEU 5 HD23 LEU 5 -2.577 -11.985 7.097 43 H ALA 6 H ALA 6 2.153 -10.652 10.416 44 HA ALA 6 HA ALA 6 0.617 -9.902 12.794 45 HB1 ALA 6 HB1 ALA 6 3.110 -8.668 11.623 46 HB2 ALA 6 HB2 ALA 6 3.054 -9.847 12.934 47 HB3 ALA 6 HB3 ALA 6 2.359 -8.244 13.163 48 H GLY 7 H GLY 7 -0.550 -7.996 12.972 49 HA2 GLY 7 HA2 GLY 7 -1.057 -6.537 10.447 50 HA3 GLY 7 HA3 GLY 7 -2.276 -6.828 11.676 51 H ILE 8 H ILE 8 -0.930 -4.371 10.396 52 HA ILE 8 HA ILE 8 -0.510 -2.884 12.915 53 HB ILE 8 HB ILE 8 0.880 -2.293 10.278 54 HG12 ILE 8 HG12 ILE 8 1.975 -3.574 12.801 55 HG13 ILE 8 HG13 ILE 8 1.765 -4.363 11.243 56 HG21 ILE 8 HG21 ILE 8 0.491 -0.307 11.650 57 HG22 ILE 8 HG22 ILE 8 2.209 -0.700 11.580 58 HG23 ILE 8 HG23 ILE 8 1.273 -1.091 13.023 59 HD11 ILE 8 HD11 ILE 8 3.456 -2.894 10.270 60 HD12 ILE 8 HD12 ILE 8 4.090 -3.793 11.649 61 HD13 ILE 8 HD13 ILE 8 3.656 -2.095 11.832 62 H ARG 9 H ARG 9 -1.408 -0.768 12.974 63 HA ARG 9 HA ARG 9 -2.971 0.061 10.616 64 HB2 ARG 9 HB2 ARG 9 -4.498 -0.916 12.298 65 HB3 ARG 9 HB3 ARG 9 -3.927 0.254 13.484 66 HG2 ARG 9 HG2 ARG 9 -4.778 2.079 12.070 67 HG3 ARG 9 HG3 ARG 9 -5.374 0.890 10.912 68 HD2 ARG 9 HD2 ARG 9 -6.842 -0.049 12.633 69 HD3 ARG 9 HD3 ARG 9 -6.243 1.134 13.795 70 HE ARG 9 HE ARG 9 -7.450 2.170 11.356 71 HH11 ARG 9 HH11 ARG 9 -7.789 1.466 14.710 72 HH12 ARG 9 HH12 ARG 9 -9.170 2.489 14.900 73 HH21 ARG 9 HH21 ARG 9 -9.253 3.463 11.600 74 HH22 ARG 9 HH22 ARG 9 -9.992 3.601 13.157 75 H ILE 10 H ILE 10 -2.412 2.002 9.937 76 HA ILE 10 HA ILE 10 -1.077 3.881 11.796 77 HB ILE 10 HB ILE 10 -0.880 3.819 8.773 78 HG12 ILE 10 HG12 ILE 10 1.147 2.713 10.734 79 HG13 ILE 10 HG13 ILE 10 -0.017 1.716 9.869 80 HG21 ILE 10 HG21 ILE 10 1.111 5.212 9.116 81 HG22 ILE 10 HG22 ILE 10 0.827 5.188 10.857 82 HG23 ILE 10 HG23 ILE 10 -0.335 5.971 9.785 83 HD11 ILE 10 HD11 ILE 10 0.951 2.503 7.743 84 HD12 ILE 10 HD12 ILE 10 2.095 1.627 8.756 85 HD13 ILE 10 HD13 ILE 10 2.171 3.387 8.662 86 H VAL 11 H VAL 11 -2.411 5.562 12.371 87 HA VAL 11 HA VAL 11 -4.245 6.612 10.306 88 HB VAL 11 HB VAL 11 -4.617 6.515 13.303 89 HG11 VAL 11 HG11 VAL 11 -6.325 7.953 11.266 90 HG12 VAL 11 HG12 VAL 11 -5.340 8.712 12.517 91 HG13 VAL 11 HG13 VAL 11 -6.727 7.721 12.968 92 HG21 VAL 11 HG21 VAL 11 -5.191 4.471 12.090 93 HG22 VAL 11 HG22 VAL 11 -6.235 5.394 11.006 94 HG23 VAL 11 HG23 VAL 11 -6.643 5.252 12.718 95 H GLY 12 H GLY 12 -3.607 8.445 9.485 96 HA2 GLY 12 HA2 GLY 12 -2.585 10.580 11.218 97 HA3 GLY 12 HA3 GLY 12 -1.558 10.050 9.893 98 H GLU 13 H GLU 13 -2.184 12.615 9.855 99 HA GLU 13 HA GLU 13 -4.646 13.328 8.652 100 HB2 GLU 13 HB2 GLU 13 -3.422 15.482 8.122 101 HB3 GLU 13 HB3 GLU 13 -3.438 15.005 9.816 102 HG2 GLU 13 HG2 GLU 13 -1.153 14.043 9.491 103 HG3 GLU 13 HG3 GLU 13 -1.153 14.736 7.870 104 H ASP 14 H ASP 14 -5.222 13.710 6.514 105 HA ASP 14 HA ASP 14 -3.933 11.921 4.656 106 HB2 ASP 14 HB2 ASP 14 -5.884 12.219 3.303 107 HB3 ASP 14 HB3 ASP 14 -6.427 12.173 4.973 108 H LYS 15 H LYS 15 -2.099 13.945 5.096 109 HA LYS 15 HA LYS 15 -2.317 16.166 3.403 110 HB2 LYS 15 HB2 LYS 15 -0.110 14.916 4.938 111 HB3 LYS 15 HB3 LYS 15 0.350 16.010 3.639 112 HG2 LYS 15 HG2 LYS 15 -1.210 17.701 4.660 113 HG3 LYS 15 HG3 LYS 15 -1.341 16.619 6.050 114 HD2 LYS 15 HD2 LYS 15 0.954 16.859 6.576 115 HD3 LYS 15 HD3 LYS 15 1.316 17.592 5.009 116 HE2 LYS 15 HE2 LYS 15 1.294 19.320 6.676 117 HE3 LYS 15 HE3 LYS 15 -0.111 19.518 5.630 118 HZ1 LYS 15 HZ1 LYS 15 -0.105 18.292 8.338 119 HZ2 LYS 15 HZ2 LYS 15 -1.461 18.428 7.337 120 HZ3 LYS 15 HZ3 LYS 15 -0.711 19.820 7.939 121 H ASN 16 H ASN 16 -0.932 16.771 1.707 122 HA ASN 16 HA ASN 16 -1.372 15.532 -0.655 123 HB2 ASN 16 HB2 ASN 16 0.611 16.958 -1.466 124 HB3 ASN 16 HB3 ASN 16 -0.726 17.786 -0.670 125 HD21 ASN 16 HD21 ASN 16 0.411 19.505 0.136 126 HD22 ASN 16 HD22 ASN 16 1.656 19.359 1.322 127 H GLY 17 H GLY 17 1.421 14.906 1.428 128 HA2 GLY 17 HA2 GLY 17 2.243 12.788 -0.485 129 HA3 GLY 17 HA3 GLY 17 3.399 13.762 0.403 130 H MET 18 H MET 18 0.898 13.136 2.512 131 HA MET 18 HA MET 18 2.577 11.475 4.104 132 HB2 MET 18 HB2 MET 18 -0.159 12.631 4.376 133 HB3 MET 18 HB3 MET 18 0.243 11.272 5.416 134 HG2 MET 18 HG2 MET 18 1.802 13.841 5.223 135 HG3 MET 18 HG3 MET 18 0.665 13.417 6.503 136 HE1 MET 18 HE1 MET 18 2.456 10.183 7.954 137 HE2 MET 18 HE2 MET 18 1.418 10.177 6.529 138 HE3 MET 18 HE3 MET 18 0.967 11.127 7.944 139 H THR 19 H THR 19 -0.553 10.720 2.526 140 HA THR 19 HA THR 19 -0.634 8.009 3.238 141 HB THR 19 HB THR 19 -2.189 7.732 1.320 142 HG1 THR 19 HG1 THR 19 -2.539 9.438 -0.077 143 HG21 THR 19 HG21 THR 19 -2.640 10.250 2.940 144 HG22 THR 19 HG22 THR 19 -3.071 8.609 3.423 145 HG23 THR 19 HG23 THR 19 -3.883 9.368 2.054 146 H ASN 20 H ASN 20 1.057 9.662 0.663 147 HA ASN 20 HA ASN 20 1.724 7.318 -0.833 148 HB2 ASN 20 HB2 ASN 20 1.556 9.602 -1.815 149 HB3 ASN 20 HB3 ASN 20 2.973 10.081 -0.885 150 HD21 ASN 20 HD21 ASN 20 1.801 8.240 -3.571 151 HD22 ASN 20 HD22 ASN 20 3.341 7.909 -4.263 152 H GLN 21 H GLN 21 3.489 9.445 1.431 153 HA GLN 21 HA GLN 21 5.935 8.048 1.273 154 HB2 GLN 21 HB2 GLN 21 6.685 9.403 3.076 155 HB3 GLN 21 HB3 GLN 21 5.663 10.404 2.066 156 HG2 GLN 21 HG2 GLN 21 3.835 10.163 3.655 157 HG3 GLN 21 HG3 GLN 21 4.826 9.101 4.650 158 HE21 GLN 21 HE21 GLN 21 4.389 12.380 3.543 159 HE22 GLN 21 HE22 GLN 21 5.376 13.117 4.752 160 H ILE 22 H ILE 22 3.133 7.666 3.368 161 HA ILE 22 HA ILE 22 4.319 6.129 5.388 162 HB ILE 22 HB ILE 22 1.497 6.444 4.420 163 HG12 ILE 22 HG12 ILE 22 2.490 8.225 5.768 164 HG13 ILE 22 HG13 ILE 22 1.208 7.423 6.669 165 HG21 ILE 22 HG21 ILE 22 2.358 4.542 6.601 166 HG22 ILE 22 HG22 ILE 22 1.579 4.115 5.078 167 HG23 ILE 22 HG23 ILE 22 0.697 5.046 6.287 168 HD11 ILE 22 HD11 ILE 22 2.872 6.163 7.925 169 HD12 ILE 22 HD12 ILE 22 3.136 7.901 8.075 170 HD13 ILE 22 HD13 ILE 22 4.162 6.941 7.008 171 H THR 23 H THR 23 2.465 4.957 2.538 172 HA THR 23 HA THR 23 3.129 2.233 3.076 173 HB THR 23 HB THR 23 2.257 3.312 0.381 174 HG1 THR 23 HG1 THR 23 0.856 3.037 2.777 175 HG21 THR 23 HG21 THR 23 3.024 0.989 0.390 176 HG22 THR 23 HG22 THR 23 1.283 1.078 0.125 177 HG23 THR 23 HG23 THR 23 1.910 0.622 1.708 178 H GLY 24 H GLY 24 4.644 4.809 1.249 179 HA2 GLY 24 HA2 GLY 24 6.579 3.369 -0.179 180 HA3 GLY 24 HA3 GLY 24 6.787 5.003 0.437 181 H VAL 25 H VAL 25 6.730 4.622 3.170 182 HA VAL 25 HA VAL 25 9.287 3.575 3.775 183 HB VAL 25 HB VAL 25 6.983 4.205 5.643 184 HG11 VAL 25 HG11 VAL 25 8.548 2.700 6.743 185 HG12 VAL 25 HG12 VAL 25 8.701 4.321 7.418 186 HG13 VAL 25 HG13 VAL 25 9.905 3.725 6.274 187 HG21 VAL 25 HG21 VAL 25 8.222 6.305 6.054 188 HG22 VAL 25 HG22 VAL 25 7.711 6.148 4.373 189 HG23 VAL 25 HG23 VAL 25 9.390 5.840 4.816 190 H ILE 26 H ILE 26 6.032 2.216 4.081 191 HA ILE 26 HA ILE 26 6.660 -0.175 5.399 192 HB ILE 26 HB ILE 26 4.520 0.402 3.341 193 HG12 ILE 26 HG12 ILE 26 4.434 0.247 6.372 194 HG13 ILE 26 HG13 ILE 26 4.376 1.725 5.417 195 HG21 ILE 26 HG21 ILE 26 4.948 -1.997 3.398 196 HG22 ILE 26 HG22 ILE 26 3.387 -1.624 4.126 197 HG23 ILE 26 HG23 ILE 26 4.771 -2.003 5.154 198 HD11 ILE 26 HD11 ILE 26 2.178 1.119 6.218 199 HD12 ILE 26 HD12 ILE 26 2.301 -0.458 5.437 200 HD13 ILE 26 HD13 ILE 26 2.242 1.011 4.460 201 H SER 27 H SER 27 6.806 0.640 1.958 202 HA SER 27 HA SER 27 7.371 -1.880 0.882 203 HB2 SER 27 HB2 SER 27 8.610 0.686 -0.135 204 HB3 SER 27 HB3 SER 27 8.149 -0.740 -1.063 205 HG SER 27 HG SER 27 6.568 1.322 -0.031 206 H LYS 28 H LYS 28 9.332 0.159 2.826 207 HA LYS 28 HA LYS 28 11.875 -0.837 1.861 208 HB2 LYS 28 HB2 LYS 28 11.338 0.904 4.274 209 HB3 LYS 28 HB3 LYS 28 12.857 0.729 3.399 210 HG2 LYS 28 HG2 LYS 28 11.846 1.784 1.426 211 HG3 LYS 28 HG3 LYS 28 10.322 1.942 2.296 212 HD2 LYS 28 HD2 LYS 28 11.546 4.050 2.297 213 HD3 LYS 28 HD3 LYS 28 11.385 3.409 3.932 214 HE2 LYS 28 HE2 LYS 28 13.626 4.298 3.552 215 HE3 LYS 28 HE3 LYS 28 13.679 2.558 3.828 216 HZ1 LYS 28 HZ1 LYS 28 15.115 3.277 2.002 217 HZ2 LYS 28 HZ2 LYS 28 13.769 3.855 1.155 218 HZ3 LYS 28 HZ3 LYS 28 13.925 2.199 1.472 219 H PHE 29 H PHE 29 9.590 -2.148 3.852 220 HA PHE 29 HA PHE 29 11.229 -3.107 5.997 221 HB2 PHE 29 HB2 PHE 29 8.505 -4.023 5.045 222 HB3 PHE 29 HB3 PHE 29 9.289 -4.586 6.516 223 HD1 PHE 29 HD2 PHE 29 10.401 -1.487 6.764 224 HD2 PHE 29 HD1 PHE 29 6.619 -3.451 6.617 225 HE1 PHE 29 HE2 PHE 29 9.389 0.374 8.008 226 HE2 PHE 29 HE1 PHE 29 5.606 -1.586 7.865 227 HZ PHE 29 HZ PHE 29 6.992 0.324 8.564 228 H ASP 30 H ASP 30 11.576 -5.407 6.459 229 HA ASP 30 HA ASP 30 12.947 -6.684 4.290 230 HB2 ASP 30 HB2 ASP 30 12.374 -8.108 6.868 231 HB3 ASP 30 HB3 ASP 30 13.853 -8.081 5.910 232 H THR 31 H THR 31 9.782 -6.898 5.573 233 HA THR 31 HA THR 31 9.369 -9.698 4.863 234 HB THR 31 HB THR 31 8.531 -9.077 7.009 235 HG1 THR 31 HG1 THR 31 6.989 -10.410 6.417 236 HG21 THR 31 HG21 THR 31 6.859 -7.326 7.351 237 HG22 THR 31 HG22 THR 31 6.928 -6.912 5.638 238 HG23 THR 31 HG23 THR 31 8.340 -6.659 6.666 239 H ASN 32 H ASN 32 7.308 -10.326 3.823 240 HA ASN 32 HA ASN 32 6.882 -8.784 1.381 241 HB2 ASN 32 HB2 ASN 32 7.222 -11.195 1.178 242 HB3 ASN 32 HB3 ASN 32 5.851 -11.505 2.238 243 HD21 ASN 32 HD21 ASN 32 6.863 -10.724 -0.947 244 HD22 ASN 32 HD22 ASN 32 5.300 -10.768 -1.680 245 H ILE 33 H ILE 33 5.196 -7.449 1.088 246 HA ILE 33 HA ILE 33 3.163 -7.060 3.029 247 HB ILE 33 HB ILE 33 3.250 -6.128 0.149 248 HG12 ILE 33 HG12 ILE 33 4.065 -4.716 2.712 249 HG13 ILE 33 HG13 ILE 33 5.170 -5.356 1.500 250 HG21 ILE 33 HG21 ILE 33 1.532 -5.183 2.455 251 HG22 ILE 33 HG22 ILE 33 0.976 -6.038 1.015 252 HG23 ILE 33 HG23 ILE 33 1.630 -4.406 0.874 253 HD11 ILE 33 HD11 ILE 33 4.951 -2.964 1.281 254 HD12 ILE 33 HD12 ILE 33 3.202 -3.113 1.108 255 HD13 ILE 33 HD13 ILE 33 4.271 -3.767 -0.133 256 H ARG 34 H ARG 34 1.993 -8.913 3.416 257 HA ARG 34 HA ARG 34 0.973 -10.586 1.324 258 HB2 ARG 34 HB2 ARG 34 1.529 -11.240 3.761 259 HB3 ARG 34 HB3 ARG 34 -0.031 -10.547 4.173 260 HG2 ARG 34 HG2 ARG 34 -0.527 -12.794 3.944 261 HG3 ARG 34 HG3 ARG 34 -0.967 -12.154 2.360 262 HD2 ARG 34 HD2 ARG 34 1.484 -13.729 3.129 263 HD3 ARG 34 HD3 ARG 34 0.238 -14.159 1.960 264 HE ARG 34 HE ARG 34 2.105 -11.919 1.526 265 HH11 ARG 34 HH11 ARG 34 0.590 -14.812 0.422 266 HH12 ARG 34 HH12 ARG 34 1.235 -14.651 -1.172 267 HH21 ARG 34 HH21 ARG 34 2.929 -11.751 -0.498 268 HH22 ARG 34 HH22 ARG 34 2.539 -12.942 -1.688 269 H THR 35 H THR 35 -0.299 -7.991 3.295 270 HA THR 35 HA THR 35 -2.429 -7.469 1.402 271 HB THR 35 HB THR 35 -3.197 -8.011 4.286 272 HG1 THR 35 HG1 THR 35 -3.125 -9.703 2.062 273 HG21 THR 35 HG21 THR 35 -4.887 -7.493 1.834 274 HG22 THR 35 HG22 THR 35 -4.628 -6.375 3.173 275 HG23 THR 35 HG23 THR 35 -5.507 -7.880 3.439 276 H ILE 36 H ILE 36 -3.203 -5.301 1.596 277 HA ILE 36 HA ILE 36 -2.657 -3.807 3.997 278 HB ILE 36 HB ILE 36 -0.491 -3.668 2.742 279 HG12 ILE 36 HG12 ILE 36 -1.868 -0.990 3.047 280 HG13 ILE 36 HG13 ILE 36 -1.314 -1.962 4.409 281 HG21 ILE 36 HG21 ILE 36 -1.308 -3.586 0.457 282 HG22 ILE 36 HG22 ILE 36 -0.350 -2.143 0.805 283 HG23 ILE 36 HG23 ILE 36 -2.111 -2.047 0.773 284 HD11 ILE 36 HD11 ILE 36 0.282 -0.234 3.871 285 HD12 ILE 36 HD12 ILE 36 0.409 -0.838 2.218 286 HD13 ILE 36 HD13 ILE 36 0.965 -1.831 3.567 287 H VAL 37 H VAL 37 -4.075 -2.185 4.307 288 HA VAL 37 HA VAL 37 -5.733 -1.287 2.036 289 HB VAL 37 HB VAL 37 -6.789 -2.008 4.786 290 HG11 VAL 37 HG11 VAL 37 -8.003 -0.124 3.852 291 HG12 VAL 37 HG12 VAL 37 -9.015 -1.567 3.812 292 HG13 VAL 37 HG13 VAL 37 -8.241 -0.992 2.335 293 HG21 VAL 37 HG21 VAL 37 -6.272 -4.005 3.493 294 HG22 VAL 37 HG22 VAL 37 -7.199 -3.385 2.127 295 HG23 VAL 37 HG23 VAL 37 -8.019 -3.803 3.632 296 H LEU 38 H LEU 38 -5.028 0.791 1.852 297 HA LEU 38 HA LEU 38 -5.101 2.506 4.260 298 HB2 LEU 38 HB2 LEU 38 -2.973 2.489 2.976 299 HB3 LEU 38 HB3 LEU 38 -3.834 3.036 1.554 300 HG LEU 38 HG LEU 38 -3.771 4.703 4.081 301 HD11 LEU 38 HD11 LEU 38 -1.449 4.295 3.524 302 HD12 LEU 38 HD12 LEU 38 -1.878 5.952 3.092 303 HD13 LEU 38 HD13 LEU 38 -1.745 4.718 1.836 304 HD21 LEU 38 HD21 LEU 38 -5.420 5.376 2.420 305 HD22 LEU 38 HD22 LEU 38 -4.183 5.398 1.163 306 HD23 LEU 38 HD23 LEU 38 -4.117 6.562 2.488 307 H ASN 39 H ASN 39 -6.846 3.805 4.488 308 HA ASN 39 HA ASN 39 -8.089 4.911 2.066 309 HB2 ASN 39 HB2 ASN 39 -10.352 4.497 2.923 310 HB3 ASN 39 HB3 ASN 39 -9.478 2.989 2.696 311 HD21 ASN 39 HD21 ASN 39 -8.822 1.816 4.518 312 HD22 ASN 39 HD22 ASN 39 -9.516 2.100 6.071 313 H ALA 40 H ALA 40 -8.342 7.060 2.198 314 HA ALA 40 HA ALA 40 -8.064 8.385 4.799 315 HB1 ALA 40 HB1 ALA 40 -8.177 9.567 2.018 316 HB2 ALA 40 HB2 ALA 40 -6.709 9.189 2.918 317 HB3 ALA 40 HB3 ALA 40 -7.806 10.439 3.505 318 H LYS 41 H LYS 41 -9.953 8.284 5.867 319 HA LYS 41 HA LYS 41 -12.375 9.308 4.519 320 HB2 LYS 41 HB2 LYS 41 -13.732 7.964 5.886 321 HB3 LYS 41 HB3 LYS 41 -12.391 6.912 5.463 322 HG2 LYS 41 HG2 LYS 41 -12.658 8.409 8.069 323 HG3 LYS 41 HG3 LYS 41 -13.082 6.716 7.822 324 HD2 LYS 41 HD2 LYS 41 -10.775 6.163 7.337 325 HD3 LYS 41 HD3 LYS 41 -10.319 7.868 7.390 326 HE2 LYS 41 HE2 LYS 41 -11.332 6.204 9.702 327 HE3 LYS 41 HE3 LYS 41 -9.675 6.756 9.454 328 HZ1 LYS 41 HZ1 LYS 41 -10.549 9.069 9.574 329 HZ2 LYS 41 HZ2 LYS 41 -10.716 8.202 11.012 330 HZ3 LYS 41 HZ3 LYS 41 -12.055 8.443 10.016 331 H ASP 42 H ASP 42 -13.439 11.050 5.387 332 HA ASP 42 HA ASP 42 -13.916 12.841 6.728 333 HB2 ASP 42 HB2 ASP 42 -14.189 10.925 8.375 334 HB3 ASP 42 HB3 ASP 42 -12.562 11.288 8.943 335 H GLY 43 H GLY 43 -11.142 12.392 5.466 336 HA2 GLY 43 HA2 GLY 43 -9.427 13.954 5.127 337 HA3 GLY 43 HA3 GLY 43 -9.876 14.755 6.618 338 H ILE 44 H ILE 44 -9.660 11.487 7.249 339 HA ILE 44 HA ILE 44 -6.761 11.605 7.813 340 HB ILE 44 HB ILE 44 -8.752 10.216 9.615 341 HG12 ILE 44 HG12 ILE 44 -7.590 12.999 9.834 342 HG13 ILE 44 HG13 ILE 44 -9.284 12.546 9.740 343 HG21 ILE 44 HG21 ILE 44 -6.462 9.373 9.717 344 HG22 ILE 44 HG22 ILE 44 -6.889 10.202 11.213 345 HG23 ILE 44 HG23 ILE 44 -5.862 11.003 10.023 346 HD11 ILE 44 HD11 ILE 44 -7.423 11.918 12.013 347 HD12 ILE 44 HD12 ILE 44 -9.131 11.484 11.922 348 HD13 ILE 44 HD13 ILE 44 -8.654 13.182 11.997 349 H PHE 45 H PHE 45 -5.626 9.658 7.579 350 HA PHE 45 HA PHE 45 -7.139 7.591 6.102 351 HB2 PHE 45 HB2 PHE 45 -5.173 7.045 4.860 352 HB3 PHE 45 HB3 PHE 45 -5.354 8.792 4.812 353 HD1 PHE 45 HD1 PHE 45 -3.356 6.006 6.102 354 HD2 PHE 45 HD2 PHE 45 -3.756 10.240 5.911 355 HE1 PHE 45 HE1 PHE 45 -1.048 6.254 6.911 356 HE2 PHE 45 HE2 PHE 45 -1.446 10.494 6.721 357 HZ PHE 45 HZ PHE 45 -0.094 8.500 7.225 358 H THR 46 H THR 46 -7.091 5.504 6.707 359 HA THR 46 HA THR 46 -5.315 4.760 8.950 360 HB THR 46 HB THR 46 -7.542 4.567 9.749 361 HG1 THR 46 HG1 THR 46 -6.841 1.920 8.926 362 HG21 THR 46 HG21 THR 46 -9.291 3.264 8.608 363 HG22 THR 46 HG22 THR 46 -8.200 2.999 7.248 364 HG23 THR 46 HG23 THR 46 -8.749 4.631 7.635 365 H CYS 47 H CYS 47 -3.579 3.899 7.954 366 HA CYS 47 HA CYS 47 -3.881 2.048 5.724 367 HB2 CYS 47 HB2 CYS 47 -2.099 3.747 5.655 368 HB3 CYS 47 HB3 CYS 47 -1.380 3.055 7.106 369 HG CYS 47 HG CYS 47 -1.790 0.936 4.518 370 H ASN 48 H ASN 48 -4.635 0.115 6.427 371 HA ASN 48 HA ASN 48 -3.476 -1.200 8.745 372 HB2 ASN 48 HB2 ASN 48 -5.603 -2.119 6.790 373 HB3 ASN 48 HB3 ASN 48 -5.116 -2.996 8.238 374 HD21 ASN 48 HD21 ASN 48 -7.148 -2.877 9.150 375 HD22 ASN 48 HD22 ASN 48 -7.815 -1.404 9.758 376 H LEU 49 H LEU 49 -1.544 -2.119 8.486 377 HA LEU 49 HA LEU 49 -0.786 -3.315 5.914 378 HB2 LEU 49 HB2 LEU 49 0.789 -1.730 6.800 379 HB3 LEU 49 HB3 LEU 49 0.801 -2.531 8.360 380 HG LEU 49 HG LEU 49 1.887 -4.503 7.312 381 HD11 LEU 49 HD11 LEU 49 1.995 -2.750 4.858 382 HD12 LEU 49 HD12 LEU 49 1.098 -4.259 5.036 383 HD13 LEU 49 HD13 LEU 49 2.861 -4.273 5.067 384 HD21 LEU 49 HD21 LEU 49 3.233 -2.806 8.427 385 HD22 LEU 49 HD22 LEU 49 3.343 -1.886 6.926 386 HD23 LEU 49 HD23 LEU 49 4.093 -3.478 7.042 387 H MET 50 H MET 50 -0.466 -5.461 5.637 388 HA MET 50 HA MET 50 -0.455 -7.211 8.020 389 HB2 MET 50 HB2 MET 50 -1.763 -7.802 5.354 390 HB3 MET 50 HB3 MET 50 -1.692 -8.894 6.730 391 HG2 MET 50 HG2 MET 50 -3.145 -6.257 6.616 392 HG3 MET 50 HG3 MET 50 -3.868 -7.865 6.577 393 HE1 MET 50 HE1 MET 50 -3.308 -9.650 8.650 394 HE2 MET 50 HE2 MET 50 -2.681 -9.110 10.208 395 HE3 MET 50 HE3 MET 50 -1.629 -9.120 8.792 396 H ILE 51 H ILE 51 1.512 -8.061 8.197 397 HA ILE 51 HA ILE 51 2.832 -9.185 5.827 398 HB ILE 51 HB ILE 51 5.039 -8.198 6.677 399 HG12 ILE 51 HG12 ILE 51 4.550 -5.824 7.710 400 HG13 ILE 51 HG13 ILE 51 3.064 -6.580 8.270 401 HG21 ILE 51 HG21 ILE 51 4.017 -7.518 4.592 402 HG22 ILE 51 HG22 ILE 51 4.729 -6.125 5.405 403 HG23 ILE 51 HG23 ILE 51 2.981 -6.371 5.443 404 HD11 ILE 51 HD11 ILE 51 4.375 -8.253 9.468 405 HD12 ILE 51 HD12 ILE 51 4.780 -6.613 9.977 406 HD13 ILE 51 HD13 ILE 51 5.865 -7.492 8.899 407 H PHE 52 H PHE 52 4.656 -10.629 6.356 408 HA PHE 52 HA PHE 52 4.029 -12.159 8.766 409 HB2 PHE 52 HB2 PHE 52 5.403 -12.790 6.189 410 HB3 PHE 52 HB3 PHE 52 5.811 -13.752 7.606 411 HD1 PHE 52 HD2 PHE 52 3.995 -14.962 8.823 412 HD2 PHE 52 HD1 PHE 52 3.368 -13.166 5.008 413 HE1 PHE 52 HE2 PHE 52 1.988 -16.349 8.503 414 HE2 PHE 52 HE1 PHE 52 1.358 -14.549 4.686 415 HZ PHE 52 HZ PHE 52 0.669 -16.144 6.431 416 H VAL 53 H VAL 53 5.173 -12.060 10.543 417 HA VAL 53 HA VAL 53 7.891 -10.897 10.460 418 HB VAL 53 HB VAL 53 7.542 -10.225 12.804 419 HG11 VAL 53 HG11 VAL 53 5.887 -8.455 12.422 420 HG12 VAL 53 HG12 VAL 53 5.353 -9.276 10.954 421 HG13 VAL 53 HG13 VAL 53 6.990 -8.624 11.055 422 HG21 VAL 53 HG21 VAL 53 5.327 -10.395 13.826 423 HG22 VAL 53 HG22 VAL 53 5.990 -11.987 13.459 424 HG23 VAL 53 HG23 VAL 53 4.744 -11.290 12.422 425 H LYS 54 H LYS 54 9.562 -11.895 11.573 426 HA LYS 54 HA LYS 54 9.303 -14.691 12.136 427 HB2 LYS 54 HB2 LYS 54 11.698 -14.535 12.809 428 HB3 LYS 54 HB3 LYS 54 11.361 -13.931 11.193 429 HG2 LYS 54 HG2 LYS 54 11.472 -11.647 11.981 430 HG3 LYS 54 HG3 LYS 54 11.699 -12.203 13.639 431 HD2 LYS 54 HD2 LYS 54 13.589 -12.850 11.373 432 HD3 LYS 54 HD3 LYS 54 13.800 -11.480 12.462 433 HE2 LYS 54 HE2 LYS 54 15.172 -13.175 13.344 434 HE3 LYS 54 HE3 LYS 54 13.734 -13.182 14.358 435 HZ1 LYS 54 HZ1 LYS 54 14.566 -15.412 13.666 436 HZ2 LYS 54 HZ2 LYS 54 14.112 -15.040 12.082 437 HZ3 LYS 54 HZ3 LYS 54 12.941 -15.126 13.298 438 H ASN 55 H ASN 55 8.901 -11.874 14.060 439 HA ASN 55 HA ASN 55 8.048 -13.376 16.308 440 HB2 ASN 55 HB2 ASN 55 9.726 -12.566 17.963 441 HB3 ASN 55 HB3 ASN 55 10.408 -13.674 16.777 442 HD21 ASN 55 HD21 ASN 55 12.082 -13.009 15.567 443 HD22 ASN 55 HD22 ASN 55 12.752 -11.417 15.618 444 H THR 56 H THR 56 7.901 -11.736 18.336 445 HA THR 56 HA THR 56 6.079 -9.719 17.468 446 HB THR 56 HB THR 56 5.895 -9.104 19.852 447 HG1 THR 56 HG1 THR 56 7.254 -9.946 21.351 448 HG21 THR 56 HG21 THR 56 5.055 -11.255 20.681 449 HG22 THR 56 HG22 THR 56 5.900 -12.092 19.378 450 HG23 THR 56 HG23 THR 56 4.574 -10.989 19.006 451 H ASP 57 H ASP 57 9.439 -9.623 18.567 452 HA ASP 57 HA ASP 57 9.602 -6.826 18.995 453 HB2 ASP 57 HB2 ASP 57 11.287 -8.339 19.909 454 HB3 ASP 57 HB3 ASP 57 11.766 -8.827 18.286 455 H LYS 58 H LYS 58 10.126 -8.876 16.194 456 HA LYS 58 HA LYS 58 10.990 -6.991 14.337 457 HB2 LYS 58 HB2 LYS 58 11.030 -9.294 13.759 458 HB3 LYS 58 HB3 LYS 58 9.327 -9.498 14.127 459 HG2 LYS 58 HG2 LYS 58 9.516 -9.596 11.794 460 HG3 LYS 58 HG3 LYS 58 8.821 -8.026 12.175 461 HD2 LYS 58 HD2 LYS 58 11.788 -8.217 11.859 462 HD3 LYS 58 HD3 LYS 58 10.801 -8.323 10.406 463 HE2 LYS 58 HE2 LYS 58 9.774 -6.158 10.970 464 HE3 LYS 58 HE3 LYS 58 10.802 -6.055 12.401 465 HZ1 LYS 58 HZ1 LYS 58 11.731 -6.130 9.579 466 HZ2 LYS 58 HZ2 LYS 58 12.740 -6.101 10.935 467 HZ3 LYS 58 HZ3 LYS 58 11.742 -4.781 10.601 468 H LEU 59 H LEU 59 7.668 -7.901 15.256 469 HA LEU 59 HA LEU 59 6.338 -6.109 13.512 470 HB2 LEU 59 HB2 LEU 59 5.166 -7.984 14.442 471 HB3 LEU 59 HB3 LEU 59 5.485 -7.442 16.080 472 HG LEU 59 HG LEU 59 4.010 -5.497 15.722 473 HD11 LEU 59 HD11 LEU 59 4.275 -5.194 13.338 474 HD12 LEU 59 HD12 LEU 59 2.571 -5.415 13.730 475 HD13 LEU 59 HD13 LEU 59 3.491 -6.742 13.023 476 HD21 LEU 59 HD21 LEU 59 3.102 -7.536 16.696 477 HD22 LEU 59 HD22 LEU 59 2.726 -8.155 15.088 478 HD23 LEU 59 HD23 LEU 59 1.894 -6.724 15.699 479 H THR 60 H THR 60 7.195 -5.810 16.970 480 HA THR 60 HA THR 60 6.001 -3.268 17.346 481 HB THR 60 HB THR 60 7.362 -3.105 19.402 482 HG1 THR 60 HG1 THR 60 8.574 -5.351 19.636 483 HG21 THR 60 HG21 THR 60 5.294 -4.444 19.426 484 HG22 THR 60 HG22 THR 60 6.506 -5.103 20.526 485 HG23 THR 60 HG23 THR 60 6.220 -5.874 18.966 486 H THR 61 H THR 61 9.250 -4.243 16.347 487 HA THR 61 HA THR 61 10.442 -1.696 16.279 488 HB THR 61 HB THR 61 10.976 -4.090 14.493 489 HG1 THR 61 HG1 THR 61 11.595 -4.652 16.519 490 HG21 THR 61 HG21 THR 61 11.805 -2.040 13.428 491 HG22 THR 61 HG22 THR 61 13.141 -3.038 14.000 492 HG23 THR 61 HG23 THR 61 12.658 -1.607 14.910 493 H LEU 62 H LEU 62 8.670 -3.469 13.701 494 HA LEU 62 HA LEU 62 8.793 -1.505 11.723 495 HB2 LEU 62 HB2 LEU 62 6.594 -3.478 12.324 496 HB3 LEU 62 HB3 LEU 62 6.630 -2.477 10.883 497 HG LEU 62 HG LEU 62 8.557 -4.673 11.644 498 HD11 LEU 62 HD11 LEU 62 6.728 -4.313 9.274 499 HD12 LEU 62 HD12 LEU 62 6.432 -5.376 10.652 500 HD13 LEU 62 HD13 LEU 62 7.791 -5.689 9.573 501 HD21 LEU 62 HD21 LEU 62 9.739 -4.156 9.558 502 HD22 LEU 62 HD22 LEU 62 9.835 -2.829 10.713 503 HD23 LEU 62 HD23 LEU 62 8.726 -2.727 9.345 504 H MET 63 H MET 63 6.231 -1.925 14.191 505 HA MET 63 HA MET 63 4.708 0.303 13.385 506 HB2 MET 63 HB2 MET 63 4.881 -0.955 16.135 507 HB3 MET 63 HB3 MET 63 3.625 0.155 15.600 508 HG2 MET 63 HG2 MET 63 3.121 -1.528 13.767 509 HG3 MET 63 HG3 MET 63 4.153 -2.646 14.653 510 HE1 MET 63 HE1 MET 63 3.470 -1.777 17.691 511 HE2 MET 63 HE2 MET 63 3.646 -3.445 17.142 512 HE3 MET 63 HE3 MET 63 2.215 -2.964 18.053 513 H ASP 64 H ASP 64 7.426 0.032 15.631 514 HA ASP 64 HA ASP 64 7.353 2.697 16.581 515 HB2 ASP 64 HB2 ASP 64 8.878 0.466 17.134 516 HB3 ASP 64 HB3 ASP 64 10.041 1.508 16.323 517 H LYS 65 H LYS 65 8.945 1.194 13.788 518 HA LYS 65 HA LYS 65 10.331 3.396 12.763 519 HB2 LYS 65 HB2 LYS 65 8.991 1.086 11.330 520 HB3 LYS 65 HB3 LYS 65 10.029 2.243 10.519 521 HG2 LYS 65 HG2 LYS 65 11.881 1.577 12.026 522 HG3 LYS 65 HG3 LYS 65 10.825 0.351 12.726 523 HD2 LYS 65 HD2 LYS 65 12.248 -0.686 11.068 524 HD3 LYS 65 HD3 LYS 65 10.587 -0.673 10.472 525 HE2 LYS 65 HE2 LYS 65 11.058 1.169 9.012 526 HE3 LYS 65 HE3 LYS 65 12.651 1.405 9.730 527 HZ1 LYS 65 HZ1 LYS 65 12.710 0.244 7.579 528 HZ2 LYS 65 HZ2 LYS 65 11.827 -1.033 8.250 529 HZ3 LYS 65 HZ3 LYS 65 13.373 -0.678 8.832 530 H LEU 66 H LEU 66 7.026 2.313 12.042 531 HA LEU 66 HA LEU 66 6.383 4.396 10.231 532 HB2 LEU 66 HB2 LEU 66 4.572 2.628 11.885 533 HB3 LEU 66 HB3 LEU 66 4.065 3.589 10.506 534 HG LEU 66 HG LEU 66 6.159 1.422 10.282 535 HD11 LEU 66 HD11 LEU 66 4.117 0.384 11.102 536 HD12 LEU 66 HD12 LEU 66 4.396 -0.045 9.415 537 HD13 LEU 66 HD13 LEU 66 3.184 1.168 9.826 538 HD21 LEU 66 HD21 LEU 66 5.598 1.519 7.902 539 HD22 LEU 66 HD22 LEU 66 6.136 3.091 8.492 540 HD23 LEU 66 HD23 LEU 66 4.418 2.791 8.222 541 H ARG 67 H ARG 67 6.175 4.153 13.708 542 HA ARG 67 HA ARG 67 4.344 6.298 14.122 543 HB2 ARG 67 HB2 ARG 67 4.831 4.416 15.725 544 HB3 ARG 67 HB3 ARG 67 6.365 5.191 16.085 545 HG2 ARG 67 HG2 ARG 67 5.234 7.116 17.005 546 HG3 ARG 67 HG3 ARG 67 3.665 6.468 16.519 547 HD2 ARG 67 HD2 ARG 67 5.559 5.210 18.514 548 HD3 ARG 67 HD3 ARG 67 4.090 6.100 18.908 549 HE ARG 67 HE ARG 67 2.869 4.305 17.691 550 HH11 ARG 67 HH11 ARG 67 5.964 3.672 19.078 551 HH12 ARG 67 HH12 ARG 67 5.694 1.966 19.166 552 HH21 ARG 67 HH21 ARG 67 2.532 2.113 17.824 553 HH22 ARG 67 HH22 ARG 67 3.776 1.099 18.472 554 H LYS 68 H LYS 68 7.537 6.369 13.073 555 HA LYS 68 HA LYS 68 8.279 8.833 14.449 556 HB2 LYS 68 HB2 LYS 68 9.793 7.325 12.309 557 HB3 LYS 68 HB3 LYS 68 10.430 8.592 13.353 558 HG2 LYS 68 HG2 LYS 68 9.475 5.867 14.224 559 HG3 LYS 68 HG3 LYS 68 11.151 6.411 14.128 560 HD2 LYS 68 HD2 LYS 68 10.898 7.880 15.948 561 HD3 LYS 68 HD3 LYS 68 9.137 7.844 15.850 562 HE2 LYS 68 HE2 LYS 68 9.958 6.564 17.768 563 HE3 LYS 68 HE3 LYS 68 9.123 5.529 16.613 564 HZ1 LYS 68 HZ1 LYS 68 11.322 4.886 15.738 565 HZ2 LYS 68 HZ2 LYS 68 11.097 4.447 17.352 566 HZ3 LYS 68 HZ3 LYS 68 12.061 5.783 16.971 567 H VAL 69 H VAL 69 6.216 8.347 12.058 568 HA VAL 69 HA VAL 69 7.083 10.548 10.331 569 HB VAL 69 HB VAL 69 4.586 8.836 10.179 570 HG11 VAL 69 HG11 VAL 69 4.397 9.736 7.886 571 HG12 VAL 69 HG12 VAL 69 5.746 10.822 8.217 572 HG13 VAL 69 HG13 VAL 69 4.238 10.987 9.119 573 HG21 VAL 69 HG21 VAL 69 6.591 7.502 9.814 574 HG22 VAL 69 HG22 VAL 69 7.171 8.662 8.619 575 HG23 VAL 69 HG23 VAL 69 5.718 7.717 8.295 576 H GLN 70 H GLN 70 6.706 12.508 11.019 577 HA GLN 70 HA GLN 70 5.104 13.330 13.107 578 HB2 GLN 70 HB2 GLN 70 5.328 15.644 12.080 579 HB3 GLN 70 HB3 GLN 70 6.820 14.781 12.418 580 HG2 GLN 70 HG2 GLN 70 5.583 14.677 9.691 581 HG3 GLN 70 HG3 GLN 70 6.570 16.051 10.182 582 HE21 GLN 70 HE21 GLN 70 8.314 14.296 11.830 583 HE22 GLN 70 HE22 GLN 70 9.327 13.488 10.689 584 H GLY 71 H GLY 71 4.064 12.721 9.828 585 HA2 GLY 71 HA2 GLY 71 1.628 14.243 10.017 586 HA3 GLY 71 HA3 GLY 71 2.017 13.058 8.786 587 H VAL 72 H VAL 72 2.557 11.212 11.279 588 HA VAL 72 HA VAL 72 -0.231 10.271 11.447 589 HB VAL 72 HB VAL 72 2.315 8.754 12.076 590 HG11 VAL 72 HG11 VAL 72 0.870 6.768 12.093 591 HG12 VAL 72 HG12 VAL 72 -0.542 7.792 11.839 592 HG13 VAL 72 HG13 VAL 72 0.387 7.926 13.332 593 HG21 VAL 72 HG21 VAL 72 1.910 7.553 9.977 594 HG22 VAL 72 HG22 VAL 72 2.165 9.276 9.695 595 HG23 VAL 72 HG23 VAL 72 0.534 8.604 9.639 596 H PHE 73 H PHE 73 -1.213 9.862 13.412 597 HA PHE 73 HA PHE 73 0.289 10.664 15.819 598 HB2 PHE 73 HB2 PHE 73 -2.272 11.141 16.582 599 HB3 PHE 73 HB3 PHE 73 -1.195 12.348 15.903 600 HD1 PHE 73 HD1 PHE 73 -4.075 10.166 15.205 601 HD2 PHE 73 HD2 PHE 73 -1.528 13.240 13.710 602 HE1 PHE 73 HE1 PHE 73 -5.669 10.607 13.382 603 HE2 PHE 73 HE2 PHE 73 -3.117 13.679 11.890 604 HZ PHE 73 HZ PHE 73 -5.190 12.369 11.722 605 H THR 74 H THR 74 -1.538 8.156 14.351 606 HA THR 74 HA THR 74 -1.275 6.630 16.865 607 HB THR 74 HB THR 74 -3.369 5.701 16.819 608 HG1 THR 74 HG1 THR 74 -4.317 4.995 15.031 609 HG21 THR 74 HG21 THR 74 -3.918 8.251 15.293 610 HG22 THR 74 HG22 THR 74 -3.716 8.127 17.042 611 HG23 THR 74 HG23 THR 74 -5.087 7.345 16.257 612 H VAL 75 H VAL 75 0.049 4.961 16.587 613 HA VAL 75 HA VAL 75 -0.228 3.348 14.131 614 HB VAL 75 HB VAL 75 2.413 3.836 15.543 615 HG11 VAL 75 HG11 VAL 75 1.761 2.365 12.980 616 HG12 VAL 75 HG12 VAL 75 2.268 1.637 14.505 617 HG13 VAL 75 HG13 VAL 75 3.384 2.664 13.605 618 HG21 VAL 75 HG21 VAL 75 1.711 5.868 14.387 619 HG22 VAL 75 HG22 VAL 75 1.427 4.949 12.907 620 HG23 VAL 75 HG23 VAL 75 3.064 5.114 13.540 621 H GLU 76 H GLU 76 -1.244 1.581 14.859 622 HA GLU 76 HA GLU 76 -0.470 0.461 17.490 623 HB2 GLU 76 HB2 GLU 76 -3.283 0.656 16.373 624 HB3 GLU 76 HB3 GLU 76 -2.828 -0.007 17.936 625 HG2 GLU 76 HG2 GLU 76 -2.413 2.870 17.128 626 HG3 GLU 76 HG3 GLU 76 -3.812 2.278 18.020 627 H ARG 77 H ARG 77 -1.068 -1.812 17.794 628 HA ARG 77 HA ARG 77 -0.704 -3.388 15.380 629 HB2 ARG 77 HB2 ARG 77 0.600 -4.217 17.129 630 HB3 ARG 77 HB3 ARG 77 -0.674 -3.995 18.319 631 HG2 ARG 77 HG2 ARG 77 -1.893 -5.890 17.442 632 HG3 ARG 77 HG3 ARG 77 -0.732 -6.073 16.127 633 HD2 ARG 77 HD2 ARG 77 0.956 -6.830 17.571 634 HD3 ARG 77 HD3 ARG 77 0.135 -6.202 19.000 635 HE ARG 77 HE ARG 77 -1.261 -8.060 19.012 636 HH11 ARG 77 HH11 ARG 77 0.797 -8.179 16.248 637 HH12 ARG 77 HH12 ARG 77 0.539 -9.867 16.003 638 HH21 ARG 77 HH21 ARG 77 -1.573 -10.208 18.688 639 HH22 ARG 77 HH22 ARG 77 -0.766 -11.013 17.384 640 H LEU 78 H LEU 78 -2.206 -4.703 14.438 641 HA LEU 78 HA LEU 78 -4.979 -4.488 15.285 642 HB2 LEU 78 HB2 LEU 78 -3.686 -5.823 12.899 643 HB3 LEU 78 HB3 LEU 78 -5.416 -5.826 13.199 644 HG LEU 78 HG LEU 78 -3.739 -3.346 12.759 645 HD11 LEU 78 HD11 LEU 78 -5.659 -4.728 10.885 646 HD12 LEU 78 HD12 LEU 78 -3.902 -4.686 10.727 647 HD13 LEU 78 HD13 LEU 78 -4.834 -3.195 10.590 648 HD21 LEU 78 HD21 LEU 78 -5.894 -2.186 12.595 649 HD22 LEU 78 HD22 LEU 78 -5.679 -2.926 14.180 650 HD23 LEU 78 HD23 LEU 78 -6.734 -3.687 12.990 651 H SER 79 H SER 79 -5.087 -5.655 17.167 652 HA SER 79 HA SER 79 -3.886 -8.154 17.641 653 HB2 SER 79 HB2 SER 79 -6.321 -6.952 18.982 654 HB3 SER 79 HB3 SER 79 -5.337 -8.265 19.625 655 HG SER 79 HG SER 79 -4.959 -5.881 20.247 656 H ASN 80 H ASN 80 -7.157 -7.356 16.520 657 HA ASN 80 HA ASN 80 -7.707 -10.229 16.155 658 HB2 ASN 80 HB2 ASN 80 -9.654 -7.909 16.110 659 HB3 ASN 80 HB3 ASN 80 -10.074 -9.616 16.011 660 HD21 ASN 80 HD21 ASN 80 -9.150 -7.020 18.067 661 HD22 ASN 80 HD22 ASN 80 -9.336 -7.860 19.563 662 H LEU 81 H LEU 81 -6.981 -10.831 14.191 663 HA LEU 81 HA LEU 81 -7.010 -9.036 11.935 664 HB2 LEU 81 HB2 LEU 81 -6.262 -11.959 12.081 665 HB3 LEU 81 HB3 LEU 81 -5.976 -10.900 10.713 666 HG LEU 81 HG LEU 81 -4.664 -10.784 13.431 667 HD11 LEU 81 HD11 LEU 81 -2.602 -11.093 12.114 668 HD12 LEU 81 HD12 LEU 81 -3.572 -11.231 10.645 669 HD13 LEU 81 HD13 LEU 81 -3.726 -12.439 11.923 670 HD21 LEU 81 HD21 LEU 81 -5.131 -8.506 12.771 671 HD22 LEU 81 HD22 LEU 81 -4.474 -8.799 11.160 672 HD23 LEU 81 HD23 LEU 81 -3.411 -8.835 12.568 673 H GLU 82 H GLU 82 -8.226 -9.143 10.105 674 HA GLU 82 HA GLU 82 -10.798 -10.474 10.294 675 HB2 GLU 82 HB2 GLU 82 -11.357 -9.150 8.293 676 HB3 GLU 82 HB3 GLU 82 -10.670 -8.136 9.557 677 HG2 GLU 82 HG2 GLU 82 -8.475 -8.256 8.400 678 HG3 GLU 82 HG3 GLU 82 -9.248 -9.159 7.099 679 H HIS 83 H HIS 83 -8.030 -11.762 9.545 680 HA HIS 83 HA HIS 83 -8.422 -12.644 6.819 681 HB2 HIS 83 HB2 HIS 83 -6.304 -13.295 8.876 682 HB3 HIS 83 HB3 HIS 83 -6.271 -13.855 7.208 683 HD1 HIS 83 HD1 HIS 83 -4.711 -12.478 5.867 684 HD2 HIS 83 HD2 HIS 83 -6.645 -10.228 8.773 685 HE1 HIS 83 HE1 HIS 83 -3.843 -10.144 5.605 686 HE2 HIS 83 HE2 HIS 83 -5.264 -8.771 7.153 687 H HIS 84 H HIS 84 -9.946 -14.125 6.477 688 HA HIS 84 HA HIS 84 -9.753 -16.709 7.821 689 HB2 HIS 84 HB2 HIS 84 -12.126 -16.795 8.396 690 HB3 HIS 84 HB3 HIS 84 -11.376 -15.412 9.184 691 HD1 HIS 84 HD1 HIS 84 -11.825 -13.034 7.923 692 HD2 HIS 84 HD2 HIS 84 -14.333 -16.186 6.900 693 HE1 HIS 84 HE1 HIS 84 -13.813 -11.976 6.825 694 HE2 HIS 84 HE2 HIS 84 -15.255 -13.904 6.104 695 H HIS 85 H HIS 85 -10.318 -18.410 6.471 696 HA HIS 85 HA HIS 85 -10.841 -17.843 3.703 697 HB2 HIS 85 HB2 HIS 85 -10.708 -20.210 3.336 698 HB3 HIS 85 HB3 HIS 85 -9.471 -19.796 4.516 699 HD1 HIS 85 HD1 HIS 85 -12.347 -21.976 3.973 700 HD2 HIS 85 HD2 HIS 85 -10.188 -20.576 7.238 701 HE1 HIS 85 HE1 HIS 85 -12.973 -23.473 5.887 702 HE2 HIS 85 HE2 HIS 85 -11.712 -22.569 7.862 703 H HIS 86 H HIS 86 -12.682 -18.819 2.496 704 HA HIS 86 HA HIS 86 -15.186 -18.540 4.013 705 HB2 HIS 86 HB2 HIS 86 -14.665 -17.293 1.805 706 HB3 HIS 86 HB3 HIS 86 -14.947 -18.838 1.011 707 HD1 HIS 86 HD1 HIS 86 -17.232 -18.920 0.074 708 HD2 HIS 86 HD2 HIS 86 -17.122 -16.754 3.617 709 HE1 HIS 86 HE1 HIS 86 -19.594 -18.201 0.495 710 HE2 HIS 86 HE2 HIS 86 -19.496 -16.818 2.587 711 H HIS 87 H HIS 87 -16.759 -20.174 2.123 712 HA HIS 87 HA HIS 87 -16.885 -22.601 3.359 713 HB2 HIS 87 HB2 HIS 87 -18.544 -21.674 1.741 714 HB3 HIS 87 HB3 HIS 87 -17.468 -22.131 0.426 715 HD1 HIS 87 HD1 HIS 87 -18.007 -24.449 3.322 716 HD2 HIS 87 HD2 HIS 87 -19.307 -23.978 -0.593 717 HE1 HIS 87 HE1 HIS 87 -19.229 -26.564 2.764 718 HE2 HIS 87 HE2 HIS 87 -20.174 -26.165 0.470 719 H HIS 88 H HIS 88 -14.682 -21.730 0.734 720 HA HIS 88 HA HIS 88 -13.240 -24.242 1.305 721 HB2 HIS 88 HB2 HIS 88 -12.259 -24.054 -1.030 722 HB3 HIS 88 HB3 HIS 88 -13.955 -24.503 -0.936 723 HD1 HIS 88 HD1 HIS 88 -11.794 -21.481 -1.713 724 HD2 HIS 88 HD2 HIS 88 -15.634 -22.913 -2.387 725 HE1 HIS 88 HE1 HIS 88 -12.831 -19.881 -3.340 726 HE2 HIS 88 HE2 HIS 88 -15.061 -20.894 -3.898 727 H1 MET 1 H1 MET 1 -13.530 19.445 -9.442 728 H2 MET 1 H2 MET 1 -12.060 18.952 -10.122 729 H3 MET 1 H3 MET 1 -13.526 18.488 -10.833 730 HA MET 1 HA MET 1 -14.039 20.704 -11.470 731 HB2 MET 1 HB2 MET 1 -11.480 21.417 -10.014 732 HB3 MET 1 HB3 MET 1 -12.363 22.527 -11.054 733 HG2 MET 1 HG2 MET 1 -14.294 22.411 -9.586 734 HG3 MET 1 HG3 MET 1 -13.463 21.239 -8.561 735 HE1 MET 1 HE1 MET 1 -13.607 24.558 -6.407 736 HE2 MET 1 HE2 MET 1 -14.041 22.850 -6.449 737 HE3 MET 1 HE3 MET 1 -14.818 23.984 -7.555 738 H THR 2 H THR 2 -10.486 20.448 -11.443 739 HA THR 2 HA THR 2 -10.535 19.983 -14.370 740 HB THR 2 HB THR 2 -9.369 22.055 -13.712 741 HG1 THR 2 HG1 THR 2 -7.864 19.909 -14.795 742 HG21 THR 2 HG21 THR 2 -7.533 20.246 -12.128 743 HG22 THR 2 HG22 THR 2 -8.670 21.415 -11.456 744 HG23 THR 2 HG23 THR 2 -7.293 21.973 -12.405 745 H ASP 3 H ASP 3 -10.953 17.940 -12.415 746 HA ASP 3 HA ASP 3 -8.747 16.119 -12.823 747 HB2 ASP 3 HB2 ASP 3 -8.325 15.829 -10.397 748 HB3 ASP 3 HB3 ASP 3 -7.927 17.456 -10.941 749 H PHE 4 H PHE 4 -9.213 14.004 -11.537 750 HA PHE 4 HA PHE 4 -11.828 13.673 -10.425 751 HB2 PHE 4 HB2 PHE 4 -12.635 11.913 -11.911 752 HB3 PHE 4 HB3 PHE 4 -12.419 13.419 -12.786 753 HD1 PHE 4 HD2 PHE 4 -10.666 13.643 -14.469 754 HD2 PHE 4 HD1 PHE 4 -11.274 9.967 -12.399 755 HE1 PHE 4 HE2 PHE 4 -9.327 12.464 -16.167 756 HE2 PHE 4 HE1 PHE 4 -9.935 8.789 -14.092 757 HZ PHE 4 HZ PHE 4 -8.954 10.033 -15.975 758 H LEU 5 H LEU 5 -12.154 11.579 -9.440 759 HA LEU 5 HA LEU 5 -9.684 10.545 -8.348 760 HB2 LEU 5 HB2 LEU 5 -11.623 10.946 -6.909 761 HB3 LEU 5 HB3 LEU 5 -12.565 9.788 -7.829 762 HG LEU 5 HG LEU 5 -11.087 7.968 -7.062 763 HD11 LEU 5 HD11 LEU 5 -9.445 8.391 -5.282 764 HD12 LEU 5 HD12 LEU 5 -9.719 10.125 -5.449 765 HD13 LEU 5 HD13 LEU 5 -9.017 9.210 -6.783 766 HD21 LEU 5 HD21 LEU 5 -11.804 7.939 -4.725 767 HD22 LEU 5 HD22 LEU 5 -13.099 8.502 -5.781 768 HD23 LEU 5 HD23 LEU 5 -12.185 9.659 -4.812 769 H ALA 6 H ALA 6 -8.574 9.190 -9.613 770 HA ALA 6 HA ALA 6 -9.973 7.328 -11.385 771 HB1 ALA 6 HB1 ALA 6 -8.225 8.785 -12.309 772 HB2 ALA 6 HB2 ALA 6 -7.845 7.075 -12.502 773 HB3 ALA 6 HB3 ALA 6 -7.041 8.021 -11.248 774 H GLY 7 H GLY 7 -10.072 5.197 -11.030 775 HA2 GLY 7 HA2 GLY 7 -8.402 4.035 -8.882 776 HA3 GLY 7 HA3 GLY 7 -10.021 3.485 -9.279 777 H ILE 8 H ILE 8 -7.134 2.317 -9.287 778 HA ILE 8 HA ILE 8 -7.337 0.991 -11.929 779 HB ILE 8 HB ILE 8 -4.728 1.401 -10.441 780 HG12 ILE 8 HG12 ILE 8 -5.822 3.124 -12.689 781 HG13 ILE 8 HG13 ILE 8 -5.709 3.618 -11.003 782 HG21 ILE 8 HG21 ILE 8 -4.757 -0.402 -12.084 783 HG22 ILE 8 HG22 ILE 8 -3.726 0.919 -12.634 784 HG23 ILE 8 HG23 ILE 8 -5.339 0.713 -13.322 785 HD11 ILE 8 HD11 ILE 8 -3.265 3.396 -11.120 786 HD12 ILE 8 HD12 ILE 8 -3.893 4.558 -12.287 787 HD13 ILE 8 HD13 ILE 8 -3.402 2.952 -12.823 788 H ARG 9 H ARG 9 -6.834 -1.277 -11.964 789 HA ARG 9 HA ARG 9 -6.437 -2.528 -9.316 790 HB2 ARG 9 HB2 ARG 9 -8.737 -2.933 -10.185 791 HB3 ARG 9 HB3 ARG 9 -8.038 -3.718 -11.597 792 HG2 ARG 9 HG2 ARG 9 -6.993 -5.403 -10.133 793 HG3 ARG 9 HG3 ARG 9 -7.735 -4.630 -8.734 794 HD2 ARG 9 HD2 ARG 9 -9.966 -5.090 -9.710 795 HD3 ARG 9 HD3 ARG 9 -9.179 -5.935 -11.046 796 HE ARG 9 HE ARG 9 -8.408 -6.951 -8.483 797 HH11 ARG 9 HH11 ARG 9 -10.825 -7.130 -10.935 798 HH12 ARG 9 HH12 ARG 9 -11.352 -8.699 -10.441 799 HH21 ARG 9 HH21 ARG 9 -9.109 -8.952 -7.867 800 HH22 ARG 9 HH22 ARG 9 -10.387 -9.722 -8.736 801 H ILE 10 H ILE 10 -4.702 -3.765 -9.134 802 HA ILE 10 HA ILE 10 -3.253 -4.606 -11.576 803 HB ILE 10 HB ILE 10 -2.108 -4.218 -8.800 804 HG12 ILE 10 HG12 ILE 10 -1.938 -2.292 -11.135 805 HG13 ILE 10 HG13 ILE 10 -3.016 -2.087 -9.758 806 HG21 ILE 10 HG21 ILE 10 -0.844 -5.728 -10.275 807 HG22 ILE 10 HG22 ILE 10 0.053 -4.250 -9.925 808 HG23 ILE 10 HG23 ILE 10 -0.742 -4.449 -11.487 809 HD11 ILE 10 HD11 ILE 10 -1.090 -1.955 -8.268 810 HD12 ILE 10 HD12 ILE 10 -1.031 -0.725 -9.529 811 HD13 ILE 10 HD13 ILE 10 -0.010 -2.157 -9.648 812 H VAL 11 H VAL 11 -3.449 -6.788 -11.946 813 HA VAL 11 HA VAL 11 -3.223 -8.562 -9.595 814 HB VAL 11 HB VAL 11 -4.864 -9.014 -12.095 815 HG11 VAL 11 HG11 VAL 11 -3.706 -11.087 -11.564 816 HG12 VAL 11 HG12 VAL 11 -5.422 -11.225 -11.181 817 HG13 VAL 11 HG13 VAL 11 -4.247 -10.981 -9.888 818 HG21 VAL 11 HG21 VAL 11 -5.942 -7.662 -10.359 819 HG22 VAL 11 HG22 VAL 11 -5.624 -8.927 -9.167 820 HG23 VAL 11 HG23 VAL 11 -6.724 -9.236 -10.514 821 H GLY 12 H GLY 12 -1.402 -9.615 -9.533 822 HA2 GLY 12 HA2 GLY 12 -0.175 -10.641 -12.002 823 HA3 GLY 12 HA3 GLY 12 0.793 -9.612 -10.953 824 H GLU 13 H GLU 13 1.689 -12.136 -11.496 825 HA GLU 13 HA GLU 13 0.766 -14.119 -9.699 826 HB2 GLU 13 HB2 GLU 13 2.810 -15.349 -10.294 827 HB3 GLU 13 HB3 GLU 13 1.985 -14.719 -11.711 828 HG2 GLU 13 HG2 GLU 13 3.606 -12.863 -11.804 829 HG3 GLU 13 HG3 GLU 13 4.446 -13.553 -10.416 830 H ASP 14 H ASP 14 1.064 -14.341 -7.596 831 HA ASP 14 HA ASP 14 2.488 -12.427 -6.069 832 HB2 ASP 14 HB2 ASP 14 0.489 -13.469 -5.196 833 HB3 ASP 14 HB3 ASP 14 1.225 -15.065 -5.304 834 H LYS 15 H LYS 15 4.645 -12.354 -6.217 835 HA LYS 15 HA LYS 15 6.216 -14.834 -6.050 836 HB2 LYS 15 HB2 LYS 15 7.127 -12.059 -6.808 837 HB3 LYS 15 HB3 LYS 15 8.109 -13.504 -6.844 838 HG2 LYS 15 HG2 LYS 15 5.682 -13.054 -8.560 839 HG3 LYS 15 HG3 LYS 15 7.338 -12.715 -9.046 840 HD2 LYS 15 HD2 LYS 15 6.867 -14.805 -9.999 841 HD3 LYS 15 HD3 LYS 15 7.812 -15.184 -8.562 842 HE2 LYS 15 HE2 LYS 15 5.950 -16.000 -7.409 843 HE3 LYS 15 HE3 LYS 15 4.809 -15.180 -8.473 844 HZ1 LYS 15 HZ1 LYS 15 6.511 -17.500 -9.204 845 HZ2 LYS 15 HZ2 LYS 15 5.444 -16.702 -10.247 846 HZ3 LYS 15 HZ3 LYS 15 4.847 -17.539 -8.902 847 H ASN 16 H ASN 16 8.472 -14.314 -5.078 848 HA ASN 16 HA ASN 16 8.518 -14.163 -2.383 849 HB2 ASN 16 HB2 ASN 16 10.539 -13.209 -4.407 850 HB3 ASN 16 HB3 ASN 16 10.907 -13.313 -2.682 851 HD21 ASN 16 HD21 ASN 16 10.209 -15.100 -5.576 852 HD22 ASN 16 HD22 ASN 16 10.687 -16.646 -4.983 853 H GLY 17 H GLY 17 8.676 -11.353 -4.546 854 HA2 GLY 17 HA2 GLY 17 8.107 -9.609 -2.234 855 HA3 GLY 17 HA3 GLY 17 9.526 -9.273 -3.207 856 H MET 18 H MET 18 6.961 -10.455 -5.094 857 HA MET 18 HA MET 18 6.759 -8.137 -6.641 858 HB2 MET 18 HB2 MET 18 5.282 -10.701 -6.452 859 HB3 MET 18 HB3 MET 18 4.428 -9.394 -7.248 860 HG2 MET 18 HG2 MET 18 7.188 -10.312 -8.012 861 HG3 MET 18 HG3 MET 18 5.703 -10.867 -8.782 862 HE1 MET 18 HE1 MET 18 3.941 -8.224 -8.742 863 HE2 MET 18 HE2 MET 18 4.061 -9.280 -10.149 864 HE3 MET 18 HE3 MET 18 4.314 -7.544 -10.326 865 H THR 19 H THR 19 4.438 -9.302 -4.172 866 HA THR 19 HA THR 19 2.555 -7.260 -4.373 867 HB THR 19 HB THR 19 1.958 -7.777 -2.025 868 HG1 THR 19 HG1 THR 19 3.257 -9.014 -0.773 869 HG21 THR 19 HG21 THR 19 1.458 -10.158 -2.331 870 HG22 THR 19 HG22 THR 19 2.607 -10.233 -3.667 871 HG23 THR 19 HG23 THR 19 1.149 -9.251 -3.812 872 H ASN 20 H ASN 20 5.645 -7.297 -2.662 873 HA ASN 20 HA ASN 20 5.196 -4.854 -1.241 874 HB2 ASN 20 HB2 ASN 20 6.660 -6.741 -0.460 875 HB3 ASN 20 HB3 ASN 20 7.792 -6.342 -1.747 876 HD21 ASN 20 HD21 ASN 20 8.057 -6.320 1.195 877 HD22 ASN 20 HD22 ASN 20 8.593 -4.732 1.572 878 H GLN 21 H GLN 21 7.170 -5.802 -4.060 879 HA GLN 21 HA GLN 21 8.267 -3.244 -4.516 880 HB2 GLN 21 HB2 GLN 21 9.093 -4.096 -6.579 881 HB3 GLN 21 HB3 GLN 21 9.171 -5.407 -5.418 882 HG2 GLN 21 HG2 GLN 21 7.188 -6.415 -6.362 883 HG3 GLN 21 HG3 GLN 21 6.987 -5.056 -7.464 884 HE21 GLN 21 HE21 GLN 21 8.842 -7.897 -6.748 885 HE22 GLN 21 HE22 GLN 21 9.637 -8.001 -8.274 886 H ILE 22 H ILE 22 5.314 -4.780 -5.658 887 HA ILE 22 HA ILE 22 4.702 -2.973 -7.733 888 HB ILE 22 HB ILE 22 3.073 -4.921 -6.133 889 HG12 ILE 22 HG12 ILE 22 4.551 -5.761 -7.899 890 HG13 ILE 22 HG13 ILE 22 2.863 -6.023 -8.323 891 HG21 ILE 22 HG21 ILE 22 1.536 -3.076 -6.516 892 HG22 ILE 22 HG22 ILE 22 1.109 -4.451 -7.531 893 HG23 ILE 22 HG23 ILE 22 1.943 -3.063 -8.231 894 HD11 ILE 22 HD11 ILE 22 2.935 -4.071 -9.790 895 HD12 ILE 22 HD12 ILE 22 4.135 -5.281 -10.241 896 HD13 ILE 22 HD13 ILE 22 4.632 -3.829 -9.373 897 H THR 23 H THR 23 3.413 -3.083 -4.382 898 HA THR 23 HA THR 23 2.021 -0.621 -4.659 899 HB THR 23 HB THR 23 2.962 -1.795 -2.025 900 HG1 THR 23 HG1 THR 23 1.755 -3.441 -2.684 901 HG21 THR 23 HG21 THR 23 0.967 -0.694 -1.130 902 HG22 THR 23 HG22 THR 23 0.576 -0.079 -2.736 903 HG23 THR 23 HG23 THR 23 2.031 0.478 -1.909 904 H GLY 24 H GLY 24 5.302 -1.469 -3.762 905 HA2 GLY 24 HA2 GLY 24 6.261 1.029 -2.923 906 HA3 GLY 24 HA3 GLY 24 7.206 -0.185 -3.774 907 H VAL 25 H VAL 25 6.197 -0.308 -6.250 908 HA VAL 25 HA VAL 25 7.056 1.975 -7.611 909 HB VAL 25 HB VAL 25 5.105 -0.150 -8.546 910 HG11 VAL 25 HG11 VAL 25 6.634 1.884 -10.178 911 HG12 VAL 25 HG12 VAL 25 4.890 1.858 -9.918 912 HG13 VAL 25 HG13 VAL 25 5.664 0.562 -10.831 913 HG21 VAL 25 HG21 VAL 25 7.288 -1.057 -7.923 914 HG22 VAL 25 HG22 VAL 25 8.091 0.123 -8.959 915 HG23 VAL 25 HG23 VAL 25 7.068 -1.125 -9.672 916 H ILE 26 H ILE 26 3.824 1.063 -6.520 917 HA ILE 26 HA ILE 26 2.365 3.169 -7.658 918 HB ILE 26 HB ILE 26 1.903 1.626 -5.103 919 HG12 ILE 26 HG12 ILE 26 0.662 1.399 -7.863 920 HG13 ILE 26 HG13 ILE 26 1.863 0.304 -7.187 921 HG21 ILE 26 HG21 ILE 26 0.024 3.522 -6.517 922 HG22 ILE 26 HG22 ILE 26 0.751 3.754 -4.926 923 HG23 ILE 26 HG23 ILE 26 -0.414 2.456 -5.181 924 HD11 ILE 26 HD11 ILE 26 0.246 -0.306 -5.423 925 HD12 ILE 26 HD12 ILE 26 -0.301 -0.699 -7.051 926 HD13 ILE 26 HD13 ILE 26 -0.954 0.712 -6.221 927 H SER 27 H SER 27 4.059 2.999 -4.511 928 HA SER 27 HA SER 27 3.347 5.657 -3.734 929 HB2 SER 27 HB2 SER 27 4.978 5.436 -1.950 930 HB3 SER 27 HB3 SER 27 4.098 3.919 -2.101 931 HG SER 27 HG SER 27 5.870 3.057 -3.205 932 H LYS 28 H LYS 28 5.862 4.315 -5.725 933 HA LYS 28 HA LYS 28 7.563 6.594 -5.827 934 HB2 LYS 28 HB2 LYS 28 7.181 4.339 -7.811 935 HB3 LYS 28 HB3 LYS 28 8.457 5.544 -7.909 936 HG2 LYS 28 HG2 LYS 28 9.380 4.759 -5.788 937 HG3 LYS 28 HG3 LYS 28 8.078 3.575 -5.654 938 HD2 LYS 28 HD2 LYS 28 10.115 2.523 -6.497 939 HD3 LYS 28 HD3 LYS 28 8.846 2.493 -7.723 940 HE2 LYS 28 HE2 LYS 28 9.873 4.501 -8.766 941 HE3 LYS 28 HE3 LYS 28 11.180 4.411 -7.586 942 HZ1 LYS 28 HZ1 LYS 28 10.515 2.421 -9.686 943 HZ2 LYS 28 HZ2 LYS 28 11.637 2.139 -8.455 944 HZ3 LYS 28 HZ3 LYS 28 11.907 3.377 -9.575 945 H PHE 29 H PHE 29 4.425 6.206 -6.981 946 HA PHE 29 HA PHE 29 4.560 7.626 -9.426 947 HB2 PHE 29 HB2 PHE 29 2.285 7.136 -7.505 948 HB3 PHE 29 HB3 PHE 29 2.077 8.065 -8.984 949 HD1 PHE 29 HD1 PHE 29 4.272 6.065 -10.333 950 HD2 PHE 29 HD2 PHE 29 0.491 5.661 -8.408 951 HE1 PHE 29 HE1 PHE 29 3.846 4.003 -11.605 952 HE2 PHE 29 HE2 PHE 29 0.066 3.595 -9.677 953 HZ PHE 29 HZ PHE 29 1.743 2.768 -11.277 954 H ASP 30 H ASP 30 3.155 9.691 -9.649 955 HA ASP 30 HA ASP 30 4.441 11.732 -7.965 956 HB2 ASP 30 HB2 ASP 30 3.242 12.930 -10.251 957 HB3 ASP 30 HB3 ASP 30 4.958 12.679 -9.938 958 H THR 31 H THR 31 1.777 10.202 -7.544 959 HA THR 31 HA THR 31 0.081 12.576 -7.073 960 HB THR 31 HB THR 31 -0.863 11.459 -8.992 961 HG1 THR 31 HG1 THR 31 -2.741 11.831 -8.117 962 HG21 THR 31 HG21 THR 31 -1.630 9.117 -8.893 963 HG22 THR 31 HG22 THR 31 -0.886 8.952 -7.303 964 HG23 THR 31 HG23 THR 31 0.120 9.248 -8.721 965 H ASN 32 H ASN 32 -1.720 12.115 -5.475 966 HA ASN 32 HA ASN 32 -0.506 10.817 -3.154 967 HB2 ASN 32 HB2 ASN 32 -1.358 13.108 -2.904 968 HB3 ASN 32 HB3 ASN 32 -2.973 12.562 -3.351 969 HD21 ASN 32 HD21 ASN 32 -0.525 12.519 -0.897 970 HD22 ASN 32 HD22 ASN 32 -1.532 11.941 0.378 971 H ILE 33 H ILE 33 -1.163 8.949 -2.306 972 HA ILE 33 HA ILE 33 -3.233 7.406 -3.561 973 HB ILE 33 HB ILE 33 -1.648 6.792 -1.052 974 HG12 ILE 33 HG12 ILE 33 -1.164 5.926 -3.921 975 HG13 ILE 33 HG13 ILE 33 -0.215 7.122 -3.045 976 HG21 ILE 33 HG21 ILE 33 -2.276 4.449 -1.487 977 HG22 ILE 33 HG22 ILE 33 -3.287 4.980 -2.832 978 HG23 ILE 33 HG23 ILE 33 -3.686 5.464 -1.183 979 HD11 ILE 33 HD11 ILE 33 0.931 4.994 -3.120 980 HD12 ILE 33 HD12 ILE 33 -0.449 4.197 -2.365 981 HD13 ILE 33 HD13 ILE 33 0.485 5.390 -1.462 982 H ARG 34 H ARG 34 -5.280 8.192 -3.196 983 HA ARG 34 HA ARG 34 -6.177 9.083 -0.615 984 HB2 ARG 34 HB2 ARG 34 -7.712 8.337 -3.116 985 HB3 ARG 34 HB3 ARG 34 -8.446 9.036 -1.681 986 HG2 ARG 34 HG2 ARG 34 -6.251 10.406 -3.224 987 HG3 ARG 34 HG3 ARG 34 -7.962 10.617 -3.593 988 HD2 ARG 34 HD2 ARG 34 -7.510 12.428 -2.209 989 HD3 ARG 34 HD3 ARG 34 -8.187 11.249 -1.088 990 HE ARG 34 HE ARG 34 -5.327 11.132 -1.230 991 HH11 ARG 34 HH11 ARG 34 -8.002 12.729 0.241 992 HH12 ARG 34 HH12 ARG 34 -7.059 13.349 1.549 993 HH21 ARG 34 HH21 ARG 34 -4.119 11.952 0.440 994 HH22 ARG 34 HH22 ARG 34 -4.873 12.932 1.650 995 H THR 35 H THR 35 -6.263 6.076 -2.404 996 HA THR 35 HA THR 35 -6.851 4.567 -0.000 997 HB THR 35 HB THR 35 -8.699 4.218 -2.375 998 HG1 THR 35 HG1 THR 35 -8.934 5.841 -0.099 999 HG21 THR 35 HG21 THR 35 -8.403 2.201 -1.041 1000 HG22 THR 35 HG22 THR 35 -10.028 2.846 -0.817 1001 HG23 THR 35 HG23 THR 35 -8.803 3.088 0.430 1002 H ILE 36 H ILE 36 -6.212 2.366 -0.197 1003 HA ILE 36 HA ILE 36 -5.757 1.212 -2.785 1004 HB ILE 36 HB ILE 36 -3.655 2.540 -2.391 1005 HG12 ILE 36 HG12 ILE 36 -3.195 -0.448 -2.536 1006 HG13 ILE 36 HG13 ILE 36 -3.836 0.506 -3.871 1007 HG21 ILE 36 HG21 ILE 36 -3.176 0.498 -0.214 1008 HG22 ILE 36 HG22 ILE 36 -3.394 2.234 0.008 1009 HG23 ILE 36 HG23 ILE 36 -1.971 1.625 -0.841 1010 HD11 ILE 36 HD11 ILE 36 -1.155 0.873 -2.567 1011 HD12 ILE 36 HD12 ILE 36 -1.799 1.838 -3.897 1012 HD13 ILE 36 HD13 ILE 36 -1.464 0.121 -4.129 1013 H VAL 37 H VAL 37 -5.945 -0.972 -2.750 1014 HA VAL 37 HA VAL 37 -5.816 -2.367 -0.147 1015 HB VAL 37 HB VAL 37 -8.068 -2.698 -2.150 1016 HG11 VAL 37 HG11 VAL 37 -7.498 -4.801 -1.054 1017 HG12 VAL 37 HG12 VAL 37 -9.061 -4.210 -0.493 1018 HG13 VAL 37 HG13 VAL 37 -7.634 -4.032 0.527 1019 HG21 VAL 37 HG21 VAL 37 -8.103 -1.475 0.617 1020 HG22 VAL 37 HG22 VAL 37 -9.519 -1.771 -0.394 1021 HG23 VAL 37 HG23 VAL 37 -8.294 -0.612 -0.910 1022 H LEU 38 H LEU 38 -4.092 -3.681 -0.514 1023 HA LEU 38 HA LEU 38 -4.118 -5.370 -2.941 1024 HB2 LEU 38 HB2 LEU 38 -2.080 -4.030 -2.653 1025 HB3 LEU 38 HB3 LEU 38 -1.824 -4.724 -1.066 1026 HG LEU 38 HG LEU 38 -1.885 -6.510 -3.497 1027 HD11 LEU 38 HD11 LEU 38 0.540 -6.267 -3.725 1028 HD12 LEU 38 HD12 LEU 38 0.529 -4.988 -2.507 1029 HD13 LEU 38 HD13 LEU 38 -0.293 -4.745 -4.048 1030 HD21 LEU 38 HD21 LEU 38 -1.882 -7.598 -1.308 1031 HD22 LEU 38 HD22 LEU 38 -0.439 -6.698 -0.845 1032 HD23 LEU 38 HD23 LEU 38 -0.358 -7.885 -2.147 1033 H ASN 39 H ASN 39 -4.669 -7.471 -2.709 1034 HA ASN 39 HA ASN 39 -3.825 -8.826 -0.240 1035 HB2 ASN 39 HB2 ASN 39 -5.877 -10.145 -0.122 1036 HB3 ASN 39 HB3 ASN 39 -6.239 -8.429 -0.003 1037 HD21 ASN 39 HD21 ASN 39 -7.359 -7.437 -1.666 1038 HD22 ASN 39 HD22 ASN 39 -8.193 -8.334 -2.878 1039 H ALA 40 H ALA 40 -2.542 -10.479 -0.661 1040 HA ALA 40 HA ALA 40 -2.543 -11.707 -3.335 1041 HB1 ALA 40 HB1 ALA 40 -0.394 -10.960 -2.431 1042 HB2 ALA 40 HB2 ALA 40 -0.412 -12.711 -2.642 1043 HB3 ALA 40 HB3 ALA 40 -0.598 -12.013 -1.032 1044 H LYS 41 H LYS 41 -3.609 -13.522 -3.669 1045 HA LYS 41 HA LYS 41 -3.841 -15.552 -1.595 1046 HB2 LYS 41 HB2 LYS 41 -6.223 -15.672 -1.622 1047 HB3 LYS 41 HB3 LYS 41 -5.805 -13.985 -1.354 1048 HG2 LYS 41 HG2 LYS 41 -6.662 -15.168 -3.991 1049 HG3 LYS 41 HG3 LYS 41 -7.695 -14.254 -2.891 1050 HD2 LYS 41 HD2 LYS 41 -6.072 -12.334 -3.131 1051 HD3 LYS 41 HD3 LYS 41 -5.284 -13.256 -4.414 1052 HE2 LYS 41 HE2 LYS 41 -6.805 -11.715 -5.430 1053 HE3 LYS 41 HE3 LYS 41 -7.479 -13.335 -5.607 1054 HZ1 LYS 41 HZ1 LYS 41 -8.928 -12.891 -3.717 1055 HZ2 LYS 41 HZ2 LYS 41 -9.166 -11.748 -4.942 1056 HZ3 LYS 41 HZ3 LYS 41 -8.279 -11.337 -3.560 1057 H ASP 42 H ASP 42 -4.099 -17.629 -2.387 1058 HA ASP 42 HA ASP 42 -4.177 -19.371 -3.833 1059 HB2 ASP 42 HB2 ASP 42 -6.357 -18.274 -4.421 1060 HB3 ASP 42 HB3 ASP 42 -5.536 -17.455 -5.745 1061 H GLY 43 H GLY 43 -1.948 -17.242 -4.031 1062 HA2 GLY 43 HA2 GLY 43 0.135 -17.577 -5.109 1063 HA3 GLY 43 HA3 GLY 43 -0.683 -18.442 -6.399 1064 H ILE 44 H ILE 44 -2.440 -15.711 -5.832 1065 HA ILE 44 HA ILE 44 -0.875 -14.029 -7.705 1066 HB ILE 44 HB ILE 44 -3.888 -13.969 -7.699 1067 HG12 ILE 44 HG12 ILE 44 -2.189 -15.908 -9.295 1068 HG13 ILE 44 HG13 ILE 44 -3.347 -16.319 -8.033 1069 HG21 ILE 44 HG21 ILE 44 -1.835 -13.403 -9.844 1070 HG22 ILE 44 HG22 ILE 44 -2.693 -12.201 -8.880 1071 HG23 ILE 44 HG23 ILE 44 -3.581 -13.217 -10.012 1072 HD11 ILE 44 HD11 ILE 44 -4.003 -15.052 -10.686 1073 HD12 ILE 44 HD12 ILE 44 -5.164 -15.464 -9.422 1074 HD13 ILE 44 HD13 ILE 44 -4.262 -16.739 -10.240 1075 H PHE 45 H PHE 45 -1.618 -11.652 -7.553 1076 HA PHE 45 HA PHE 45 -2.897 -11.029 -4.970 1077 HB2 PHE 45 HB2 PHE 45 -1.369 -9.257 -4.479 1078 HB3 PHE 45 HB3 PHE 45 -0.397 -10.677 -4.845 1079 HD1 PHE 45 HD2 PHE 45 -1.451 -7.360 -6.018 1080 HD2 PHE 45 HD1 PHE 45 1.010 -10.748 -6.810 1081 HE1 PHE 45 HE2 PHE 45 -0.224 -6.070 -7.713 1082 HE2 PHE 45 HE1 PHE 45 2.240 -9.457 -8.501 1083 HZ PHE 45 HZ PHE 45 1.617 -7.119 -8.957 1084 H THR 46 H THR 46 -4.225 -9.201 -4.942 1085 HA THR 46 HA THR 46 -4.510 -7.732 -7.493 1086 HB THR 46 HB THR 46 -6.472 -9.094 -7.362 1087 HG1 THR 46 HG1 THR 46 -7.263 -6.532 -6.379 1088 HG21 THR 46 HG21 THR 46 -8.007 -9.070 -5.451 1089 HG22 THR 46 HG22 THR 46 -6.884 -8.040 -4.562 1090 HG23 THR 46 HG23 THR 46 -6.417 -9.684 -4.997 1091 H CYS 47 H CYS 47 -3.763 -5.750 -7.188 1092 HA CYS 47 HA CYS 47 -4.252 -4.391 -4.615 1093 HB2 CYS 47 HB2 CYS 47 -1.884 -4.597 -5.226 1094 HB3 CYS 47 HB3 CYS 47 -2.191 -3.768 -6.746 1095 HG CYS 47 HG CYS 47 -1.247 -2.462 -3.970 1096 H ASN 48 H ASN 48 -5.982 -3.114 -4.673 1097 HA ASN 48 HA ASN 48 -6.756 -1.726 -7.130 1098 HB2 ASN 48 HB2 ASN 48 -8.132 -1.981 -4.443 1099 HB3 ASN 48 HB3 ASN 48 -8.773 -1.055 -5.797 1100 HD21 ASN 48 HD21 ASN 48 -10.600 -2.324 -5.927 1101 HD22 ASN 48 HD22 ASN 48 -10.570 -3.938 -6.535 1102 H LEU 49 H LEU 49 -5.794 0.174 -7.498 1103 HA LEU 49 HA LEU 49 -4.934 1.859 -5.251 1104 HB2 LEU 49 HB2 LEU 49 -3.221 1.370 -6.870 1105 HB3 LEU 49 HB3 LEU 49 -4.253 1.877 -8.194 1106 HG LEU 49 HG LEU 49 -4.165 4.205 -7.369 1107 HD11 LEU 49 HD11 LEU 49 -3.830 3.803 -5.004 1108 HD12 LEU 49 HD12 LEU 49 -2.537 4.821 -5.637 1109 HD13 LEU 49 HD13 LEU 49 -2.238 3.112 -5.318 1110 HD21 LEU 49 HD21 LEU 49 -1.447 2.959 -7.796 1111 HD22 LEU 49 HD22 LEU 49 -1.853 4.663 -7.999 1112 HD23 LEU 49 HD23 LEU 49 -2.573 3.454 -9.060 1113 H MET 50 H MET 50 -5.763 3.846 -4.846 1114 HA MET 50 HA MET 50 -7.641 5.027 -6.801 1115 HB2 MET 50 HB2 MET 50 -7.932 5.027 -3.788 1116 HB3 MET 50 HB3 MET 50 -8.981 5.882 -4.910 1117 HG2 MET 50 HG2 MET 50 -8.642 2.898 -4.688 1118 HG3 MET 50 HG3 MET 50 -10.035 3.849 -4.175 1119 HE1 MET 50 HE1 MET 50 -11.345 5.450 -5.996 1120 HE2 MET 50 HE2 MET 50 -11.165 5.256 -7.739 1121 HE3 MET 50 HE3 MET 50 -9.852 5.956 -6.791 1122 H ILE 51 H ILE 51 -6.691 6.787 -7.591 1123 HA ILE 51 HA ILE 51 -5.506 8.747 -5.747 1124 HB ILE 51 HB ILE 51 -3.655 9.152 -7.442 1125 HG12 ILE 51 HG12 ILE 51 -3.085 6.880 -8.674 1126 HG13 ILE 51 HG13 ILE 51 -4.822 6.618 -8.564 1127 HG21 ILE 51 HG21 ILE 51 -2.211 7.405 -6.546 1128 HG22 ILE 51 HG22 ILE 51 -3.625 6.504 -5.996 1129 HG23 ILE 51 HG23 ILE 51 -3.250 8.075 -5.289 1130 HD11 ILE 51 HD11 ILE 51 -3.444 8.932 -9.914 1131 HD12 ILE 51 HD12 ILE 51 -5.191 8.715 -9.787 1132 HD13 ILE 51 HD13 ILE 51 -4.224 7.562 -10.704 1133 H PHE 52 H PHE 52 -5.131 10.911 -6.867 1134 HA PHE 52 HA PHE 52 -7.406 11.446 -8.646 1135 HB2 PHE 52 HB2 PHE 52 -5.847 13.103 -6.716 1136 HB3 PHE 52 HB3 PHE 52 -6.555 13.922 -8.104 1137 HD1 PHE 52 HD2 PHE 52 -9.031 13.747 -8.490 1138 HD2 PHE 52 HD1 PHE 52 -7.185 12.486 -4.860 1139 HE1 PHE 52 HE2 PHE 52 -11.209 13.845 -7.356 1140 HE2 PHE 52 HE1 PHE 52 -9.364 12.584 -3.721 1141 HZ PHE 52 HZ PHE 52 -11.378 13.265 -4.963 1142 H VAL 53 H VAL 53 -7.221 12.204 -10.681 1143 HA VAL 53 HA VAL 53 -4.533 12.889 -11.716 1144 HB VAL 53 HB VAL 53 -5.060 11.818 -13.840 1145 HG11 VAL 53 HG11 VAL 53 -5.073 9.455 -13.139 1146 HG12 VAL 53 HG12 VAL 53 -5.478 9.964 -11.499 1147 HG13 VAL 53 HG13 VAL 53 -3.932 10.433 -12.212 1148 HG21 VAL 53 HG21 VAL 53 -7.468 12.119 -13.854 1149 HG22 VAL 53 HG22 VAL 53 -7.642 10.965 -12.532 1150 HG23 VAL 53 HG23 VAL 53 -7.061 10.422 -14.107 1151 H LYS 54 H LYS 54 -4.505 14.413 -13.473 1152 HA LYS 54 HA LYS 54 -6.740 16.275 -13.391 1153 HB2 LYS 54 HB2 LYS 54 -5.260 17.769 -14.677 1154 HB3 LYS 54 HB3 LYS 54 -4.509 17.181 -13.199 1155 HG2 LYS 54 HG2 LYS 54 -3.327 15.455 -14.587 1156 HG3 LYS 54 HG3 LYS 54 -3.957 16.274 -16.019 1157 HD2 LYS 54 HD2 LYS 54 -2.223 17.553 -13.896 1158 HD3 LYS 54 HD3 LYS 54 -1.652 16.979 -15.463 1159 HE2 LYS 54 HE2 LYS 54 -3.006 18.603 -16.612 1160 HE3 LYS 54 HE3 LYS 54 -3.778 19.093 -15.105 1161 HZ1 LYS 54 HZ1 LYS 54 -2.012 20.618 -15.875 1162 HZ2 LYS 54 HZ2 LYS 54 -0.877 19.386 -15.652 1163 HZ3 LYS 54 HZ3 LYS 54 -1.730 19.998 -14.329 1164 H ASN 55 H ASN 55 -5.593 13.808 -15.524 1165 HA ASN 55 HA ASN 55 -7.860 14.243 -17.255 1166 HB2 ASN 55 HB2 ASN 55 -6.539 14.331 -19.359 1167 HB3 ASN 55 HB3 ASN 55 -6.302 15.744 -18.338 1168 HD21 ASN 55 HD21 ASN 55 -4.328 16.263 -19.217 1169 HD22 ASN 55 HD22 ASN 55 -2.911 15.315 -18.960 1170 H THR 56 H THR 56 -7.822 12.546 -19.122 1171 HA THR 56 HA THR 56 -7.803 10.006 -17.844 1172 HB THR 56 HB THR 56 -8.467 9.080 -20.035 1173 HG1 THR 56 HG1 THR 56 -8.026 10.145 -21.806 1174 HG21 THR 56 HG21 THR 56 -10.565 10.314 -20.280 1175 HG22 THR 56 HG22 THR 56 -9.900 11.659 -19.355 1176 HG23 THR 56 HG23 THR 56 -10.171 10.101 -18.573 1177 H ASP 57 H ASP 57 -5.537 11.553 -20.065 1178 HA ASP 57 HA ASP 57 -4.110 9.206 -20.801 1179 HB2 ASP 57 HB2 ASP 57 -3.858 11.196 -22.151 1180 HB3 ASP 57 HB3 ASP 57 -3.266 12.118 -20.772 1181 H LYS 58 H LYS 58 -3.814 11.528 -18.206 1182 HA LYS 58 HA LYS 58 -1.432 10.706 -17.036 1183 HB2 LYS 58 HB2 LYS 58 -2.550 12.726 -16.338 1184 HB3 LYS 58 HB3 LYS 58 -3.977 11.826 -15.839 1185 HG2 LYS 58 HG2 LYS 58 -2.670 12.514 -13.919 1186 HG3 LYS 58 HG3 LYS 58 -2.706 10.756 -14.087 1187 HD2 LYS 58 HD2 LYS 58 -0.489 10.856 -15.197 1188 HD3 LYS 58 HD3 LYS 58 -0.453 12.597 -14.906 1189 HE2 LYS 58 HE2 LYS 58 -0.502 12.222 -12.513 1190 HE3 LYS 58 HE3 LYS 58 -0.631 10.478 -12.766 1191 HZ1 LYS 58 HZ1 LYS 58 1.655 12.222 -13.482 1192 HZ2 LYS 58 HZ2 LYS 58 1.527 10.601 -13.936 1193 HZ3 LYS 58 HZ3 LYS 58 1.620 11.015 -12.299 1194 H LEU 59 H LEU 59 -4.736 9.502 -16.586 1195 HA LEU 59 HA LEU 59 -4.121 7.536 -14.640 1196 HB2 LEU 59 HB2 LEU 59 -6.375 8.315 -14.900 1197 HB3 LEU 59 HB3 LEU 59 -6.410 7.827 -16.583 1198 HG LEU 59 HG LEU 59 -6.416 5.478 -15.956 1199 HD11 LEU 59 HD11 LEU 59 -5.018 5.533 -13.992 1200 HD12 LEU 59 HD12 LEU 59 -6.572 4.808 -13.581 1201 HD13 LEU 59 HD13 LEU 59 -6.223 6.473 -13.115 1202 HD21 LEU 59 HD21 LEU 59 -8.447 7.066 -14.379 1203 HD22 LEU 59 HD22 LEU 59 -8.594 5.370 -14.845 1204 HD23 LEU 59 HD23 LEU 59 -8.566 6.623 -16.084 1205 H THR 60 H THR 60 -4.505 7.317 -18.187 1206 HA THR 60 HA THR 60 -4.030 4.527 -18.338 1207 HB THR 60 HB THR 60 -3.610 4.891 -20.765 1208 HG1 THR 60 HG1 THR 60 -2.787 6.831 -21.142 1209 HG21 THR 60 HG21 THR 60 -6.025 6.350 -19.679 1210 HG22 THR 60 HG22 THR 60 -5.900 4.609 -19.926 1211 HG23 THR 60 HG23 THR 60 -5.854 5.701 -21.310 1212 H THR 61 H THR 61 -1.854 7.266 -18.214 1213 HA THR 61 HA THR 61 0.481 5.947 -19.143 1214 HB THR 61 HB THR 61 0.260 8.295 -17.233 1215 HG1 THR 61 HG1 THR 61 -0.565 8.520 -19.465 1216 HG21 THR 61 HG21 THR 61 2.656 7.281 -18.781 1217 HG22 THR 61 HG22 THR 61 2.449 7.213 -17.031 1218 HG23 THR 61 HG23 THR 61 2.595 8.773 -17.842 1219 H LEU 62 H LEU 62 -0.928 6.320 -15.908 1220 HA LEU 62 HA LEU 62 1.138 5.121 -14.431 1221 HB2 LEU 62 HB2 LEU 62 -1.836 5.115 -13.888 1222 HB3 LEU 62 HB3 LEU 62 -0.604 4.662 -12.725 1223 HG LEU 62 HG LEU 62 -0.977 7.411 -13.936 1224 HD11 LEU 62 HD11 LEU 62 -2.675 6.834 -12.278 1225 HD12 LEU 62 HD12 LEU 62 -1.579 8.074 -11.667 1226 HD13 LEU 62 HD13 LEU 62 -1.410 6.404 -11.126 1227 HD21 LEU 62 HD21 LEU 62 0.782 8.121 -12.377 1228 HD22 LEU 62 HD22 LEU 62 1.388 6.953 -13.552 1229 HD23 LEU 62 HD23 LEU 62 1.035 6.441 -11.900 1230 H MET 63 H MET 63 -1.543 3.698 -16.217 1231 HA MET 63 HA MET 63 -1.317 1.036 -15.379 1232 HB2 MET 63 HB2 MET 63 -2.045 2.043 -18.142 1233 HB3 MET 63 HB3 MET 63 -2.400 0.445 -17.501 1234 HG2 MET 63 HG2 MET 63 -3.880 1.399 -15.843 1235 HG3 MET 63 HG3 MET 63 -3.469 3.028 -16.379 1236 HE1 MET 63 HE1 MET 63 -7.133 2.770 -17.621 1237 HE2 MET 63 HE2 MET 63 -5.953 3.697 -16.692 1238 HE3 MET 63 HE3 MET 63 -6.481 2.113 -16.121 1239 H ASP 64 H ASP 64 0.210 2.633 -18.183 1240 HA ASP 64 HA ASP 64 1.794 0.517 -19.069 1241 HB2 ASP 64 HB2 ASP 64 1.404 2.646 -20.295 1242 HB3 ASP 64 HB3 ASP 64 2.456 3.473 -19.156 1243 H LYS 65 H LYS 65 2.538 3.042 -16.678 1244 HA LYS 65 HA LYS 65 5.183 2.362 -16.097 1245 HB2 LYS 65 HB2 LYS 65 3.039 3.503 -14.294 1246 HB3 LYS 65 HB3 LYS 65 4.744 3.436 -13.868 1247 HG2 LYS 65 HG2 LYS 65 5.254 4.862 -15.826 1248 HG3 LYS 65 HG3 LYS 65 3.526 4.965 -16.168 1249 HD2 LYS 65 HD2 LYS 65 4.209 6.950 -14.977 1250 HD3 LYS 65 HD3 LYS 65 3.184 5.976 -13.924 1251 HE2 LYS 65 HE2 LYS 65 5.165 5.112 -12.778 1252 HE3 LYS 65 HE3 LYS 65 6.208 6.041 -13.854 1253 HZ1 LYS 65 HZ1 LYS 65 4.238 7.175 -11.945 1254 HZ2 LYS 65 HZ2 LYS 65 5.214 8.071 -12.986 1255 HZ3 LYS 65 HZ3 LYS 65 5.915 7.165 -11.744 1256 H LEU 66 H LEU 66 2.185 1.088 -14.691 1257 HA LEU 66 HA LEU 66 3.459 -0.699 -12.856 1258 HB2 LEU 66 HB2 LEU 66 0.655 -0.656 -13.987 1259 HB3 LEU 66 HB3 LEU 66 1.175 -1.678 -12.657 1260 HG LEU 66 HG LEU 66 1.327 1.339 -12.560 1261 HD11 LEU 66 HD11 LEU 66 -0.881 -0.457 -11.558 1262 HD12 LEU 66 HD12 LEU 66 -0.995 0.718 -12.868 1263 HD13 LEU 66 HD13 LEU 66 -0.723 1.268 -11.215 1264 HD21 LEU 66 HD21 LEU 66 1.414 -0.762 -10.389 1265 HD22 LEU 66 HD22 LEU 66 1.488 0.984 -10.147 1266 HD23 LEU 66 HD23 LEU 66 2.792 0.157 -10.998 1267 H ARG 67 H ARG 67 2.208 -1.007 -16.139 1268 HA ARG 67 HA ARG 67 2.342 -3.826 -16.326 1269 HB2 ARG 67 HB2 ARG 67 2.289 -1.671 -18.448 1270 HB3 ARG 67 HB3 ARG 67 2.262 -3.390 -18.829 1271 HG2 ARG 67 HG2 ARG 67 0.181 -3.658 -17.595 1272 HG3 ARG 67 HG3 ARG 67 0.220 -1.959 -17.127 1273 HD2 ARG 67 HD2 ARG 67 0.026 -1.310 -19.490 1274 HD3 ARG 67 HD3 ARG 67 -0.015 -3.014 -19.951 1275 HE ARG 67 HE ARG 67 -2.053 -2.604 -18.105 1276 HH11 ARG 67 HH11 ARG 67 -1.262 -1.563 -21.285 1277 HH12 ARG 67 HH12 ARG 67 -2.915 -1.390 -21.759 1278 HH21 ARG 67 HH21 ARG 67 -4.178 -2.349 -18.703 1279 HH22 ARG 67 HH22 ARG 67 -4.549 -1.795 -20.301 1280 H LYS 68 H LYS 68 4.885 -1.641 -16.088 1281 HA LYS 68 HA LYS 68 6.783 -2.882 -17.825 1282 HB2 LYS 68 HB2 LYS 68 7.333 -1.273 -15.319 1283 HB3 LYS 68 HB3 LYS 68 8.476 -1.616 -16.609 1284 HG2 LYS 68 HG2 LYS 68 6.021 0.121 -16.762 1285 HG3 LYS 68 HG3 LYS 68 7.707 0.638 -16.829 1286 HD2 LYS 68 HD2 LYS 68 7.993 -0.574 -18.945 1287 HD3 LYS 68 HD3 LYS 68 6.308 -1.097 -18.873 1288 HE2 LYS 68 HE2 LYS 68 5.676 1.349 -18.823 1289 HE3 LYS 68 HE3 LYS 68 7.361 1.710 -19.194 1290 HZ1 LYS 68 HZ1 LYS 68 5.587 0.023 -20.872 1291 HZ2 LYS 68 HZ2 LYS 68 7.162 0.505 -21.244 1292 HZ3 LYS 68 HZ3 LYS 68 5.921 1.654 -21.162 1293 H VAL 69 H VAL 69 5.523 -3.721 -14.720 1294 HA VAL 69 HA VAL 69 7.727 -5.492 -14.007 1295 HB VAL 69 HB VAL 69 4.988 -5.264 -12.729 1296 HG11 VAL 69 HG11 VAL 69 7.577 -6.438 -11.695 1297 HG12 VAL 69 HG12 VAL 69 6.154 -7.349 -12.204 1298 HG13 VAL 69 HG13 VAL 69 6.068 -6.301 -10.788 1299 HG21 VAL 69 HG21 VAL 69 6.088 -3.829 -11.052 1300 HG22 VAL 69 HG22 VAL 69 6.121 -3.107 -12.661 1301 HG23 VAL 69 HG23 VAL 69 7.572 -3.867 -12.007 1302 H GLN 70 H GLN 70 7.968 -7.174 -15.229 1303 HA GLN 70 HA GLN 70 6.277 -8.636 -16.772 1304 HB2 GLN 70 HB2 GLN 70 7.845 -10.531 -16.449 1305 HB3 GLN 70 HB3 GLN 70 8.663 -9.008 -16.761 1306 HG2 GLN 70 HG2 GLN 70 8.259 -10.099 -13.989 1307 HG3 GLN 70 HG3 GLN 70 9.671 -10.484 -14.967 1308 HE21 GLN 70 HE21 GLN 70 9.540 -9.148 -12.417 1309 HE22 GLN 70 HE22 GLN 70 10.246 -7.589 -12.643 1310 H GLY 71 H GLY 71 6.515 -8.801 -13.273 1311 HA2 GLY 71 HA2 GLY 71 5.246 -11.295 -12.877 1312 HA3 GLY 71 HA3 GLY 71 5.375 -10.011 -11.689 1313 H VAL 72 H VAL 72 3.895 -8.122 -13.515 1314 HA VAL 72 HA VAL 72 1.215 -8.951 -12.700 1315 HB VAL 72 HB VAL 72 2.120 -6.351 -13.968 1316 HG11 VAL 72 HG11 VAL 72 -0.247 -6.797 -14.376 1317 HG12 VAL 72 HG12 VAL 72 -0.055 -5.474 -13.230 1318 HG13 VAL 72 HG13 VAL 72 -0.511 -7.078 -12.655 1319 HG21 VAL 72 HG21 VAL 72 1.901 -5.407 -11.705 1320 HG22 VAL 72 HG22 VAL 72 3.132 -6.668 -11.776 1321 HG23 VAL 72 HG23 VAL 72 1.552 -7.018 -11.073 1322 H PHE 73 H PHE 73 -0.493 -9.352 -14.088 1323 HA PHE 73 HA PHE 73 0.107 -9.239 -16.969 1324 HB2 PHE 73 HB2 PHE 73 -1.735 -11.195 -16.964 1325 HB3 PHE 73 HB3 PHE 73 -0.009 -11.481 -16.865 1326 HD1 PHE 73 HD1 PHE 73 -3.144 -11.383 -14.923 1327 HD2 PHE 73 HD2 PHE 73 0.993 -12.405 -14.923 1328 HE1 PHE 73 HE1 PHE 73 -3.458 -12.656 -12.843 1329 HE2 PHE 73 HE2 PHE 73 0.681 -13.674 -12.845 1330 HZ PHE 73 HZ PHE 73 -1.544 -13.805 -11.803 1331 H THR 74 H THR 74 -2.149 -8.362 -14.486 1332 HA THR 74 HA THR 74 -3.806 -7.134 -16.613 1333 HB THR 74 HB THR 74 -5.816 -7.502 -15.511 1334 HG1 THR 74 HG1 THR 74 -5.249 -6.828 -13.423 1335 HG21 THR 74 HG21 THR 74 -4.210 -9.944 -14.765 1336 HG22 THR 74 HG22 THR 74 -4.880 -9.626 -16.366 1337 HG23 THR 74 HG23 THR 74 -5.957 -9.869 -14.990 1338 H VAL 75 H VAL 75 -3.586 -4.998 -16.592 1339 HA VAL 75 HA VAL 75 -3.811 -3.616 -13.989 1340 HB VAL 75 HB VAL 75 -2.249 -2.571 -16.369 1341 HG11 VAL 75 HG11 VAL 75 -1.474 -0.844 -14.795 1342 HG12 VAL 75 HG12 VAL 75 -2.530 -1.517 -13.553 1343 HG13 VAL 75 HG13 VAL 75 -3.224 -0.804 -15.009 1344 HG21 VAL 75 HG21 VAL 75 -1.082 -4.480 -15.380 1345 HG22 VAL 75 HG22 VAL 75 -1.199 -3.734 -13.785 1346 HG23 VAL 75 HG23 VAL 75 -0.223 -2.974 -15.043 1347 H GLU 76 H GLU 76 -5.871 -2.898 -13.978 1348 HA GLU 76 HA GLU 76 -7.064 -1.971 -16.525 1349 HB2 GLU 76 HB2 GLU 76 -8.357 -3.640 -14.356 1350 HB3 GLU 76 HB3 GLU 76 -9.192 -2.998 -15.766 1351 HG2 GLU 76 HG2 GLU 76 -7.855 -4.365 -17.238 1352 HG3 GLU 76 HG3 GLU 76 -6.874 -4.926 -15.881 1353 H ARG 77 H ARG 77 -8.952 -0.589 -16.309 1354 HA ARG 77 HA ARG 77 -8.713 1.300 -14.098 1355 HB2 ARG 77 HB2 ARG 77 -8.867 1.994 -16.529 1356 HB3 ARG 77 HB3 ARG 77 -10.536 1.439 -16.510 1357 HG2 ARG 77 HG2 ARG 77 -11.004 3.065 -14.695 1358 HG3 ARG 77 HG3 ARG 77 -9.353 3.667 -14.862 1359 HD2 ARG 77 HD2 ARG 77 -11.619 3.824 -16.832 1360 HD3 ARG 77 HD3 ARG 77 -10.659 5.135 -16.144 1361 HE ARG 77 HE ARG 77 -9.271 3.210 -17.836 1362 HH11 ARG 77 HH11 ARG 77 -10.677 6.346 -17.540 1363 HH12 ARG 77 HH12 ARG 77 -9.910 6.927 -18.978 1364 HH21 ARG 77 HH21 ARG 77 -8.297 3.971 -19.647 1365 HH22 ARG 77 HH22 ARG 77 -8.568 5.608 -20.146 1366 H LEU 78 H LEU 78 -10.018 1.186 -12.360 1367 HA LEU 78 HA LEU 78 -12.212 -0.617 -12.176 1368 HB2 LEU 78 HB2 LEU 78 -11.328 1.649 -10.381 1369 HB3 LEU 78 HB3 LEU 78 -12.610 0.521 -9.971 1370 HG LEU 78 HG LEU 78 -9.728 -0.253 -10.479 1371 HD11 LEU 78 HD11 LEU 78 -9.946 1.045 -8.422 1372 HD12 LEU 78 HD12 LEU 78 -9.593 -0.647 -8.075 1373 HD13 LEU 78 HD13 LEU 78 -11.232 -0.028 -7.870 1374 HD21 LEU 78 HD21 LEU 78 -12.075 -1.870 -9.478 1375 HD22 LEU 78 HD22 LEU 78 -10.406 -2.434 -9.586 1376 HD23 LEU 78 HD23 LEU 78 -11.294 -2.024 -11.053 1377 H SER 79 H SER 79 -12.102 2.947 -12.162 1378 HA SER 79 HA SER 79 -13.527 4.553 -12.897 1379 HB2 SER 79 HB2 SER 79 -13.596 3.330 -15.019 1380 HB3 SER 79 HB3 SER 79 -14.897 2.309 -14.405 1381 HG SER 79 HG SER 79 -15.854 3.924 -15.579 1382 H ASN 80 H ASN 80 -15.762 1.769 -12.516 1383 HA ASN 80 HA ASN 80 -17.711 3.334 -11.137 1384 HB2 ASN 80 HB2 ASN 80 -18.220 1.308 -12.514 1385 HB3 ASN 80 HB3 ASN 80 -17.472 0.317 -11.266 1386 HD21 ASN 80 HD21 ASN 80 -19.454 3.156 -10.640 1387 HD22 ASN 80 HD22 ASN 80 -20.767 2.293 -9.926 1388 H LEU 81 H LEU 81 -17.507 4.039 -9.078 1389 HA LEU 81 HA LEU 81 -15.805 2.508 -7.227 1390 HB2 LEU 81 HB2 LEU 81 -16.222 5.501 -7.298 1391 HB3 LEU 81 HB3 LEU 81 -15.140 4.622 -6.231 1392 HG LEU 81 HG LEU 81 -14.848 4.846 -9.235 1393 HD11 LEU 81 HD11 LEU 81 -13.294 6.142 -6.993 1394 HD12 LEU 81 HD12 LEU 81 -14.390 6.954 -8.114 1395 HD13 LEU 81 HD13 LEU 81 -12.896 6.233 -8.710 1396 HD21 LEU 81 HD21 LEU 81 -13.989 2.717 -8.408 1397 HD22 LEU 81 HD22 LEU 81 -13.044 3.558 -7.178 1398 HD23 LEU 81 HD23 LEU 81 -12.663 3.778 -8.886 1399 H GLU 82 H GLU 82 -16.315 2.659 -5.003 1400 HA GLU 82 HA GLU 82 -19.144 2.953 -4.399 1401 HB2 GLU 82 HB2 GLU 82 -18.521 2.003 -2.205 1402 HB3 GLU 82 HB3 GLU 82 -17.999 0.989 -3.547 1403 HG2 GLU 82 HG2 GLU 82 -16.073 3.001 -2.542 1404 HG3 GLU 82 HG3 GLU 82 -16.412 1.619 -1.507 1405 H HIS 83 H HIS 83 -16.334 4.805 -4.218 1406 HA HIS 83 HA HIS 83 -16.432 6.176 -1.825 1407 HB2 HIS 83 HB2 HIS 83 -15.626 7.213 -4.549 1408 HB3 HIS 83 HB3 HIS 83 -15.237 8.004 -3.024 1409 HD1 HIS 83 HD1 HIS 83 -12.992 7.438 -2.148 1410 HD2 HIS 83 HD2 HIS 83 -14.509 4.411 -4.556 1411 HE1 HIS 83 HE1 HIS 83 -11.152 5.745 -2.339 1412 HE2 HIS 83 HE2 HIS 83 -12.178 3.829 -3.601 1413 H HIS 84 H HIS 84 -17.663 7.566 -4.883 1414 HA HIS 84 HA HIS 84 -19.991 8.596 -3.423 1415 HB2 HIS 84 HB2 HIS 84 -18.190 10.283 -5.183 1416 HB3 HIS 84 HB3 HIS 84 -19.767 10.795 -4.590 1417 HD1 HIS 84 HD1 HIS 84 -19.798 10.339 -1.720 1418 HD2 HIS 84 HD2 HIS 84 -16.269 11.399 -3.646 1419 HE1 HIS 84 HE1 HIS 84 -18.314 11.291 0.067 1420 HE2 HIS 84 HE2 HIS 84 -16.123 11.736 -1.088 1421 H HIS 85 H HIS 85 -21.479 7.354 -4.407 1422 HA HIS 85 HA HIS 85 -21.519 7.076 -7.321 1423 HB2 HIS 85 HB2 HIS 85 -21.964 5.160 -5.698 1424 HB3 HIS 85 HB3 HIS 85 -23.492 5.947 -5.317 1425 HD1 HIS 85 HD1 HIS 85 -25.397 5.661 -6.969 1426 HD2 HIS 85 HD2 HIS 85 -21.805 4.084 -8.344 1427 HE1 HIS 85 HE1 HIS 85 -25.982 4.345 -9.024 1428 HE2 HIS 85 HE2 HIS 85 -23.820 3.282 -9.750 1429 H HIS 86 H HIS 86 -21.876 9.689 -6.472 1430 HA HIS 86 HA HIS 86 -24.776 10.221 -6.605 1431 HB2 HIS 86 HB2 HIS 86 -23.856 10.975 -4.520 1432 HB3 HIS 86 HB3 HIS 86 -22.512 11.769 -5.330 1433 HD1 HIS 86 HD1 HIS 86 -22.984 14.056 -6.448 1434 HD2 HIS 86 HD2 HIS 86 -26.241 12.450 -4.427 1435 HE1 HIS 86 HE1 HIS 86 -24.623 15.938 -6.218 1436 HE2 HIS 86 HE2 HIS 86 -26.640 14.913 -5.118 1437 H HIS 87 H HIS 87 -25.586 11.562 -8.139 1438 HA HIS 87 HA HIS 87 -23.735 13.203 -9.735 1439 HB2 HIS 87 HB2 HIS 87 -24.227 11.273 -11.122 1440 HB3 HIS 87 HB3 HIS 87 -25.954 11.451 -10.828 1441 HD1 HIS 87 HD1 HIS 87 -27.227 13.098 -12.275 1442 HD2 HIS 87 HD2 HIS 87 -23.121 13.236 -12.904 1443 HE1 HIS 87 HE1 HIS 87 -26.906 14.545 -14.301 1444 HE2 HIS 87 HE2 HIS 87 -24.432 14.498 -14.742 1445 H HIS 88 H HIS 88 -24.364 15.287 -9.863 1446 HA HIS 88 HA HIS 88 -27.177 15.938 -9.198 1447 HB2 HIS 88 HB2 HIS 88 -25.539 16.702 -7.504 1448 HB3 HIS 88 HB3 HIS 88 -24.713 17.647 -8.738 1449 HD1 HIS 88 HD1 HIS 88 -25.909 19.801 -9.575 1450 HD2 HIS 88 HD2 HIS 88 -27.887 17.830 -6.499 1451 HE1 HIS 88 HE1 HIS 88 -27.641 21.417 -8.746 1452 HE2 HIS 88 HE2 HIS 88 -28.904 20.161 -6.976 Start of MODEL 8 1 H1 MET 1 H1 MET 1 11.098 -18.664 16.816 2 H2 MET 1 H2 MET 1 9.690 -18.167 16.023 3 H3 MET 1 H3 MET 1 10.976 -18.814 15.135 4 HA MET 1 HA MET 1 10.705 -20.948 16.163 5 HB2 MET 1 HB2 MET 1 9.874 -20.095 18.330 6 HB3 MET 1 HB3 MET 1 8.340 -19.687 17.576 7 HG2 MET 1 HG2 MET 1 7.908 -22.034 17.122 8 HG3 MET 1 HG3 MET 1 9.478 -22.471 17.799 9 HE1 MET 1 HE1 MET 1 8.295 -24.239 19.432 10 HE2 MET 1 HE2 MET 1 6.746 -23.806 18.708 11 HE3 MET 1 HE3 MET 1 6.923 -23.828 20.462 12 H THR 2 H THR 2 7.429 -19.537 15.892 13 HA THR 2 HA THR 2 7.246 -20.665 13.157 14 HB THR 2 HB THR 2 5.065 -20.614 15.266 15 HG1 THR 2 HG1 THR 2 5.206 -23.001 14.482 16 HG21 THR 2 HG21 THR 2 4.906 -21.487 12.371 17 HG22 THR 2 HG22 THR 2 4.117 -20.074 13.075 18 HG23 THR 2 HG23 THR 2 3.636 -21.694 13.577 19 H ASP 3 H ASP 3 6.927 -19.127 11.665 20 HA ASP 3 HA ASP 3 6.502 -16.416 12.343 21 HB2 ASP 3 HB2 ASP 3 6.264 -16.088 9.862 22 HB3 ASP 3 HB3 ASP 3 7.729 -16.933 10.350 23 H PHE 4 H PHE 4 4.716 -15.088 12.164 24 HA PHE 4 HA PHE 4 2.142 -16.338 11.497 25 HB2 PHE 4 HB2 PHE 4 1.068 -15.252 13.405 26 HB3 PHE 4 HB3 PHE 4 2.346 -16.330 13.949 27 HD1 PHE 4 HD1 PHE 4 1.299 -12.826 13.609 28 HD2 PHE 4 HD2 PHE 4 4.336 -15.462 15.027 29 HE1 PHE 4 HE1 PHE 4 2.285 -10.987 14.910 30 HE2 PHE 4 HE2 PHE 4 5.320 -13.623 16.333 31 HZ PHE 4 HZ PHE 4 4.302 -11.380 16.267 32 H LEU 5 H LEU 5 0.486 -14.842 10.878 33 HA LEU 5 HA LEU 5 1.548 -12.622 9.364 34 HB2 LEU 5 HB2 LEU 5 -0.126 -14.108 8.408 35 HB3 LEU 5 HB3 LEU 5 -1.251 -13.693 9.684 36 HG LEU 5 HG LEU 5 -1.400 -11.396 8.843 37 HD11 LEU 5 HD11 LEU 5 0.858 -11.167 7.952 38 HD12 LEU 5 HD12 LEU 5 -0.347 -10.758 6.735 39 HD13 LEU 5 HD13 LEU 5 0.481 -12.315 6.665 40 HD21 LEU 5 HD21 LEU 5 -1.818 -13.466 6.684 41 HD22 LEU 5 HD22 LEU 5 -2.555 -11.864 6.737 42 HD23 LEU 5 HD23 LEU 5 -2.954 -13.059 7.970 43 H ALA 6 H ALA 6 2.046 -10.871 10.515 44 HA ALA 6 HA ALA 6 0.403 -10.018 12.773 45 HB1 ALA 6 HB1 ALA 6 2.258 -8.527 13.292 46 HB2 ALA 6 HB2 ALA 6 3.065 -8.987 11.793 47 HB3 ALA 6 HB3 ALA 6 2.824 -10.181 13.069 48 H GLY 7 H GLY 7 -0.577 -8.001 12.932 49 HA2 GLY 7 HA2 GLY 7 -0.784 -6.472 10.408 50 HA3 GLY 7 HA3 GLY 7 -2.116 -6.681 11.529 51 H ILE 8 H ILE 8 -0.685 -4.263 10.427 52 HA ILE 8 HA ILE 8 -0.320 -2.890 13.020 53 HB ILE 8 HB ILE 8 1.273 -2.292 10.505 54 HG12 ILE 8 HG12 ILE 8 2.200 -3.533 13.116 55 HG13 ILE 8 HG13 ILE 8 2.005 -4.392 11.593 56 HG21 ILE 8 HG21 ILE 8 0.824 -0.291 11.826 57 HG22 ILE 8 HG22 ILE 8 2.529 -0.728 11.934 58 HG23 ILE 8 HG23 ILE 8 1.441 -1.087 13.275 59 HD11 ILE 8 HD11 ILE 8 3.954 -2.157 12.121 60 HD12 ILE 8 HD12 ILE 8 3.761 -3.015 10.592 61 HD13 ILE 8 HD13 ILE 8 4.337 -3.874 12.020 62 H ARG 9 H ARG 9 -1.594 -1.109 13.250 63 HA ARG 9 HA ARG 9 -2.969 -0.058 10.866 64 HB2 ARG 9 HB2 ARG 9 -4.466 -0.861 12.621 65 HB3 ARG 9 HB3 ARG 9 -3.687 0.190 13.797 66 HG2 ARG 9 HG2 ARG 9 -4.481 2.158 12.597 67 HG3 ARG 9 HG3 ARG 9 -5.215 1.128 11.367 68 HD2 ARG 9 HD2 ARG 9 -6.705 0.165 13.053 69 HD3 ARG 9 HD3 ARG 9 -5.961 1.176 14.295 70 HE ARG 9 HE ARG 9 -6.817 3.113 12.970 71 HH11 ARG 9 HH11 ARG 9 -8.344 0.033 12.779 72 HH12 ARG 9 HH12 ARG 9 -9.862 0.695 12.281 73 HH21 ARG 9 HH21 ARG 9 -8.796 3.952 12.371 74 HH22 ARG 9 HH22 ARG 9 -10.119 2.877 12.081 75 H ILE 10 H ILE 10 -2.384 1.855 10.090 76 HA ILE 10 HA ILE 10 -0.994 3.792 11.851 77 HB ILE 10 HB ILE 10 -0.779 3.575 8.836 78 HG12 ILE 10 HG12 ILE 10 1.249 2.677 10.905 79 HG13 ILE 10 HG13 ILE 10 0.191 1.589 10.011 80 HG21 ILE 10 HG21 ILE 10 1.145 5.082 9.103 81 HG22 ILE 10 HG22 ILE 10 0.834 5.166 10.837 82 HG23 ILE 10 HG23 ILE 10 -0.346 5.813 9.697 83 HD11 ILE 10 HD11 ILE 10 2.294 3.390 8.826 84 HD12 ILE 10 HD12 ILE 10 1.221 2.324 7.917 85 HD13 ILE 10 HD13 ILE 10 2.401 1.641 9.034 86 H VAL 11 H VAL 11 -2.322 5.503 12.347 87 HA VAL 11 HA VAL 11 -4.069 6.516 10.183 88 HB VAL 11 HB VAL 11 -4.571 6.551 13.164 89 HG11 VAL 11 HG11 VAL 11 -5.213 8.721 12.257 90 HG12 VAL 11 HG12 VAL 11 -6.644 7.773 12.663 91 HG13 VAL 11 HG13 VAL 11 -6.138 7.930 10.980 92 HG21 VAL 11 HG21 VAL 11 -6.592 5.305 12.550 93 HG22 VAL 11 HG22 VAL 11 -5.139 4.466 12.003 94 HG23 VAL 11 HG23 VAL 11 -6.122 5.374 10.849 95 H GLY 12 H GLY 12 -3.460 8.341 9.359 96 HA2 GLY 12 HA2 GLY 12 -2.343 10.463 11.060 97 HA3 GLY 12 HA3 GLY 12 -1.416 9.940 9.660 98 H GLU 13 H GLU 13 -2.078 12.541 9.701 99 HA GLU 13 HA GLU 13 -4.664 13.103 8.620 100 HB2 GLU 13 HB2 GLU 13 -3.804 15.387 8.293 101 HB3 GLU 13 HB3 GLU 13 -3.497 14.776 9.914 102 HG2 GLU 13 HG2 GLU 13 -1.186 14.429 9.423 103 HG3 GLU 13 HG3 GLU 13 -1.444 14.749 7.706 104 H ASP 14 H ASP 14 -5.313 13.570 6.546 105 HA ASP 14 HA ASP 14 -3.884 12.363 4.393 106 HB2 ASP 14 HB2 ASP 14 -6.333 12.374 4.484 107 HB3 ASP 14 HB3 ASP 14 -6.349 14.130 4.397 108 H LYS 15 H LYS 15 -1.855 13.618 4.549 109 HA LYS 15 HA LYS 15 -1.995 16.182 3.153 110 HB2 LYS 15 HB2 LYS 15 0.065 14.796 4.788 111 HB3 LYS 15 HB3 LYS 15 0.627 15.890 3.532 112 HG2 LYS 15 HG2 LYS 15 -0.669 17.702 4.505 113 HG3 LYS 15 HG3 LYS 15 -1.262 16.613 5.766 114 HD2 LYS 15 HD2 LYS 15 0.843 16.425 6.764 115 HD3 LYS 15 HD3 LYS 15 1.681 16.994 5.317 116 HE2 LYS 15 HE2 LYS 15 1.810 18.797 6.779 117 HE3 LYS 15 HE3 LYS 15 0.471 19.204 5.713 118 HZ1 LYS 15 HZ1 LYS 15 0.195 18.041 8.432 119 HZ2 LYS 15 HZ2 LYS 15 -1.069 18.505 7.418 120 HZ3 LYS 15 HZ3 LYS 15 -0.019 19.672 8.044 121 H ASN 16 H ASN 16 -0.710 16.619 1.350 122 HA ASN 16 HA ASN 16 -1.130 15.183 -0.879 123 HB2 ASN 16 HB2 ASN 16 1.375 16.810 -0.436 124 HB3 ASN 16 HB3 ASN 16 0.554 16.520 -1.971 125 HD21 ASN 16 HD21 ASN 16 0.547 18.288 0.991 126 HD22 ASN 16 HD22 ASN 16 -0.713 19.389 0.580 127 H GLY 17 H GLY 17 1.708 14.694 1.206 128 HA2 GLY 17 HA2 GLY 17 2.541 12.474 -0.584 129 HA3 GLY 17 HA3 GLY 17 3.672 13.476 0.305 130 H MET 18 H MET 18 1.071 12.888 2.311 131 HA MET 18 HA MET 18 2.675 11.294 4.054 132 HB2 MET 18 HB2 MET 18 -0.080 12.446 4.130 133 HB3 MET 18 HB3 MET 18 0.264 11.119 5.229 134 HG2 MET 18 HG2 MET 18 1.902 13.638 5.068 135 HG3 MET 18 HG3 MET 18 0.585 13.373 6.213 136 HE1 MET 18 HE1 MET 18 0.573 11.283 7.918 137 HE2 MET 18 HE2 MET 18 1.961 10.225 8.165 138 HE3 MET 18 HE3 MET 18 1.061 10.157 6.650 139 H THR 19 H THR 19 -0.328 10.504 2.270 140 HA THR 19 HA THR 19 -0.506 7.837 3.170 141 HB THR 19 HB THR 19 -2.018 7.473 1.242 142 HG1 THR 19 HG1 THR 19 -2.371 9.283 -0.168 143 HG21 THR 19 HG21 THR 19 -2.444 10.125 2.643 144 HG22 THR 19 HG22 THR 19 -2.906 8.540 3.266 145 HG23 THR 19 HG23 THR 19 -3.688 9.183 1.823 146 H ASN 20 H ASN 20 1.275 9.289 0.520 147 HA ASN 20 HA ASN 20 2.009 6.811 -0.725 148 HB2 ASN 20 HB2 ASN 20 3.185 9.592 -1.006 149 HB3 ASN 20 HB3 ASN 20 3.616 8.211 -2.012 150 HD21 ASN 20 HD21 ASN 20 2.911 9.146 -3.892 151 HD22 ASN 20 HD22 ASN 20 1.244 9.417 -4.240 152 H GLN 21 H GLN 21 3.680 9.137 1.405 153 HA GLN 21 HA GLN 21 6.135 7.765 1.442 154 HB2 GLN 21 HB2 GLN 21 6.814 9.221 3.166 155 HB3 GLN 21 HB3 GLN 21 5.758 10.160 2.133 156 HG2 GLN 21 HG2 GLN 21 3.947 9.919 3.729 157 HG3 GLN 21 HG3 GLN 21 4.961 8.903 4.753 158 HE21 GLN 21 HE21 GLN 21 4.411 12.128 3.586 159 HE22 GLN 21 HE22 GLN 21 5.390 12.923 4.760 160 H ILE 22 H ILE 22 3.291 7.520 3.521 161 HA ILE 22 HA ILE 22 4.364 5.914 5.542 162 HB ILE 22 HB ILE 22 1.584 6.277 4.466 163 HG12 ILE 22 HG12 ILE 22 2.573 8.047 5.851 164 HG13 ILE 22 HG13 ILE 22 1.212 7.289 6.675 165 HG21 ILE 22 HG21 ILE 22 0.684 4.897 6.288 166 HG22 ILE 22 HG22 ILE 22 2.321 4.387 6.705 167 HG23 ILE 22 HG23 ILE 22 1.629 3.944 5.143 168 HD11 ILE 22 HD11 ILE 22 2.713 6.014 8.060 169 HD12 ILE 22 HD12 ILE 22 3.116 7.727 8.158 170 HD13 ILE 22 HD13 ILE 22 4.108 6.644 7.184 171 H THR 23 H THR 23 2.564 4.845 2.637 172 HA THR 23 HA THR 23 3.132 2.089 3.135 173 HB THR 23 HB THR 23 2.249 3.297 0.497 174 HG1 THR 23 HG1 THR 23 0.595 3.854 1.793 175 HG21 THR 23 HG21 THR 23 3.016 0.988 0.330 176 HG22 THR 23 HG22 THR 23 1.263 1.063 0.148 177 HG23 THR 23 HG23 THR 23 1.967 0.526 1.673 178 H GLY 24 H GLY 24 4.710 4.657 1.360 179 HA2 GLY 24 HA2 GLY 24 6.610 3.185 -0.090 180 HA3 GLY 24 HA3 GLY 24 6.853 4.808 0.539 181 H VAL 25 H VAL 25 6.800 4.440 3.250 182 HA VAL 25 HA VAL 25 9.310 3.322 3.879 183 HB VAL 25 HB VAL 25 6.999 3.953 5.738 184 HG11 VAL 25 HG11 VAL 25 9.917 3.464 6.376 185 HG12 VAL 25 HG12 VAL 25 8.566 2.412 6.800 186 HG13 VAL 25 HG13 VAL 25 8.695 4.014 7.526 187 HG21 VAL 25 HG21 VAL 25 8.226 6.046 6.182 188 HG22 VAL 25 HG22 VAL 25 7.755 5.909 4.489 189 HG23 VAL 25 HG23 VAL 25 9.423 5.593 4.964 190 H ILE 26 H ILE 26 6.015 2.058 4.251 191 HA ILE 26 HA ILE 26 6.563 -0.381 5.470 192 HB ILE 26 HB ILE 26 4.450 0.330 3.428 193 HG12 ILE 26 HG12 ILE 26 4.334 0.010 6.444 194 HG13 ILE 26 HG13 ILE 26 4.354 1.542 5.579 195 HG21 ILE 26 HG21 ILE 26 4.800 -2.082 3.358 196 HG22 ILE 26 HG22 ILE 26 3.255 -1.703 4.117 197 HG23 ILE 26 HG23 ILE 26 4.634 -2.173 5.112 198 HD11 ILE 26 HD11 ILE 26 2.190 -0.543 5.423 199 HD12 ILE 26 HD12 ILE 26 2.209 0.996 4.559 200 HD13 ILE 26 HD13 ILE 26 2.119 0.972 6.321 201 H SER 27 H SER 27 6.618 0.399 1.987 202 HA SER 27 HA SER 27 7.258 -2.221 1.107 203 HB2 SER 27 HB2 SER 27 7.756 -1.244 -1.046 204 HB3 SER 27 HB3 SER 27 6.356 -0.406 -0.379 205 HG SER 27 HG SER 27 7.638 1.335 0.112 206 H LYS 28 H LYS 28 9.182 0.250 2.553 207 HA LYS 28 HA LYS 28 11.716 -0.737 1.571 208 HB2 LYS 28 HB2 LYS 28 11.116 1.261 3.771 209 HB3 LYS 28 HB3 LYS 28 12.718 0.907 3.133 210 HG2 LYS 28 HG2 LYS 28 11.803 1.615 0.862 211 HG3 LYS 28 HG3 LYS 28 10.416 2.256 1.745 212 HD2 LYS 28 HD2 LYS 28 13.281 3.048 2.285 213 HD3 LYS 28 HD3 LYS 28 12.194 3.940 1.224 214 HE2 LYS 28 HE2 LYS 28 10.657 4.270 3.132 215 HE3 LYS 28 HE3 LYS 28 11.815 3.450 4.179 216 HZ1 LYS 28 HZ1 LYS 28 13.419 5.171 3.737 217 HZ2 LYS 28 HZ2 LYS 28 11.984 5.877 4.291 218 HZ3 LYS 28 HZ3 LYS 28 12.373 5.933 2.648 219 H PHE 29 H PHE 29 9.642 -2.123 3.677 220 HA PHE 29 HA PHE 29 11.503 -2.902 5.741 221 HB2 PHE 29 HB2 PHE 29 8.745 -3.930 5.047 222 HB3 PHE 29 HB3 PHE 29 9.696 -4.534 6.398 223 HD1 PHE 29 HD2 PHE 29 10.831 -1.643 7.034 224 HD2 PHE 29 HD1 PHE 29 6.922 -3.268 6.491 225 HE1 PHE 29 HE2 PHE 29 9.895 0.120 8.467 226 HE2 PHE 29 HE1 PHE 29 5.991 -1.501 7.926 227 HZ PHE 29 HZ PHE 29 7.477 0.195 8.916 228 H ASP 30 H ASP 30 11.836 -5.258 6.224 229 HA ASP 30 HA ASP 30 13.052 -6.544 3.931 230 HB2 ASP 30 HB2 ASP 30 13.956 -8.104 5.627 231 HB3 ASP 30 HB3 ASP 30 14.258 -6.423 6.055 232 H THR 31 H THR 31 10.120 -6.826 5.691 233 HA THR 31 HA THR 31 9.671 -9.632 5.062 234 HB THR 31 HB THR 31 8.946 -8.849 7.242 235 HG1 THR 31 HG1 THR 31 7.081 -9.939 7.193 236 HG21 THR 31 HG21 THR 31 8.501 -6.504 6.707 237 HG22 THR 31 HG22 THR 31 7.103 -7.240 7.492 238 HG23 THR 31 HG23 THR 31 7.097 -6.976 5.747 239 H ASN 32 H ASN 32 7.684 -10.360 4.000 240 HA ASN 32 HA ASN 32 7.250 -8.836 1.555 241 HB2 ASN 32 HB2 ASN 32 7.746 -11.234 1.394 242 HB3 ASN 32 HB3 ASN 32 6.315 -11.608 2.349 243 HD21 ASN 32 HD21 ASN 32 7.470 -10.413 -0.717 244 HD22 ASN 32 HD22 ASN 32 5.999 -10.672 -1.583 245 H ILE 33 H ILE 33 5.511 -7.616 1.157 246 HA ILE 33 HA ILE 33 3.442 -7.253 3.082 247 HB ILE 33 HB ILE 33 3.573 -6.300 0.209 248 HG12 ILE 33 HG12 ILE 33 4.316 -4.868 2.781 249 HG13 ILE 33 HG13 ILE 33 5.461 -5.511 1.609 250 HG21 ILE 33 HG21 ILE 33 1.909 -4.628 0.875 251 HG22 ILE 33 HG22 ILE 33 1.830 -5.341 2.486 252 HG23 ILE 33 HG23 ILE 33 1.285 -6.265 1.086 253 HD11 ILE 33 HD11 ILE 33 4.622 -3.948 -0.067 254 HD12 ILE 33 HD12 ILE 33 5.206 -3.114 1.371 255 HD13 ILE 33 HD13 ILE 33 3.474 -3.304 1.109 256 H ARG 34 H ARG 34 2.049 -8.923 3.436 257 HA ARG 34 HA ARG 34 1.075 -10.548 1.232 258 HB2 ARG 34 HB2 ARG 34 0.227 -10.625 4.137 259 HB3 ARG 34 HB3 ARG 34 -0.046 -11.871 2.925 260 HG2 ARG 34 HG2 ARG 34 2.609 -11.020 4.075 261 HG3 ARG 34 HG3 ARG 34 1.756 -12.535 4.376 262 HD2 ARG 34 HD2 ARG 34 2.825 -11.634 1.694 263 HD3 ARG 34 HD3 ARG 34 3.614 -12.787 2.768 264 HE ARG 34 HE ARG 34 1.219 -13.926 2.406 265 HH11 ARG 34 HH11 ARG 34 3.464 -12.585 0.160 266 HH12 ARG 34 HH12 ARG 34 3.014 -13.680 -1.105 267 HH21 ARG 34 HH21 ARG 34 0.673 -15.341 0.770 268 HH22 ARG 34 HH22 ARG 34 1.456 -15.216 -0.766 269 H THR 35 H THR 35 -0.107 -8.005 3.338 270 HA THR 35 HA THR 35 -2.186 -7.367 1.417 271 HB THR 35 HB THR 35 -2.963 -7.934 4.299 272 HG1 THR 35 HG1 THR 35 -3.001 -9.500 2.034 273 HG21 THR 35 HG21 THR 35 -4.224 -6.064 3.337 274 HG22 THR 35 HG22 THR 35 -5.258 -7.475 3.553 275 HG23 THR 35 HG23 THR 35 -4.657 -7.064 1.947 276 H ILE 36 H ILE 36 -2.375 -5.191 1.252 277 HA ILE 36 HA ILE 36 -1.848 -3.544 3.633 278 HB ILE 36 HB ILE 36 0.189 -3.464 2.199 279 HG12 ILE 36 HG12 ILE 36 0.355 -0.981 2.072 280 HG13 ILE 36 HG13 ILE 36 -1.380 -0.869 2.353 281 HG21 ILE 36 HG21 ILE 36 -0.834 -3.777 0.013 282 HG22 ILE 36 HG22 ILE 36 0.115 -2.289 0.043 283 HG23 ILE 36 HG23 ILE 36 -1.645 -2.215 0.155 284 HD11 ILE 36 HD11 ILE 36 -0.083 -0.429 4.369 285 HD12 ILE 36 HD12 ILE 36 0.633 -2.038 4.262 286 HD13 ILE 36 HD13 ILE 36 -1.098 -1.860 4.551 287 H VAL 37 H VAL 37 -3.420 -2.119 4.004 288 HA VAL 37 HA VAL 37 -5.195 -1.326 1.772 289 HB VAL 37 HB VAL 37 -6.049 -1.896 4.627 290 HG11 VAL 37 HG11 VAL 37 -7.693 -1.071 2.224 291 HG12 VAL 37 HG12 VAL 37 -7.354 -0.083 3.646 292 HG13 VAL 37 HG13 VAL 37 -8.340 -1.537 3.799 293 HG21 VAL 37 HG21 VAL 37 -7.313 -3.781 3.666 294 HG22 VAL 37 HG22 VAL 37 -5.579 -3.960 3.406 295 HG23 VAL 37 HG23 VAL 37 -6.619 -3.433 2.082 296 H LEU 38 H LEU 38 -5.774 0.826 1.695 297 HA LEU 38 HA LEU 38 -5.259 2.532 4.010 298 HB2 LEU 38 HB2 LEU 38 -3.198 2.551 2.592 299 HB3 LEU 38 HB3 LEU 38 -4.151 3.169 1.261 300 HG LEU 38 HG LEU 38 -3.984 4.696 3.854 301 HD11 LEU 38 HD11 LEU 38 -2.095 5.957 2.945 302 HD12 LEU 38 HD12 LEU 38 -2.023 4.863 1.563 303 HD13 LEU 38 HD13 LEU 38 -1.678 4.260 3.185 304 HD21 LEU 38 HD21 LEU 38 -4.442 5.541 0.984 305 HD22 LEU 38 HD22 LEU 38 -4.378 6.625 2.374 306 HD23 LEU 38 HD23 LEU 38 -5.667 5.431 2.248 307 H ASN 39 H ASN 39 -6.825 4.075 4.247 308 HA ASN 39 HA ASN 39 -8.204 5.101 1.904 309 HB2 ASN 39 HB2 ASN 39 -10.454 4.670 2.735 310 HB3 ASN 39 HB3 ASN 39 -9.584 3.154 2.543 311 HD21 ASN 39 HD21 ASN 39 -8.938 2.028 4.385 312 HD22 ASN 39 HD22 ASN 39 -9.645 2.330 5.926 313 H ALA 40 H ALA 40 -8.514 7.224 2.089 314 HA ALA 40 HA ALA 40 -8.168 8.481 4.735 315 HB1 ALA 40 HB1 ALA 40 -6.617 9.170 2.958 316 HB2 ALA 40 HB2 ALA 40 -7.617 10.513 3.512 317 HB3 ALA 40 HB3 ALA 40 -7.981 9.715 1.981 318 H LYS 41 H LYS 41 -10.067 8.763 5.720 319 HA LYS 41 HA LYS 41 -12.282 9.985 4.193 320 HB2 LYS 41 HB2 LYS 41 -13.890 8.741 5.434 321 HB3 LYS 41 HB3 LYS 41 -12.685 7.587 4.887 322 HG2 LYS 41 HG2 LYS 41 -12.749 8.781 7.654 323 HG3 LYS 41 HG3 LYS 41 -13.472 7.233 7.218 324 HD2 LYS 41 HD2 LYS 41 -11.268 6.392 6.542 325 HD3 LYS 41 HD3 LYS 41 -10.543 7.944 6.965 326 HE2 LYS 41 HE2 LYS 41 -10.236 6.226 8.718 327 HE3 LYS 41 HE3 LYS 41 -11.129 7.637 9.290 328 HZ1 LYS 41 HZ1 LYS 41 -12.068 5.475 10.000 329 HZ2 LYS 41 HZ2 LYS 41 -12.417 5.121 8.384 330 HZ3 LYS 41 HZ3 LYS 41 -13.161 6.435 9.141 331 H ASP 42 H ASP 42 -13.455 11.623 5.207 332 HA ASP 42 HA ASP 42 -13.828 13.426 6.532 333 HB2 ASP 42 HB2 ASP 42 -12.570 11.755 8.721 334 HB3 ASP 42 HB3 ASP 42 -13.557 13.194 8.954 335 H GLY 43 H GLY 43 -10.911 12.708 5.442 336 HA2 GLY 43 HA2 GLY 43 -9.240 14.398 5.108 337 HA3 GLY 43 HA3 GLY 43 -9.647 15.075 6.676 338 H ILE 44 H ILE 44 -9.563 11.826 7.157 339 HA ILE 44 HA ILE 44 -6.657 11.766 7.729 340 HB ILE 44 HB ILE 44 -8.755 10.417 9.444 341 HG12 ILE 44 HG12 ILE 44 -7.400 13.092 9.877 342 HG13 ILE 44 HG13 ILE 44 -9.120 12.807 9.618 343 HG21 ILE 44 HG21 ILE 44 -6.931 10.230 11.072 344 HG22 ILE 44 HG22 ILE 44 -5.833 11.018 9.939 345 HG23 ILE 44 HG23 ILE 44 -6.518 9.440 9.550 346 HD11 ILE 44 HD11 ILE 44 -9.252 11.607 11.723 347 HD12 ILE 44 HD12 ILE 44 -8.603 13.230 11.966 348 HD13 ILE 44 HD13 ILE 44 -7.521 11.835 11.974 349 H PHE 45 H PHE 45 -5.652 9.685 7.573 350 HA PHE 45 HA PHE 45 -7.274 7.711 6.084 351 HB2 PHE 45 HB2 PHE 45 -5.368 7.076 4.785 352 HB3 PHE 45 HB3 PHE 45 -5.490 8.829 4.719 353 HD1 PHE 45 HD1 PHE 45 -3.556 5.988 6.006 354 HD2 PHE 45 HD2 PHE 45 -3.798 10.232 5.715 355 HE1 PHE 45 HE1 PHE 45 -1.218 6.167 6.733 356 HE2 PHE 45 HE2 PHE 45 -1.456 10.413 6.447 357 HZ PHE 45 HZ PHE 45 -0.167 8.377 6.958 358 H THR 46 H THR 46 -7.081 5.554 6.544 359 HA THR 46 HA THR 46 -5.342 4.805 8.816 360 HB THR 46 HB THR 46 -7.531 4.613 9.679 361 HG1 THR 46 HG1 THR 46 -6.800 2.010 8.734 362 HG21 THR 46 HG21 THR 46 -8.331 3.139 7.165 363 HG22 THR 46 HG22 THR 46 -8.787 4.791 7.587 364 HG23 THR 46 HG23 THR 46 -9.368 3.439 8.560 365 H CYS 47 H CYS 47 -3.652 3.783 7.940 366 HA CYS 47 HA CYS 47 -4.037 1.952 5.690 367 HB2 CYS 47 HB2 CYS 47 -2.205 3.577 5.536 368 HB3 CYS 47 HB3 CYS 47 -1.480 2.915 6.996 369 HG CYS 47 HG CYS 47 -2.003 0.850 4.351 370 H ASN 48 H ASN 48 -4.207 -0.169 5.958 371 HA ASN 48 HA ASN 48 -3.493 -1.388 8.540 372 HB2 ASN 48 HB2 ASN 48 -5.302 -2.444 6.341 373 HB3 ASN 48 HB3 ASN 48 -5.027 -3.205 7.905 374 HD21 ASN 48 HD21 ASN 48 -7.218 -3.137 8.382 375 HD22 ASN 48 HD22 ASN 48 -8.022 -1.672 8.808 376 H LEU 49 H LEU 49 -1.480 -2.238 8.473 377 HA LEU 49 HA LEU 49 -0.470 -3.446 6.000 378 HB2 LEU 49 HB2 LEU 49 0.992 -1.825 6.994 379 HB3 LEU 49 HB3 LEU 49 0.886 -2.604 8.562 380 HG LEU 49 HG LEU 49 2.132 -4.535 7.716 381 HD11 LEU 49 HD11 LEU 49 3.160 -4.489 5.489 382 HD12 LEU 49 HD12 LEU 49 2.272 -3.010 5.114 383 HD13 LEU 49 HD13 LEU 49 1.398 -4.516 5.402 384 HD21 LEU 49 HD21 LEU 49 3.507 -1.911 7.123 385 HD22 LEU 49 HD22 LEU 49 4.304 -3.454 7.434 386 HD23 LEU 49 HD23 LEU 49 3.366 -2.676 8.707 387 H MET 50 H MET 50 -0.206 -5.583 5.739 388 HA MET 50 HA MET 50 -0.285 -7.346 8.110 389 HB2 MET 50 HB2 MET 50 -1.569 -7.890 5.424 390 HB3 MET 50 HB3 MET 50 -1.552 -8.988 6.799 391 HG2 MET 50 HG2 MET 50 -2.917 -6.305 6.662 392 HG3 MET 50 HG3 MET 50 -3.693 -7.885 6.616 393 HE1 MET 50 HE1 MET 50 -1.531 -9.210 8.843 394 HE2 MET 50 HE2 MET 50 -3.224 -9.685 8.704 395 HE3 MET 50 HE3 MET 50 -2.579 -9.165 10.261 396 H ILE 51 H ILE 51 1.631 -8.298 8.311 397 HA ILE 51 HA ILE 51 2.955 -9.477 5.976 398 HB ILE 51 HB ILE 51 5.186 -8.547 6.839 399 HG12 ILE 51 HG12 ILE 51 4.813 -6.172 7.864 400 HG13 ILE 51 HG13 ILE 51 3.244 -6.797 8.354 401 HG21 ILE 51 HG21 ILE 51 3.189 -6.673 5.567 402 HG22 ILE 51 HG22 ILE 51 4.208 -7.848 4.736 403 HG23 ILE 51 HG23 ILE 51 4.942 -6.467 5.548 404 HD11 ILE 51 HD11 ILE 51 4.851 -6.947 10.154 405 HD12 ILE 51 HD12 ILE 51 5.926 -7.912 9.142 406 HD13 ILE 51 HD13 ILE 51 4.359 -8.559 9.632 407 H PHE 52 H PHE 52 4.763 -10.972 6.603 408 HA PHE 52 HA PHE 52 4.008 -12.435 9.023 409 HB2 PHE 52 HB2 PHE 52 5.568 -13.155 6.559 410 HB3 PHE 52 HB3 PHE 52 5.753 -14.120 8.018 411 HD1 PHE 52 HD2 PHE 52 3.733 -15.223 9.020 412 HD2 PHE 52 HD1 PHE 52 3.675 -13.431 5.153 413 HE1 PHE 52 HE2 PHE 52 1.705 -16.500 8.465 414 HE2 PHE 52 HE1 PHE 52 1.646 -14.708 4.594 415 HZ PHE 52 HZ PHE 52 0.660 -16.244 6.247 416 H VAL 53 H VAL 53 5.268 -12.732 10.776 417 HA VAL 53 HA VAL 53 8.066 -11.773 10.728 418 HB VAL 53 HB VAL 53 7.846 -10.771 12.918 419 HG11 VAL 53 HG11 VAL 53 5.560 -9.840 11.179 420 HG12 VAL 53 HG12 VAL 53 7.245 -9.334 11.025 421 HG13 VAL 53 HG13 VAL 53 6.326 -8.917 12.473 422 HG21 VAL 53 HG21 VAL 53 4.970 -11.683 12.854 423 HG22 VAL 53 HG22 VAL 53 5.684 -10.639 14.083 424 HG23 VAL 53 HG23 VAL 53 6.246 -12.300 13.904 425 H LYS 54 H LYS 54 9.495 -12.867 12.223 426 HA LYS 54 HA LYS 54 8.648 -15.564 12.837 427 HB2 LYS 54 HB2 LYS 54 10.986 -15.997 13.469 428 HB3 LYS 54 HB3 LYS 54 10.828 -15.346 11.844 429 HG2 LYS 54 HG2 LYS 54 11.304 -13.403 14.030 430 HG3 LYS 54 HG3 LYS 54 12.638 -14.472 13.596 431 HD2 LYS 54 HD2 LYS 54 12.659 -13.684 11.351 432 HD3 LYS 54 HD3 LYS 54 11.124 -12.838 11.559 433 HE2 LYS 54 HE2 LYS 54 12.097 -11.240 12.999 434 HE3 LYS 54 HE3 LYS 54 13.584 -12.171 13.147 435 HZ1 LYS 54 HZ1 LYS 54 13.892 -10.305 11.660 436 HZ2 LYS 54 HZ2 LYS 54 12.616 -10.824 10.682 437 HZ3 LYS 54 HZ3 LYS 54 14.024 -11.753 10.800 438 H ASN 55 H ASN 55 8.928 -12.623 14.564 439 HA ASN 55 HA ASN 55 7.985 -13.919 16.975 440 HB2 ASN 55 HB2 ASN 55 9.685 -12.886 18.452 441 HB3 ASN 55 HB3 ASN 55 10.384 -14.071 17.351 442 HD21 ASN 55 HD21 ASN 55 11.880 -13.414 15.873 443 HD22 ASN 55 HD22 ASN 55 12.500 -11.804 15.792 444 H THR 56 H THR 56 7.509 -12.202 18.724 445 HA THR 56 HA THR 56 5.799 -10.266 17.483 446 HB THR 56 HB THR 56 5.187 -9.623 19.815 447 HG1 THR 56 HG1 THR 56 6.932 -10.009 21.071 448 HG21 THR 56 HG21 THR 56 4.002 -11.441 18.666 449 HG22 THR 56 HG22 THR 56 4.127 -11.756 20.397 450 HG23 THR 56 HG23 THR 56 5.188 -12.599 19.269 451 H ASP 57 H ASP 57 8.932 -10.073 19.073 452 HA ASP 57 HA ASP 57 8.931 -7.264 19.519 453 HB2 ASP 57 HB2 ASP 57 10.466 -8.836 20.667 454 HB3 ASP 57 HB3 ASP 57 11.295 -9.123 19.139 455 H LYS 58 H LYS 58 9.901 -9.299 16.833 456 HA LYS 58 HA LYS 58 11.038 -7.428 15.118 457 HB2 LYS 58 HB2 LYS 58 11.137 -9.709 14.488 458 HB3 LYS 58 HB3 LYS 58 9.401 -9.922 14.666 459 HG2 LYS 58 HG2 LYS 58 10.016 -9.942 12.333 460 HG3 LYS 58 HG3 LYS 58 9.025 -8.528 12.698 461 HD2 LYS 58 HD2 LYS 58 11.205 -7.229 12.916 462 HD3 LYS 58 HD3 LYS 58 12.011 -8.642 12.233 463 HE2 LYS 58 HE2 LYS 58 10.627 -8.462 10.225 464 HE3 LYS 58 HE3 LYS 58 9.806 -7.059 10.912 465 HZ1 LYS 58 HZ1 LYS 58 11.529 -6.384 9.388 466 HZ2 LYS 58 HZ2 LYS 58 12.692 -7.243 10.257 467 HZ3 LYS 58 HZ3 LYS 58 11.936 -5.904 10.956 468 H LEU 59 H LEU 59 7.653 -8.098 15.832 469 HA LEU 59 HA LEU 59 6.554 -6.421 13.802 470 HB2 LEU 59 HB2 LEU 59 5.276 -8.246 14.768 471 HB3 LEU 59 HB3 LEU 59 5.375 -7.516 16.360 472 HG LEU 59 HG LEU 59 3.989 -5.632 15.583 473 HD11 LEU 59 HD11 LEU 59 4.591 -5.603 13.241 474 HD12 LEU 59 HD12 LEU 59 2.846 -5.782 13.410 475 HD13 LEU 59 HD13 LEU 59 3.838 -7.180 12.997 476 HD21 LEU 59 HD21 LEU 59 2.928 -7.552 16.644 477 HD22 LEU 59 HD22 LEU 59 2.773 -8.351 15.080 478 HD23 LEU 59 HD23 LEU 59 1.880 -6.865 15.403 479 H THR 60 H THR 60 7.086 -5.960 17.308 480 HA THR 60 HA THR 60 5.981 -3.364 17.459 481 HB THR 60 HB THR 60 7.226 -3.120 19.586 482 HG1 THR 60 HG1 THR 60 9.105 -4.153 19.507 483 HG21 THR 60 HG21 THR 60 5.092 -4.326 19.572 484 HG22 THR 60 HG22 THR 60 6.192 -5.013 20.767 485 HG23 THR 60 HG23 THR 60 5.938 -5.835 19.227 486 H THR 61 H THR 61 9.172 -4.482 16.540 487 HA THR 61 HA THR 61 10.570 -2.045 16.658 488 HB THR 61 HB THR 61 10.975 -4.368 14.753 489 HG1 THR 61 HG1 THR 61 11.253 -4.883 16.990 490 HG21 THR 61 HG21 THR 61 12.847 -2.085 15.419 491 HG22 THR 61 HG22 THR 61 12.045 -2.347 13.868 492 HG23 THR 61 HG23 THR 61 13.255 -3.496 14.443 493 H LEU 62 H LEU 62 8.582 -3.443 14.068 494 HA LEU 62 HA LEU 62 9.125 -1.513 12.085 495 HB2 LEU 62 HB2 LEU 62 6.634 -3.170 12.498 496 HB3 LEU 62 HB3 LEU 62 7.015 -2.274 11.038 497 HG LEU 62 HG LEU 62 8.556 -4.638 12.134 498 HD11 LEU 62 HD11 LEU 62 6.849 -4.341 9.662 499 HD12 LEU 62 HD12 LEU 62 6.413 -5.231 11.121 500 HD13 LEU 62 HD13 LEU 62 7.762 -5.778 10.126 501 HD21 LEU 62 HD21 LEU 62 9.875 -4.486 10.061 502 HD22 LEU 62 HD22 LEU 62 10.077 -3.057 11.074 503 HD23 LEU 62 HD23 LEU 62 9.040 -2.987 9.649 504 H MET 63 H MET 63 6.675 -1.623 14.625 505 HA MET 63 HA MET 63 5.050 0.504 13.924 506 HB2 MET 63 HB2 MET 63 5.945 -0.237 16.720 507 HB3 MET 63 HB3 MET 63 4.516 0.705 16.310 508 HG2 MET 63 HG2 MET 63 3.526 -1.202 15.212 509 HG3 MET 63 HG3 MET 63 4.987 -2.153 15.484 510 HE1 MET 63 HE1 MET 63 2.493 -3.904 17.896 511 HE2 MET 63 HE2 MET 63 3.689 -4.118 16.616 512 HE3 MET 63 HE3 MET 63 2.177 -3.270 16.281 513 H ASP 64 H ASP 64 8.018 0.630 15.898 514 HA ASP 64 HA ASP 64 8.049 3.400 16.331 515 HB2 ASP 64 HB2 ASP 64 9.463 1.643 17.489 516 HB3 ASP 64 HB3 ASP 64 10.495 1.641 16.064 517 H LYS 65 H LYS 65 9.473 1.458 13.715 518 HA LYS 65 HA LYS 65 10.793 3.496 12.312 519 HB2 LYS 65 HB2 LYS 65 9.465 0.976 11.294 520 HB3 LYS 65 HB3 LYS 65 10.510 1.991 10.313 521 HG2 LYS 65 HG2 LYS 65 12.348 1.578 11.933 522 HG3 LYS 65 HG3 LYS 65 11.284 0.465 12.796 523 HD2 LYS 65 HD2 LYS 65 12.737 -0.791 11.311 524 HD3 LYS 65 HD3 LYS 65 11.075 -0.893 10.735 525 HE2 LYS 65 HE2 LYS 65 12.610 -0.539 8.878 526 HE3 LYS 65 HE3 LYS 65 11.547 0.852 9.073 527 HZ1 LYS 65 HZ1 LYS 65 14.361 0.663 10.004 528 HZ2 LYS 65 HZ2 LYS 65 13.349 1.997 10.232 529 HZ3 LYS 65 HZ3 LYS 65 13.810 1.544 8.669 530 H LEU 66 H LEU 66 7.413 2.512 12.277 531 HA LEU 66 HA LEU 66 6.662 4.260 10.104 532 HB2 LEU 66 HB2 LEU 66 4.990 2.723 12.102 533 HB3 LEU 66 HB3 LEU 66 4.359 3.545 10.684 534 HG LEU 66 HG LEU 66 6.372 1.292 10.540 535 HD11 LEU 66 HD11 LEU 66 3.371 1.149 10.234 536 HD12 LEU 66 HD12 LEU 66 4.322 0.445 11.541 537 HD13 LEU 66 HD13 LEU 66 4.506 -0.158 9.895 538 HD21 LEU 66 HD21 LEU 66 4.618 2.576 8.442 539 HD22 LEU 66 HD22 LEU 66 5.681 1.192 8.183 540 HD23 LEU 66 HD23 LEU 66 6.365 2.762 8.601 541 H ARG 67 H ARG 67 6.819 4.510 13.585 542 HA ARG 67 HA ARG 67 5.096 6.778 13.829 543 HB2 ARG 67 HB2 ARG 67 7.200 5.684 15.707 544 HB3 ARG 67 HB3 ARG 67 6.118 7.015 16.106 545 HG2 ARG 67 HG2 ARG 67 4.214 5.385 15.574 546 HG3 ARG 67 HG3 ARG 67 5.443 4.123 15.640 547 HD2 ARG 67 HD2 ARG 67 5.225 4.064 17.861 548 HD3 ARG 67 HD3 ARG 67 5.782 5.734 17.951 549 HE ARG 67 HE ARG 67 2.986 4.837 17.879 550 HH11 ARG 67 HH11 ARG 67 5.287 7.376 18.325 551 HH12 ARG 67 HH12 ARG 67 4.110 8.473 18.960 552 HH21 ARG 67 HH21 ARG 67 1.492 6.260 18.697 553 HH22 ARG 67 HH22 ARG 67 1.987 7.849 19.166 554 H LYS 68 H LYS 68 8.135 6.525 12.461 555 HA LYS 68 HA LYS 68 9.319 8.969 13.365 556 HB2 LYS 68 HB2 LYS 68 9.907 7.491 10.793 557 HB3 LYS 68 HB3 LYS 68 10.959 8.628 11.626 558 HG2 LYS 68 HG2 LYS 68 10.122 5.913 12.637 559 HG3 LYS 68 HG3 LYS 68 11.694 6.336 11.959 560 HD2 LYS 68 HD2 LYS 68 12.093 7.880 13.812 561 HD3 LYS 68 HD3 LYS 68 10.498 7.517 14.475 562 HE2 LYS 68 HE2 LYS 68 11.165 5.169 14.765 563 HE3 LYS 68 HE3 LYS 68 12.762 5.547 14.123 564 HZ1 LYS 68 HZ1 LYS 68 13.172 6.978 15.981 565 HZ2 LYS 68 HZ2 LYS 68 12.684 5.466 16.561 566 HZ3 LYS 68 HZ3 LYS 68 11.600 6.763 16.565 567 H VAL 69 H VAL 69 6.657 8.457 11.405 568 HA VAL 69 HA VAL 69 7.164 10.669 9.577 569 HB VAL 69 HB VAL 69 4.770 8.833 9.840 570 HG11 VAL 69 HG11 VAL 69 4.060 9.768 7.670 571 HG12 VAL 69 HG12 VAL 69 5.381 10.934 7.752 572 HG13 VAL 69 HG13 VAL 69 4.079 10.989 8.941 573 HG21 VAL 69 HG21 VAL 69 5.613 7.855 7.736 574 HG22 VAL 69 HG22 VAL 69 6.761 7.675 9.062 575 HG23 VAL 69 HG23 VAL 69 7.026 8.907 7.828 576 H GLN 70 H GLN 70 6.714 12.682 10.116 577 HA GLN 70 HA GLN 70 5.584 13.540 12.494 578 HB2 GLN 70 HB2 GLN 70 5.496 15.783 11.450 579 HB3 GLN 70 HB3 GLN 70 7.025 14.962 11.172 580 HG2 GLN 70 HG2 GLN 70 6.313 14.367 8.913 581 HG3 GLN 70 HG3 GLN 70 4.760 15.156 9.189 582 HE21 GLN 70 HE21 GLN 70 8.167 15.650 8.669 583 HE22 GLN 70 HE22 GLN 70 8.062 17.333 8.310 584 H GLY 71 H GLY 71 3.936 12.874 9.447 585 HA2 GLY 71 HA2 GLY 71 1.547 14.325 10.126 586 HA3 GLY 71 HA3 GLY 71 1.759 13.250 8.760 587 H VAL 72 H VAL 72 2.658 11.215 11.050 588 HA VAL 72 HA VAL 72 -0.046 10.128 11.350 589 HB VAL 72 HB VAL 72 2.603 8.876 12.118 590 HG11 VAL 72 HG11 VAL 72 -0.161 7.673 11.887 591 HG12 VAL 72 HG12 VAL 72 0.748 7.928 13.376 592 HG13 VAL 72 HG13 VAL 72 1.325 6.768 12.180 593 HG21 VAL 72 HG21 VAL 72 0.899 8.437 9.661 594 HG22 VAL 72 HG22 VAL 72 2.365 7.547 10.079 595 HG23 VAL 72 HG23 VAL 72 2.455 9.269 9.711 596 H PHE 73 H PHE 73 -0.995 9.587 13.324 597 HA PHE 73 HA PHE 73 0.395 10.506 15.747 598 HB2 PHE 73 HB2 PHE 73 -2.135 11.009 16.498 599 HB3 PHE 73 HB3 PHE 73 -1.092 12.203 15.746 600 HD1 PHE 73 HD1 PHE 73 -3.984 9.997 15.228 601 HD2 PHE 73 HD2 PHE 73 -1.475 12.981 13.510 602 HE1 PHE 73 HE1 PHE 73 -5.638 10.366 13.442 603 HE2 PHE 73 HE2 PHE 73 -3.121 13.345 11.723 604 HZ PHE 73 HZ PHE 73 -5.204 12.043 11.685 605 H THR 74 H THR 74 -1.354 7.974 14.229 606 HA THR 74 HA THR 74 -1.192 6.477 16.773 607 HB THR 74 HB THR 74 -3.227 5.374 16.498 608 HG1 THR 74 HG1 THR 74 -4.278 5.136 14.580 609 HG21 THR 74 HG21 THR 74 -3.624 7.720 17.102 610 HG22 THR 74 HG22 THR 74 -4.953 7.077 16.138 611 HG23 THR 74 HG23 THR 74 -3.757 8.138 15.393 612 H VAL 75 H VAL 75 0.117 4.785 16.620 613 HA VAL 75 HA VAL 75 0.067 3.119 14.198 614 HB VAL 75 HB VAL 75 2.646 3.849 15.625 615 HG11 VAL 75 HG11 VAL 75 2.691 1.602 14.711 616 HG12 VAL 75 HG12 VAL 75 3.732 2.658 13.756 617 HG13 VAL 75 HG13 VAL 75 2.141 2.199 13.145 618 HG21 VAL 75 HG21 VAL 75 1.821 5.762 14.345 619 HG22 VAL 75 HG22 VAL 75 1.664 4.749 12.910 620 HG23 VAL 75 HG23 VAL 75 3.260 5.075 13.589 621 H GLU 76 H GLU 76 -0.829 1.289 14.993 622 HA GLU 76 HA GLU 76 0.300 0.082 17.421 623 HB2 GLU 76 HB2 GLU 76 -2.022 -0.365 18.279 624 HB3 GLU 76 HB3 GLU 76 -1.528 1.321 18.321 625 HG2 GLU 76 HG2 GLU 76 -2.809 1.761 16.289 626 HG3 GLU 76 HG3 GLU 76 -3.298 0.068 16.225 627 H ARG 77 H ARG 77 -1.007 -2.125 17.826 628 HA ARG 77 HA ARG 77 -0.534 -3.644 15.385 629 HB2 ARG 77 HB2 ARG 77 0.491 -4.322 17.535 630 HB3 ARG 77 HB3 ARG 77 -1.112 -4.599 18.199 631 HG2 ARG 77 HG2 ARG 77 -1.504 -6.370 16.577 632 HG3 ARG 77 HG3 ARG 77 0.075 -6.073 15.850 633 HD2 ARG 77 HD2 ARG 77 0.270 -7.971 17.292 634 HD3 ARG 77 HD3 ARG 77 1.117 -6.622 18.048 635 HE ARG 77 HE ARG 77 -1.567 -6.806 18.974 636 HH11 ARG 77 HH11 ARG 77 1.577 -8.170 19.347 637 HH12 ARG 77 HH12 ARG 77 1.242 -8.814 20.913 638 HH21 ARG 77 HH21 ARG 77 -1.982 -7.631 21.005 639 HH22 ARG 77 HH22 ARG 77 -0.755 -8.528 21.829 640 H LEU 78 H LEU 78 -1.957 -5.154 14.505 641 HA LEU 78 HA LEU 78 -4.810 -4.919 15.226 642 HB2 LEU 78 HB2 LEU 78 -3.477 -5.812 12.659 643 HB3 LEU 78 HB3 LEU 78 -5.204 -5.906 12.945 644 HG LEU 78 HG LEU 78 -3.615 -3.330 12.922 645 HD11 LEU 78 HD11 LEU 78 -4.641 -2.915 10.748 646 HD12 LEU 78 HD12 LEU 78 -5.413 -4.501 10.795 647 HD13 LEU 78 HD13 LEU 78 -3.655 -4.377 10.707 648 HD21 LEU 78 HD21 LEU 78 -5.816 -2.257 12.848 649 HD22 LEU 78 HD22 LEU 78 -5.629 -3.228 14.307 650 HD23 LEU 78 HD23 LEU 78 -6.595 -3.836 12.963 651 H SER 79 H SER 79 -5.237 -6.518 16.694 652 HA SER 79 HA SER 79 -4.059 -9.179 16.361 653 HB2 SER 79 HB2 SER 79 -4.064 -8.237 18.617 654 HB3 SER 79 HB3 SER 79 -5.818 -8.069 18.567 655 HG SER 79 HG SER 79 -6.001 -10.314 18.505 656 H ASN 80 H ASN 80 -7.022 -7.549 15.737 657 HA ASN 80 HA ASN 80 -8.495 -10.066 15.413 658 HB2 ASN 80 HB2 ASN 80 -10.483 -8.559 15.059 659 HB3 ASN 80 HB3 ASN 80 -9.737 -8.436 16.647 660 HD21 ASN 80 HD21 ASN 80 -11.398 -6.540 15.100 661 HD22 ASN 80 HD22 ASN 80 -10.476 -5.084 15.028 662 H LEU 81 H LEU 81 -7.935 -10.985 13.505 663 HA LEU 81 HA LEU 81 -7.667 -9.266 11.132 664 HB2 LEU 81 HB2 LEU 81 -6.671 -12.083 11.566 665 HB3 LEU 81 HB3 LEU 81 -6.378 -11.101 10.145 666 HG LEU 81 HG LEU 81 -5.287 -10.666 12.926 667 HD11 LEU 81 HD11 LEU 81 -3.924 -11.165 10.277 668 HD12 LEU 81 HD12 LEU 81 -4.139 -12.350 11.570 669 HD13 LEU 81 HD13 LEU 81 -3.126 -10.930 11.834 670 HD21 LEU 81 HD21 LEU 81 -5.059 -8.856 10.516 671 HD22 LEU 81 HD22 LEU 81 -4.152 -8.680 12.018 672 HD23 LEU 81 HD23 LEU 81 -5.905 -8.493 12.022 673 H GLU 82 H GLU 82 -8.509 -9.887 9.119 674 HA GLU 82 HA GLU 82 -10.751 -11.815 9.188 675 HB2 GLU 82 HB2 GLU 82 -11.700 -10.486 7.307 676 HB3 GLU 82 HB3 GLU 82 -11.511 -9.545 8.781 677 HG2 GLU 82 HG2 GLU 82 -9.406 -8.602 7.860 678 HG3 GLU 82 HG3 GLU 82 -9.707 -9.476 6.361 679 H HIS 83 H HIS 83 -8.264 -12.916 8.820 680 HA HIS 83 HA HIS 83 -7.872 -13.184 5.899 681 HB2 HIS 83 HB2 HIS 83 -5.871 -13.507 8.143 682 HB3 HIS 83 HB3 HIS 83 -5.527 -13.812 6.444 683 HD1 HIS 83 HD1 HIS 83 -4.472 -11.907 5.288 684 HD2 HIS 83 HD2 HIS 83 -6.821 -10.657 8.478 685 HE1 HIS 83 HE1 HIS 83 -4.148 -9.426 5.435 686 HE2 HIS 83 HE2 HIS 83 -5.669 -8.675 7.294 687 H HIS 84 H HIS 84 -8.422 -15.026 8.831 688 HA HIS 84 HA HIS 84 -7.362 -17.497 7.935 689 HB2 HIS 84 HB2 HIS 84 -9.436 -16.912 10.056 690 HB3 HIS 84 HB3 HIS 84 -8.705 -18.494 9.795 691 HD1 HIS 84 HD1 HIS 84 -6.046 -18.601 10.185 692 HD2 HIS 84 HD2 HIS 84 -7.982 -15.229 11.656 693 HE1 HIS 84 HE1 HIS 84 -4.430 -17.539 11.786 694 HE2 HIS 84 HE2 HIS 84 -5.651 -15.558 12.732 695 H HIS 85 H HIS 85 -10.693 -16.272 7.952 696 HA HIS 85 HA HIS 85 -12.638 -17.061 7.163 697 HB2 HIS 85 HB2 HIS 85 -12.656 -17.620 4.720 698 HB3 HIS 85 HB3 HIS 85 -11.906 -16.093 5.140 699 HD1 HIS 85 HD1 HIS 85 -9.313 -15.927 4.813 700 HD2 HIS 85 HD2 HIS 85 -11.018 -19.445 3.417 701 HE1 HIS 85 HE1 HIS 85 -7.584 -16.965 3.330 702 HE2 HIS 85 HE2 HIS 85 -8.730 -18.953 2.310 703 H HIS 86 H HIS 86 -10.488 -19.616 5.782 704 HA HIS 86 HA HIS 86 -12.497 -21.601 6.379 705 HB2 HIS 86 HB2 HIS 86 -11.233 -21.859 4.331 706 HB3 HIS 86 HB3 HIS 86 -9.712 -21.869 5.219 707 HD1 HIS 86 HD1 HIS 86 -8.908 -24.087 6.096 708 HD2 HIS 86 HD2 HIS 86 -12.837 -24.245 4.753 709 HE1 HIS 86 HE1 HIS 86 -9.542 -26.513 6.161 710 HE2 HIS 86 HE2 HIS 86 -11.990 -26.546 5.591 711 H HIS 87 H HIS 87 -12.690 -21.692 8.598 712 HA HIS 87 HA HIS 87 -10.350 -22.685 10.092 713 HB2 HIS 87 HB2 HIS 87 -11.801 -22.231 12.130 714 HB3 HIS 87 HB3 HIS 87 -11.290 -20.816 11.219 715 HD1 HIS 87 HD1 HIS 87 -13.151 -19.696 9.676 716 HD2 HIS 87 HD2 HIS 87 -14.527 -22.509 12.412 717 HE1 HIS 87 HE1 HIS 87 -15.621 -19.312 9.855 718 HE2 HIS 87 HE2 HIS 87 -16.385 -20.875 11.667 719 H HIS 88 H HIS 88 -13.297 -23.661 8.694 720 HA HIS 88 HA HIS 88 -13.130 -26.289 10.041 721 HB2 HIS 88 HB2 HIS 88 -15.232 -25.160 10.583 722 HB3 HIS 88 HB3 HIS 88 -15.562 -24.899 8.874 723 HD1 HIS 88 HD1 HIS 88 -16.062 -27.100 7.450 724 HD2 HIS 88 HD2 HIS 88 -16.120 -27.568 11.578 725 HE1 HIS 88 HE1 HIS 88 -17.267 -29.257 7.864 726 HE2 HIS 88 HE2 HIS 88 -17.377 -29.476 10.361 727 H1 MET 1 H1 MET 1 -10.545 19.612 -9.897 728 H2 MET 1 H2 MET 1 -10.639 21.263 -9.562 729 H3 MET 1 H3 MET 1 -10.304 20.743 -11.131 730 HA MET 1 HA MET 1 -12.824 20.217 -9.663 731 HB2 MET 1 HB2 MET 1 -12.184 22.275 -11.788 732 HB3 MET 1 HB3 MET 1 -13.822 21.848 -11.306 733 HG2 MET 1 HG2 MET 1 -13.398 22.618 -9.053 734 HG3 MET 1 HG3 MET 1 -11.717 22.961 -9.459 735 HE1 MET 1 HE1 MET 1 -10.918 24.921 -10.981 736 HE2 MET 1 HE2 MET 1 -11.996 25.994 -11.872 737 HE3 MET 1 HE3 MET 1 -11.874 24.294 -12.324 738 H THR 2 H THR 2 -11.557 20.495 -13.032 739 HA THR 2 HA THR 2 -13.213 18.410 -14.043 740 HB THR 2 HB THR 2 -12.224 20.022 -15.583 741 HG1 THR 2 HG1 THR 2 -12.148 17.366 -15.925 742 HG21 THR 2 HG21 THR 2 -9.566 18.783 -14.857 743 HG22 THR 2 HG22 THR 2 -10.103 20.404 -14.420 744 HG23 THR 2 HG23 THR 2 -9.833 19.994 -16.113 745 H ASP 3 H ASP 3 -10.440 18.350 -12.107 746 HA ASP 3 HA ASP 3 -9.274 15.870 -12.695 747 HB2 ASP 3 HB2 ASP 3 -9.587 17.066 -9.930 748 HB3 ASP 3 HB3 ASP 3 -8.297 16.015 -10.504 749 H PHE 4 H PHE 4 -9.679 13.756 -11.888 750 HA PHE 4 HA PHE 4 -12.150 13.364 -10.358 751 HB2 PHE 4 HB2 PHE 4 -12.906 11.591 -11.862 752 HB3 PHE 4 HB3 PHE 4 -12.774 13.121 -12.716 753 HD1 PHE 4 HD2 PHE 4 -11.061 13.457 -14.419 754 HD2 PHE 4 HD1 PHE 4 -11.436 9.734 -12.381 755 HE1 PHE 4 HE2 PHE 4 -9.645 12.384 -16.121 756 HE2 PHE 4 HE1 PHE 4 -10.020 8.659 -14.081 757 HZ PHE 4 HZ PHE 4 -9.115 9.982 -15.946 758 H LEU 5 H LEU 5 -12.345 11.263 -9.381 759 HA LEU 5 HA LEU 5 -9.835 10.226 -8.431 760 HB2 LEU 5 HB2 LEU 5 -11.801 10.442 -6.963 761 HB3 LEU 5 HB3 LEU 5 -12.672 9.309 -7.972 762 HG LEU 5 HG LEU 5 -11.088 7.523 -7.340 763 HD11 LEU 5 HD11 LEU 5 -9.882 9.615 -5.527 764 HD12 LEU 5 HD12 LEU 5 -9.111 8.879 -6.933 765 HD13 LEU 5 HD13 LEU 5 -9.489 7.894 -5.519 766 HD21 LEU 5 HD21 LEU 5 -11.828 7.246 -5.036 767 HD22 LEU 5 HD22 LEU 5 -13.146 7.837 -6.046 768 HD23 LEU 5 HD23 LEU 5 -12.298 8.945 -4.966 769 H ALA 6 H ALA 6 -8.696 9.016 -9.849 770 HA ALA 6 HA ALA 6 -10.050 7.127 -11.622 771 HB1 ALA 6 HB1 ALA 6 -7.142 7.930 -11.483 772 HB2 ALA 6 HB2 ALA 6 -8.350 8.606 -12.576 773 HB3 ALA 6 HB3 ALA 6 -7.881 6.912 -12.720 774 H GLY 7 H GLY 7 -10.167 5.013 -11.209 775 HA2 GLY 7 HA2 GLY 7 -8.542 3.873 -9.032 776 HA3 GLY 7 HA3 GLY 7 -10.030 3.192 -9.669 777 H ILE 8 H ILE 8 -7.315 1.982 -9.304 778 HA ILE 8 HA ILE 8 -7.048 0.948 -12.052 779 HB ILE 8 HB ILE 8 -4.701 1.517 -10.212 780 HG12 ILE 8 HG12 ILE 8 -5.513 2.889 -12.798 781 HG13 ILE 8 HG13 ILE 8 -5.643 3.587 -11.187 782 HG21 ILE 8 HG21 ILE 8 -4.753 0.461 -13.045 783 HG22 ILE 8 HG22 ILE 8 -4.363 -0.470 -11.598 784 HG23 ILE 8 HG23 ILE 8 -3.304 0.843 -12.112 785 HD11 ILE 8 HD11 ILE 8 -3.710 4.453 -12.369 786 HD12 ILE 8 HD12 ILE 8 -3.082 2.819 -12.576 787 HD13 ILE 8 HD13 ILE 8 -3.210 3.516 -10.960 788 H ARG 9 H ARG 9 -7.254 -1.200 -12.135 789 HA ARG 9 HA ARG 9 -6.972 -2.819 -9.707 790 HB2 ARG 9 HB2 ARG 9 -9.028 -3.175 -10.887 791 HB3 ARG 9 HB3 ARG 9 -8.192 -3.363 -12.419 792 HG2 ARG 9 HG2 ARG 9 -8.919 -5.509 -11.678 793 HG3 ARG 9 HG3 ARG 9 -7.163 -5.451 -11.556 794 HD2 ARG 9 HD2 ARG 9 -7.907 -6.505 -9.585 795 HD3 ARG 9 HD3 ARG 9 -7.504 -4.855 -9.112 796 HE ARG 9 HE ARG 9 -9.864 -4.370 -9.037 797 HH11 ARG 9 HH11 ARG 9 -9.022 -7.701 -9.233 798 HH12 ARG 9 HH12 ARG 9 -10.545 -8.238 -8.621 799 HH21 ARG 9 HH21 ARG 9 -11.831 -5.077 -8.261 800 HH22 ARG 9 HH22 ARG 9 -12.114 -6.775 -8.086 801 H ILE 10 H ILE 10 -5.080 -3.793 -9.335 802 HA ILE 10 HA ILE 10 -3.417 -4.669 -11.627 803 HB ILE 10 HB ILE 10 -2.472 -4.074 -8.812 804 HG12 ILE 10 HG12 ILE 10 -2.159 -2.313 -11.262 805 HG13 ILE 10 HG13 ILE 10 -3.341 -2.035 -9.987 806 HG21 ILE 10 HG21 ILE 10 -0.230 -4.101 -9.818 807 HG22 ILE 10 HG22 ILE 10 -0.936 -4.525 -11.378 808 HG23 ILE 10 HG23 ILE 10 -1.058 -5.644 -10.019 809 HD11 ILE 10 HD11 ILE 10 -1.551 -1.740 -8.370 810 HD12 ILE 10 HD12 ILE 10 -1.375 -0.626 -9.726 811 HD13 ILE 10 HD13 ILE 10 -0.351 -2.058 -9.624 812 H VAL 11 H VAL 11 -3.488 -6.882 -11.875 813 HA VAL 11 HA VAL 11 -3.437 -8.504 -9.401 814 HB VAL 11 HB VAL 11 -4.861 -9.128 -11.993 815 HG11 VAL 11 HG11 VAL 11 -4.369 -10.974 -9.656 816 HG12 VAL 11 HG12 VAL 11 -3.702 -11.146 -11.280 817 HG13 VAL 11 HG13 VAL 11 -5.437 -11.309 -11.020 818 HG21 VAL 11 HG21 VAL 11 -5.818 -8.897 -9.130 819 HG22 VAL 11 HG22 VAL 11 -6.823 -9.356 -10.507 820 HG23 VAL 11 HG23 VAL 11 -6.118 -7.742 -10.432 821 H GLY 12 H GLY 12 -1.693 -9.665 -9.097 822 HA2 GLY 12 HA2 GLY 12 -0.224 -10.839 -11.330 823 HA3 GLY 12 HA3 GLY 12 0.647 -9.637 -10.388 824 H GLU 13 H GLU 13 1.761 -12.051 -10.493 825 HA GLU 13 HA GLU 13 0.850 -13.894 -8.511 826 HB2 GLU 13 HB2 GLU 13 3.060 -15.007 -8.936 827 HB3 GLU 13 HB3 GLU 13 2.077 -14.727 -10.370 828 HG2 GLU 13 HG2 GLU 13 3.494 -12.563 -10.616 829 HG3 GLU 13 HG3 GLU 13 4.611 -13.372 -9.520 830 H ASP 14 H ASP 14 1.487 -14.230 -6.406 831 HA ASP 14 HA ASP 14 2.364 -11.859 -5.017 832 HB2 ASP 14 HB2 ASP 14 1.620 -12.971 -3.033 833 HB3 ASP 14 HB3 ASP 14 0.482 -13.397 -4.299 834 H LYS 15 H LYS 15 4.581 -12.532 -6.384 835 HA LYS 15 HA LYS 15 6.161 -14.456 -4.946 836 HB2 LYS 15 HB2 LYS 15 6.501 -12.931 -7.473 837 HB3 LYS 15 HB3 LYS 15 7.926 -13.611 -6.703 838 HG2 LYS 15 HG2 LYS 15 6.871 -15.826 -6.712 839 HG3 LYS 15 HG3 LYS 15 5.459 -15.136 -7.515 840 HD2 LYS 15 HD2 LYS 15 6.819 -16.221 -9.162 841 HD3 LYS 15 HD3 LYS 15 6.942 -14.480 -9.409 842 HE2 LYS 15 HE2 LYS 15 9.109 -14.436 -8.356 843 HE3 LYS 15 HE3 LYS 15 8.966 -16.135 -7.901 844 HZ1 LYS 15 HZ1 LYS 15 9.026 -15.131 -10.696 845 HZ2 LYS 15 HZ2 LYS 15 9.003 -16.752 -10.212 846 HZ3 LYS 15 HZ3 LYS 15 10.351 -15.790 -9.881 847 H ASN 16 H ASN 16 8.534 -13.977 -4.727 848 HA ASN 16 HA ASN 16 8.647 -12.581 -2.295 849 HB2 ASN 16 HB2 ASN 16 10.979 -13.593 -3.930 850 HB3 ASN 16 HB3 ASN 16 10.935 -13.336 -2.186 851 HD21 ASN 16 HD21 ASN 16 10.084 -15.419 -4.788 852 HD22 ASN 16 HD22 ASN 16 9.479 -16.725 -3.833 853 H GLY 17 H GLY 17 7.913 -10.497 -3.174 854 HA2 GLY 17 HA2 GLY 17 9.236 -8.357 -2.720 855 HA3 GLY 17 HA3 GLY 17 10.178 -8.832 -4.124 856 H MET 18 H MET 18 7.431 -9.889 -5.154 857 HA MET 18 HA MET 18 6.880 -7.754 -6.902 858 HB2 MET 18 HB2 MET 18 5.628 -10.379 -6.239 859 HB3 MET 18 HB3 MET 18 4.618 -9.225 -7.088 860 HG2 MET 18 HG2 MET 18 7.326 -10.136 -8.038 861 HG3 MET 18 HG3 MET 18 5.785 -10.812 -8.577 862 HE1 MET 18 HE1 MET 18 4.122 -7.549 -10.117 863 HE2 MET 18 HE2 MET 18 4.079 -8.012 -8.415 864 HE3 MET 18 HE3 MET 18 3.846 -9.231 -9.667 865 H THR 19 H THR 19 4.902 -8.920 -4.142 866 HA THR 19 HA THR 19 2.986 -6.882 -4.219 867 HB THR 19 HB THR 19 2.570 -7.430 -1.821 868 HG1 THR 19 HG1 THR 19 3.885 -8.904 -0.787 869 HG21 THR 19 HG21 THR 19 1.537 -8.797 -3.584 870 HG22 THR 19 HG22 THR 19 1.933 -9.775 -2.170 871 HG23 THR 19 HG23 THR 19 2.955 -9.847 -3.606 872 H ASN 20 H ASN 20 6.211 -6.935 -2.854 873 HA ASN 20 HA ASN 20 5.936 -4.533 -1.315 874 HB2 ASN 20 HB2 ASN 20 8.424 -5.985 -2.273 875 HB3 ASN 20 HB3 ASN 20 8.405 -4.679 -1.094 876 HD21 ASN 20 HD21 ASN 20 7.743 -5.090 0.976 877 HD22 ASN 20 HD22 ASN 20 7.501 -6.687 1.583 878 H GLN 21 H GLN 21 7.267 -5.333 -4.501 879 HA GLN 21 HA GLN 21 8.295 -2.717 -4.982 880 HB2 GLN 21 HB2 GLN 21 8.905 -3.499 -7.143 881 HB3 GLN 21 HB3 GLN 21 9.204 -4.803 -6.013 882 HG2 GLN 21 HG2 GLN 21 7.172 -5.921 -6.732 883 HG3 GLN 21 HG3 GLN 21 6.799 -4.580 -7.815 884 HE21 GLN 21 HE21 GLN 21 8.899 -7.299 -7.262 885 HE22 GLN 21 HE22 GLN 21 9.554 -7.363 -8.856 886 H ILE 22 H ILE 22 5.295 -4.358 -5.749 887 HA ILE 22 HA ILE 22 4.374 -2.658 -7.783 888 HB ILE 22 HB ILE 22 3.007 -4.519 -5.862 889 HG12 ILE 22 HG12 ILE 22 4.277 -5.498 -7.707 890 HG13 ILE 22 HG13 ILE 22 2.556 -5.773 -7.948 891 HG21 ILE 22 HG21 ILE 22 1.602 -2.837 -7.950 892 HG22 ILE 22 HG22 ILE 22 1.388 -2.739 -6.201 893 HG23 ILE 22 HG23 ILE 22 0.885 -4.188 -7.069 894 HD11 ILE 22 HD11 ILE 22 4.186 -3.639 -9.305 895 HD12 ILE 22 HD12 ILE 22 2.473 -3.966 -9.568 896 HD13 ILE 22 HD13 ILE 22 3.681 -5.169 -10.021 897 H THR 23 H THR 23 3.499 -2.623 -4.304 898 HA THR 23 HA THR 23 2.100 -0.138 -4.589 899 HB THR 23 HB THR 23 3.053 -1.108 -1.901 900 HG1 THR 23 HG1 THR 23 1.040 -2.296 -3.537 901 HG21 THR 23 HG21 THR 23 1.746 0.957 -2.008 902 HG22 THR 23 HG22 THR 23 0.817 -0.319 -1.221 903 HG23 THR 23 HG23 THR 23 0.472 0.119 -2.894 904 H GLY 24 H GLY 24 5.370 -1.082 -3.808 905 HA2 GLY 24 HA2 GLY 24 6.397 1.327 -2.803 906 HA3 GLY 24 HA3 GLY 24 7.311 0.142 -3.724 907 H VAL 25 H VAL 25 6.233 0.242 -6.220 908 HA VAL 25 HA VAL 25 7.245 2.636 -7.334 909 HB VAL 25 HB VAL 25 5.427 0.554 -8.575 910 HG11 VAL 25 HG11 VAL 25 5.238 2.644 -9.815 911 HG12 VAL 25 HG12 VAL 25 6.148 1.458 -10.752 912 HG13 VAL 25 HG13 VAL 25 6.995 2.764 -9.921 913 HG21 VAL 25 HG21 VAL 25 7.500 -0.272 -9.614 914 HG22 VAL 25 HG22 VAL 25 7.584 -0.334 -7.853 915 HG23 VAL 25 HG23 VAL 25 8.421 0.947 -8.730 916 H ILE 26 H ILE 26 3.940 1.610 -6.575 917 HA ILE 26 HA ILE 26 2.518 3.715 -7.718 918 HB ILE 26 HB ILE 26 1.924 2.148 -5.203 919 HG12 ILE 26 HG12 ILE 26 0.838 1.922 -8.029 920 HG13 ILE 26 HG13 ILE 26 2.021 0.840 -7.301 921 HG21 ILE 26 HG21 ILE 26 -0.400 2.947 -5.431 922 HG22 ILE 26 HG22 ILE 26 0.115 4.031 -6.724 923 HG23 ILE 26 HG23 ILE 26 0.730 4.256 -5.086 924 HD11 ILE 26 HD11 ILE 26 -0.169 -0.172 -7.302 925 HD12 ILE 26 HD12 ILE 26 -0.838 1.205 -6.429 926 HD13 ILE 26 HD13 ILE 26 0.342 0.153 -5.647 927 H SER 27 H SER 27 4.016 3.563 -4.482 928 HA SER 27 HA SER 27 3.126 6.086 -3.581 929 HB2 SER 27 HB2 SER 27 4.810 5.930 -1.852 930 HB3 SER 27 HB3 SER 27 4.132 4.324 -2.108 931 HG SER 27 HG SER 27 5.966 3.709 -3.158 932 H LYS 28 H LYS 28 5.573 5.248 -5.856 933 HA LYS 28 HA LYS 28 7.088 7.698 -5.628 934 HB2 LYS 28 HB2 LYS 28 7.158 5.658 -7.862 935 HB3 LYS 28 HB3 LYS 28 8.385 6.861 -7.487 936 HG2 LYS 28 HG2 LYS 28 8.876 5.717 -5.380 937 HG3 LYS 28 HG3 LYS 28 7.626 4.522 -5.735 938 HD2 LYS 28 HD2 LYS 28 8.889 3.949 -7.829 939 HD3 LYS 28 HD3 LYS 28 10.183 5.006 -7.265 940 HE2 LYS 28 HE2 LYS 28 9.136 2.575 -5.813 941 HE3 LYS 28 HE3 LYS 28 10.633 2.653 -6.740 942 HZ1 LYS 28 HZ1 LYS 28 11.066 2.896 -4.397 943 HZ2 LYS 28 HZ2 LYS 28 10.018 4.215 -4.291 944 HZ3 LYS 28 HZ3 LYS 28 11.444 4.337 -5.196 945 H PHE 29 H PHE 29 4.066 7.142 -6.855 946 HA PHE 29 HA PHE 29 4.236 8.538 -9.349 947 HB2 PHE 29 HB2 PHE 29 1.869 7.820 -7.616 948 HB3 PHE 29 HB3 PHE 29 1.717 8.647 -9.161 949 HD1 PHE 29 HD1 PHE 29 4.212 6.876 -10.243 950 HD2 PHE 29 HD2 PHE 29 0.392 6.074 -8.527 951 HE1 PHE 29 HE1 PHE 29 4.148 4.710 -11.403 952 HE2 PHE 29 HE2 PHE 29 0.330 3.905 -9.684 953 HZ PHE 29 HZ PHE 29 2.209 3.218 -11.123 954 H ASP 30 H ASP 30 3.003 10.509 -9.822 955 HA ASP 30 HA ASP 30 3.851 12.704 -8.224 956 HB2 ASP 30 HB2 ASP 30 1.693 12.931 -10.315 957 HB3 ASP 30 HB3 ASP 30 2.983 14.066 -9.928 958 H THR 31 H THR 31 0.927 10.860 -8.415 959 HA THR 31 HA THR 31 -0.756 12.889 -7.179 960 HB THR 31 HB THR 31 -1.699 11.640 -9.028 961 HG1 THR 31 HG1 THR 31 -3.573 11.629 -8.049 962 HG21 THR 31 HG21 THR 31 -1.331 9.161 -7.338 963 HG22 THR 31 HG22 THR 31 -0.382 9.573 -8.765 964 HG23 THR 31 HG23 THR 31 -2.107 9.239 -8.921 965 H ASN 32 H ASN 32 -2.318 12.105 -5.445 966 HA ASN 32 HA ASN 32 -0.743 10.814 -3.319 967 HB2 ASN 32 HB2 ASN 32 -1.403 13.074 -2.781 968 HB3 ASN 32 HB3 ASN 32 -3.083 12.729 -3.179 969 HD21 ASN 32 HD21 ASN 32 -0.505 12.038 -0.907 970 HD22 ASN 32 HD22 ASN 32 -1.540 11.572 0.391 971 H ILE 33 H ILE 33 -1.336 8.919 -2.484 972 HA ILE 33 HA ILE 33 -3.493 7.414 -3.589 973 HB ILE 33 HB ILE 33 -1.813 6.787 -1.148 974 HG12 ILE 33 HG12 ILE 33 -1.420 5.932 -4.031 975 HG13 ILE 33 HG13 ILE 33 -0.462 7.153 -3.202 976 HG21 ILE 33 HG21 ILE 33 -2.446 4.451 -1.582 977 HG22 ILE 33 HG22 ILE 33 -3.494 4.983 -2.897 978 HG23 ILE 33 HG23 ILE 33 -3.853 5.457 -1.235 979 HD11 ILE 33 HD11 ILE 33 0.718 5.043 -3.303 980 HD12 ILE 33 HD12 ILE 33 -0.616 4.231 -2.484 981 HD13 ILE 33 HD13 ILE 33 0.333 5.451 -1.632 982 H ARG 34 H ARG 34 -5.552 8.073 -3.110 983 HA ARG 34 HA ARG 34 -6.264 8.924 -0.427 984 HB2 ARG 34 HB2 ARG 34 -8.163 8.350 -2.709 985 HB3 ARG 34 HB3 ARG 34 -8.469 9.335 -1.285 986 HG2 ARG 34 HG2 ARG 34 -6.725 9.973 -3.651 987 HG3 ARG 34 HG3 ARG 34 -8.157 10.830 -3.083 988 HD2 ARG 34 HD2 ARG 34 -5.446 10.714 -1.761 989 HD3 ARG 34 HD3 ARG 34 -6.196 12.110 -2.522 990 HE ARG 34 HE ARG 34 -6.543 11.235 0.152 991 HH11 ARG 34 HH11 ARG 34 -8.245 12.745 -2.444 992 HH12 ARG 34 HH12 ARG 34 -9.345 13.556 -1.387 993 HH21 ARG 34 HH21 ARG 34 -7.907 12.321 1.478 994 HH22 ARG 34 HH22 ARG 34 -9.145 13.332 0.811 995 H THR 35 H THR 35 -6.522 6.054 -2.396 996 HA THR 35 HA THR 35 -7.126 4.442 -0.057 997 HB THR 35 HB THR 35 -8.969 4.347 -2.461 998 HG1 THR 35 HG1 THR 35 -9.104 5.863 -0.255 999 HG21 THR 35 HG21 THR 35 -8.599 2.133 -1.480 1000 HG22 THR 35 HG22 THR 35 -10.246 2.691 -1.184 1001 HG23 THR 35 HG23 THR 35 -9.049 2.756 0.109 1002 H ILE 36 H ILE 36 -6.428 2.298 -0.304 1003 HA ILE 36 HA ILE 36 -5.961 1.188 -2.911 1004 HB ILE 36 HB ILE 36 -3.903 2.575 -2.508 1005 HG12 ILE 36 HG12 ILE 36 -3.318 -0.390 -2.672 1006 HG13 ILE 36 HG13 ILE 36 -4.026 0.529 -3.998 1007 HG21 ILE 36 HG21 ILE 36 -2.204 1.742 -0.950 1008 HG22 ILE 36 HG22 ILE 36 -3.335 0.523 -0.363 1009 HG23 ILE 36 HG23 ILE 36 -3.669 2.234 -0.100 1010 HD11 ILE 36 HD11 ILE 36 -1.340 1.009 -2.740 1011 HD12 ILE 36 HD12 ILE 36 -2.056 1.969 -4.036 1012 HD13 ILE 36 HD13 ILE 36 -1.655 0.273 -4.312 1013 H VAL 37 H VAL 37 -5.958 -1.028 -2.901 1014 HA VAL 37 HA VAL 37 -5.800 -2.426 -0.310 1015 HB VAL 37 HB VAL 37 -8.032 -2.819 -2.327 1016 HG11 VAL 37 HG11 VAL 37 -7.361 -4.962 -1.400 1017 HG12 VAL 37 HG12 VAL 37 -8.922 -4.485 -0.736 1018 HG13 VAL 37 HG13 VAL 37 -7.461 -4.316 0.239 1019 HG21 VAL 37 HG21 VAL 37 -9.524 -2.109 -0.506 1020 HG22 VAL 37 HG22 VAL 37 -8.378 -0.840 -0.940 1021 HG23 VAL 37 HG23 VAL 37 -8.123 -1.799 0.519 1022 H LEU 38 H LEU 38 -3.972 -3.599 -0.692 1023 HA LEU 38 HA LEU 38 -3.955 -5.380 -3.051 1024 HB2 LEU 38 HB2 LEU 38 -1.967 -3.929 -2.807 1025 HB3 LEU 38 HB3 LEU 38 -1.662 -4.605 -1.221 1026 HG LEU 38 HG LEU 38 -1.677 -6.372 -3.671 1027 HD11 LEU 38 HD11 LEU 38 0.781 -6.075 -3.796 1028 HD12 LEU 38 HD12 LEU 38 0.655 -4.761 -2.624 1029 HD13 LEU 38 HD13 LEU 38 -0.111 -4.608 -4.205 1030 HD21 LEU 38 HD21 LEU 38 -0.139 -7.743 -2.322 1031 HD22 LEU 38 HD22 LEU 38 -1.684 -7.509 -1.509 1032 HD23 LEU 38 HD23 LEU 38 -0.271 -6.585 -0.998 1033 H ASN 39 H ASN 39 -4.800 -7.311 -2.607 1034 HA ASN 39 HA ASN 39 -3.961 -8.681 -0.137 1035 HB2 ASN 39 HB2 ASN 39 -6.258 -9.761 -0.088 1036 HB3 ASN 39 HB3 ASN 39 -6.209 -8.054 0.333 1037 HD21 ASN 39 HD21 ASN 39 -8.388 -9.747 -0.730 1038 HD22 ASN 39 HD22 ASN 39 -8.935 -8.924 -2.147 1039 H ALA 40 H ALA 40 -3.095 -10.631 -0.453 1040 HA ALA 40 HA ALA 40 -3.111 -11.754 -3.162 1041 HB1 ALA 40 HB1 ALA 40 -1.209 -13.085 -2.415 1042 HB2 ALA 40 HB2 ALA 40 -1.413 -12.481 -0.770 1043 HB3 ALA 40 HB3 ALA 40 -0.950 -11.375 -2.065 1044 H LYS 41 H LYS 41 -4.752 -13.093 -3.551 1045 HA LYS 41 HA LYS 41 -5.392 -15.188 -1.570 1046 HB2 LYS 41 HB2 LYS 41 -7.618 -15.325 -2.453 1047 HB3 LYS 41 HB3 LYS 41 -7.282 -13.632 -2.121 1048 HG2 LYS 41 HG2 LYS 41 -6.984 -14.841 -4.860 1049 HG3 LYS 41 HG3 LYS 41 -8.504 -14.163 -4.277 1050 HD2 LYS 41 HD2 LYS 41 -7.468 -11.986 -3.993 1051 HD3 LYS 41 HD3 LYS 41 -5.894 -12.640 -4.444 1052 HE2 LYS 41 HE2 LYS 41 -6.975 -11.409 -6.290 1053 HE3 LYS 41 HE3 LYS 41 -6.684 -13.101 -6.687 1054 HZ1 LYS 41 HZ1 LYS 41 -9.291 -12.020 -5.756 1055 HZ2 LYS 41 HZ2 LYS 41 -8.981 -13.597 -6.292 1056 HZ3 LYS 41 HZ3 LYS 41 -8.891 -12.304 -7.375 1057 H ASP 42 H ASP 42 -5.270 -17.307 -2.179 1058 HA ASP 42 HA ASP 42 -4.728 -19.160 -3.378 1059 HB2 ASP 42 HB2 ASP 42 -5.831 -17.507 -5.659 1060 HB3 ASP 42 HB3 ASP 42 -5.429 -19.216 -5.784 1061 H GLY 43 H GLY 43 -2.808 -16.759 -3.234 1062 HA2 GLY 43 HA2 GLY 43 -0.516 -16.693 -3.707 1063 HA3 GLY 43 HA3 GLY 43 -0.747 -17.887 -4.965 1064 H ILE 44 H ILE 44 -3.005 -15.400 -5.251 1065 HA ILE 44 HA ILE 44 -1.214 -13.742 -6.915 1066 HB ILE 44 HB ILE 44 -4.123 -14.247 -7.571 1067 HG12 ILE 44 HG12 ILE 44 -1.648 -15.537 -8.749 1068 HG13 ILE 44 HG13 ILE 44 -2.942 -16.339 -7.864 1069 HG21 ILE 44 HG21 ILE 44 -3.238 -12.130 -8.386 1070 HG22 ILE 44 HG22 ILE 44 -3.519 -13.232 -9.734 1071 HG23 ILE 44 HG23 ILE 44 -1.879 -12.968 -9.138 1072 HD11 ILE 44 HD11 ILE 44 -3.141 -16.720 -10.251 1073 HD12 ILE 44 HD12 ILE 44 -3.200 -14.978 -10.530 1074 HD13 ILE 44 HD13 ILE 44 -4.504 -15.772 -9.648 1075 H PHE 45 H PHE 45 -1.563 -11.527 -6.797 1076 HA PHE 45 HA PHE 45 -3.350 -10.711 -4.588 1077 HB2 PHE 45 HB2 PHE 45 -1.881 -8.868 -4.116 1078 HB3 PHE 45 HB3 PHE 45 -0.908 -10.329 -4.204 1079 HD1 PHE 45 HD2 PHE 45 -1.764 -7.177 -5.893 1080 HD2 PHE 45 HD1 PHE 45 0.761 -10.606 -5.908 1081 HE1 PHE 45 HE2 PHE 45 -0.306 -6.086 -7.543 1082 HE2 PHE 45 HE1 PHE 45 2.228 -9.514 -7.556 1083 HZ PHE 45 HZ PHE 45 1.687 -7.258 -8.378 1084 H THR 46 H THR 46 -4.758 -9.036 -4.822 1085 HA THR 46 HA THR 46 -4.887 -7.748 -7.480 1086 HB THR 46 HB THR 46 -6.841 -9.060 -7.369 1087 HG1 THR 46 HG1 THR 46 -7.895 -6.655 -6.326 1088 HG21 THR 46 HG21 THR 46 -7.305 -8.029 -4.568 1089 HG22 THR 46 HG22 THR 46 -6.762 -9.652 -4.998 1090 HG23 THR 46 HG23 THR 46 -8.374 -9.110 -5.463 1091 H CYS 47 H CYS 47 -3.849 -5.876 -7.117 1092 HA CYS 47 HA CYS 47 -4.387 -4.300 -4.719 1093 HB2 CYS 47 HB2 CYS 47 -2.054 -4.612 -5.387 1094 HB3 CYS 47 HB3 CYS 47 -2.389 -3.889 -6.955 1095 HG CYS 47 HG CYS 47 -2.151 -1.410 -6.257 1096 H ASN 48 H ASN 48 -6.220 -3.111 -4.861 1097 HA ASN 48 HA ASN 48 -6.879 -1.655 -7.308 1098 HB2 ASN 48 HB2 ASN 48 -8.284 -1.850 -4.633 1099 HB3 ASN 48 HB3 ASN 48 -8.849 -0.834 -5.951 1100 HD21 ASN 48 HD21 ASN 48 -10.345 -2.867 -4.793 1101 HD22 ASN 48 HD22 ASN 48 -10.601 -4.102 -5.972 1102 H LEU 49 H LEU 49 -5.824 0.208 -7.667 1103 HA LEU 49 HA LEU 49 -4.989 1.899 -5.415 1104 HB2 LEU 49 HB2 LEU 49 -3.250 1.411 -7.002 1105 HB3 LEU 49 HB3 LEU 49 -4.264 1.899 -8.347 1106 HG LEU 49 HG LEU 49 -4.194 4.237 -7.551 1107 HD11 LEU 49 HD11 LEU 49 -3.888 3.844 -5.173 1108 HD12 LEU 49 HD12 LEU 49 -2.609 4.886 -5.796 1109 HD13 LEU 49 HD13 LEU 49 -2.279 3.184 -5.468 1110 HD21 LEU 49 HD21 LEU 49 -2.580 3.490 -9.216 1111 HD22 LEU 49 HD22 LEU 49 -1.476 2.969 -7.941 1112 HD23 LEU 49 HD23 LEU 49 -1.852 4.682 -8.141 1113 H MET 50 H MET 50 -5.946 3.819 -4.961 1114 HA MET 50 HA MET 50 -7.818 4.960 -6.948 1115 HB2 MET 50 HB2 MET 50 -8.156 5.003 -3.942 1116 HB3 MET 50 HB3 MET 50 -9.266 5.684 -5.123 1117 HG2 MET 50 HG2 MET 50 -8.635 2.772 -4.690 1118 HG3 MET 50 HG3 MET 50 -10.141 3.607 -4.327 1119 HE1 MET 50 HE1 MET 50 -11.201 4.605 -8.045 1120 HE2 MET 50 HE2 MET 50 -10.121 5.520 -6.994 1121 HE3 MET 50 HE3 MET 50 -11.603 4.819 -6.342 1122 H ILE 51 H ILE 51 -6.955 6.766 -7.710 1123 HA ILE 51 HA ILE 51 -5.866 8.774 -5.864 1124 HB ILE 51 HB ILE 51 -3.967 9.171 -7.534 1125 HG12 ILE 51 HG12 ILE 51 -3.284 6.869 -8.612 1126 HG13 ILE 51 HG13 ILE 51 -5.006 6.516 -8.509 1127 HG21 ILE 51 HG21 ILE 51 -2.529 7.464 -6.497 1128 HG22 ILE 51 HG22 ILE 51 -3.967 6.647 -5.883 1129 HG23 ILE 51 HG23 ILE 51 -3.570 8.271 -5.324 1130 HD11 ILE 51 HD11 ILE 51 -4.375 7.350 -10.702 1131 HD12 ILE 51 HD12 ILE 51 -3.757 8.834 -9.977 1132 HD13 ILE 51 HD13 ILE 51 -5.482 8.463 -9.899 1133 H PHE 52 H PHE 52 -5.625 10.947 -6.886 1134 HA PHE 52 HA PHE 52 -7.791 11.370 -8.814 1135 HB2 PHE 52 HB2 PHE 52 -6.359 13.156 -6.875 1136 HB3 PHE 52 HB3 PHE 52 -7.222 13.868 -8.233 1137 HD1 PHE 52 HD2 PHE 52 -9.652 13.617 -8.434 1138 HD2 PHE 52 HD1 PHE 52 -7.548 12.194 -5.012 1139 HE1 PHE 52 HE2 PHE 52 -11.773 13.470 -7.201 1140 HE2 PHE 52 HE1 PHE 52 -9.668 12.049 -3.771 1141 HZ PHE 52 HZ PHE 52 -11.781 12.688 -4.862 1142 H VAL 53 H VAL 53 -7.561 12.183 -10.827 1143 HA VAL 53 HA VAL 53 -4.889 13.051 -11.733 1144 HB VAL 53 HB VAL 53 -5.090 11.867 -13.818 1145 HG11 VAL 53 HG11 VAL 53 -5.091 9.517 -13.095 1146 HG12 VAL 53 HG12 VAL 53 -5.747 10.010 -11.534 1147 HG13 VAL 53 HG13 VAL 53 -4.138 10.546 -12.024 1148 HG21 VAL 53 HG21 VAL 53 -7.478 12.057 -14.165 1149 HG22 VAL 53 HG22 VAL 53 -7.786 10.931 -12.844 1150 HG23 VAL 53 HG23 VAL 53 -6.979 10.371 -14.310 1151 H LYS 54 H LYS 54 -4.891 14.539 -13.488 1152 HA LYS 54 HA LYS 54 -7.169 16.258 -13.666 1153 HB2 LYS 54 HB2 LYS 54 -4.910 17.159 -13.817 1154 HB3 LYS 54 HB3 LYS 54 -4.589 16.191 -15.250 1155 HG2 LYS 54 HG2 LYS 54 -5.000 18.431 -15.948 1156 HG3 LYS 54 HG3 LYS 54 -6.382 17.449 -16.432 1157 HD2 LYS 54 HD2 LYS 54 -7.246 19.492 -15.559 1158 HD3 LYS 54 HD3 LYS 54 -7.550 18.246 -14.345 1159 HE2 LYS 54 HE2 LYS 54 -5.560 18.979 -13.108 1160 HE3 LYS 54 HE3 LYS 54 -5.276 20.232 -14.317 1161 HZ1 LYS 54 HZ1 LYS 54 -7.604 20.021 -12.485 1162 HZ2 LYS 54 HZ2 LYS 54 -7.474 21.160 -13.732 1163 HZ3 LYS 54 HZ3 LYS 54 -6.381 21.191 -12.445 1164 H ASN 55 H ASN 55 -5.632 13.952 -15.908 1165 HA ASN 55 HA ASN 55 -8.113 13.886 -17.500 1166 HB2 ASN 55 HB2 ASN 55 -5.315 14.016 -18.658 1167 HB3 ASN 55 HB3 ASN 55 -6.795 13.799 -19.585 1168 HD21 ASN 55 HD21 ASN 55 -4.870 16.025 -17.751 1169 HD22 ASN 55 HD22 ASN 55 -5.685 17.455 -18.272 1170 H THR 56 H THR 56 -8.215 11.959 -18.954 1171 HA THR 56 HA THR 56 -7.635 9.572 -17.522 1172 HB THR 56 HB THR 56 -8.504 8.379 -19.500 1173 HG1 THR 56 HG1 THR 56 -8.578 9.326 -21.392 1174 HG21 THR 56 HG21 THR 56 -10.091 9.292 -17.869 1175 HG22 THR 56 HG22 THR 56 -10.762 9.349 -19.500 1176 HG23 THR 56 HG23 THR 56 -10.133 10.819 -18.752 1177 H ASP 57 H ASP 57 -5.916 11.311 -20.023 1178 HA ASP 57 HA ASP 57 -4.196 9.249 -20.907 1179 HB2 ASP 57 HB2 ASP 57 -3.593 12.214 -20.730 1180 HB3 ASP 57 HB3 ASP 57 -2.769 11.038 -21.754 1181 H LYS 58 H LYS 58 -3.958 11.578 -18.277 1182 HA LYS 58 HA LYS 58 -1.472 10.847 -17.228 1183 HB2 LYS 58 HB2 LYS 58 -2.524 12.822 -16.421 1184 HB3 LYS 58 HB3 LYS 58 -3.994 11.959 -15.995 1185 HG2 LYS 58 HG2 LYS 58 -2.709 12.601 -14.024 1186 HG3 LYS 58 HG3 LYS 58 -2.864 10.851 -14.182 1187 HD2 LYS 58 HD2 LYS 58 -0.582 10.796 -15.191 1188 HD3 LYS 58 HD3 LYS 58 -0.445 12.527 -14.886 1189 HE2 LYS 58 HE2 LYS 58 -0.676 12.125 -12.481 1190 HE3 LYS 58 HE3 LYS 58 -0.842 10.393 -12.782 1191 HZ1 LYS 58 HZ1 LYS 58 1.540 12.065 -13.352 1192 HZ2 LYS 58 HZ2 LYS 58 1.394 10.436 -13.767 1193 HZ3 LYS 58 HZ3 LYS 58 1.403 10.895 -12.141 1194 H LEU 59 H LEU 59 -4.684 9.455 -16.767 1195 HA LEU 59 HA LEU 59 -3.983 7.517 -14.817 1196 HB2 LEU 59 HB2 LEU 59 -6.270 8.162 -15.072 1197 HB3 LEU 59 HB3 LEU 59 -6.267 7.749 -16.773 1198 HG LEU 59 HG LEU 59 -6.133 5.363 -16.212 1199 HD11 LEU 59 HD11 LEU 59 -4.898 5.468 -14.135 1200 HD12 LEU 59 HD12 LEU 59 -6.426 4.623 -13.887 1201 HD13 LEU 59 HD13 LEU 59 -6.243 6.293 -13.344 1202 HD21 LEU 59 HD21 LEU 59 -8.383 5.123 -15.279 1203 HD22 LEU 59 HD22 LEU 59 -8.321 6.397 -16.496 1204 HD23 LEU 59 HD23 LEU 59 -8.362 6.817 -14.782 1205 H THR 60 H THR 60 -4.270 7.316 -18.378 1206 HA THR 60 HA THR 60 -3.679 4.567 -18.626 1207 HB THR 60 HB THR 60 -3.163 5.005 -20.977 1208 HG1 THR 60 HG1 THR 60 -3.368 7.340 -21.611 1209 HG21 THR 60 HG21 THR 60 -5.261 6.073 -21.655 1210 HG22 THR 60 HG22 THR 60 -5.485 6.691 -20.018 1211 HG23 THR 60 HG23 THR 60 -5.527 4.953 -20.318 1212 H THR 61 H THR 61 -1.580 7.409 -18.530 1213 HA THR 61 HA THR 61 0.878 6.203 -19.097 1214 HB THR 61 HB THR 61 0.283 8.514 -17.229 1215 HG1 THR 61 HG1 THR 61 -0.229 9.157 -19.262 1216 HG21 THR 61 HG21 THR 61 2.472 7.566 -16.686 1217 HG22 THR 61 HG22 THR 61 2.655 9.126 -17.490 1218 HG23 THR 61 HG23 THR 61 2.936 7.633 -18.386 1219 H LEU 62 H LEU 62 -0.864 6.453 -15.995 1220 HA LEU 62 HA LEU 62 1.145 5.256 -14.402 1221 HB2 LEU 62 HB2 LEU 62 -1.845 5.354 -13.989 1222 HB3 LEU 62 HB3 LEU 62 -0.691 4.825 -12.777 1223 HG LEU 62 HG LEU 62 -0.966 7.607 -13.933 1224 HD11 LEU 62 HD11 LEU 62 -1.495 8.227 -11.631 1225 HD12 LEU 62 HD12 LEU 62 -1.340 6.540 -11.133 1226 HD13 LEU 62 HD13 LEU 62 -2.628 7.020 -12.242 1227 HD21 LEU 62 HD21 LEU 62 0.854 8.254 -12.419 1228 HD22 LEU 62 HD22 LEU 62 1.401 7.096 -13.631 1229 HD23 LEU 62 HD23 LEU 62 1.088 6.562 -11.978 1230 H MET 63 H MET 63 -1.657 3.848 -16.102 1231 HA MET 63 HA MET 63 -1.442 1.190 -15.308 1232 HB2 MET 63 HB2 MET 63 -1.987 2.082 -18.150 1233 HB3 MET 63 HB3 MET 63 -2.472 0.563 -17.413 1234 HG2 MET 63 HG2 MET 63 -4.004 1.744 -15.947 1235 HG3 MET 63 HG3 MET 63 -3.493 3.287 -16.641 1236 HE1 MET 63 HE1 MET 63 -5.777 4.187 -17.679 1237 HE2 MET 63 HE2 MET 63 -6.356 2.959 -16.556 1238 HE3 MET 63 HE3 MET 63 -7.017 3.040 -18.190 1239 H ASP 64 H ASP 64 0.088 2.740 -18.107 1240 HA ASP 64 HA ASP 64 1.628 0.637 -19.030 1241 HB2 ASP 64 HB2 ASP 64 1.245 2.807 -20.183 1242 HB3 ASP 64 HB3 ASP 64 2.350 3.577 -19.051 1243 H LYS 65 H LYS 65 2.492 3.087 -16.592 1244 HA LYS 65 HA LYS 65 5.117 2.251 -16.081 1245 HB2 LYS 65 HB2 LYS 65 3.085 3.565 -14.264 1246 HB3 LYS 65 HB3 LYS 65 4.776 3.359 -13.833 1247 HG2 LYS 65 HG2 LYS 65 5.349 4.675 -15.911 1248 HG3 LYS 65 HG3 LYS 65 3.628 5.029 -16.063 1249 HD2 LYS 65 HD2 LYS 65 4.697 6.878 -14.950 1250 HD3 LYS 65 HD3 LYS 65 3.689 6.031 -13.777 1251 HE2 LYS 65 HE2 LYS 65 5.593 4.982 -12.783 1252 HE3 LYS 65 HE3 LYS 65 6.648 5.528 -14.087 1253 HZ1 LYS 65 HZ1 LYS 65 6.302 7.807 -13.360 1254 HZ2 LYS 65 HZ2 LYS 65 6.937 6.867 -12.110 1255 HZ3 LYS 65 HZ3 LYS 65 5.300 7.285 -12.103 1256 H LEU 66 H LEU 66 2.060 1.137 -14.693 1257 HA LEU 66 HA LEU 66 3.280 -0.668 -12.820 1258 HB2 LEU 66 HB2 LEU 66 0.438 -0.505 -13.844 1259 HB3 LEU 66 HB3 LEU 66 0.964 -1.457 -12.466 1260 HG LEU 66 HG LEU 66 1.252 1.550 -12.593 1261 HD11 LEU 66 HD11 LEU 66 -1.108 1.003 -12.738 1262 HD12 LEU 66 HD12 LEU 66 -0.725 1.667 -11.150 1263 HD13 LEU 66 HD13 LEU 66 -0.966 -0.068 -11.345 1264 HD21 LEU 66 HD21 LEU 66 1.516 1.354 -10.165 1265 HD22 LEU 66 HD22 LEU 66 2.751 0.433 -11.022 1266 HD23 LEU 66 HD23 LEU 66 1.381 -0.401 -10.288 1267 H ARG 67 H ARG 67 2.253 -0.875 -16.130 1268 HA ARG 67 HA ARG 67 2.096 -3.733 -16.269 1269 HB2 ARG 67 HB2 ARG 67 2.207 -1.588 -18.399 1270 HB3 ARG 67 HB3 ARG 67 2.066 -3.304 -18.770 1271 HG2 ARG 67 HG2 ARG 67 -0.029 -3.396 -17.482 1272 HG3 ARG 67 HG3 ARG 67 0.103 -1.669 -17.160 1273 HD2 ARG 67 HD2 ARG 67 -0.083 -1.180 -19.528 1274 HD3 ARG 67 HD3 ARG 67 -0.090 -2.902 -19.910 1275 HE ARG 67 HE ARG 67 -2.201 -2.107 -18.126 1276 HH11 ARG 67 HH11 ARG 67 -1.273 -2.427 -21.416 1277 HH12 ARG 67 HH12 ARG 67 -2.900 -2.522 -21.984 1278 HH21 ARG 67 HH21 ARG 67 -4.283 -2.242 -18.851 1279 HH22 ARG 67 HH22 ARG 67 -4.595 -2.423 -20.542 1280 H LYS 68 H LYS 68 4.744 -1.677 -16.033 1281 HA LYS 68 HA LYS 68 6.575 -3.020 -17.775 1282 HB2 LYS 68 HB2 LYS 68 7.272 -1.408 -15.312 1283 HB3 LYS 68 HB3 LYS 68 8.316 -1.750 -16.685 1284 HG2 LYS 68 HG2 LYS 68 5.870 0.014 -16.656 1285 HG3 LYS 68 HG3 LYS 68 7.550 0.530 -16.786 1286 HD2 LYS 68 HD2 LYS 68 7.718 -0.642 -18.957 1287 HD3 LYS 68 HD3 LYS 68 6.019 -1.105 -18.820 1288 HE2 LYS 68 HE2 LYS 68 5.472 1.351 -18.657 1289 HE3 LYS 68 HE3 LYS 68 7.154 1.680 -19.072 1290 HZ1 LYS 68 HZ1 LYS 68 5.208 0.191 -20.749 1291 HZ2 LYS 68 HZ2 LYS 68 6.821 0.502 -21.156 1292 HZ3 LYS 68 HZ3 LYS 68 5.726 1.781 -21.005 1293 H VAL 69 H VAL 69 5.207 -3.910 -14.784 1294 HA VAL 69 HA VAL 69 7.516 -5.335 -13.767 1295 HB VAL 69 HB VAL 69 4.667 -5.314 -12.736 1296 HG11 VAL 69 HG11 VAL 69 7.233 -6.210 -11.415 1297 HG12 VAL 69 HG12 VAL 69 5.925 -7.257 -11.968 1298 HG13 VAL 69 HG13 VAL 69 5.650 -6.129 -10.641 1299 HG21 VAL 69 HG21 VAL 69 7.053 -3.670 -11.861 1300 HG22 VAL 69 HG22 VAL 69 5.466 -3.680 -11.090 1301 HG23 VAL 69 HG23 VAL 69 5.643 -3.069 -12.735 1302 H GLN 70 H GLN 70 8.027 -7.349 -14.252 1303 HA GLN 70 HA GLN 70 6.663 -8.944 -16.097 1304 HB2 GLN 70 HB2 GLN 70 8.256 -10.714 -15.450 1305 HB3 GLN 70 HB3 GLN 70 9.049 -9.163 -15.689 1306 HG2 GLN 70 HG2 GLN 70 9.071 -8.820 -13.246 1307 HG3 GLN 70 HG3 GLN 70 8.339 -10.409 -13.036 1308 HE21 GLN 70 HE21 GLN 70 11.207 -8.682 -13.941 1309 HE22 GLN 70 HE22 GLN 70 12.286 -10.025 -13.848 1310 H GLY 71 H GLY 71 6.505 -8.956 -12.561 1311 HA2 GLY 71 HA2 GLY 71 5.204 -11.481 -12.312 1312 HA3 GLY 71 HA3 GLY 71 5.309 -10.244 -11.073 1313 H VAL 72 H VAL 72 3.958 -8.378 -13.206 1314 HA VAL 72 HA VAL 72 1.236 -9.081 -12.371 1315 HB VAL 72 HB VAL 72 2.217 -6.594 -13.798 1316 HG11 VAL 72 HG11 VAL 72 -0.454 -7.219 -12.518 1317 HG12 VAL 72 HG12 VAL 72 -0.140 -6.992 -14.239 1318 HG13 VAL 72 HG13 VAL 72 0.038 -5.637 -13.125 1319 HG21 VAL 72 HG21 VAL 72 1.974 -5.492 -11.617 1320 HG22 VAL 72 HG22 VAL 72 3.173 -6.784 -11.561 1321 HG23 VAL 72 HG23 VAL 72 1.566 -7.041 -10.878 1322 H PHE 73 H PHE 73 -0.462 -9.468 -13.790 1323 HA PHE 73 HA PHE 73 0.212 -9.590 -16.655 1324 HB2 PHE 73 HB2 PHE 73 -1.564 -11.605 -16.546 1325 HB3 PHE 73 HB3 PHE 73 0.168 -11.831 -16.381 1326 HD1 PHE 73 HD1 PHE 73 -3.022 -11.687 -14.535 1327 HD2 PHE 73 HD2 PHE 73 1.147 -12.551 -14.344 1328 HE1 PHE 73 HE1 PHE 73 -3.347 -12.793 -12.360 1329 HE2 PHE 73 HE2 PHE 73 0.825 -13.655 -12.173 1330 HZ PHE 73 HZ PHE 73 -1.419 -13.777 -11.179 1331 H THR 74 H THR 74 -1.920 -8.374 -14.323 1332 HA THR 74 HA THR 74 -3.624 -7.396 -16.522 1333 HB THR 74 HB THR 74 -5.654 -7.695 -15.409 1334 HG1 THR 74 HG1 THR 74 -5.828 -7.496 -13.320 1335 HG21 THR 74 HG21 THR 74 -5.798 -10.036 -14.731 1336 HG22 THR 74 HG22 THR 74 -4.044 -10.108 -14.548 1337 HG23 THR 74 HG23 THR 74 -4.755 -9.873 -16.146 1338 H VAL 75 H VAL 75 -3.501 -5.247 -16.620 1339 HA VAL 75 HA VAL 75 -3.712 -3.680 -14.138 1340 HB VAL 75 HB VAL 75 -1.805 -2.949 -16.379 1341 HG11 VAL 75 HG11 VAL 75 -2.798 -1.006 -15.303 1342 HG12 VAL 75 HG12 VAL 75 -1.091 -1.138 -14.885 1343 HG13 VAL 75 HG13 VAL 75 -2.323 -1.616 -13.716 1344 HG21 VAL 75 HG21 VAL 75 0.011 -3.359 -14.785 1345 HG22 VAL 75 HG22 VAL 75 -0.914 -4.829 -15.092 1346 HG23 VAL 75 HG23 VAL 75 -1.156 -3.931 -13.592 1347 H GLU 76 H GLU 76 -5.711 -2.855 -14.429 1348 HA GLU 76 HA GLU 76 -6.290 -1.351 -16.907 1349 HB2 GLU 76 HB2 GLU 76 -8.272 -3.216 -15.563 1350 HB3 GLU 76 HB3 GLU 76 -8.522 -2.299 -17.042 1351 HG2 GLU 76 HG2 GLU 76 -6.848 -3.643 -18.184 1352 HG3 GLU 76 HG3 GLU 76 -6.532 -4.537 -16.697 1353 H ARG 77 H ARG 77 -8.170 0.193 -16.588 1354 HA ARG 77 HA ARG 77 -8.072 1.306 -13.905 1355 HB2 ARG 77 HB2 ARG 77 -9.226 3.214 -14.763 1356 HB3 ARG 77 HB3 ARG 77 -7.969 2.788 -15.905 1357 HG2 ARG 77 HG2 ARG 77 -9.614 1.734 -17.347 1358 HG3 ARG 77 HG3 ARG 77 -10.886 2.103 -16.191 1359 HD2 ARG 77 HD2 ARG 77 -10.581 4.469 -16.523 1360 HD3 ARG 77 HD3 ARG 77 -9.178 4.185 -17.554 1361 HE ARG 77 HE ARG 77 -11.109 2.866 -18.858 1362 HH11 ARG 77 HH11 ARG 77 -11.096 6.050 -17.511 1363 HH12 ARG 77 HH12 ARG 77 -12.059 6.700 -18.791 1364 HH21 ARG 77 HH21 ARG 77 -12.384 3.724 -20.461 1365 HH22 ARG 77 HH22 ARG 77 -12.814 5.400 -20.405 1366 H LEU 78 H LEU 78 -9.846 1.728 -12.634 1367 HA LEU 78 HA LEU 78 -12.106 -0.097 -12.935 1368 HB2 LEU 78 HB2 LEU 78 -11.178 1.643 -10.641 1369 HB3 LEU 78 HB3 LEU 78 -12.610 0.625 -10.582 1370 HG LEU 78 HG LEU 78 -9.774 -0.373 -10.965 1371 HD11 LEU 78 HD11 LEU 78 -11.541 -0.461 -8.519 1372 HD12 LEU 78 HD12 LEU 78 -10.092 0.526 -8.728 1373 HD13 LEU 78 HD13 LEU 78 -9.963 -1.232 -8.687 1374 HD21 LEU 78 HD21 LEU 78 -11.422 -1.831 -12.022 1375 HD22 LEU 78 HD22 LEU 78 -12.347 -1.895 -10.521 1376 HD23 LEU 78 HD23 LEU 78 -10.728 -2.596 -10.591 1377 H SER 79 H SER 79 -13.107 1.057 -14.674 1378 HA SER 79 HA SER 79 -13.628 3.795 -14.750 1379 HB2 SER 79 HB2 SER 79 -13.868 2.307 -16.713 1380 HB3 SER 79 HB3 SER 79 -15.310 1.595 -15.994 1381 HG SER 79 HG SER 79 -15.415 3.494 -17.599 1382 H ASN 80 H ASN 80 -15.709 1.190 -13.531 1383 HA ASN 80 HA ASN 80 -17.505 3.164 -12.316 1384 HB2 ASN 80 HB2 ASN 80 -18.854 1.053 -11.741 1385 HB3 ASN 80 HB3 ASN 80 -18.736 1.503 -13.438 1386 HD21 ASN 80 HD21 ASN 80 -17.873 -0.831 -11.048 1387 HD22 ASN 80 HD22 ASN 80 -17.209 -1.996 -12.137 1388 H LEU 81 H LEU 81 -16.849 3.892 -10.392 1389 HA LEU 81 HA LEU 81 -14.934 2.428 -8.838 1390 HB2 LEU 81 HB2 LEU 81 -16.283 5.071 -8.318 1391 HB3 LEU 81 HB3 LEU 81 -15.013 4.393 -7.317 1392 HG LEU 81 HG LEU 81 -14.804 5.393 -10.152 1393 HD11 LEU 81 HD11 LEU 81 -13.049 6.813 -9.185 1394 HD12 LEU 81 HD12 LEU 81 -13.367 6.119 -7.594 1395 HD13 LEU 81 HD13 LEU 81 -14.610 7.075 -8.409 1396 HD21 LEU 81 HD21 LEU 81 -12.795 3.756 -8.604 1397 HD22 LEU 81 HD22 LEU 81 -12.454 4.631 -10.098 1398 HD23 LEU 81 HD23 LEU 81 -13.613 3.302 -10.102 1399 H GLU 82 H GLU 82 -15.042 1.839 -6.711 1400 HA GLU 82 HA GLU 82 -17.651 0.971 -5.715 1401 HB2 GLU 82 HB2 GLU 82 -16.230 -0.249 -4.028 1402 HB3 GLU 82 HB3 GLU 82 -15.922 -0.701 -5.700 1403 HG2 GLU 82 HG2 GLU 82 -13.919 0.604 -5.764 1404 HG3 GLU 82 HG3 GLU 82 -14.260 1.303 -4.183 1405 H HIS 83 H HIS 83 -17.013 3.802 -5.667 1406 HA HIS 83 HA HIS 83 -16.594 4.312 -2.794 1407 HB2 HIS 83 HB2 HIS 83 -16.090 6.062 -5.209 1408 HB3 HIS 83 HB3 HIS 83 -16.002 6.658 -3.555 1409 HD1 HIS 83 HD1 HIS 83 -13.691 6.652 -2.659 1410 HD2 HIS 83 HD2 HIS 83 -14.278 3.625 -5.445 1411 HE1 HIS 83 HE1 HIS 83 -11.486 5.470 -2.849 1412 HE2 HIS 83 HE2 HIS 83 -11.965 3.478 -4.306 1413 H HIS 84 H HIS 84 -18.938 3.561 -2.798 1414 HA HIS 84 HA HIS 84 -20.586 5.949 -2.533 1415 HB2 HIS 84 HB2 HIS 84 -21.003 5.074 -4.858 1416 HB3 HIS 84 HB3 HIS 84 -21.577 3.573 -4.142 1417 HD1 HIS 84 HD1 HIS 84 -23.867 3.689 -2.832 1418 HD2 HIS 84 HD2 HIS 84 -22.812 7.186 -4.820 1419 HE1 HIS 84 HE1 HIS 84 -25.951 5.081 -2.901 1420 HE2 HIS 84 HE2 HIS 84 -25.323 7.135 -4.202 1421 H HIS 85 H HIS 85 -19.489 4.545 -0.481 1422 HA HIS 85 HA HIS 85 -21.313 2.524 0.481 1423 HB2 HIS 85 HB2 HIS 85 -18.854 3.822 1.633 1424 HB3 HIS 85 HB3 HIS 85 -19.870 2.766 2.611 1425 HD1 HIS 85 HD1 HIS 85 -19.910 0.252 2.006 1426 HD2 HIS 85 HD2 HIS 85 -17.289 2.510 -0.299 1427 HE1 HIS 85 HE1 HIS 85 -18.460 -1.412 0.811 1428 HE2 HIS 85 HE2 HIS 85 -16.818 -0.028 -0.496 1429 H HIS 86 H HIS 86 -21.768 5.730 0.272 1430 HA HIS 86 HA HIS 86 -23.275 5.891 2.800 1431 HB2 HIS 86 HB2 HIS 86 -22.499 8.106 0.879 1432 HB3 HIS 86 HB3 HIS 86 -23.407 8.324 2.373 1433 HD1 HIS 86 HD1 HIS 86 -20.285 9.151 1.359 1434 HD2 HIS 86 HD2 HIS 86 -21.557 6.702 4.465 1435 HE1 HIS 86 HE1 HIS 86 -18.377 9.075 2.981 1436 HE2 HIS 86 HE2 HIS 86 -19.088 7.419 4.729 1437 H HIS 87 H HIS 87 -25.284 5.190 2.595 1438 HA HIS 87 HA HIS 87 -26.580 4.737 0.137 1439 HB2 HIS 87 HB2 HIS 87 -28.483 4.013 1.476 1440 HB3 HIS 87 HB3 HIS 87 -26.987 3.415 2.187 1441 HD1 HIS 87 HD1 HIS 87 -29.730 5.923 2.770 1442 HD2 HIS 87 HD2 HIS 87 -26.430 4.353 4.751 1443 HE1 HIS 87 HE1 HIS 87 -29.902 6.753 5.130 1444 HE2 HIS 87 HE2 HIS 87 -27.830 5.905 6.270 1445 H HIS 88 H HIS 88 -28.718 5.475 -0.492 1446 HA HIS 88 HA HIS 88 -29.067 8.338 -0.387 1447 HB2 HIS 88 HB2 HIS 88 -29.533 7.115 -2.450 1448 HB3 HIS 88 HB3 HIS 88 -30.759 6.153 -1.633 1449 HD1 HIS 88 HD1 HIS 88 -33.089 7.001 -1.834 1450 HD2 HIS 88 HD2 HIS 88 -30.288 9.981 -2.561 1451 HE1 HIS 88 HE1 HIS 88 -34.411 8.995 -2.575 1452 HE2 HIS 88 HE2 HIS 88 -32.692 10.742 -3.132 Start of MODEL 9 1 H1 MET 1 H1 MET 1 9.813 -22.060 10.060 2 H2 MET 1 H2 MET 1 11.025 -22.212 11.232 3 H3 MET 1 H3 MET 1 11.383 -21.520 9.734 4 HA MET 1 HA MET 1 11.191 -19.837 11.459 5 HB2 MET 1 HB2 MET 1 8.982 -19.793 9.387 6 HB3 MET 1 HB3 MET 1 9.530 -18.391 10.294 7 HG2 MET 1 HG2 MET 1 11.226 -20.006 8.400 8 HG3 MET 1 HG3 MET 1 10.442 -18.473 8.020 9 HE1 MET 1 HE1 MET 1 14.185 -17.404 8.199 10 HE2 MET 1 HE2 MET 1 12.702 -17.383 7.246 11 HE3 MET 1 HE3 MET 1 13.533 -18.908 7.548 12 H THR 2 H THR 2 9.930 -18.754 13.041 13 HA THR 2 HA THR 2 7.589 -20.197 14.079 14 HB THR 2 HB THR 2 8.841 -17.685 15.243 15 HG1 THR 2 HG1 THR 2 10.187 -18.993 16.450 16 HG21 THR 2 HG21 THR 2 7.235 -19.912 16.521 17 HG22 THR 2 HG22 THR 2 6.629 -18.301 16.131 18 HG23 THR 2 HG23 THR 2 7.887 -18.498 17.350 19 H ASP 3 H ASP 3 7.294 -18.994 11.558 20 HA ASP 3 HA ASP 3 6.614 -16.265 11.578 21 HB2 ASP 3 HB2 ASP 3 5.804 -16.704 9.263 22 HB3 ASP 3 HB3 ASP 3 7.428 -17.312 9.576 23 H PHE 4 H PHE 4 4.753 -15.179 11.723 24 HA PHE 4 HA PHE 4 2.188 -16.543 11.474 25 HB2 PHE 4 HB2 PHE 4 1.277 -15.510 13.500 26 HB3 PHE 4 HB3 PHE 4 2.636 -16.549 13.899 27 HD1 PHE 4 HD1 PHE 4 1.460 -13.078 13.686 28 HD2 PHE 4 HD2 PHE 4 4.679 -15.632 14.816 29 HE1 PHE 4 HE1 PHE 4 2.508 -11.215 14.905 30 HE2 PHE 4 HE2 PHE 4 5.726 -13.771 16.040 31 HZ PHE 4 HZ PHE 4 4.642 -11.554 16.077 32 H LEU 5 H LEU 5 0.440 -15.073 10.984 33 HA LEU 5 HA LEU 5 1.344 -12.830 9.415 34 HB2 LEU 5 HB2 LEU 5 -0.444 -14.269 8.599 35 HB3 LEU 5 HB3 LEU 5 -1.437 -13.855 9.982 36 HG LEU 5 HG LEU 5 -1.620 -11.544 9.202 37 HD11 LEU 5 HD11 LEU 5 0.093 -12.436 6.879 38 HD12 LEU 5 HD12 LEU 5 0.554 -11.294 8.142 39 HD13 LEU 5 HD13 LEU 5 -0.732 -10.883 7.007 40 HD21 LEU 5 HD21 LEU 5 -2.235 -13.537 7.021 41 HD22 LEU 5 HD22 LEU 5 -2.958 -11.938 7.199 42 HD23 LEU 5 HD23 LEU 5 -3.258 -13.181 8.414 43 H ALA 6 H ALA 6 1.975 -11.101 10.514 44 HA ALA 6 HA ALA 6 0.505 -10.181 12.865 45 HB1 ALA 6 HB1 ALA 6 2.944 -10.339 12.991 46 HB2 ALA 6 HB2 ALA 6 2.398 -8.675 13.196 47 HB3 ALA 6 HB3 ALA 6 3.092 -9.194 11.659 48 H GLY 7 H GLY 7 -0.237 -8.003 13.068 49 HA2 GLY 7 HA2 GLY 7 -0.597 -6.546 10.519 50 HA3 GLY 7 HA3 GLY 7 -1.950 -6.816 11.605 51 H ILE 8 H ILE 8 -0.656 -4.320 10.624 52 HA ILE 8 HA ILE 8 -0.206 -3.066 13.260 53 HB ILE 8 HB ILE 8 1.160 -2.263 10.671 54 HG12 ILE 8 HG12 ILE 8 2.281 -3.629 13.140 55 HG13 ILE 8 HG13 ILE 8 2.078 -4.362 11.553 56 HG21 ILE 8 HG21 ILE 8 1.508 -1.196 13.480 57 HG22 ILE 8 HG22 ILE 8 0.710 -0.360 12.148 58 HG23 ILE 8 HG23 ILE 8 2.439 -0.703 12.065 59 HD11 ILE 8 HD11 ILE 8 3.927 -2.080 12.223 60 HD12 ILE 8 HD12 ILE 8 3.726 -2.812 10.631 61 HD13 ILE 8 HD13 ILE 8 4.390 -3.761 11.959 62 H ARG 9 H ARG 9 -1.308 -1.195 13.647 63 HA ARG 9 HA ARG 9 -3.245 -0.341 11.588 64 HB2 ARG 9 HB2 ARG 9 -4.269 -1.352 13.558 65 HB3 ARG 9 HB3 ARG 9 -3.406 -0.242 14.609 66 HG2 ARG 9 HG2 ARG 9 -5.717 0.413 14.378 67 HG3 ARG 9 HG3 ARG 9 -4.665 1.636 13.678 68 HD2 ARG 9 HD2 ARG 9 -5.222 0.942 11.461 69 HD3 ARG 9 HD3 ARG 9 -6.040 -0.506 12.056 70 HE ARG 9 HE ARG 9 -7.202 1.885 13.089 71 HH11 ARG 9 HH11 ARG 9 -7.107 -0.106 10.287 72 HH12 ARG 9 HH12 ARG 9 -8.702 0.331 9.792 73 HH21 ARG 9 HH21 ARG 9 -9.243 2.425 12.459 74 HH22 ARG 9 HH22 ARG 9 -9.907 1.736 11.020 75 H ILE 10 H ILE 10 -2.917 1.624 10.736 76 HA ILE 10 HA ILE 10 -1.476 3.669 12.326 77 HB ILE 10 HB ILE 10 -1.353 3.260 9.326 78 HG12 ILE 10 HG12 ILE 10 0.787 2.751 11.415 79 HG13 ILE 10 HG13 ILE 10 -0.139 1.501 10.588 80 HG21 ILE 10 HG21 ILE 10 0.398 4.978 9.365 81 HG22 ILE 10 HG22 ILE 10 0.148 5.197 11.096 82 HG23 ILE 10 HG23 ILE 10 -1.138 5.607 9.960 83 HD11 ILE 10 HD11 ILE 10 1.759 3.449 9.296 84 HD12 ILE 10 HD12 ILE 10 0.815 2.221 8.452 85 HD13 ILE 10 HD13 ILE 10 2.056 1.741 9.606 86 H VAL 11 H VAL 11 -2.577 5.553 12.623 87 HA VAL 11 HA VAL 11 -4.324 6.475 10.431 88 HB VAL 11 HB VAL 11 -4.995 6.498 13.372 89 HG11 VAL 11 HG11 VAL 11 -5.323 8.787 12.597 90 HG12 VAL 11 HG12 VAL 11 -6.878 8.000 12.867 91 HG13 VAL 11 HG13 VAL 11 -6.266 8.204 11.225 92 HG21 VAL 11 HG21 VAL 11 -7.111 5.555 12.588 93 HG22 VAL 11 HG22 VAL 11 -5.744 4.584 12.037 94 HG23 VAL 11 HG23 VAL 11 -6.557 5.682 10.915 95 H GLY 12 H GLY 12 -3.623 8.281 9.612 96 HA2 GLY 12 HA2 GLY 12 -2.359 10.307 11.337 97 HA3 GLY 12 HA3 GLY 12 -1.496 9.738 9.914 98 H GLU 13 H GLU 13 -2.154 12.426 10.277 99 HA GLU 13 HA GLU 13 -4.608 13.158 9.072 100 HB2 GLU 13 HB2 GLU 13 -3.563 15.421 8.876 101 HB3 GLU 13 HB3 GLU 13 -3.494 14.720 10.489 102 HG2 GLU 13 HG2 GLU 13 -1.145 14.023 10.024 103 HG3 GLU 13 HG3 GLU 13 -1.239 14.893 8.492 104 H ASP 14 H ASP 14 -5.232 13.351 7.019 105 HA ASP 14 HA ASP 14 -3.610 12.255 4.943 106 HB2 ASP 14 HB2 ASP 14 -5.963 11.826 4.890 107 HB3 ASP 14 HB3 ASP 14 -6.344 13.546 4.945 108 H LYS 15 H LYS 15 -1.942 13.385 4.142 109 HA LYS 15 HA LYS 15 -2.466 16.098 3.147 110 HB2 LYS 15 HB2 LYS 15 -0.205 15.245 4.919 111 HB3 LYS 15 HB3 LYS 15 0.010 16.582 3.794 112 HG2 LYS 15 HG2 LYS 15 -1.812 17.790 4.800 113 HG3 LYS 15 HG3 LYS 15 -2.172 16.431 5.867 114 HD2 LYS 15 HD2 LYS 15 -0.959 18.083 7.120 115 HD3 LYS 15 HD3 LYS 15 0.095 16.692 6.870 116 HE2 LYS 15 HE2 LYS 15 1.246 17.850 5.075 117 HE3 LYS 15 HE3 LYS 15 0.140 19.220 5.216 118 HZ1 LYS 15 HZ1 LYS 15 2.243 19.634 6.339 119 HZ2 LYS 15 HZ2 LYS 15 2.005 18.291 7.333 120 HZ3 LYS 15 HZ3 LYS 15 0.966 19.619 7.447 121 H ASN 16 H ASN 16 -0.800 16.893 1.690 122 HA ASN 16 HA ASN 16 -0.882 15.625 -0.681 123 HB2 ASN 16 HB2 ASN 16 0.962 17.145 -1.382 124 HB3 ASN 16 HB3 ASN 16 -0.302 17.946 -0.447 125 HD21 ASN 16 HD21 ASN 16 0.157 18.725 1.588 126 HD22 ASN 16 HD22 ASN 16 1.769 18.838 2.201 127 H GLY 17 H GLY 17 1.646 15.083 1.735 128 HA2 GLY 17 HA2 GLY 17 2.935 13.183 -0.148 129 HA3 GLY 17 HA3 GLY 17 3.818 14.113 1.048 130 H MET 18 H MET 18 1.089 13.213 2.641 131 HA MET 18 HA MET 18 2.588 11.374 4.251 132 HB2 MET 18 HB2 MET 18 -0.203 12.488 4.351 133 HB3 MET 18 HB3 MET 18 0.240 11.152 5.404 134 HG2 MET 18 HG2 MET 18 1.730 13.763 5.295 135 HG3 MET 18 HG3 MET 18 0.438 13.404 6.441 136 HE1 MET 18 HE1 MET 18 1.987 10.338 8.378 137 HE2 MET 18 HE2 MET 18 1.024 10.251 6.903 138 HE3 MET 18 HE3 MET 18 0.569 11.368 8.190 139 H THR 19 H THR 19 -0.390 10.918 2.302 140 HA THR 19 HA THR 19 -0.664 8.168 2.810 141 HB THR 19 HB THR 19 -2.054 8.115 0.735 142 HG1 THR 19 HG1 THR 19 -2.330 10.124 -0.377 143 HG21 THR 19 HG21 THR 19 -3.062 8.804 2.855 144 HG22 THR 19 HG22 THR 19 -3.759 9.714 1.513 145 HG23 THR 19 HG23 THR 19 -2.562 10.471 2.564 146 H ASN 20 H ASN 20 1.276 9.898 0.452 147 HA ASN 20 HA ASN 20 1.996 7.576 -1.069 148 HB2 ASN 20 HB2 ASN 20 3.243 10.336 -0.939 149 HB3 ASN 20 HB3 ASN 20 3.683 9.092 -2.106 150 HD21 ASN 20 HD21 ASN 20 2.355 8.698 -3.827 151 HD22 ASN 20 HD22 ASN 20 1.003 9.692 -4.225 152 H GLN 21 H GLN 21 3.587 9.513 1.460 153 HA GLN 21 HA GLN 21 6.013 8.042 1.375 154 HB2 GLN 21 HB2 GLN 21 6.738 9.345 3.199 155 HB3 GLN 21 HB3 GLN 21 5.740 10.402 2.228 156 HG2 GLN 21 HG2 GLN 21 3.888 10.085 3.803 157 HG3 GLN 21 HG3 GLN 21 4.908 9.028 4.780 158 HE21 GLN 21 HE21 GLN 21 4.314 12.296 3.778 159 HE22 GLN 21 HE22 GLN 21 5.301 13.050 4.973 160 H ILE 22 H ILE 22 3.081 7.720 3.283 161 HA ILE 22 HA ILE 22 4.049 6.074 5.336 162 HB ILE 22 HB ILE 22 1.327 6.499 4.140 163 HG12 ILE 22 HG12 ILE 22 2.313 8.239 5.585 164 HG13 ILE 22 HG13 ILE 22 0.874 7.527 6.303 165 HG21 ILE 22 HG21 ILE 22 1.945 4.583 6.393 166 HG22 ILE 22 HG22 ILE 22 1.290 4.170 4.807 167 HG23 ILE 22 HG23 ILE 22 0.333 5.132 5.932 168 HD11 ILE 22 HD11 ILE 22 2.259 6.156 7.756 169 HD12 ILE 22 HD12 ILE 22 2.619 7.871 7.955 170 HD13 ILE 22 HD13 ILE 22 3.711 6.844 7.027 171 H THR 23 H THR 23 2.335 5.089 2.347 172 HA THR 23 HA THR 23 2.774 2.310 2.890 173 HB THR 23 HB THR 23 2.060 3.366 0.150 174 HG1 THR 23 HG1 THR 23 0.466 3.301 2.502 175 HG21 THR 23 HG21 THR 23 2.399 0.953 0.397 176 HG22 THR 23 HG22 THR 23 0.701 1.315 0.089 177 HG23 THR 23 HG23 THR 23 1.237 0.914 1.722 178 H GLY 24 H GLY 24 4.473 4.796 1.108 179 HA2 GLY 24 HA2 GLY 24 6.256 3.213 -0.379 180 HA3 GLY 24 HA3 GLY 24 6.586 4.834 0.213 181 H VAL 25 H VAL 25 6.717 4.625 2.881 182 HA VAL 25 HA VAL 25 9.208 3.464 3.426 183 HB VAL 25 HB VAL 25 7.021 4.244 5.375 184 HG11 VAL 25 HG11 VAL 25 9.946 3.675 5.898 185 HG12 VAL 25 HG12 VAL 25 8.575 2.713 6.454 186 HG13 VAL 25 HG13 VAL 25 8.810 4.349 7.068 187 HG21 VAL 25 HG21 VAL 25 9.463 5.753 4.420 188 HG22 VAL 25 HG22 VAL 25 8.323 6.312 5.646 189 HG23 VAL 25 HG23 VAL 25 7.790 6.098 3.979 190 H ILE 26 H ILE 26 5.938 2.222 4.037 191 HA ILE 26 HA ILE 26 6.552 -0.126 5.398 192 HB ILE 26 HB ILE 26 4.346 0.440 3.408 193 HG12 ILE 26 HG12 ILE 26 4.367 0.333 6.441 194 HG13 ILE 26 HG13 ILE 26 4.336 1.801 5.470 195 HG21 ILE 26 HG21 ILE 26 4.615 -1.933 5.259 196 HG22 ILE 26 HG22 ILE 26 4.712 -1.968 3.499 197 HG23 ILE 26 HG23 ILE 26 3.195 -1.539 4.288 198 HD11 ILE 26 HD11 ILE 26 2.141 1.281 6.351 199 HD12 ILE 26 HD12 ILE 26 2.180 -0.300 5.571 200 HD13 ILE 26 HD13 ILE 26 2.146 1.168 4.592 201 H SER 27 H SER 27 6.505 0.464 1.904 202 HA SER 27 HA SER 27 6.959 -2.156 0.999 203 HB2 SER 27 HB2 SER 27 8.015 0.351 -0.336 204 HB3 SER 27 HB3 SER 27 7.572 -1.172 -1.107 205 HG SER 27 HG SER 27 5.939 0.857 -0.072 206 H LYS 28 H LYS 28 9.075 0.024 2.580 207 HA LYS 28 HA LYS 28 11.516 -0.987 1.378 208 HB2 LYS 28 HB2 LYS 28 11.258 0.942 3.691 209 HB3 LYS 28 HB3 LYS 28 12.630 0.738 2.606 210 HG2 LYS 28 HG2 LYS 28 11.309 1.611 0.746 211 HG3 LYS 28 HG3 LYS 28 9.913 1.772 1.807 212 HD2 LYS 28 HD2 LYS 28 10.978 3.922 1.515 213 HD3 LYS 28 HD3 LYS 28 11.150 3.387 3.186 214 HE2 LYS 28 HE2 LYS 28 13.444 2.674 2.734 215 HE3 LYS 28 HE3 LYS 28 13.272 3.157 1.045 216 HZ1 LYS 28 HZ1 LYS 28 14.419 4.840 2.332 217 HZ2 LYS 28 HZ2 LYS 28 13.108 4.972 3.388 218 HZ3 LYS 28 HZ3 LYS 28 12.939 5.435 1.770 219 H PHE 29 H PHE 29 9.548 -2.109 3.828 220 HA PHE 29 HA PHE 29 11.443 -2.751 5.846 221 HB2 PHE 29 HB2 PHE 29 8.735 -3.940 5.224 222 HB3 PHE 29 HB3 PHE 29 9.690 -4.390 6.629 223 HD1 PHE 29 HD2 PHE 29 10.712 -1.374 6.901 224 HD2 PHE 29 HD1 PHE 29 6.900 -3.266 6.687 225 HE1 PHE 29 HE2 PHE 29 9.717 0.483 8.169 226 HE2 PHE 29 HE1 PHE 29 5.907 -1.411 7.957 227 HZ PHE 29 HZ PHE 29 7.316 0.466 8.700 228 H ASP 30 H ASP 30 11.786 -5.071 6.558 229 HA ASP 30 HA ASP 30 13.194 -6.513 4.515 230 HB2 ASP 30 HB2 ASP 30 12.563 -7.722 7.193 231 HB3 ASP 30 HB3 ASP 30 14.047 -7.813 6.251 232 H THR 31 H THR 31 10.095 -6.792 6.090 233 HA THR 31 HA THR 31 9.618 -9.523 5.255 234 HB THR 31 HB THR 31 8.759 -8.860 7.415 235 HG1 THR 31 HG1 THR 31 7.029 -10.040 7.094 236 HG21 THR 31 HG21 THR 31 6.987 -7.178 7.661 237 HG22 THR 31 HG22 THR 31 7.084 -6.817 5.938 238 HG23 THR 31 HG23 THR 31 8.455 -6.463 6.992 239 H ASN 32 H ASN 32 7.631 -10.135 4.112 240 HA ASN 32 HA ASN 32 7.258 -8.434 1.758 241 HB2 ASN 32 HB2 ASN 32 7.944 -10.689 1.266 242 HB3 ASN 32 HB3 ASN 32 6.657 -11.355 2.267 243 HD21 ASN 32 HD21 ASN 32 7.290 -9.513 -0.664 244 HD22 ASN 32 HD22 ASN 32 5.835 -9.981 -1.472 245 H ILE 33 H ILE 33 5.395 -7.441 1.283 246 HA ILE 33 HA ILE 33 3.380 -7.184 3.265 247 HB ILE 33 HB ILE 33 3.328 -6.274 0.379 248 HG12 ILE 33 HG12 ILE 33 4.124 -4.796 2.908 249 HG13 ILE 33 HG13 ILE 33 5.225 -5.339 1.645 250 HG21 ILE 33 HG21 ILE 33 1.603 -4.683 1.115 251 HG22 ILE 33 HG22 ILE 33 1.622 -5.412 2.722 252 HG23 ILE 33 HG23 ILE 33 1.085 -6.355 1.332 253 HD11 ILE 33 HD11 ILE 33 4.147 -3.818 0.064 254 HD12 ILE 33 HD12 ILE 33 4.788 -2.964 1.468 255 HD13 ILE 33 HD13 ILE 33 3.056 -3.271 1.339 256 H ARG 34 H ARG 34 1.943 -8.753 3.713 257 HA ARG 34 HA ARG 34 1.010 -10.563 1.647 258 HB2 ARG 34 HB2 ARG 34 1.507 -11.222 4.075 259 HB3 ARG 34 HB3 ARG 34 0.000 -10.423 4.494 260 HG2 ARG 34 HG2 ARG 34 -0.554 -12.691 4.308 261 HG3 ARG 34 HG3 ARG 34 -1.117 -11.972 2.799 262 HD2 ARG 34 HD2 ARG 34 1.489 -13.469 3.167 263 HD3 ARG 34 HD3 ARG 34 0.023 -14.140 2.457 264 HE ARG 34 HE ARG 34 0.304 -12.604 0.608 265 HH11 ARG 34 HH11 ARG 34 3.033 -13.065 2.664 266 HH12 ARG 34 HH12 ARG 34 4.141 -12.415 1.509 267 HH21 ARG 34 HH21 ARG 34 1.767 -11.837 -0.888 268 HH22 ARG 34 HH22 ARG 34 3.438 -11.734 -0.458 269 H THR 35 H THR 35 -0.239 -7.896 3.556 270 HA THR 35 HA THR 35 -2.257 -7.328 1.564 271 HB THR 35 HB THR 35 -3.136 -8.013 4.390 272 HG1 THR 35 HG1 THR 35 -3.159 -9.404 1.980 273 HG21 THR 35 HG21 THR 35 -5.413 -7.540 3.603 274 HG22 THR 35 HG22 THR 35 -4.772 -7.035 2.038 275 HG23 THR 35 HG23 THR 35 -4.393 -6.106 3.489 276 H ILE 36 H ILE 36 -2.532 -5.142 1.433 277 HA ILE 36 HA ILE 36 -1.979 -3.511 3.827 278 HB ILE 36 HB ILE 36 0.026 -3.441 2.336 279 HG12 ILE 36 HG12 ILE 36 0.174 -0.928 2.213 280 HG13 ILE 36 HG13 ILE 36 -1.530 -0.854 2.648 281 HG21 ILE 36 HG21 ILE 36 -1.856 -2.129 0.374 282 HG22 ILE 36 HG22 ILE 36 -1.062 -3.692 0.179 283 HG23 ILE 36 HG23 ILE 36 -0.101 -2.213 0.209 284 HD11 ILE 36 HD11 ILE 36 -1.023 -1.944 4.775 285 HD12 ILE 36 HD12 ILE 36 -0.121 -0.444 4.566 286 HD13 ILE 36 HD13 ILE 36 0.683 -1.996 4.334 287 H VAL 37 H VAL 37 -3.364 -1.844 4.157 288 HA VAL 37 HA VAL 37 -5.161 -1.010 1.969 289 HB VAL 37 HB VAL 37 -6.065 -1.577 4.811 290 HG11 VAL 37 HG11 VAL 37 -7.259 0.323 3.879 291 HG12 VAL 37 HG12 VAL 37 -8.332 -1.074 3.956 292 HG13 VAL 37 HG13 VAL 37 -7.624 -0.591 2.415 293 HG21 VAL 37 HG21 VAL 37 -7.435 -3.361 3.817 294 HG22 VAL 37 HG22 VAL 37 -5.715 -3.646 3.557 295 HG23 VAL 37 HG23 VAL 37 -6.717 -3.034 2.239 296 H LEU 38 H LEU 38 -5.401 1.173 1.822 297 HA LEU 38 HA LEU 38 -5.093 2.832 4.213 298 HB2 LEU 38 HB2 LEU 38 -2.870 2.797 3.098 299 HB3 LEU 38 HB3 LEU 38 -3.608 3.405 1.632 300 HG LEU 38 HG LEU 38 -3.711 4.987 4.206 301 HD11 LEU 38 HD11 LEU 38 -1.727 6.231 3.405 302 HD12 LEU 38 HD12 LEU 38 -1.524 5.039 2.120 303 HD13 LEU 38 HD13 LEU 38 -1.360 4.551 3.808 304 HD21 LEU 38 HD21 LEU 38 -5.217 5.726 2.430 305 HD22 LEU 38 HD22 LEU 38 -3.868 5.801 1.296 306 HD23 LEU 38 HD23 LEU 38 -3.926 6.900 2.675 307 H ASN 39 H ASN 39 -6.842 4.124 4.344 308 HA ASN 39 HA ASN 39 -7.888 5.316 1.865 309 HB2 ASN 39 HB2 ASN 39 -10.202 4.875 2.470 310 HB3 ASN 39 HB3 ASN 39 -9.315 3.359 2.370 311 HD21 ASN 39 HD21 ASN 39 -8.813 2.261 4.305 312 HD22 ASN 39 HD22 ASN 39 -9.689 2.569 5.758 313 H ALA 40 H ALA 40 -8.579 7.397 2.038 314 HA ALA 40 HA ALA 40 -8.193 8.721 4.653 315 HB1 ALA 40 HB1 ALA 40 -7.892 10.780 3.359 316 HB2 ALA 40 HB2 ALA 40 -8.212 9.899 1.864 317 HB3 ALA 40 HB3 ALA 40 -6.778 9.523 2.820 318 H LYS 41 H LYS 41 -9.892 9.342 5.723 319 HA LYS 41 HA LYS 41 -12.353 10.182 4.347 320 HB2 LYS 41 HB2 LYS 41 -13.700 8.926 5.952 321 HB3 LYS 41 HB3 LYS 41 -12.606 7.837 5.104 322 HG2 LYS 41 HG2 LYS 41 -11.065 7.926 7.027 323 HG3 LYS 41 HG3 LYS 41 -12.227 8.942 7.883 324 HD2 LYS 41 HD2 LYS 41 -13.880 7.136 7.793 325 HD3 LYS 41 HD3 LYS 41 -12.736 6.129 6.897 326 HE2 LYS 41 HE2 LYS 41 -11.227 6.080 8.781 327 HE3 LYS 41 HE3 LYS 41 -12.236 7.223 9.670 328 HZ1 LYS 41 HZ1 LYS 41 -13.053 4.489 8.850 329 HZ2 LYS 41 HZ2 LYS 41 -13.986 5.577 9.745 330 HZ3 LYS 41 HZ3 LYS 41 -12.567 4.943 10.402 331 H ASP 42 H ASP 42 -13.409 11.903 5.329 332 HA ASP 42 HA ASP 42 -13.843 13.640 6.715 333 HB2 ASP 42 HB2 ASP 42 -12.682 11.837 8.848 334 HB3 ASP 42 HB3 ASP 42 -13.656 13.275 9.141 335 H GLY 43 H GLY 43 -10.887 13.081 5.699 336 HA2 GLY 43 HA2 GLY 43 -9.320 14.915 5.516 337 HA3 GLY 43 HA3 GLY 43 -9.722 15.372 7.162 338 H ILE 44 H ILE 44 -9.537 12.194 7.489 339 HA ILE 44 HA ILE 44 -6.604 12.156 7.951 340 HB ILE 44 HB ILE 44 -8.580 10.503 9.529 341 HG12 ILE 44 HG12 ILE 44 -7.621 13.296 10.203 342 HG13 ILE 44 HG13 ILE 44 -9.269 12.826 9.792 343 HG21 ILE 44 HG21 ILE 44 -6.792 10.480 11.212 344 HG22 ILE 44 HG22 ILE 44 -5.791 11.486 10.165 345 HG23 ILE 44 HG23 ILE 44 -6.226 9.851 9.663 346 HD11 ILE 44 HD11 ILE 44 -9.378 11.457 11.807 347 HD12 ILE 44 HD12 ILE 44 -8.995 13.134 12.190 348 HD13 ILE 44 HD13 ILE 44 -7.723 11.912 12.209 349 H PHE 45 H PHE 45 -5.616 9.971 7.785 350 HA PHE 45 HA PHE 45 -7.216 8.148 6.095 351 HB2 PHE 45 HB2 PHE 45 -5.287 7.510 4.846 352 HB3 PHE 45 HB3 PHE 45 -5.274 9.268 4.901 353 HD1 PHE 45 HD1 PHE 45 -3.721 6.211 6.269 354 HD2 PHE 45 HD2 PHE 45 -3.483 10.450 5.933 355 HE1 PHE 45 HE1 PHE 45 -1.450 6.151 7.200 356 HE2 PHE 45 HE2 PHE 45 -1.208 10.392 6.865 357 HZ PHE 45 HZ PHE 45 -0.198 8.236 7.507 358 H THR 46 H THR 46 -7.022 5.929 6.452 359 HA THR 46 HA THR 46 -5.491 5.120 8.845 360 HB THR 46 HB THR 46 -7.782 4.999 9.504 361 HG1 THR 46 HG1 THR 46 -6.666 3.206 10.208 362 HG21 THR 46 HG21 THR 46 -8.306 3.386 7.000 363 HG22 THR 46 HG22 THR 46 -8.845 5.039 7.299 364 HG23 THR 46 HG23 THR 46 -9.477 3.715 8.278 365 H CYS 47 H CYS 47 -3.913 3.765 8.380 366 HA CYS 47 HA CYS 47 -4.143 2.032 6.004 367 HB2 CYS 47 HB2 CYS 47 -2.306 3.679 5.922 368 HB3 CYS 47 HB3 CYS 47 -1.635 2.999 7.401 369 HG CYS 47 HG CYS 47 -2.078 0.986 4.698 370 H ASN 48 H ASN 48 -4.203 -0.110 6.265 371 HA ASN 48 HA ASN 48 -3.406 -1.289 8.862 372 HB2 ASN 48 HB2 ASN 48 -5.258 -2.360 6.709 373 HB3 ASN 48 HB3 ASN 48 -4.773 -3.261 8.141 374 HD21 ASN 48 HD21 ASN 48 -7.414 -2.546 7.347 375 HD22 ASN 48 HD22 ASN 48 -8.075 -1.554 8.598 376 H LEU 49 H LEU 49 -1.409 -2.181 8.794 377 HA LEU 49 HA LEU 49 -0.387 -3.268 6.261 378 HB2 LEU 49 HB2 LEU 49 1.081 -1.684 7.310 379 HB3 LEU 49 HB3 LEU 49 0.990 -2.535 8.841 380 HG LEU 49 HG LEU 49 2.234 -4.424 7.909 381 HD11 LEU 49 HD11 LEU 49 1.481 -4.376 5.621 382 HD12 LEU 49 HD12 LEU 49 3.239 -4.250 5.653 383 HD13 LEU 49 HD13 LEU 49 2.257 -2.816 5.356 384 HD21 LEU 49 HD21 LEU 49 3.582 -1.772 7.379 385 HD22 LEU 49 HD22 LEU 49 4.400 -3.320 7.597 386 HD23 LEU 49 HD23 LEU 49 3.497 -2.605 8.931 387 H MET 50 H MET 50 -0.512 -5.393 5.905 388 HA MET 50 HA MET 50 -0.466 -7.238 8.215 389 HB2 MET 50 HB2 MET 50 -1.699 -7.740 5.497 390 HB3 MET 50 HB3 MET 50 -1.782 -8.798 6.899 391 HG2 MET 50 HG2 MET 50 -3.059 -6.088 6.587 392 HG3 MET 50 HG3 MET 50 -3.868 -7.651 6.650 393 HE1 MET 50 HE1 MET 50 -3.607 -9.275 8.839 394 HE2 MET 50 HE2 MET 50 -2.960 -8.708 10.376 395 HE3 MET 50 HE3 MET 50 -1.883 -8.929 8.998 396 H ILE 51 H ILE 51 1.439 -8.212 8.401 397 HA ILE 51 HA ILE 51 2.780 -9.299 6.031 398 HB ILE 51 HB ILE 51 5.011 -8.438 6.992 399 HG12 ILE 51 HG12 ILE 51 4.585 -6.069 8.050 400 HG13 ILE 51 HG13 ILE 51 3.038 -6.755 8.529 401 HG21 ILE 51 HG21 ILE 51 3.078 -6.506 5.712 402 HG22 ILE 51 HG22 ILE 51 4.114 -7.668 4.881 403 HG23 ILE 51 HG23 ILE 51 4.832 -6.319 5.760 404 HD11 ILE 51 HD11 ILE 51 4.647 -6.905 10.320 405 HD12 ILE 51 HD12 ILE 51 5.765 -7.789 9.281 406 HD13 ILE 51 HD13 ILE 51 4.226 -8.520 9.747 407 H PHE 52 H PHE 52 4.503 -10.851 6.561 408 HA PHE 52 HA PHE 52 3.773 -12.381 8.954 409 HB2 PHE 52 HB2 PHE 52 5.080 -13.080 6.352 410 HB3 PHE 52 HB3 PHE 52 5.419 -14.087 7.755 411 HD1 PHE 52 HD2 PHE 52 3.644 -15.369 8.828 412 HD2 PHE 52 HD1 PHE 52 2.909 -13.108 5.295 413 HE1 PHE 52 HE2 PHE 52 1.554 -16.615 8.473 414 HE2 PHE 52 HE1 PHE 52 0.817 -14.353 4.937 415 HZ PHE 52 HZ PHE 52 0.137 -16.109 6.523 416 H VAL 53 H VAL 53 5.081 -12.683 10.667 417 HA VAL 53 HA VAL 53 7.951 -12.018 10.427 418 HB VAL 53 HB VAL 53 8.036 -10.806 12.448 419 HG11 VAL 53 HG11 VAL 53 6.450 -8.963 12.178 420 HG12 VAL 53 HG12 VAL 53 5.486 -9.956 11.083 421 HG13 VAL 53 HG13 VAL 53 7.122 -9.472 10.626 422 HG21 VAL 53 HG21 VAL 53 5.196 -11.672 12.999 423 HG22 VAL 53 HG22 VAL 53 6.126 -10.541 13.985 424 HG23 VAL 53 HG23 VAL 53 6.648 -12.219 13.838 425 H LYS 54 H LYS 54 9.332 -13.161 11.933 426 HA LYS 54 HA LYS 54 8.266 -15.757 12.696 427 HB2 LYS 54 HB2 LYS 54 11.084 -14.690 13.017 428 HB3 LYS 54 HB3 LYS 54 10.578 -16.356 13.247 429 HG2 LYS 54 HG2 LYS 54 11.509 -16.432 11.145 430 HG3 LYS 54 HG3 LYS 54 9.804 -16.198 10.766 431 HD2 LYS 54 HD2 LYS 54 11.182 -14.740 9.389 432 HD3 LYS 54 HD3 LYS 54 10.208 -13.781 10.506 433 HE2 LYS 54 HE2 LYS 54 12.540 -12.971 10.329 434 HE3 LYS 54 HE3 LYS 54 12.111 -13.466 11.965 435 HZ1 LYS 54 HZ1 LYS 54 14.306 -14.253 11.328 436 HZ2 LYS 54 HZ2 LYS 54 13.651 -15.099 10.022 437 HZ3 LYS 54 HZ3 LYS 54 13.264 -15.555 11.602 438 H ASN 55 H ASN 55 9.352 -12.817 14.271 439 HA ASN 55 HA ASN 55 8.536 -13.926 16.876 440 HB2 ASN 55 HB2 ASN 55 10.988 -12.188 16.449 441 HB3 ASN 55 HB3 ASN 55 10.423 -12.832 17.986 442 HD21 ASN 55 HD21 ASN 55 12.038 -13.543 15.010 443 HD22 ASN 55 HD22 ASN 55 12.592 -15.114 15.454 444 H THR 56 H THR 56 7.573 -12.455 18.304 445 HA THR 56 HA THR 56 6.150 -10.298 17.159 446 HB THR 56 HB THR 56 5.446 -9.728 19.455 447 HG1 THR 56 HG1 THR 56 6.474 -10.493 21.180 448 HG21 THR 56 HG21 THR 56 4.306 -11.564 18.290 449 HG22 THR 56 HG22 THR 56 4.378 -11.856 20.028 450 HG23 THR 56 HG23 THR 56 5.478 -12.711 18.945 451 H ASP 57 H ASP 57 9.252 -10.455 18.694 452 HA ASP 57 HA ASP 57 9.628 -7.768 19.443 453 HB2 ASP 57 HB2 ASP 57 11.775 -9.640 18.413 454 HB3 ASP 57 HB3 ASP 57 11.966 -8.310 19.554 455 H LYS 58 H LYS 58 10.110 -9.477 16.421 456 HA LYS 58 HA LYS 58 11.212 -7.417 14.867 457 HB2 LYS 58 HB2 LYS 58 11.302 -9.609 13.987 458 HB3 LYS 58 HB3 LYS 58 9.583 -9.876 14.243 459 HG2 LYS 58 HG2 LYS 58 10.110 -9.634 11.881 460 HG3 LYS 58 HG3 LYS 58 9.050 -8.342 12.449 461 HD2 LYS 58 HD2 LYS 58 10.986 -6.835 12.619 462 HD3 LYS 58 HD3 LYS 58 12.044 -8.128 12.057 463 HE2 LYS 58 HE2 LYS 58 10.912 -8.169 9.915 464 HE3 LYS 58 HE3 LYS 58 9.747 -6.967 10.478 465 HZ1 LYS 58 HZ1 LYS 58 11.499 -5.975 9.120 466 HZ2 LYS 58 HZ2 LYS 58 12.669 -6.518 10.206 467 HZ3 LYS 58 HZ3 LYS 58 11.534 -5.372 10.699 468 H LEU 59 H LEU 59 7.832 -8.356 15.431 469 HA LEU 59 HA LEU 59 6.628 -6.483 13.708 470 HB2 LEU 59 HB2 LEU 59 5.438 -8.424 14.542 471 HB3 LEU 59 HB3 LEU 59 5.570 -7.839 16.190 472 HG LEU 59 HG LEU 59 4.116 -5.923 15.616 473 HD11 LEU 59 HD11 LEU 59 4.615 -5.710 13.258 474 HD12 LEU 59 HD12 LEU 59 2.881 -5.942 13.487 475 HD13 LEU 59 HD13 LEU 59 3.885 -7.282 12.932 476 HD21 LEU 59 HD21 LEU 59 3.142 -7.932 16.583 477 HD22 LEU 59 HD22 LEU 59 2.950 -8.636 14.977 478 HD23 LEU 59 HD23 LEU 59 2.029 -7.201 15.425 479 H THR 60 H THR 60 7.269 -6.311 17.220 480 HA THR 60 HA THR 60 6.079 -3.794 17.663 481 HB THR 60 HB THR 60 7.426 -3.681 19.734 482 HG1 THR 60 HG1 THR 60 8.758 -5.677 20.096 483 HG21 THR 60 HG21 THR 60 5.365 -5.004 19.724 484 HG22 THR 60 HG22 THR 60 6.575 -5.740 20.775 485 HG23 THR 60 HG23 THR 60 6.265 -6.421 19.178 486 H THR 61 H THR 61 9.259 -4.675 16.492 487 HA THR 61 HA THR 61 10.492 -2.138 16.699 488 HB THR 61 HB THR 61 11.045 -4.395 14.752 489 HG1 THR 61 HG1 THR 61 11.491 -5.054 16.831 490 HG21 THR 61 HG21 THR 61 12.734 -1.970 15.413 491 HG22 THR 61 HG22 THR 61 11.947 -2.298 13.869 492 HG23 THR 61 HG23 THR 61 13.253 -3.341 14.432 493 H LEU 62 H LEU 62 8.640 -3.641 14.044 494 HA LEU 62 HA LEU 62 8.971 -1.612 12.135 495 HB2 LEU 62 HB2 LEU 62 6.597 -3.435 12.553 496 HB3 LEU 62 HB3 LEU 62 6.879 -2.469 11.115 497 HG LEU 62 HG LEU 62 8.607 -4.755 12.089 498 HD11 LEU 62 HD11 LEU 62 6.819 -4.517 9.668 499 HD12 LEU 62 HD12 LEU 62 6.479 -5.468 11.113 500 HD13 LEU 62 HD13 LEU 62 7.840 -5.897 10.079 501 HD21 LEU 62 HD21 LEU 62 9.840 -4.450 9.979 502 HD22 LEU 62 HD22 LEU 62 9.988 -3.050 11.039 503 HD23 LEU 62 HD23 LEU 62 8.901 -2.994 9.649 504 H MET 63 H MET 63 6.688 -1.872 14.809 505 HA MET 63 HA MET 63 4.974 0.253 14.269 506 HB2 MET 63 HB2 MET 63 6.099 -0.551 16.963 507 HB3 MET 63 HB3 MET 63 4.670 0.440 16.708 508 HG2 MET 63 HG2 MET 63 3.494 -1.406 15.727 509 HG3 MET 63 HG3 MET 63 4.947 -2.409 15.788 510 HE1 MET 63 HE1 MET 63 2.676 -4.065 18.502 511 HE2 MET 63 HE2 MET 63 3.562 -4.293 16.994 512 HE3 MET 63 HE3 MET 63 2.102 -3.298 17.021 513 H ASP 64 H ASP 64 8.040 0.321 16.074 514 HA ASP 64 HA ASP 64 8.135 3.055 16.618 515 HB2 ASP 64 HB2 ASP 64 9.593 1.316 17.646 516 HB3 ASP 64 HB3 ASP 64 10.468 1.182 16.126 517 H LYS 65 H LYS 65 9.393 1.226 13.845 518 HA LYS 65 HA LYS 65 10.659 3.307 12.472 519 HB2 LYS 65 HB2 LYS 65 9.264 0.850 11.397 520 HB3 LYS 65 HB3 LYS 65 10.303 1.891 10.435 521 HG2 LYS 65 HG2 LYS 65 12.176 1.367 11.983 522 HG3 LYS 65 HG3 LYS 65 11.112 0.244 12.832 523 HD2 LYS 65 HD2 LYS 65 12.488 -0.990 11.269 524 HD3 LYS 65 HD3 LYS 65 10.815 -1.017 10.713 525 HE2 LYS 65 HE2 LYS 65 12.304 -0.628 8.841 526 HE3 LYS 65 HE3 LYS 65 11.334 0.813 9.138 527 HZ1 LYS 65 HZ1 LYS 65 14.124 0.424 10.066 528 HZ2 LYS 65 HZ2 LYS 65 13.201 1.827 10.249 529 HZ3 LYS 65 HZ3 LYS 65 13.674 1.319 8.708 530 H LEU 66 H LEU 66 7.293 2.164 12.195 531 HA LEU 66 HA LEU 66 6.546 4.109 10.228 532 HB2 LEU 66 HB2 LEU 66 4.899 2.311 12.015 533 HB3 LEU 66 HB3 LEU 66 4.220 3.317 10.746 534 HG LEU 66 HG LEU 66 6.290 1.175 10.227 535 HD11 LEU 66 HD11 LEU 66 4.465 -0.230 9.421 536 HD12 LEU 66 HD12 LEU 66 3.291 0.980 9.938 537 HD13 LEU 66 HD13 LEU 66 4.273 0.138 11.135 538 HD21 LEU 66 HD21 LEU 66 4.442 2.701 8.384 539 HD22 LEU 66 HD22 LEU 66 5.550 1.417 7.902 540 HD23 LEU 66 HD23 LEU 66 6.185 2.932 8.540 541 H ARG 67 H ARG 67 6.617 4.079 13.699 542 HA ARG 67 HA ARG 67 4.744 6.198 14.105 543 HB2 ARG 67 HB2 ARG 67 5.275 4.482 15.805 544 HB3 ARG 67 HB3 ARG 67 6.896 5.143 15.956 545 HG2 ARG 67 HG2 ARG 67 6.083 7.156 16.920 546 HG3 ARG 67 HG3 ARG 67 4.413 6.756 16.506 547 HD2 ARG 67 HD2 ARG 67 6.132 5.180 18.429 548 HD3 ARG 67 HD3 ARG 67 4.958 6.405 18.910 549 HE ARG 67 HE ARG 67 3.366 4.827 17.554 550 HH11 ARG 67 HH11 ARG 67 5.866 3.944 19.752 551 HH12 ARG 67 HH12 ARG 67 5.098 2.457 20.192 552 HH21 ARG 67 HH21 ARG 67 2.389 2.907 18.157 553 HH22 ARG 67 HH22 ARG 67 3.175 1.887 19.310 554 H LYS 68 H LYS 68 7.873 6.228 12.867 555 HA LYS 68 HA LYS 68 8.764 8.737 13.985 556 HB2 LYS 68 HB2 LYS 68 9.810 7.335 11.515 557 HB3 LYS 68 HB3 LYS 68 10.632 8.571 12.455 558 HG2 LYS 68 HG2 LYS 68 10.002 5.754 13.313 559 HG3 LYS 68 HG3 LYS 68 11.588 6.431 12.945 560 HD2 LYS 68 HD2 LYS 68 11.391 7.945 14.866 561 HD3 LYS 68 HD3 LYS 68 9.794 7.280 15.228 562 HE2 LYS 68 HE2 LYS 68 10.887 5.032 15.450 563 HE3 LYS 68 HE3 LYS 68 12.445 5.842 15.318 564 HZ1 LYS 68 HZ1 LYS 68 11.988 7.057 17.309 565 HZ2 LYS 68 HZ2 LYS 68 11.742 5.412 17.622 566 HZ3 LYS 68 HZ3 LYS 68 10.421 6.437 17.399 567 H VAL 69 H VAL 69 6.383 8.083 11.759 568 HA VAL 69 HA VAL 69 7.032 10.021 9.756 569 HB VAL 69 HB VAL 69 4.425 8.568 10.263 570 HG11 VAL 69 HG11 VAL 69 3.835 9.234 7.969 571 HG12 VAL 69 HG12 VAL 69 5.323 10.174 7.856 572 HG13 VAL 69 HG13 VAL 69 4.067 10.642 9.005 573 HG21 VAL 69 HG21 VAL 69 6.645 8.010 8.286 574 HG22 VAL 69 HG22 VAL 69 5.121 7.130 8.403 575 HG23 VAL 69 HG23 VAL 69 6.283 7.063 9.728 576 H GLN 70 H GLN 70 6.389 12.015 9.527 577 HA GLN 70 HA GLN 70 5.923 13.688 11.631 578 HB2 GLN 70 HB2 GLN 70 5.374 15.394 9.930 579 HB3 GLN 70 HB3 GLN 70 6.777 14.425 9.501 580 HG2 GLN 70 HG2 GLN 70 5.304 13.044 8.040 581 HG3 GLN 70 HG3 GLN 70 3.992 14.168 8.378 582 HE21 GLN 70 HE21 GLN 70 7.337 15.135 7.940 583 HE22 GLN 70 HE22 GLN 70 7.091 15.962 6.442 584 H GLY 71 H GLY 71 3.375 12.420 9.445 585 HA2 GLY 71 HA2 GLY 71 1.393 14.026 10.905 586 HA3 GLY 71 HA3 GLY 71 1.155 13.253 9.353 587 H VAL 72 H VAL 72 2.555 11.008 11.436 588 HA VAL 72 HA VAL 72 -0.062 9.729 11.790 589 HB VAL 72 HB VAL 72 2.713 8.593 12.211 590 HG11 VAL 72 HG11 VAL 72 0.011 7.229 12.351 591 HG12 VAL 72 HG12 VAL 72 1.116 7.505 13.698 592 HG13 VAL 72 HG13 VAL 72 1.572 6.407 12.396 593 HG21 VAL 72 HG21 VAL 72 2.195 9.034 9.861 594 HG22 VAL 72 HG22 VAL 72 0.691 8.124 10.011 595 HG23 VAL 72 HG23 VAL 72 2.241 7.299 10.178 596 H PHE 73 H PHE 73 -1.068 9.515 13.697 597 HA PHE 73 HA PHE 73 0.442 10.175 16.143 598 HB2 PHE 73 HB2 PHE 73 -2.006 10.874 16.938 599 HB3 PHE 73 HB3 PHE 73 -0.935 11.982 16.103 600 HD1 PHE 73 HD1 PHE 73 -3.981 9.960 15.801 601 HD2 PHE 73 HD2 PHE 73 -1.357 12.691 13.848 602 HE1 PHE 73 HE1 PHE 73 -5.683 10.361 14.068 603 HE2 PHE 73 HE2 PHE 73 -3.054 13.093 12.120 604 HZ PHE 73 HZ PHE 73 -5.218 11.934 12.225 605 H THR 74 H THR 74 -1.086 7.677 14.590 606 HA THR 74 HA THR 74 -1.331 6.226 17.142 607 HB THR 74 HB THR 74 -3.354 5.100 16.510 608 HG1 THR 74 HG1 THR 74 -4.142 5.121 14.523 609 HG21 THR 74 HG21 THR 74 -3.688 7.288 17.566 610 HG22 THR 74 HG22 THR 74 -4.978 6.935 16.417 611 HG23 THR 74 HG23 THR 74 -3.691 8.058 15.978 612 H VAL 75 H VAL 75 -0.009 4.523 17.091 613 HA VAL 75 HA VAL 75 0.089 2.871 14.645 614 HB VAL 75 HB VAL 75 2.506 3.464 16.381 615 HG11 VAL 75 HG11 VAL 75 2.565 1.226 15.419 616 HG12 VAL 75 HG12 VAL 75 3.758 2.259 14.631 617 HG13 VAL 75 HG13 VAL 75 2.240 1.886 13.815 618 HG21 VAL 75 HG21 VAL 75 1.908 5.431 15.055 619 HG22 VAL 75 HG22 VAL 75 1.866 4.444 13.591 620 HG23 VAL 75 HG23 VAL 75 3.390 4.692 14.443 621 H GLU 76 H GLU 76 -0.975 1.077 15.252 622 HA GLU 76 HA GLU 76 -0.410 -0.109 17.911 623 HB2 GLU 76 HB2 GLU 76 -3.041 -0.176 16.413 624 HB3 GLU 76 HB3 GLU 76 -2.733 -0.850 18.007 625 HG2 GLU 76 HG2 GLU 76 -2.371 1.393 18.895 626 HG3 GLU 76 HG3 GLU 76 -2.644 2.081 17.293 627 H ARG 77 H ARG 77 -1.256 -2.464 17.978 628 HA ARG 77 HA ARG 77 -0.432 -3.897 15.545 629 HB2 ARG 77 HB2 ARG 77 0.781 -4.596 17.503 630 HB3 ARG 77 HB3 ARG 77 -0.704 -4.799 18.420 631 HG2 ARG 77 HG2 ARG 77 -1.348 -6.683 17.042 632 HG3 ARG 77 HG3 ARG 77 0.058 -6.439 16.003 633 HD2 ARG 77 HD2 ARG 77 0.365 -8.272 17.634 634 HD3 ARG 77 HD3 ARG 77 1.552 -6.982 17.810 635 HE ARG 77 HE ARG 77 0.116 -6.186 19.700 636 HH11 ARG 77 HH11 ARG 77 0.064 -9.508 18.760 637 HH12 ARG 77 HH12 ARG 77 -0.294 -10.058 20.361 638 HH21 ARG 77 HH21 ARG 77 -0.370 -6.904 21.719 639 HH22 ARG 77 HH22 ARG 77 -0.585 -8.598 22.003 640 H LEU 78 H LEU 78 -1.940 -4.839 14.307 641 HA LEU 78 HA LEU 78 -4.694 -5.006 15.108 642 HB2 LEU 78 HB2 LEU 78 -3.243 -6.101 12.693 643 HB3 LEU 78 HB3 LEU 78 -4.981 -6.176 12.913 644 HG LEU 78 HG LEU 78 -3.384 -3.612 12.733 645 HD11 LEU 78 HD11 LEU 78 -4.382 -3.372 10.507 646 HD12 LEU 78 HD12 LEU 78 -5.091 -4.982 10.654 647 HD13 LEU 78 HD13 LEU 78 -3.337 -4.788 10.609 648 HD21 LEU 78 HD21 LEU 78 -6.364 -4.116 12.752 649 HD22 LEU 78 HD22 LEU 78 -5.591 -2.553 12.478 650 HD23 LEU 78 HD23 LEU 78 -5.422 -3.358 14.039 651 H SER 79 H SER 79 -4.772 -6.337 16.912 652 HA SER 79 HA SER 79 -3.606 -8.975 16.931 653 HB2 SER 79 HB2 SER 79 -3.823 -7.687 19.018 654 HB3 SER 79 HB3 SER 79 -5.579 -7.700 18.855 655 HG SER 79 HG SER 79 -5.471 -9.493 19.937 656 H ASN 80 H ASN 80 -6.955 -7.763 16.984 657 HA ASN 80 HA ASN 80 -7.984 -10.368 16.206 658 HB2 ASN 80 HB2 ASN 80 -10.217 -9.188 16.304 659 HB3 ASN 80 HB3 ASN 80 -9.315 -9.217 17.812 660 HD21 ASN 80 HD21 ASN 80 -11.417 -7.397 16.861 661 HD22 ASN 80 HD22 ASN 80 -10.738 -5.812 16.964 662 H LEU 81 H LEU 81 -7.565 -10.879 14.137 663 HA LEU 81 HA LEU 81 -7.713 -8.846 12.042 664 HB2 LEU 81 HB2 LEU 81 -6.871 -11.746 11.872 665 HB3 LEU 81 HB3 LEU 81 -6.728 -10.559 10.589 666 HG LEU 81 HG LEU 81 -5.213 -10.590 13.203 667 HD11 LEU 81 HD11 LEU 81 -4.315 -10.907 10.336 668 HD12 LEU 81 HD12 LEU 81 -4.381 -12.174 11.563 669 HD13 LEU 81 HD13 LEU 81 -3.252 -10.832 11.745 670 HD21 LEU 81 HD21 LEU 81 -5.167 -8.530 10.994 671 HD22 LEU 81 HD22 LEU 81 -4.062 -8.588 12.368 672 HD23 LEU 81 HD23 LEU 81 -5.780 -8.293 12.632 673 H GLU 82 H GLU 82 -8.728 -9.413 9.954 674 HA GLU 82 HA GLU 82 -11.178 -11.022 10.290 675 HB2 GLU 82 HB2 GLU 82 -11.827 -9.585 8.148 676 HB3 GLU 82 HB3 GLU 82 -12.104 -9.011 9.782 677 HG2 GLU 82 HG2 GLU 82 -11.158 -7.321 8.275 678 HG3 GLU 82 HG3 GLU 82 -10.177 -7.617 9.697 679 H HIS 83 H HIS 83 -8.376 -11.813 9.362 680 HA HIS 83 HA HIS 83 -8.736 -12.389 6.559 681 HB2 HIS 83 HB2 HIS 83 -6.536 -13.160 8.493 682 HB3 HIS 83 HB3 HIS 83 -6.535 -13.616 6.791 683 HD1 HIS 83 HD1 HIS 83 -5.092 -12.108 5.461 684 HD2 HIS 83 HD2 HIS 83 -6.918 -10.115 8.612 685 HE1 HIS 83 HE1 HIS 83 -4.288 -9.741 5.319 686 HE2 HIS 83 HE2 HIS 83 -5.668 -8.519 7.023 687 H HIS 84 H HIS 84 -10.719 -13.639 6.822 688 HA HIS 84 HA HIS 84 -10.340 -16.360 7.915 689 HB2 HIS 84 HB2 HIS 84 -12.948 -14.936 7.315 690 HB3 HIS 84 HB3 HIS 84 -12.752 -16.470 8.162 691 HD1 HIS 84 HD1 HIS 84 -13.499 -13.125 8.897 692 HD2 HIS 84 HD2 HIS 84 -10.922 -15.910 10.593 693 HE1 HIS 84 HE1 HIS 84 -13.056 -12.302 11.227 694 HE2 HIS 84 HE2 HIS 84 -11.648 -14.095 12.284 695 H HIS 85 H HIS 85 -10.184 -18.005 6.497 696 HA HIS 85 HA HIS 85 -10.614 -17.601 3.692 697 HB2 HIS 85 HB2 HIS 85 -8.862 -19.128 4.495 698 HB3 HIS 85 HB3 HIS 85 -10.084 -20.168 5.219 699 HD1 HIS 85 HD1 HIS 85 -8.850 -19.032 1.821 700 HD2 HIS 85 HD2 HIS 85 -11.185 -22.034 3.498 701 HE1 HIS 85 HE1 HIS 85 -9.284 -20.658 -0.032 702 HE2 HIS 85 HE2 HIS 85 -10.595 -22.521 1.026 703 H HIS 86 H HIS 86 -12.852 -16.892 3.854 704 HA HIS 86 HA HIS 86 -14.919 -18.777 4.527 705 HB2 HIS 86 HB2 HIS 86 -14.954 -16.132 4.463 706 HB3 HIS 86 HB3 HIS 86 -15.399 -16.377 2.778 707 HD1 HIS 86 HD1 HIS 86 -17.737 -17.481 2.324 708 HD2 HIS 86 HD2 HIS 86 -16.941 -16.666 6.321 709 HE1 HIS 86 HE1 HIS 86 -19.944 -17.666 3.504 710 HE2 HIS 86 HE2 HIS 86 -19.460 -17.053 5.893 711 H HIS 87 H HIS 87 -16.263 -19.942 3.061 712 HA HIS 87 HA HIS 87 -16.646 -21.287 1.267 713 HB2 HIS 87 HB2 HIS 87 -16.957 -19.350 -0.109 714 HB3 HIS 87 HB3 HIS 87 -15.228 -19.044 -0.193 715 HD1 HIS 87 HD1 HIS 87 -14.016 -20.002 -2.138 716 HD2 HIS 87 HD2 HIS 87 -17.758 -21.730 -1.632 717 HE1 HIS 87 HE1 HIS 87 -14.364 -21.445 -4.158 718 HE2 HIS 87 HE2 HIS 87 -16.530 -22.634 -3.721 719 H HIS 88 H HIS 88 -15.456 -22.991 2.058 720 HA HIS 88 HA HIS 88 -12.620 -23.192 1.244 721 HB2 HIS 88 HB2 HIS 88 -12.302 -24.702 3.163 722 HB3 HIS 88 HB3 HIS 88 -12.885 -23.122 3.670 723 HD1 HIS 88 HD1 HIS 88 -13.917 -26.713 3.438 724 HD2 HIS 88 HD2 HIS 88 -15.424 -23.108 4.845 725 HE1 HIS 88 HE1 HIS 88 -15.943 -27.313 4.784 726 HE2 HIS 88 HE2 HIS 88 -16.973 -25.102 5.388 727 H1 MET 1 H1 MET 1 -10.851 22.784 -15.412 728 H2 MET 1 H2 MET 1 -9.443 21.933 -15.814 729 H3 MET 1 H3 MET 1 -9.404 23.616 -15.680 730 HA MET 1 HA MET 1 -8.398 22.556 -13.757 731 HB2 MET 1 HB2 MET 1 -9.549 23.840 -12.070 732 HB3 MET 1 HB3 MET 1 -9.582 24.755 -13.572 733 HG2 MET 1 HG2 MET 1 -11.878 24.117 -13.962 734 HG3 MET 1 HG3 MET 1 -11.861 23.068 -12.546 735 HE1 MET 1 HE1 MET 1 -14.249 25.862 -11.306 736 HE2 MET 1 HE2 MET 1 -13.990 24.127 -11.475 737 HE3 MET 1 HE3 MET 1 -14.173 25.135 -12.910 738 H THR 2 H THR 2 -10.839 20.785 -14.982 739 HA THR 2 HA THR 2 -11.891 19.618 -12.547 740 HB THR 2 HB THR 2 -12.330 18.747 -15.419 741 HG1 THR 2 HG1 THR 2 -14.407 19.899 -14.973 742 HG21 THR 2 HG21 THR 2 -14.345 17.660 -14.534 743 HG22 THR 2 HG22 THR 2 -13.902 18.155 -12.900 744 HG23 THR 2 HG23 THR 2 -12.891 17.007 -13.779 745 H ASP 3 H ASP 3 -11.113 17.880 -11.531 746 HA ASP 3 HA ASP 3 -9.668 15.839 -13.085 747 HB2 ASP 3 HB2 ASP 3 -8.185 15.412 -11.167 748 HB3 ASP 3 HB3 ASP 3 -8.014 17.064 -11.746 749 H PHE 4 H PHE 4 -9.888 13.637 -12.193 750 HA PHE 4 HA PHE 4 -12.261 13.321 -10.489 751 HB2 PHE 4 HB2 PHE 4 -13.162 11.595 -11.957 752 HB3 PHE 4 HB3 PHE 4 -12.990 13.111 -12.831 753 HD1 PHE 4 HD2 PHE 4 -11.326 13.348 -14.608 754 HD2 PHE 4 HD1 PHE 4 -11.817 9.662 -12.520 755 HE1 PHE 4 HE2 PHE 4 -10.039 12.181 -16.355 756 HE2 PHE 4 HE1 PHE 4 -10.528 8.500 -14.261 757 HZ PHE 4 HZ PHE 4 -9.632 9.757 -16.174 758 H LEU 5 H LEU 5 -12.482 11.225 -9.515 759 HA LEU 5 HA LEU 5 -9.931 10.205 -8.630 760 HB2 LEU 5 HB2 LEU 5 -11.747 10.587 -7.049 761 HB3 LEU 5 HB3 LEU 5 -12.760 9.453 -7.916 762 HG LEU 5 HG LEU 5 -11.269 7.606 -7.273 763 HD11 LEU 5 HD11 LEU 5 -9.731 9.714 -5.751 764 HD12 LEU 5 HD12 LEU 5 -9.162 8.820 -7.160 765 HD13 LEU 5 HD13 LEU 5 -9.470 7.972 -5.646 766 HD21 LEU 5 HD21 LEU 5 -12.137 9.293 -4.921 767 HD22 LEU 5 HD22 LEU 5 -11.799 7.561 -4.892 768 HD23 LEU 5 HD23 LEU 5 -13.159 8.176 -5.827 769 H ALA 6 H ALA 6 -8.914 8.910 -10.019 770 HA ALA 6 HA ALA 6 -10.396 6.932 -11.595 771 HB1 ALA 6 HB1 ALA 6 -8.369 6.760 -12.920 772 HB2 ALA 6 HB2 ALA 6 -7.517 7.815 -11.792 773 HB3 ALA 6 HB3 ALA 6 -8.853 8.447 -12.753 774 H GLY 7 H GLY 7 -10.085 4.745 -11.408 775 HA2 GLY 7 HA2 GLY 7 -8.299 3.821 -9.236 776 HA3 GLY 7 HA3 GLY 7 -9.807 3.038 -9.674 777 H ILE 8 H ILE 8 -6.978 2.046 -9.542 778 HA ILE 8 HA ILE 8 -6.985 0.736 -12.188 779 HB ILE 8 HB ILE 8 -4.399 1.506 -10.806 780 HG12 ILE 8 HG12 ILE 8 -5.725 2.945 -13.131 781 HG13 ILE 8 HG13 ILE 8 -5.600 3.573 -11.491 782 HG21 ILE 8 HG21 ILE 8 -5.004 0.556 -13.614 783 HG22 ILE 8 HG22 ILE 8 -4.285 -0.406 -12.320 784 HG23 ILE 8 HG23 ILE 8 -3.403 0.967 -12.987 785 HD11 ILE 8 HD11 ILE 8 -3.169 3.621 -11.685 786 HD12 ILE 8 HD12 ILE 8 -3.934 4.566 -12.961 787 HD13 ILE 8 HD13 ILE 8 -3.283 2.968 -13.320 788 H ARG 9 H ARG 9 -7.005 -1.451 -11.969 789 HA ARG 9 HA ARG 9 -6.209 -2.604 -9.377 790 HB2 ARG 9 HB2 ARG 9 -8.534 -3.048 -10.245 791 HB3 ARG 9 HB3 ARG 9 -7.807 -3.957 -11.564 792 HG2 ARG 9 HG2 ARG 9 -6.762 -5.467 -9.894 793 HG3 ARG 9 HG3 ARG 9 -7.604 -4.588 -8.618 794 HD2 ARG 9 HD2 ARG 9 -8.913 -6.505 -9.055 795 HD3 ARG 9 HD3 ARG 9 -9.759 -5.162 -9.820 796 HE ARG 9 HE ARG 9 -8.255 -7.277 -11.199 797 HH11 ARG 9 HH11 ARG 9 -10.415 -4.595 -11.338 798 HH12 ARG 9 HH12 ARG 9 -10.877 -4.918 -12.972 799 HH21 ARG 9 HH21 ARG 9 -8.864 -7.665 -13.297 800 HH22 ARG 9 HH22 ARG 9 -10.003 -6.618 -14.062 801 H ILE 10 H ILE 10 -4.358 -3.656 -9.241 802 HA ILE 10 HA ILE 10 -3.021 -4.651 -11.684 803 HB ILE 10 HB ILE 10 -1.801 -4.109 -8.963 804 HG12 ILE 10 HG12 ILE 10 -1.663 -2.326 -11.411 805 HG13 ILE 10 HG13 ILE 10 -2.734 -2.040 -10.044 806 HG21 ILE 10 HG21 ILE 10 0.335 -4.197 -10.149 807 HG22 ILE 10 HG22 ILE 10 -0.508 -4.535 -11.660 808 HG23 ILE 10 HG23 ILE 10 -0.561 -5.705 -10.341 809 HD11 ILE 10 HD11 ILE 10 -0.752 -0.663 -9.894 810 HD12 ILE 10 HD12 ILE 10 0.274 -2.095 -9.953 811 HD13 ILE 10 HD13 ILE 10 -0.795 -1.830 -8.573 812 H VAL 11 H VAL 11 -3.220 -6.857 -11.938 813 HA VAL 11 HA VAL 11 -3.171 -8.505 -9.483 814 HB VAL 11 HB VAL 11 -4.509 -9.090 -12.131 815 HG11 VAL 11 HG11 VAL 11 -4.205 -10.910 -9.742 816 HG12 VAL 11 HG12 VAL 11 -3.466 -11.138 -11.328 817 HG13 VAL 11 HG13 VAL 11 -5.219 -11.228 -11.150 818 HG21 VAL 11 HG21 VAL 11 -5.609 -8.797 -9.330 819 HG22 VAL 11 HG22 VAL 11 -6.551 -9.180 -10.774 820 HG23 VAL 11 HG23 VAL 11 -5.756 -7.612 -10.632 821 H GLY 12 H GLY 12 -1.326 -9.476 -9.143 822 HA2 GLY 12 HA2 GLY 12 0.184 -10.616 -11.403 823 HA3 GLY 12 HA3 GLY 12 0.998 -9.497 -10.322 824 H GLU 13 H GLU 13 2.034 -11.979 -10.643 825 HA GLU 13 HA GLU 13 1.056 -14.002 -8.963 826 HB2 GLU 13 HB2 GLU 13 3.413 -14.919 -9.160 827 HB3 GLU 13 HB3 GLU 13 2.580 -14.593 -10.676 828 HG2 GLU 13 HG2 GLU 13 3.801 -12.355 -10.687 829 HG3 GLU 13 HG3 GLU 13 4.795 -13.016 -9.390 830 H ASP 14 H ASP 14 0.892 -14.065 -6.825 831 HA ASP 14 HA ASP 14 1.997 -12.162 -5.061 832 HB2 ASP 14 HB2 ASP 14 -0.084 -13.397 -4.610 833 HB3 ASP 14 HB3 ASP 14 0.827 -14.896 -4.468 834 H LYS 15 H LYS 15 4.177 -11.992 -4.848 835 HA LYS 15 HA LYS 15 5.683 -14.387 -4.080 836 HB2 LYS 15 HB2 LYS 15 6.174 -12.680 -6.482 837 HB3 LYS 15 HB3 LYS 15 7.543 -13.433 -5.670 838 HG2 LYS 15 HG2 LYS 15 6.688 -15.613 -6.045 839 HG3 LYS 15 HG3 LYS 15 5.130 -14.981 -6.576 840 HD2 LYS 15 HD2 LYS 15 6.539 -15.779 -8.438 841 HD3 LYS 15 HD3 LYS 15 6.117 -14.075 -8.573 842 HE2 LYS 15 HE2 LYS 15 8.321 -13.430 -7.804 843 HE3 LYS 15 HE3 LYS 15 8.747 -15.118 -7.514 844 HZ1 LYS 15 HZ1 LYS 15 7.979 -14.095 -10.189 845 HZ2 LYS 15 HZ2 LYS 15 8.713 -15.572 -9.812 846 HZ3 LYS 15 HZ3 LYS 15 9.582 -14.131 -9.648 847 H ASN 16 H ASN 16 7.979 -13.876 -3.570 848 HA ASN 16 HA ASN 16 8.009 -12.604 -1.138 849 HB2 ASN 16 HB2 ASN 16 10.470 -12.880 -1.229 850 HB3 ASN 16 HB3 ASN 16 9.593 -14.317 -1.744 851 HD21 ASN 16 HD21 ASN 16 9.737 -14.993 -3.853 852 HD22 ASN 16 HD22 ASN 16 10.859 -14.320 -4.979 853 H GLY 17 H GLY 17 8.777 -11.140 -4.246 854 HA2 GLY 17 HA2 GLY 17 9.481 -8.633 -2.806 855 HA3 GLY 17 HA3 GLY 17 10.198 -9.102 -4.338 856 H MET 18 H MET 18 7.253 -10.027 -4.980 857 HA MET 18 HA MET 18 6.780 -7.845 -6.718 858 HB2 MET 18 HB2 MET 18 5.261 -10.335 -5.987 859 HB3 MET 18 HB3 MET 18 4.503 -9.122 -7.007 860 HG2 MET 18 HG2 MET 18 7.138 -10.447 -7.614 861 HG3 MET 18 HG3 MET 18 5.577 -10.958 -8.268 862 HE1 MET 18 HE1 MET 18 4.234 -7.967 -8.489 863 HE2 MET 18 HE2 MET 18 3.987 -9.274 -9.647 864 HE3 MET 18 HE3 MET 18 4.505 -7.685 -10.209 865 H THR 19 H THR 19 4.895 -8.899 -3.846 866 HA THR 19 HA THR 19 2.931 -6.894 -4.017 867 HB THR 19 HB THR 19 2.510 -7.355 -1.603 868 HG1 THR 19 HG1 THR 19 3.832 -8.842 -0.539 869 HG21 THR 19 HG21 THR 19 1.512 -8.814 -3.300 870 HG22 THR 19 HG22 THR 19 1.937 -9.731 -1.855 871 HG23 THR 19 HG23 THR 19 2.957 -9.826 -3.291 872 H ASN 20 H ASN 20 6.150 -6.849 -2.616 873 HA ASN 20 HA ASN 20 5.828 -4.351 -1.241 874 HB2 ASN 20 HB2 ASN 20 8.341 -5.861 -2.025 875 HB3 ASN 20 HB3 ASN 20 8.291 -4.474 -0.943 876 HD21 ASN 20 HD21 ASN 20 7.688 -4.764 1.153 877 HD22 ASN 20 HD22 ASN 20 7.389 -6.313 1.854 878 H GLN 21 H GLN 21 7.412 -5.367 -4.261 879 HA GLN 21 HA GLN 21 8.415 -2.811 -4.901 880 HB2 GLN 21 HB2 GLN 21 9.066 -3.705 -6.989 881 HB3 GLN 21 HB3 GLN 21 9.252 -4.996 -5.825 882 HG2 GLN 21 HG2 GLN 21 7.247 -6.062 -6.603 883 HG3 GLN 21 HG3 GLN 21 6.884 -4.699 -7.661 884 HE21 GLN 21 HE21 GLN 21 8.894 -7.490 -7.189 885 HE22 GLN 21 HE22 GLN 21 9.539 -7.531 -8.785 886 H ILE 22 H ILE 22 5.420 -4.452 -5.767 887 HA ILE 22 HA ILE 22 4.568 -2.750 -7.822 888 HB ILE 22 HB ILE 22 3.151 -4.604 -5.937 889 HG12 ILE 22 HG12 ILE 22 4.428 -5.596 -7.757 890 HG13 ILE 22 HG13 ILE 22 2.710 -5.836 -8.044 891 HG21 ILE 22 HG21 ILE 22 1.769 -2.948 -8.053 892 HG22 ILE 22 HG22 ILE 22 1.553 -2.798 -6.308 893 HG23 ILE 22 HG23 ILE 22 1.048 -4.270 -7.134 894 HD11 ILE 22 HD11 ILE 22 4.435 -3.747 -9.351 895 HD12 ILE 22 HD12 ILE 22 2.713 -3.997 -9.642 896 HD13 ILE 22 HD13 ILE 22 3.872 -5.248 -10.088 897 H THR 23 H THR 23 3.582 -2.688 -4.378 898 HA THR 23 HA THR 23 2.146 -0.237 -4.734 899 HB THR 23 HB THR 23 2.984 -1.425 -2.073 900 HG1 THR 23 HG1 THR 23 1.634 -2.997 -2.531 901 HG21 THR 23 HG21 THR 23 0.968 -0.303 -1.259 902 HG22 THR 23 HG22 THR 23 0.644 0.314 -2.879 903 HG23 THR 23 HG23 THR 23 2.072 0.862 -1.999 904 H GLY 24 H GLY 24 5.399 -1.088 -3.770 905 HA2 GLY 24 HA2 GLY 24 6.310 1.395 -2.833 906 HA3 GLY 24 HA3 GLY 24 7.298 0.208 -3.673 907 H VAL 25 H VAL 25 6.119 0.157 -6.173 908 HA VAL 25 HA VAL 25 7.109 2.437 -7.482 909 HB VAL 25 HB VAL 25 5.125 0.364 -8.450 910 HG11 VAL 25 HG11 VAL 25 4.858 2.420 -9.758 911 HG12 VAL 25 HG12 VAL 25 5.609 1.153 -10.727 912 HG13 VAL 25 HG13 VAL 25 6.594 2.459 -10.068 913 HG21 VAL 25 HG21 VAL 25 7.070 -0.551 -9.656 914 HG22 VAL 25 HG22 VAL 25 7.332 -0.530 -7.914 915 HG23 VAL 25 HG23 VAL 25 8.095 0.691 -8.931 916 H ILE 26 H ILE 26 3.832 1.606 -6.441 917 HA ILE 26 HA ILE 26 2.350 3.659 -7.550 918 HB ILE 26 HB ILE 26 2.038 2.515 -4.764 919 HG12 ILE 26 HG12 ILE 26 2.019 0.761 -6.474 920 HG13 ILE 26 HG13 ILE 26 0.412 0.971 -5.790 921 HG21 ILE 26 HG21 ILE 26 -0.321 3.180 -4.968 922 HG22 ILE 26 HG22 ILE 26 0.048 3.973 -6.500 923 HG23 ILE 26 HG23 ILE 26 0.771 4.567 -5.004 924 HD11 ILE 26 HD11 ILE 26 -0.255 2.245 -7.758 925 HD12 ILE 26 HD12 ILE 26 0.323 0.636 -8.186 926 HD13 ILE 26 HD13 ILE 26 1.359 2.040 -8.438 927 H SER 27 H SER 27 4.154 3.736 -4.469 928 HA SER 27 HA SER 27 3.396 6.346 -3.709 929 HB2 SER 27 HB2 SER 27 5.118 6.232 -2.044 930 HB3 SER 27 HB3 SER 27 4.454 4.607 -2.210 931 HG SER 27 HG SER 27 6.263 3.961 -3.259 932 H LYS 28 H LYS 28 5.719 5.272 -6.034 933 HA LYS 28 HA LYS 28 7.322 7.665 -6.007 934 HB2 LYS 28 HB2 LYS 28 7.208 5.438 -8.060 935 HB3 LYS 28 HB3 LYS 28 8.419 6.712 -8.001 936 HG2 LYS 28 HG2 LYS 28 8.957 5.848 -5.651 937 HG3 LYS 28 HG3 LYS 28 8.008 4.429 -6.089 938 HD2 LYS 28 HD2 LYS 28 10.367 5.431 -7.690 939 HD3 LYS 28 HD3 LYS 28 10.491 4.209 -6.428 940 HE2 LYS 28 HE2 LYS 28 10.384 3.040 -8.482 941 HE3 LYS 28 HE3 LYS 28 8.804 2.856 -7.731 942 HZ1 LYS 28 HZ1 LYS 28 8.690 3.347 -10.122 943 HZ2 LYS 28 HZ2 LYS 28 9.451 4.829 -9.855 944 HZ3 LYS 28 HZ3 LYS 28 7.926 4.537 -9.196 945 H PHE 29 H PHE 29 4.248 7.049 -7.214 946 HA PHE 29 HA PHE 29 4.346 8.452 -9.679 947 HB2 PHE 29 HB2 PHE 29 2.059 7.784 -7.828 948 HB3 PHE 29 HB3 PHE 29 1.820 8.683 -9.321 949 HD1 PHE 29 HD1 PHE 29 4.103 6.985 -10.758 950 HD2 PHE 29 HD2 PHE 29 0.546 6.034 -8.608 951 HE1 PHE 29 HE1 PHE 29 3.908 4.882 -12.014 952 HE2 PHE 29 HE2 PHE 29 0.356 3.926 -9.863 953 HZ PHE 29 HZ PHE 29 2.032 3.350 -11.566 954 H ASP 30 H ASP 30 3.241 10.469 -10.164 955 HA ASP 30 HA ASP 30 4.070 12.614 -8.431 956 HB2 ASP 30 HB2 ASP 30 3.176 14.050 -10.269 957 HB3 ASP 30 HB3 ASP 30 4.349 12.858 -10.820 958 H THR 31 H THR 31 1.150 10.871 -8.977 959 HA THR 31 HA THR 31 -0.607 12.943 -7.937 960 HB THR 31 HB THR 31 -1.508 11.558 -9.699 961 HG1 THR 31 HG1 THR 31 -3.335 11.784 -8.674 962 HG21 THR 31 HG21 THR 31 -0.180 9.533 -9.330 963 HG22 THR 31 HG22 THR 31 -1.901 9.154 -9.414 964 HG23 THR 31 HG23 THR 31 -1.083 9.200 -7.852 965 H ASN 32 H ASN 32 -2.005 12.608 -6.079 966 HA ASN 32 HA ASN 32 -0.513 11.382 -3.884 967 HB2 ASN 32 HB2 ASN 32 -1.235 13.657 -3.513 968 HB3 ASN 32 HB3 ASN 32 -2.903 13.238 -3.891 969 HD21 ASN 32 HD21 ASN 32 -0.319 12.800 -1.557 970 HD22 ASN 32 HD22 ASN 32 -1.346 12.365 -0.238 971 H ILE 33 H ILE 33 -1.080 9.582 -2.852 972 HA ILE 33 HA ILE 33 -3.075 7.865 -3.906 973 HB ILE 33 HB ILE 33 -1.551 7.635 -1.295 974 HG12 ILE 33 HG12 ILE 33 -0.987 6.432 -4.025 975 HG13 ILE 33 HG13 ILE 33 -0.088 7.754 -3.289 976 HG21 ILE 33 HG21 ILE 33 -3.560 6.233 -1.312 977 HG22 ILE 33 HG22 ILE 33 -2.100 5.249 -1.396 978 HG23 ILE 33 HG23 ILE 33 -3.061 5.524 -2.850 979 HD11 ILE 33 HD11 ILE 33 -0.260 4.939 -2.232 980 HD12 ILE 33 HD12 ILE 33 0.661 6.261 -1.514 981 HD13 ILE 33 HD13 ILE 33 1.099 5.642 -3.105 982 H ARG 34 H ARG 34 -5.219 7.938 -3.542 983 HA ARG 34 HA ARG 34 -6.223 9.232 -1.104 984 HB2 ARG 34 HB2 ARG 34 -7.825 8.241 -3.471 985 HB3 ARG 34 HB3 ARG 34 -8.374 9.318 -2.194 986 HG2 ARG 34 HG2 ARG 34 -6.407 9.912 -4.394 987 HG3 ARG 34 HG3 ARG 34 -7.983 10.652 -4.115 988 HD2 ARG 34 HD2 ARG 34 -5.509 10.944 -2.407 989 HD3 ARG 34 HD3 ARG 34 -6.234 12.178 -3.434 990 HE ARG 34 HE ARG 34 -8.231 11.883 -1.844 991 HH11 ARG 34 HH11 ARG 34 -4.925 11.589 -0.919 992 HH12 ARG 34 HH12 ARG 34 -5.229 12.087 0.711 993 HH21 ARG 34 HH21 ARG 34 -8.594 12.555 0.242 994 HH22 ARG 34 HH22 ARG 34 -7.264 12.653 1.349 995 H THR 35 H THR 35 -6.384 6.171 -2.854 996 HA THR 35 HA THR 35 -6.704 4.761 -0.329 997 HB THR 35 HB THR 35 -8.665 4.281 -2.599 998 HG1 THR 35 HG1 THR 35 -8.790 5.842 -0.310 999 HG21 THR 35 HG21 THR 35 -8.458 3.006 0.137 1000 HG22 THR 35 HG22 THR 35 -8.125 2.220 -1.407 1001 HG23 THR 35 HG23 THR 35 -9.764 2.740 -1.016 1002 H ILE 36 H ILE 36 -5.457 2.957 -0.330 1003 HA ILE 36 HA ILE 36 -4.944 1.596 -2.894 1004 HB ILE 36 HB ILE 36 -2.921 2.928 -2.324 1005 HG12 ILE 36 HG12 ILE 36 -1.271 1.039 -2.420 1006 HG13 ILE 36 HG13 ILE 36 -2.595 -0.081 -2.128 1007 HG21 ILE 36 HG21 ILE 36 -2.821 1.192 0.140 1008 HG22 ILE 36 HG22 ILE 36 -3.095 2.936 0.096 1009 HG23 ILE 36 HG23 ILE 36 -1.535 2.272 -0.399 1010 HD11 ILE 36 HD11 ILE 36 -1.969 0.031 -4.478 1011 HD12 ILE 36 HD12 ILE 36 -2.345 1.756 -4.499 1012 HD13 ILE 36 HD13 ILE 36 -3.628 0.575 -4.222 1013 H VAL 37 H VAL 37 -5.197 -0.568 -2.818 1014 HA VAL 37 HA VAL 37 -5.199 -1.937 -0.201 1015 HB VAL 37 HB VAL 37 -7.301 -2.339 -2.354 1016 HG11 VAL 37 HG11 VAL 37 -6.772 -4.422 -1.191 1017 HG12 VAL 37 HG12 VAL 37 -8.381 -3.851 -0.748 1018 HG13 VAL 37 HG13 VAL 37 -7.032 -3.633 0.367 1019 HG21 VAL 37 HG21 VAL 37 -8.896 -1.439 -0.715 1020 HG22 VAL 37 HG22 VAL 37 -7.668 -0.251 -1.150 1021 HG23 VAL 37 HG23 VAL 37 -7.566 -1.101 0.394 1022 H LEU 38 H LEU 38 -4.383 -4.024 -0.236 1023 HA LEU 38 HA LEU 38 -3.929 -5.329 -2.819 1024 HB2 LEU 38 HB2 LEU 38 -1.870 -4.025 -2.245 1025 HB3 LEU 38 HB3 LEU 38 -1.719 -4.968 -0.778 1026 HG LEU 38 HG LEU 38 -1.688 -6.281 -3.500 1027 HD11 LEU 38 HD11 LEU 38 0.064 -4.597 -3.524 1028 HD12 LEU 38 HD12 LEU 38 0.768 -6.209 -3.401 1029 HD13 LEU 38 HD13 LEU 38 0.675 -5.175 -1.973 1030 HD21 LEU 38 HD21 LEU 38 -0.413 -8.019 -2.301 1031 HD22 LEU 38 HD22 LEU 38 -2.014 -7.779 -1.607 1032 HD23 LEU 38 HD23 LEU 38 -0.597 -7.107 -0.802 1033 H ASN 39 H ASN 39 -4.894 -7.251 -2.619 1034 HA ASN 39 HA ASN 39 -4.399 -8.809 -0.166 1035 HB2 ASN 39 HB2 ASN 39 -6.686 -9.703 -0.237 1036 HB3 ASN 39 HB3 ASN 39 -6.692 -7.955 -0.045 1037 HD21 ASN 39 HD21 ASN 39 -7.318 -6.662 -1.817 1038 HD22 ASN 39 HD22 ASN 39 -8.263 -7.312 -3.104 1039 H ALA 40 H ALA 40 -3.803 -10.878 -0.461 1040 HA ALA 40 HA ALA 40 -3.462 -11.801 -3.238 1041 HB1 ALA 40 HB1 ALA 40 -1.445 -11.655 -1.862 1042 HB2 ALA 40 HB2 ALA 40 -1.781 -13.324 -2.328 1043 HB3 ALA 40 HB3 ALA 40 -2.151 -12.772 -0.693 1044 H LYS 41 H LYS 41 -4.971 -13.073 -3.973 1045 HA LYS 41 HA LYS 41 -6.144 -15.174 -2.253 1046 HB2 LYS 41 HB2 LYS 41 -8.256 -14.864 -3.410 1047 HB3 LYS 41 HB3 LYS 41 -7.726 -13.312 -2.767 1048 HG2 LYS 41 HG2 LYS 41 -6.744 -12.851 -5.057 1049 HG3 LYS 41 HG3 LYS 41 -7.633 -14.267 -5.617 1050 HD2 LYS 41 HD2 LYS 41 -9.732 -13.209 -4.831 1051 HD3 LYS 41 HD3 LYS 41 -8.804 -11.772 -4.382 1052 HE2 LYS 41 HE2 LYS 41 -9.705 -11.308 -6.520 1053 HE3 LYS 41 HE3 LYS 41 -8.006 -11.705 -6.788 1054 HZ1 LYS 41 HZ1 LYS 41 -8.706 -13.968 -7.376 1055 HZ2 LYS 41 HZ2 LYS 41 -9.358 -12.804 -8.410 1056 HZ3 LYS 41 HZ3 LYS 41 -10.326 -13.507 -7.216 1057 H ASP 42 H ASP 42 -6.370 -17.213 -3.193 1058 HA ASP 42 HA ASP 42 -6.040 -18.949 -4.625 1059 HB2 ASP 42 HB2 ASP 42 -6.228 -16.910 -6.859 1060 HB3 ASP 42 HB3 ASP 42 -6.559 -18.636 -6.961 1061 H GLY 43 H GLY 43 -3.719 -17.069 -3.821 1062 HA2 GLY 43 HA2 GLY 43 -1.407 -17.455 -4.018 1063 HA3 GLY 43 HA3 GLY 43 -1.696 -18.342 -5.505 1064 H ILE 44 H ILE 44 -3.386 -15.449 -5.613 1065 HA ILE 44 HA ILE 44 -1.172 -13.992 -6.937 1066 HB ILE 44 HB ILE 44 -4.048 -13.984 -7.877 1067 HG12 ILE 44 HG12 ILE 44 -1.717 -15.577 -8.973 1068 HG13 ILE 44 HG13 ILE 44 -3.141 -16.227 -8.164 1069 HG21 ILE 44 HG21 ILE 44 -2.751 -12.000 -8.476 1070 HG22 ILE 44 HG22 ILE 44 -3.136 -12.963 -9.902 1071 HG23 ILE 44 HG23 ILE 44 -1.516 -13.023 -9.210 1072 HD11 ILE 44 HD11 ILE 44 -3.112 -14.752 -10.782 1073 HD12 ILE 44 HD12 ILE 44 -4.545 -15.393 -9.975 1074 HD13 ILE 44 HD13 ILE 44 -3.298 -16.493 -10.568 1075 H PHE 45 H PHE 45 -1.359 -11.655 -6.827 1076 HA PHE 45 HA PHE 45 -3.211 -10.789 -4.688 1077 HB2 PHE 45 HB2 PHE 45 -1.630 -9.162 -3.944 1078 HB3 PHE 45 HB3 PHE 45 -0.771 -10.690 -4.097 1079 HD1 PHE 45 HD1 PHE 45 0.887 -11.013 -5.841 1080 HD2 PHE 45 HD2 PHE 45 -1.144 -7.300 -5.403 1081 HE1 PHE 45 HE1 PHE 45 2.564 -9.928 -7.277 1082 HE2 PHE 45 HE2 PHE 45 0.524 -6.210 -6.846 1083 HZ PHE 45 HZ PHE 45 2.375 -7.529 -7.783 1084 H THR 46 H THR 46 -4.397 -8.944 -4.915 1085 HA THR 46 HA THR 46 -4.233 -7.552 -7.517 1086 HB THR 46 HB THR 46 -6.311 -8.678 -7.535 1087 HG1 THR 46 HG1 THR 46 -6.863 -6.028 -6.612 1088 HG21 THR 46 HG21 THR 46 -7.964 -8.564 -5.727 1089 HG22 THR 46 HG22 THR 46 -6.837 -7.620 -4.753 1090 HG23 THR 46 HG23 THR 46 -6.456 -9.292 -5.174 1091 H CYS 47 H CYS 47 -3.158 -5.717 -7.137 1092 HA CYS 47 HA CYS 47 -3.643 -4.146 -4.722 1093 HB2 CYS 47 HB2 CYS 47 -1.328 -4.453 -5.535 1094 HB3 CYS 47 HB3 CYS 47 -1.748 -3.629 -7.030 1095 HG CYS 47 HG CYS 47 -0.502 -2.321 -4.395 1096 H ASN 48 H ASN 48 -5.270 -2.731 -4.690 1097 HA ASN 48 HA ASN 48 -6.303 -1.607 -7.198 1098 HB2 ASN 48 HB2 ASN 48 -7.558 -1.773 -4.440 1099 HB3 ASN 48 HB3 ASN 48 -8.325 -1.054 -5.852 1100 HD21 ASN 48 HD21 ASN 48 -10.039 -2.534 -5.699 1101 HD22 ASN 48 HD22 ASN 48 -9.854 -4.179 -6.178 1102 H LEU 49 H LEU 49 -5.431 0.313 -7.682 1103 HA LEU 49 HA LEU 49 -4.687 2.187 -5.555 1104 HB2 LEU 49 HB2 LEU 49 -2.962 1.739 -7.181 1105 HB3 LEU 49 HB3 LEU 49 -4.048 2.118 -8.507 1106 HG LEU 49 HG LEU 49 -4.112 4.470 -7.796 1107 HD11 LEU 49 HD11 LEU 49 -3.778 4.201 -5.413 1108 HD12 LEU 49 HD12 LEU 49 -2.550 5.278 -6.074 1109 HD13 LEU 49 HD13 LEU 49 -2.138 3.609 -5.679 1110 HD21 LEU 49 HD21 LEU 49 -1.317 3.388 -8.161 1111 HD22 LEU 49 HD22 LEU 49 -1.813 5.064 -8.405 1112 HD23 LEU 49 HD23 LEU 49 -2.459 3.794 -9.443 1113 H MET 50 H MET 50 -5.810 3.978 -5.136 1114 HA MET 50 HA MET 50 -7.723 4.991 -7.148 1115 HB2 MET 50 HB2 MET 50 -8.021 5.062 -4.135 1116 HB3 MET 50 HB3 MET 50 -9.149 5.756 -5.292 1117 HG2 MET 50 HG2 MET 50 -8.504 2.835 -4.934 1118 HG3 MET 50 HG3 MET 50 -9.991 3.656 -4.474 1119 HE1 MET 50 HE1 MET 50 -11.183 4.775 -8.139 1120 HE2 MET 50 HE2 MET 50 -9.969 5.638 -7.194 1121 HE3 MET 50 HE3 MET 50 -11.436 5.042 -6.415 1122 H ILE 51 H ILE 51 -6.948 6.830 -7.961 1123 HA ILE 51 HA ILE 51 -5.910 8.904 -6.170 1124 HB ILE 51 HB ILE 51 -4.022 9.327 -7.866 1125 HG12 ILE 51 HG12 ILE 51 -3.205 7.040 -8.832 1126 HG13 ILE 51 HG13 ILE 51 -4.886 6.548 -8.665 1127 HG21 ILE 51 HG21 ILE 51 -3.605 8.569 -5.600 1128 HG22 ILE 51 HG22 ILE 51 -2.505 7.771 -6.723 1129 HG23 ILE 51 HG23 ILE 51 -3.896 6.897 -6.079 1130 HD11 ILE 51 HD11 ILE 51 -5.556 8.372 -10.145 1131 HD12 ILE 51 HD12 ILE 51 -4.400 7.285 -10.914 1132 HD13 ILE 51 HD13 ILE 51 -3.866 8.854 -10.308 1133 H PHE 52 H PHE 52 -5.692 11.040 -7.269 1134 HA PHE 52 HA PHE 52 -7.899 11.408 -9.148 1135 HB2 PHE 52 HB2 PHE 52 -6.329 13.288 -7.396 1136 HB3 PHE 52 HB3 PHE 52 -7.323 13.907 -8.709 1137 HD1 PHE 52 HD2 PHE 52 -9.781 13.320 -8.735 1138 HD2 PHE 52 HD1 PHE 52 -7.306 12.722 -5.320 1139 HE1 PHE 52 HE2 PHE 52 -11.780 13.229 -7.312 1140 HE2 PHE 52 HE1 PHE 52 -9.307 12.629 -3.889 1141 HZ PHE 52 HZ PHE 52 -11.548 12.887 -4.882 1142 H VAL 53 H VAL 53 -7.687 11.944 -11.235 1143 HA VAL 53 HA VAL 53 -5.006 12.680 -12.251 1144 HB VAL 53 HB VAL 53 -5.476 11.523 -14.332 1145 HG11 VAL 53 HG11 VAL 53 -5.501 9.200 -13.564 1146 HG12 VAL 53 HG12 VAL 53 -6.046 9.730 -11.972 1147 HG13 VAL 53 HG13 VAL 53 -4.447 10.197 -12.558 1148 HG21 VAL 53 HG21 VAL 53 -7.490 10.142 -14.614 1149 HG22 VAL 53 HG22 VAL 53 -7.878 11.854 -14.450 1150 HG23 VAL 53 HG23 VAL 53 -8.116 10.761 -13.086 1151 H LYS 54 H LYS 54 -4.890 14.295 -13.801 1152 HA LYS 54 HA LYS 54 -7.089 16.154 -13.833 1153 HB2 LYS 54 HB2 LYS 54 -5.560 17.629 -15.057 1154 HB3 LYS 54 HB3 LYS 54 -4.810 16.962 -13.613 1155 HG2 LYS 54 HG2 LYS 54 -3.802 15.197 -15.185 1156 HG3 LYS 54 HG3 LYS 54 -4.279 16.286 -16.487 1157 HD2 LYS 54 HD2 LYS 54 -2.417 16.912 -14.194 1158 HD3 LYS 54 HD3 LYS 54 -1.976 16.719 -15.890 1159 HE2 LYS 54 HE2 LYS 54 -3.292 18.700 -16.464 1160 HE3 LYS 54 HE3 LYS 54 -3.770 18.881 -14.775 1161 HZ1 LYS 54 HZ1 LYS 54 -1.975 20.364 -15.225 1162 HZ2 LYS 54 HZ2 LYS 54 -1.030 19.132 -15.890 1163 HZ3 LYS 54 HZ3 LYS 54 -1.378 19.128 -14.234 1164 H ASN 55 H ASN 55 -6.137 13.601 -15.899 1165 HA ASN 55 HA ASN 55 -8.429 14.031 -17.554 1166 HB2 ASN 55 HB2 ASN 55 -7.344 14.209 -19.721 1167 HB3 ASN 55 HB3 ASN 55 -6.822 15.540 -18.697 1168 HD21 ASN 55 HD21 ASN 55 -4.695 15.679 -18.113 1169 HD22 ASN 55 HD22 ASN 55 -3.466 14.647 -18.750 1170 H THR 56 H THR 56 -8.460 12.301 -19.405 1171 HA THR 56 HA THR 56 -8.232 9.773 -18.085 1172 HB THR 56 HB THR 56 -9.096 8.817 -20.230 1173 HG1 THR 56 HG1 THR 56 -9.893 10.855 -21.572 1174 HG21 THR 56 HG21 THR 56 -10.644 9.582 -18.497 1175 HG22 THR 56 HG22 THR 56 -11.300 9.905 -20.104 1176 HG23 THR 56 HG23 THR 56 -10.593 11.217 -19.160 1177 H ASP 57 H ASP 57 -6.320 11.357 -20.598 1178 HA ASP 57 HA ASP 57 -4.801 9.082 -21.376 1179 HB2 ASP 57 HB2 ASP 57 -4.923 11.102 -22.762 1180 HB3 ASP 57 HB3 ASP 57 -4.111 12.032 -21.507 1181 H LYS 58 H LYS 58 -4.411 11.538 -18.903 1182 HA LYS 58 HA LYS 58 -1.929 10.850 -17.837 1183 HB2 LYS 58 HB2 LYS 58 -2.968 12.837 -17.057 1184 HB3 LYS 58 HB3 LYS 58 -4.453 11.996 -16.638 1185 HG2 LYS 58 HG2 LYS 58 -3.253 12.630 -14.642 1186 HG3 LYS 58 HG3 LYS 58 -3.302 10.872 -14.802 1187 HD2 LYS 58 HD2 LYS 58 -0.995 10.982 -15.790 1188 HD3 LYS 58 HD3 LYS 58 -0.973 12.705 -15.407 1189 HE2 LYS 58 HE2 LYS 58 -1.306 12.158 -13.028 1190 HE3 LYS 58 HE3 LYS 58 -1.265 10.442 -13.430 1191 HZ1 LYS 58 HZ1 LYS 58 1.002 10.868 -14.365 1192 HZ2 LYS 58 HZ2 LYS 58 0.878 11.048 -12.688 1193 HZ3 LYS 58 HZ3 LYS 58 0.930 12.410 -13.675 1194 H LEU 59 H LEU 59 -5.147 9.533 -17.154 1195 HA LEU 59 HA LEU 59 -4.410 7.702 -15.145 1196 HB2 LEU 59 HB2 LEU 59 -6.702 8.336 -15.436 1197 HB3 LEU 59 HB3 LEU 59 -6.709 7.770 -17.094 1198 HG LEU 59 HG LEU 59 -6.586 5.453 -16.351 1199 HD11 LEU 59 HD11 LEU 59 -5.248 5.686 -14.357 1200 HD12 LEU 59 HD12 LEU 59 -6.772 4.895 -13.955 1201 HD13 LEU 59 HD13 LEU 59 -6.531 6.597 -13.560 1202 HD21 LEU 59 HD21 LEU 59 -8.785 5.294 -15.284 1203 HD22 LEU 59 HD22 LEU 59 -8.787 6.478 -16.590 1204 HD23 LEU 59 HD23 LEU 59 -8.732 7.018 -14.912 1205 H THR 60 H THR 60 -4.760 7.264 -18.676 1206 HA THR 60 HA THR 60 -4.155 4.492 -18.684 1207 HB THR 60 HB THR 60 -3.673 4.825 -21.141 1208 HG1 THR 60 HG1 THR 60 -3.006 6.905 -21.348 1209 HG21 THR 60 HG21 THR 60 -5.996 5.365 -21.724 1210 HG22 THR 60 HG22 THR 60 -6.262 5.997 -20.100 1211 HG23 THR 60 HG23 THR 60 -5.928 4.281 -20.333 1212 H THR 61 H THR 61 -2.102 7.348 -18.750 1213 HA THR 61 HA THR 61 0.298 6.121 -19.567 1214 HB THR 61 HB THR 61 -0.150 8.533 -17.793 1215 HG1 THR 61 HG1 THR 61 0.648 8.295 -20.530 1216 HG21 THR 61 HG21 THR 61 2.440 7.589 -19.045 1217 HG22 THR 61 HG22 THR 61 2.073 7.601 -17.318 1218 HG23 THR 61 HG23 THR 61 2.200 9.122 -18.204 1219 H LEU 62 H LEU 62 -1.132 6.486 -16.334 1220 HA LEU 62 HA LEU 62 1.030 5.463 -14.855 1221 HB2 LEU 62 HB2 LEU 62 -1.929 5.361 -14.262 1222 HB3 LEU 62 HB3 LEU 62 -0.677 4.932 -13.110 1223 HG LEU 62 HG LEU 62 -1.169 7.667 -14.305 1224 HD11 LEU 62 HD11 LEU 62 -1.667 8.307 -12.013 1225 HD12 LEU 62 HD12 LEU 62 -1.370 6.655 -11.470 1226 HD13 LEU 62 HD13 LEU 62 -2.731 7.003 -12.537 1227 HD21 LEU 62 HD21 LEU 62 0.666 8.438 -12.864 1228 HD22 LEU 62 HD22 LEU 62 1.234 7.287 -14.072 1229 HD23 LEU 62 HD23 LEU 62 1.001 6.768 -12.402 1230 H MET 63 H MET 63 -1.596 3.815 -16.536 1231 HA MET 63 HA MET 63 -1.320 1.231 -15.552 1232 HB2 MET 63 HB2 MET 63 -1.889 2.057 -18.409 1233 HB3 MET 63 HB3 MET 63 -2.182 0.459 -17.738 1234 HG2 MET 63 HG2 MET 63 -3.826 1.390 -16.204 1235 HG3 MET 63 HG3 MET 63 -3.518 3.005 -16.846 1236 HE1 MET 63 HE1 MET 63 -6.055 3.373 -17.344 1237 HE2 MET 63 HE2 MET 63 -6.453 1.772 -16.711 1238 HE3 MET 63 HE3 MET 63 -7.058 2.272 -18.290 1239 H ASP 64 H ASP 64 0.326 2.647 -18.378 1240 HA ASP 64 HA ASP 64 1.941 0.519 -19.099 1241 HB2 ASP 64 HB2 ASP 64 1.675 2.579 -20.419 1242 HB3 ASP 64 HB3 ASP 64 2.599 3.470 -19.219 1243 H LYS 65 H LYS 65 2.641 3.119 -16.787 1244 HA LYS 65 HA LYS 65 5.252 2.384 -16.097 1245 HB2 LYS 65 HB2 LYS 65 3.131 3.727 -14.403 1246 HB3 LYS 65 HB3 LYS 65 4.851 3.710 -14.030 1247 HG2 LYS 65 HG2 LYS 65 5.239 4.876 -16.226 1248 HG3 LYS 65 HG3 LYS 65 3.489 5.032 -16.372 1249 HD2 LYS 65 HD2 LYS 65 4.346 7.092 -15.488 1250 HD3 LYS 65 HD3 LYS 65 3.486 6.260 -14.190 1251 HE2 LYS 65 HE2 LYS 65 5.505 5.611 -13.140 1252 HE3 LYS 65 HE3 LYS 65 6.469 6.019 -14.561 1253 HZ1 LYS 65 HZ1 LYS 65 6.654 7.666 -12.771 1254 HZ2 LYS 65 HZ2 LYS 65 5.000 7.993 -12.893 1255 HZ3 LYS 65 HZ3 LYS 65 6.026 8.333 -14.191 1256 H LEU 66 H LEU 66 2.149 1.222 -14.894 1257 HA LEU 66 HA LEU 66 3.302 -0.483 -12.865 1258 HB2 LEU 66 HB2 LEU 66 0.510 -0.396 -14.025 1259 HB3 LEU 66 HB3 LEU 66 0.987 -1.291 -12.591 1260 HG LEU 66 HG LEU 66 1.167 1.717 -12.848 1261 HD11 LEU 66 HD11 LEU 66 -1.161 1.034 -12.923 1262 HD12 LEU 66 HD12 LEU 66 -0.791 1.802 -11.380 1263 HD13 LEU 66 HD13 LEU 66 -0.940 0.047 -11.479 1264 HD21 LEU 66 HD21 LEU 66 1.481 1.653 -10.417 1265 HD22 LEU 66 HD22 LEU 66 2.755 0.777 -11.262 1266 HD23 LEU 66 HD23 LEU 66 1.458 -0.111 -10.461 1267 H ARG 67 H ARG 67 2.349 -0.812 -16.212 1268 HA ARG 67 HA ARG 67 2.316 -3.679 -16.262 1269 HB2 ARG 67 HB2 ARG 67 2.577 -1.712 -18.553 1270 HB3 ARG 67 HB3 ARG 67 2.284 -3.438 -18.727 1271 HG2 ARG 67 HG2 ARG 67 0.178 -3.060 -17.340 1272 HG3 ARG 67 HG3 ARG 67 0.447 -1.340 -17.608 1273 HD2 ARG 67 HD2 ARG 67 -1.051 -1.987 -19.298 1274 HD3 ARG 67 HD3 ARG 67 0.520 -1.903 -20.097 1275 HE ARG 67 HE ARG 67 -0.495 -4.482 -19.119 1276 HH11 ARG 67 HH11 ARG 67 0.503 -2.485 -21.740 1277 HH12 ARG 67 HH12 ARG 67 0.502 -3.790 -22.871 1278 HH21 ARG 67 HH21 ARG 67 -0.532 -6.138 -20.578 1279 HH22 ARG 67 HH22 ARG 67 -0.089 -5.839 -22.227 1280 H LYS 68 H LYS 68 4.846 -1.529 -15.940 1281 HA LYS 68 HA LYS 68 6.831 -2.714 -17.606 1282 HB2 LYS 68 HB2 LYS 68 7.107 -1.026 -15.109 1283 HB3 LYS 68 HB3 LYS 68 8.438 -1.453 -16.175 1284 HG2 LYS 68 HG2 LYS 68 6.020 0.175 -16.956 1285 HG3 LYS 68 HG3 LYS 68 7.622 0.814 -16.581 1286 HD2 LYS 68 HD2 LYS 68 8.554 -0.503 -18.462 1287 HD3 LYS 68 HD3 LYS 68 6.923 -1.049 -18.858 1288 HE2 LYS 68 HE2 LYS 68 6.236 1.253 -19.281 1289 HE3 LYS 68 HE3 LYS 68 7.839 1.830 -18.824 1290 HZ1 LYS 68 HZ1 LYS 68 7.249 0.037 -21.115 1291 HZ2 LYS 68 HZ2 LYS 68 8.772 0.640 -20.693 1292 HZ3 LYS 68 HZ3 LYS 68 7.566 1.693 -21.224 1293 H VAL 69 H VAL 69 5.411 -3.762 -14.694 1294 HA VAL 69 HA VAL 69 7.727 -5.301 -13.812 1295 HB VAL 69 HB VAL 69 4.939 -5.144 -12.632 1296 HG11 VAL 69 HG11 VAL 69 7.491 -6.315 -11.511 1297 HG12 VAL 69 HG12 VAL 69 6.060 -7.215 -12.016 1298 HG13 VAL 69 HG13 VAL 69 5.976 -6.131 -10.627 1299 HG21 VAL 69 HG21 VAL 69 7.484 -3.732 -11.805 1300 HG22 VAL 69 HG22 VAL 69 5.947 -3.677 -10.940 1301 HG23 VAL 69 HG23 VAL 69 6.075 -2.983 -12.556 1302 H GLN 70 H GLN 70 8.118 -7.191 -14.778 1303 HA GLN 70 HA GLN 70 6.378 -8.649 -16.405 1304 HB2 GLN 70 HB2 GLN 70 8.033 -10.513 -16.152 1305 HB3 GLN 70 HB3 GLN 70 8.742 -8.967 -16.599 1306 HG2 GLN 70 HG2 GLN 70 9.432 -8.602 -14.281 1307 HG3 GLN 70 HG3 GLN 70 8.713 -10.144 -13.824 1308 HE21 GLN 70 HE21 GLN 70 11.488 -9.196 -13.654 1309 HE22 GLN 70 HE22 GLN 70 12.427 -10.360 -14.519 1310 H GLY 71 H GLY 71 6.800 -8.798 -12.929 1311 HA2 GLY 71 HA2 GLY 71 5.577 -11.297 -12.448 1312 HA3 GLY 71 HA3 GLY 71 5.693 -9.979 -11.295 1313 H VAL 72 H VAL 72 4.185 -8.261 -13.351 1314 HA VAL 72 HA VAL 72 1.504 -9.083 -12.512 1315 HB VAL 72 HB VAL 72 2.382 -6.552 -13.923 1316 HG11 VAL 72 HG11 VAL 72 -0.260 -7.240 -12.620 1317 HG12 VAL 72 HG12 VAL 72 0.031 -7.092 -14.354 1318 HG13 VAL 72 HG13 VAL 72 0.176 -5.678 -13.313 1319 HG21 VAL 72 HG21 VAL 72 1.756 -7.038 -11.006 1320 HG22 VAL 72 HG22 VAL 72 2.092 -5.468 -11.737 1321 HG23 VAL 72 HG23 VAL 72 3.347 -6.706 -11.693 1322 H PHE 73 H PHE 73 -0.116 -9.659 -13.916 1323 HA PHE 73 HA PHE 73 0.591 -9.781 -16.776 1324 HB2 PHE 73 HB2 PHE 73 -1.318 -11.713 -16.585 1325 HB3 PHE 73 HB3 PHE 73 0.410 -12.001 -16.515 1326 HD1 PHE 73 HD1 PHE 73 -2.673 -11.776 -14.531 1327 HD2 PHE 73 HD2 PHE 73 1.495 -12.646 -14.480 1328 HE1 PHE 73 HE1 PHE 73 -2.918 -12.815 -12.314 1329 HE2 PHE 73 HE2 PHE 73 1.256 -13.686 -12.265 1330 HZ PHE 73 HZ PHE 73 -0.953 -13.775 -11.181 1331 H THR 74 H THR 74 -1.802 -8.792 -14.442 1332 HA THR 74 HA THR 74 -3.394 -7.719 -16.697 1333 HB THR 74 HB THR 74 -5.411 -8.134 -15.690 1334 HG1 THR 74 HG1 THR 74 -5.665 -7.513 -13.699 1335 HG21 THR 74 HG21 THR 74 -5.456 -10.371 -14.711 1336 HG22 THR 74 HG22 THR 74 -3.718 -10.290 -14.427 1337 HG23 THR 74 HG23 THR 74 -4.341 -10.317 -16.079 1338 H VAL 75 H VAL 75 -3.453 -5.583 -16.800 1339 HA VAL 75 HA VAL 75 -3.531 -4.029 -14.297 1340 HB VAL 75 HB VAL 75 -2.065 -3.162 -16.813 1341 HG11 VAL 75 HG11 VAL 75 -3.076 -1.298 -15.592 1342 HG12 VAL 75 HG12 VAL 75 -1.318 -1.253 -15.477 1343 HG13 VAL 75 HG13 VAL 75 -2.277 -1.823 -14.110 1344 HG21 VAL 75 HG21 VAL 75 -0.937 -4.025 -14.141 1345 HG22 VAL 75 HG22 VAL 75 -0.006 -3.390 -15.498 1346 HG23 VAL 75 HG23 VAL 75 -0.840 -4.937 -15.650 1347 H GLU 76 H GLU 76 -5.609 -3.351 -14.242 1348 HA GLU 76 HA GLU 76 -6.857 -2.409 -16.753 1349 HB2 GLU 76 HB2 GLU 76 -8.131 -4.189 -14.657 1350 HB3 GLU 76 HB3 GLU 76 -8.957 -3.529 -16.063 1351 HG2 GLU 76 HG2 GLU 76 -7.536 -4.809 -17.549 1352 HG3 GLU 76 HG3 GLU 76 -6.591 -5.396 -16.182 1353 H ARG 77 H ARG 77 -8.602 -0.933 -16.529 1354 HA ARG 77 HA ARG 77 -8.257 0.899 -14.314 1355 HB2 ARG 77 HB2 ARG 77 -8.464 1.768 -16.578 1356 HB3 ARG 77 HB3 ARG 77 -10.032 0.996 -16.762 1357 HG2 ARG 77 HG2 ARG 77 -10.858 2.429 -14.875 1358 HG3 ARG 77 HG3 ARG 77 -9.323 3.298 -14.953 1359 HD2 ARG 77 HD2 ARG 77 -11.334 3.021 -17.187 1360 HD3 ARG 77 HD3 ARG 77 -11.055 4.462 -16.213 1361 HE ARG 77 HE ARG 77 -8.709 4.333 -17.197 1362 HH11 ARG 77 HH11 ARG 77 -11.491 3.204 -18.895 1363 HH12 ARG 77 HH12 ARG 77 -10.844 3.628 -20.444 1364 HH21 ARG 77 HH21 ARG 77 -7.906 4.875 -19.194 1365 HH22 ARG 77 HH22 ARG 77 -8.862 4.594 -20.606 1366 H LEU 78 H LEU 78 -9.559 1.106 -12.582 1367 HA LEU 78 HA LEU 78 -12.075 -0.363 -12.433 1368 HB2 LEU 78 HB2 LEU 78 -10.725 1.409 -10.388 1369 HB3 LEU 78 HB3 LEU 78 -12.155 0.436 -10.108 1370 HG LEU 78 HG LEU 78 -9.416 -0.660 -10.781 1371 HD11 LEU 78 HD11 LEU 78 -9.450 0.319 -8.556 1372 HD12 LEU 78 HD12 LEU 78 -9.377 -1.439 -8.457 1373 HD13 LEU 78 HD13 LEU 78 -10.899 -0.602 -8.151 1374 HD21 LEU 78 HD21 LEU 78 -11.190 -2.107 -11.600 1375 HD22 LEU 78 HD22 LEU 78 -11.977 -2.073 -10.022 1376 HD23 LEU 78 HD23 LEU 78 -10.399 -2.840 -10.205 1377 H SER 79 H SER 79 -13.459 0.671 -13.811 1378 HA SER 79 HA SER 79 -13.787 3.537 -13.825 1379 HB2 SER 79 HB2 SER 79 -15.640 3.036 -15.429 1380 HB3 SER 79 HB3 SER 79 -14.103 2.308 -15.891 1381 HG SER 79 HG SER 79 -15.626 0.725 -16.109 1382 H ASN 80 H ASN 80 -16.034 0.865 -13.099 1383 HA ASN 80 HA ASN 80 -17.917 2.574 -11.776 1384 HB2 ASN 80 HB2 ASN 80 -18.614 0.545 -12.977 1385 HB3 ASN 80 HB3 ASN 80 -17.714 -0.452 -11.840 1386 HD21 ASN 80 HD21 ASN 80 -19.581 2.369 -10.903 1387 HD22 ASN 80 HD22 ASN 80 -20.791 1.495 -10.042 1388 H LEU 81 H LEU 81 -17.323 3.513 -9.903 1389 HA LEU 81 HA LEU 81 -15.897 1.920 -7.870 1390 HB2 LEU 81 HB2 LEU 81 -16.216 4.919 -8.058 1391 HB3 LEU 81 HB3 LEU 81 -15.231 4.054 -6.894 1392 HG LEU 81 HG LEU 81 -14.745 4.128 -9.879 1393 HD11 LEU 81 HD11 LEU 81 -12.802 5.509 -9.301 1394 HD12 LEU 81 HD12 LEU 81 -13.312 5.514 -7.611 1395 HD13 LEU 81 HD13 LEU 81 -14.318 6.284 -8.839 1396 HD21 LEU 81 HD21 LEU 81 -13.118 2.911 -7.639 1397 HD22 LEU 81 HD22 LEU 81 -12.603 3.050 -9.320 1398 HD23 LEU 81 HD23 LEU 81 -13.982 2.034 -8.904 1399 H GLU 82 H GLU 82 -16.502 2.239 -5.607 1400 HA GLU 82 HA GLU 82 -19.375 2.833 -5.273 1401 HB2 GLU 82 HB2 GLU 82 -19.379 1.199 -3.430 1402 HB3 GLU 82 HB3 GLU 82 -18.894 0.472 -4.956 1403 HG2 GLU 82 HG2 GLU 82 -16.533 0.627 -4.248 1404 HG3 GLU 82 HG3 GLU 82 -17.064 1.278 -2.697 1405 H HIS 83 H HIS 83 -17.085 4.722 -4.993 1406 HA HIS 83 HA HIS 83 -16.809 5.268 -2.157 1407 HB2 HIS 83 HB2 HIS 83 -15.993 6.867 -4.603 1408 HB3 HIS 83 HB3 HIS 83 -15.607 7.320 -2.950 1409 HD1 HIS 83 HD1 HIS 83 -13.333 6.685 -2.285 1410 HD2 HIS 83 HD2 HIS 83 -14.854 4.086 -5.149 1411 HE1 HIS 83 HE1 HIS 83 -11.445 5.128 -2.848 1412 HE2 HIS 83 HE2 HIS 83 -12.452 3.446 -4.424 1413 H HIS 84 H HIS 84 -19.533 5.224 -2.934 1414 HA HIS 84 HA HIS 84 -20.411 7.946 -3.426 1415 HB2 HIS 84 HB2 HIS 84 -22.717 6.879 -3.410 1416 HB3 HIS 84 HB3 HIS 84 -21.614 6.321 -4.659 1417 HD1 HIS 84 HD1 HIS 84 -21.756 3.879 -4.989 1418 HD2 HIS 84 HD2 HIS 84 -22.517 4.927 -1.036 1419 HE1 HIS 84 HE1 HIS 84 -22.203 1.724 -3.790 1420 HE2 HIS 84 HE2 HIS 84 -22.806 2.394 -1.441 1421 H HIS 85 H HIS 85 -20.899 9.374 -1.881 1422 HA HIS 85 HA HIS 85 -21.812 8.388 0.746 1423 HB2 HIS 85 HB2 HIS 85 -20.720 11.084 -0.088 1424 HB3 HIS 85 HB3 HIS 85 -21.403 10.762 1.503 1425 HD1 HIS 85 HD1 HIS 85 -18.280 10.708 -0.296 1426 HD2 HIS 85 HD2 HIS 85 -19.895 8.600 2.899 1427 HE1 HIS 85 HE1 HIS 85 -16.324 9.668 0.876 1428 HE2 HIS 85 HE2 HIS 85 -17.336 8.279 2.712 1429 H HIS 86 H HIS 86 -22.997 9.495 -2.148 1430 HA HIS 86 HA HIS 86 -25.559 10.282 -0.903 1431 HB2 HIS 86 HB2 HIS 86 -24.306 11.295 -3.465 1432 HB3 HIS 86 HB3 HIS 86 -25.996 11.555 -3.052 1433 HD1 HIS 86 HD1 HIS 86 -26.526 13.315 -1.271 1434 HD2 HIS 86 HD2 HIS 86 -22.457 12.833 -1.970 1435 HE1 HIS 86 HE1 HIS 86 -25.422 15.272 -0.165 1436 HE2 HIS 86 HE2 HIS 86 -22.975 15.008 -0.661 1437 H HIS 87 H HIS 87 -27.469 9.515 -1.919 1438 HA HIS 87 HA HIS 87 -27.324 7.814 -4.252 1439 HB2 HIS 87 HB2 HIS 87 -28.216 5.802 -3.195 1440 HB3 HIS 87 HB3 HIS 87 -26.686 6.239 -2.441 1441 HD1 HIS 87 HD1 HIS 87 -30.417 6.493 -1.783 1442 HD2 HIS 87 HD2 HIS 87 -26.808 6.568 0.285 1443 HE1 HIS 87 HE1 HIS 87 -31.031 6.485 0.649 1444 HE2 HIS 87 HE2 HIS 87 -28.842 6.356 1.870 1445 H HIS 88 H HIS 88 -29.375 7.452 -5.206 1446 HA HIS 88 HA HIS 88 -31.549 9.083 -4.142 1447 HB2 HIS 88 HB2 HIS 88 -32.715 8.474 -6.292 1448 HB3 HIS 88 HB3 HIS 88 -31.198 9.339 -6.488 1449 HD1 HIS 88 HD1 HIS 88 -32.636 5.857 -6.822 1450 HD2 HIS 88 HD2 HIS 88 -29.330 8.051 -8.052 1451 HE1 HIS 88 HE1 HIS 88 -31.458 4.411 -8.498 1452 HE2 HIS 88 HE2 HIS 88 -29.369 5.681 -9.086 Start of MODEL 10 1 H1 MET 1 H1 MET 1 13.015 -20.249 11.053 2 H2 MET 1 H2 MET 1 12.504 -21.751 11.635 3 H3 MET 1 H3 MET 1 13.784 -20.945 12.389 4 HA MET 1 HA MET 1 11.781 -20.750 13.700 5 HB2 MET 1 HB2 MET 1 12.697 -18.199 12.352 6 HB3 MET 1 HB3 MET 1 11.678 -18.233 13.785 7 HG2 MET 1 HG2 MET 1 13.420 -19.301 15.061 8 HG3 MET 1 HG3 MET 1 14.429 -19.452 13.624 9 HE1 MET 1 HE1 MET 1 15.752 -17.507 12.514 10 HE2 MET 1 HE2 MET 1 15.486 -15.802 12.881 11 HE3 MET 1 HE3 MET 1 14.203 -16.753 12.134 12 H THR 2 H THR 2 9.603 -20.009 13.912 13 HA THR 2 HA THR 2 8.114 -20.259 11.399 14 HB THR 2 HB THR 2 7.176 -20.465 14.274 15 HG1 THR 2 HG1 THR 2 8.006 -22.401 13.950 16 HG21 THR 2 HG21 THR 2 5.628 -20.948 11.716 17 HG22 THR 2 HG22 THR 2 5.374 -19.606 12.833 18 HG23 THR 2 HG23 THR 2 5.045 -21.259 13.350 19 H ASP 3 H ASP 3 7.176 -18.578 10.440 20 HA ASP 3 HA ASP 3 6.947 -16.010 11.795 21 HB2 ASP 3 HB2 ASP 3 6.333 -16.839 8.944 22 HB3 ASP 3 HB3 ASP 3 6.199 -15.194 9.552 23 H PHE 4 H PHE 4 4.987 -14.862 12.083 24 HA PHE 4 HA PHE 4 2.490 -16.297 11.482 25 HB2 PHE 4 HB2 PHE 4 1.469 -15.515 13.542 26 HB3 PHE 4 HB3 PHE 4 2.923 -16.424 13.923 27 HD1 PHE 4 HD1 PHE 4 1.467 -13.026 13.745 28 HD2 PHE 4 HD2 PHE 4 4.742 -15.400 15.092 29 HE1 PHE 4 HE1 PHE 4 2.273 -11.141 15.099 30 HE2 PHE 4 HE2 PHE 4 5.548 -13.511 16.449 31 HZ PHE 4 HZ PHE 4 4.318 -11.372 16.442 32 H LEU 5 H LEU 5 0.645 -14.892 11.112 33 HA LEU 5 HA LEU 5 1.455 -12.623 9.533 34 HB2 LEU 5 HB2 LEU 5 -0.279 -14.156 8.756 35 HB3 LEU 5 HB3 LEU 5 -1.270 -13.754 10.141 36 HG LEU 5 HG LEU 5 -1.565 -11.466 9.308 37 HD11 LEU 5 HD11 LEU 5 -0.715 -10.809 7.107 38 HD12 LEU 5 HD12 LEU 5 0.138 -12.347 6.971 39 HD13 LEU 5 HD13 LEU 5 0.604 -11.188 8.215 40 HD21 LEU 5 HD21 LEU 5 -2.906 -11.967 7.333 41 HD22 LEU 5 HD22 LEU 5 -3.137 -13.198 8.575 42 HD23 LEU 5 HD23 LEU 5 -2.114 -13.535 7.178 43 H ALA 6 H ALA 6 2.012 -10.838 10.617 44 HA ALA 6 HA ALA 6 0.445 -9.946 12.930 45 HB1 ALA 6 HB1 ALA 6 2.889 -10.096 13.157 46 HB2 ALA 6 HB2 ALA 6 2.298 -8.451 13.389 47 HB3 ALA 6 HB3 ALA 6 3.073 -8.906 11.869 48 H GLY 7 H GLY 7 -0.830 -8.153 12.894 49 HA2 GLY 7 HA2 GLY 7 -0.958 -6.628 10.369 50 HA3 GLY 7 HA3 GLY 7 -2.295 -6.844 11.484 51 H ILE 8 H ILE 8 -0.823 -4.450 10.315 52 HA ILE 8 HA ILE 8 -0.555 -2.971 12.864 53 HB ILE 8 HB ILE 8 1.021 -2.367 10.343 54 HG12 ILE 8 HG12 ILE 8 1.988 -3.716 12.888 55 HG13 ILE 8 HG13 ILE 8 1.776 -4.507 11.330 56 HG21 ILE 8 HG21 ILE 8 1.233 -1.271 13.150 57 HG22 ILE 8 HG22 ILE 8 0.600 -0.423 11.740 58 HG23 ILE 8 HG23 ILE 8 2.304 -0.867 11.806 59 HD11 ILE 8 HD11 ILE 8 3.528 -3.087 10.373 60 HD12 ILE 8 HD12 ILE 8 4.113 -4.014 11.754 61 HD13 ILE 8 HD13 ILE 8 3.739 -2.302 11.940 62 H ARG 9 H ARG 9 -1.763 -1.085 12.970 63 HA ARG 9 HA ARG 9 -2.924 -0.097 10.435 64 HB2 ARG 9 HB2 ARG 9 -4.725 -0.943 11.783 65 HB3 ARG 9 HB3 ARG 9 -4.157 -0.062 13.197 66 HG2 ARG 9 HG2 ARG 9 -4.816 2.018 12.304 67 HG3 ARG 9 HG3 ARG 9 -5.001 1.354 10.679 68 HD2 ARG 9 HD2 ARG 9 -6.720 0.603 13.049 69 HD3 ARG 9 HD3 ARG 9 -7.159 1.803 11.831 70 HE ARG 9 HE ARG 9 -6.531 -0.891 10.920 71 HH11 ARG 9 HH11 ARG 9 -8.895 1.527 11.511 72 HH12 ARG 9 HH12 ARG 9 -10.132 0.706 10.633 73 HH21 ARG 9 HH21 ARG 9 -8.118 -1.970 9.803 74 HH22 ARG 9 HH22 ARG 9 -9.689 -1.260 9.656 75 H ILE 10 H ILE 10 -2.357 1.840 9.821 76 HA ILE 10 HA ILE 10 -1.129 3.711 11.758 77 HB ILE 10 HB ILE 10 -0.794 3.703 8.749 78 HG12 ILE 10 HG12 ILE 10 1.163 2.575 10.765 79 HG13 ILE 10 HG13 ILE 10 0.043 1.581 9.839 80 HG21 ILE 10 HG21 ILE 10 0.769 5.048 10.954 81 HG22 ILE 10 HG22 ILE 10 -0.308 5.832 9.798 82 HG23 ILE 10 HG23 ILE 10 1.189 5.084 9.241 83 HD11 ILE 10 HD11 ILE 10 1.078 2.400 7.764 84 HD12 ILE 10 HD12 ILE 10 2.212 1.550 8.813 85 HD13 ILE 10 HD13 ILE 10 2.238 3.313 8.730 86 H VAL 11 H VAL 11 -2.517 5.359 12.282 87 HA VAL 11 HA VAL 11 -4.230 6.423 10.118 88 HB VAL 11 HB VAL 11 -4.753 6.448 13.099 89 HG11 VAL 11 HG11 VAL 11 -6.416 7.620 10.862 90 HG12 VAL 11 HG12 VAL 11 -5.514 8.537 12.069 91 HG13 VAL 11 HG13 VAL 11 -6.879 7.535 12.563 92 HG21 VAL 11 HG21 VAL 11 -6.684 5.044 12.527 93 HG22 VAL 11 HG22 VAL 11 -5.175 4.282 12.025 94 HG23 VAL 11 HG23 VAL 11 -6.206 5.070 10.827 95 H GLY 12 H GLY 12 -3.506 8.233 9.319 96 HA2 GLY 12 HA2 GLY 12 -2.365 10.296 11.102 97 HA3 GLY 12 HA3 GLY 12 -1.482 9.801 9.665 98 H GLU 13 H GLU 13 -1.945 12.375 9.722 99 HA GLU 13 HA GLU 13 -4.539 13.149 8.769 100 HB2 GLU 13 HB2 GLU 13 -3.480 15.395 8.511 101 HB3 GLU 13 HB3 GLU 13 -3.320 14.699 10.117 102 HG2 GLU 13 HG2 GLU 13 -1.007 13.953 9.461 103 HG3 GLU 13 HG3 GLU 13 -1.199 14.908 7.990 104 H ASP 14 H ASP 14 -5.252 13.480 6.741 105 HA ASP 14 HA ASP 14 -3.832 12.317 4.564 106 HB2 ASP 14 HB2 ASP 14 -6.251 12.144 4.691 107 HB3 ASP 14 HB3 ASP 14 -6.415 13.895 4.632 108 H LYS 15 H LYS 15 -1.882 13.652 4.532 109 HA LYS 15 HA LYS 15 -2.235 16.154 3.052 110 HB2 LYS 15 HB2 LYS 15 0.023 14.911 4.546 111 HB3 LYS 15 HB3 LYS 15 0.402 16.024 3.239 112 HG2 LYS 15 HG2 LYS 15 -0.834 17.779 4.292 113 HG3 LYS 15 HG3 LYS 15 -1.405 16.679 5.555 114 HD2 LYS 15 HD2 LYS 15 0.767 16.451 6.472 115 HD3 LYS 15 HD3 LYS 15 1.522 17.204 5.065 116 HE2 LYS 15 HE2 LYS 15 1.501 18.773 6.876 117 HE3 LYS 15 HE3 LYS 15 0.372 19.308 5.636 118 HZ1 LYS 15 HZ1 LYS 15 -0.351 17.918 8.152 119 HZ2 LYS 15 HZ2 LYS 15 -1.441 18.422 6.962 120 HZ3 LYS 15 HZ3 LYS 15 -0.559 19.563 7.835 121 H ASN 16 H ASN 16 -0.982 16.567 1.179 122 HA ASN 16 HA ASN 16 -1.474 14.913 -0.938 123 HB2 ASN 16 HB2 ASN 16 0.098 16.347 -2.203 124 HB3 ASN 16 HB3 ASN 16 -0.977 17.276 -1.161 125 HD21 ASN 16 HD21 ASN 16 -0.143 18.348 0.612 126 HD22 ASN 16 HD22 ASN 16 1.553 18.572 0.845 127 H GLY 17 H GLY 17 1.386 14.821 1.126 128 HA2 GLY 17 HA2 GLY 17 2.490 12.686 -0.610 129 HA3 GLY 17 HA3 GLY 17 3.480 13.786 0.329 130 H MET 18 H MET 18 0.893 12.955 2.261 131 HA MET 18 HA MET 18 2.617 11.414 3.973 132 HB2 MET 18 HB2 MET 18 -0.196 12.438 4.173 133 HB3 MET 18 HB3 MET 18 0.348 11.209 5.307 134 HG2 MET 18 HG2 MET 18 1.664 13.886 4.878 135 HG3 MET 18 HG3 MET 18 0.575 13.478 6.203 136 HE1 MET 18 HE1 MET 18 1.115 11.363 7.853 137 HE2 MET 18 HE2 MET 18 2.687 10.566 7.907 138 HE3 MET 18 HE3 MET 18 1.634 10.340 6.512 139 H THR 19 H THR 19 -0.463 10.617 2.325 140 HA THR 19 HA THR 19 -0.567 7.915 3.085 141 HB THR 19 HB THR 19 -2.069 7.610 1.125 142 HG1 THR 19 HG1 THR 19 -2.457 9.451 -0.204 143 HG21 THR 19 HG21 THR 19 -2.574 10.166 2.667 144 HG22 THR 19 HG22 THR 19 -2.985 8.537 3.208 145 HG23 THR 19 HG23 THR 19 -3.788 9.228 1.798 146 H ASN 20 H ASN 20 1.161 9.528 0.518 147 HA ASN 20 HA ASN 20 1.931 7.166 -0.903 148 HB2 ASN 20 HB2 ASN 20 3.072 9.974 -0.949 149 HB3 ASN 20 HB3 ASN 20 3.474 8.702 -2.099 150 HD21 ASN 20 HD21 ASN 20 2.103 8.286 -3.753 151 HD22 ASN 20 HD22 ASN 20 0.677 9.202 -4.072 152 H GLN 21 H GLN 21 3.573 9.352 1.383 153 HA GLN 21 HA GLN 21 6.059 8.006 1.320 154 HB2 GLN 21 HB2 GLN 21 6.758 9.464 3.010 155 HB3 GLN 21 HB3 GLN 21 5.560 10.394 2.132 156 HG2 GLN 21 HG2 GLN 21 3.908 9.939 3.850 157 HG3 GLN 21 HG3 GLN 21 5.054 8.918 4.715 158 HE21 GLN 21 HE21 GLN 21 5.796 11.988 3.167 159 HE22 GLN 21 HE22 GLN 21 6.170 12.827 4.625 160 H ILE 22 H ILE 22 3.211 7.648 3.371 161 HA ILE 22 HA ILE 22 4.357 6.067 5.397 162 HB ILE 22 HB ILE 22 1.541 6.435 4.411 163 HG12 ILE 22 HG12 ILE 22 2.530 8.250 5.698 164 HG13 ILE 22 HG13 ILE 22 1.266 7.471 6.643 165 HG21 ILE 22 HG21 ILE 22 0.709 5.113 6.319 166 HG22 ILE 22 HG22 ILE 22 2.360 4.597 6.669 167 HG23 ILE 22 HG23 ILE 22 1.590 4.124 5.155 168 HD11 ILE 22 HD11 ILE 22 3.191 7.985 8.016 169 HD12 ILE 22 HD12 ILE 22 4.227 7.033 6.953 170 HD13 ILE 22 HD13 ILE 22 2.964 6.241 7.896 171 H THR 23 H THR 23 2.403 4.993 2.592 172 HA THR 23 HA THR 23 2.975 2.243 3.120 173 HB THR 23 HB THR 23 2.038 3.213 0.419 174 HG1 THR 23 HG1 THR 23 0.405 4.123 1.432 175 HG21 THR 23 HG21 THR 23 2.486 0.809 0.743 176 HG22 THR 23 HG22 THR 23 0.775 1.127 0.455 177 HG23 THR 23 HG23 THR 23 1.346 0.789 2.090 178 H GLY 24 H GLY 24 4.472 4.760 1.201 179 HA2 GLY 24 HA2 GLY 24 6.283 3.252 -0.312 180 HA3 GLY 24 HA3 GLY 24 6.583 4.871 0.300 181 H VAL 25 H VAL 25 6.779 4.635 2.957 182 HA VAL 25 HA VAL 25 9.253 3.413 3.478 183 HB VAL 25 HB VAL 25 7.079 4.217 5.431 184 HG11 VAL 25 HG11 VAL 25 9.983 3.562 5.981 185 HG12 VAL 25 HG12 VAL 25 8.594 2.584 6.459 186 HG13 VAL 25 HG13 VAL 25 8.824 4.189 7.154 187 HG21 VAL 25 HG21 VAL 25 7.941 6.067 4.079 188 HG22 VAL 25 HG22 VAL 25 9.591 5.645 4.534 189 HG23 VAL 25 HG23 VAL 25 8.460 6.225 5.757 190 H ILE 26 H ILE 26 5.950 2.263 4.071 191 HA ILE 26 HA ILE 26 6.458 -0.130 5.375 192 HB ILE 26 HB ILE 26 4.326 0.611 3.376 193 HG12 ILE 26 HG12 ILE 26 4.278 0.217 6.382 194 HG13 ILE 26 HG13 ILE 26 4.264 1.766 5.547 195 HG21 ILE 26 HG21 ILE 26 4.514 -1.956 4.950 196 HG22 ILE 26 HG22 ILE 26 4.597 -1.786 3.197 197 HG23 ILE 26 HG23 ILE 26 3.098 -1.415 4.047 198 HD11 ILE 26 HD11 ILE 26 2.092 1.204 4.565 199 HD12 ILE 26 HD12 ILE 26 2.052 1.189 6.328 200 HD13 ILE 26 HD13 ILE 26 2.105 -0.331 5.435 201 H SER 27 H SER 27 6.367 0.425 1.843 202 HA SER 27 HA SER 27 6.931 -2.258 1.128 203 HB2 SER 27 HB2 SER 27 7.328 -1.452 -1.115 204 HB3 SER 27 HB3 SER 27 5.979 -0.543 -0.437 205 HG SER 27 HG SER 27 7.377 1.186 -0.068 206 H LYS 28 H LYS 28 8.976 0.277 2.262 207 HA LYS 28 HA LYS 28 11.448 -0.701 1.177 208 HB2 LYS 28 HB2 LYS 28 10.969 1.180 3.503 209 HB3 LYS 28 HB3 LYS 28 12.517 0.903 2.715 210 HG2 LYS 28 HG2 LYS 28 11.658 1.858 0.647 211 HG3 LYS 28 HG3 LYS 28 10.075 2.085 1.396 212 HD2 LYS 28 HD2 LYS 28 11.122 3.583 3.068 213 HD3 LYS 28 HD3 LYS 28 12.665 3.404 2.229 214 HE2 LYS 28 HE2 LYS 28 10.137 4.530 1.015 215 HE3 LYS 28 HE3 LYS 28 11.483 5.491 1.627 216 HZ1 LYS 28 HZ1 LYS 28 11.623 5.244 -0.754 217 HZ2 LYS 28 HZ2 LYS 28 11.602 3.560 -0.627 218 HZ3 LYS 28 HZ3 LYS 28 12.914 4.435 -0.025 219 H PHE 29 H PHE 29 9.480 -1.967 3.576 220 HA PHE 29 HA PHE 29 11.418 -2.713 5.524 221 HB2 PHE 29 HB2 PHE 29 8.679 -3.837 4.924 222 HB3 PHE 29 HB3 PHE 29 9.674 -4.381 6.266 223 HD1 PHE 29 HD2 PHE 29 10.718 -1.347 6.633 224 HD2 PHE 29 HD1 PHE 29 6.919 -3.277 6.542 225 HE1 PHE 29 HE2 PHE 29 9.779 0.440 8.037 226 HE2 PHE 29 HE1 PHE 29 5.980 -1.489 7.948 227 HZ PHE 29 HZ PHE 29 7.408 0.370 8.700 228 H ASP 30 H ASP 30 11.834 -5.025 6.095 229 HA ASP 30 HA ASP 30 13.036 -6.387 3.845 230 HB2 ASP 30 HB2 ASP 30 13.888 -7.931 5.641 231 HB3 ASP 30 HB3 ASP 30 14.315 -6.239 5.880 232 H THR 31 H THR 31 10.157 -6.698 5.726 233 HA THR 31 HA THR 31 9.747 -9.506 5.109 234 HB THR 31 HB THR 31 9.066 -8.827 7.298 235 HG1 THR 31 HG1 THR 31 7.235 -9.930 7.240 236 HG21 THR 31 HG21 THR 31 8.704 -6.445 6.871 237 HG22 THR 31 HG22 THR 31 7.330 -7.160 7.714 238 HG23 THR 31 HG23 THR 31 7.224 -6.823 5.986 239 H ASN 32 H ASN 32 7.688 -10.272 4.190 240 HA ASN 32 HA ASN 32 7.204 -8.860 1.679 241 HB2 ASN 32 HB2 ASN 32 7.865 -11.217 1.599 242 HB3 ASN 32 HB3 ASN 32 6.475 -11.657 2.580 243 HD21 ASN 32 HD21 ASN 32 6.446 -9.319 -0.060 244 HD22 ASN 32 HD22 ASN 32 5.417 -10.253 -1.086 245 H ILE 33 H ILE 33 5.398 -7.733 1.283 246 HA ILE 33 HA ILE 33 3.299 -7.547 3.239 247 HB ILE 33 HB ILE 33 3.443 -6.317 0.473 248 HG12 ILE 33 HG12 ILE 33 4.216 -5.127 3.155 249 HG13 ILE 33 HG13 ILE 33 5.353 -5.681 1.932 250 HG21 ILE 33 HG21 ILE 33 1.726 -5.607 2.859 251 HG22 ILE 33 HG22 ILE 33 1.171 -6.346 1.356 252 HG23 ILE 33 HG23 ILE 33 1.804 -4.701 1.348 253 HD11 ILE 33 HD11 ILE 33 5.118 -3.270 1.893 254 HD12 ILE 33 HD12 ILE 33 3.384 -3.427 1.616 255 HD13 ILE 33 HD13 ILE 33 4.526 -3.981 0.391 256 H ARG 34 H ARG 34 1.761 -9.108 3.382 257 HA ARG 34 HA ARG 34 0.887 -10.481 0.943 258 HB2 ARG 34 HB2 ARG 34 0.423 -11.047 3.873 259 HB3 ARG 34 HB3 ARG 34 -0.365 -11.955 2.585 260 HG2 ARG 34 HG2 ARG 34 2.622 -11.704 2.940 261 HG3 ARG 34 HG3 ARG 34 1.650 -13.083 3.462 262 HD2 ARG 34 HD2 ARG 34 1.060 -13.623 1.205 263 HD3 ARG 34 HD3 ARG 34 1.738 -12.110 0.604 264 HE ARG 34 HE ARG 34 3.886 -12.985 0.857 265 HH11 ARG 34 HH11 ARG 34 1.478 -15.268 1.757 266 HH12 ARG 34 HH12 ARG 34 2.565 -16.605 1.698 267 HH21 ARG 34 HH21 ARG 34 5.265 -14.698 0.762 268 HH22 ARG 34 HH22 ARG 34 4.689 -16.289 1.110 269 H THR 35 H THR 35 -0.209 -8.068 3.147 270 HA THR 35 HA THR 35 -2.424 -7.471 1.380 271 HB THR 35 HB THR 35 -3.112 -7.829 4.302 272 HG1 THR 35 HG1 THR 35 -3.277 -9.697 2.178 273 HG21 THR 35 HG21 THR 35 -4.833 -7.549 1.833 274 HG22 THR 35 HG22 THR 35 -4.535 -6.295 3.038 275 HG23 THR 35 HG23 THR 35 -5.424 -7.753 3.482 276 H ILE 36 H ILE 36 -2.925 -5.302 1.410 277 HA ILE 36 HA ILE 36 -2.265 -3.714 3.759 278 HB ILE 36 HB ILE 36 -0.240 -3.576 2.322 279 HG12 ILE 36 HG12 ILE 36 -1.151 -1.646 3.794 280 HG13 ILE 36 HG13 ILE 36 0.122 -1.283 2.636 281 HG21 ILE 36 HG21 ILE 36 -1.230 -3.838 0.138 282 HG22 ILE 36 HG22 ILE 36 -0.326 -2.321 0.203 283 HG23 ILE 36 HG23 ILE 36 -2.087 -2.305 0.303 284 HD11 ILE 36 HD11 ILE 36 -2.814 -0.735 2.270 285 HD12 ILE 36 HD12 ILE 36 -1.542 -0.349 1.112 286 HD13 ILE 36 HD13 ILE 36 -1.577 0.450 2.684 287 H VAL 37 H VAL 37 -3.787 -2.188 4.158 288 HA VAL 37 HA VAL 37 -5.571 -1.384 1.954 289 HB VAL 37 HB VAL 37 -6.514 -2.212 4.713 290 HG11 VAL 37 HG11 VAL 37 -8.797 -1.836 3.805 291 HG12 VAL 37 HG12 VAL 37 -8.072 -1.112 2.369 292 HG13 VAL 37 HG13 VAL 37 -7.852 -0.354 3.948 293 HG21 VAL 37 HG21 VAL 37 -7.729 -3.997 3.533 294 HG22 VAL 37 HG22 VAL 37 -5.985 -4.137 3.318 295 HG23 VAL 37 HG23 VAL 37 -6.985 -3.493 2.014 296 H LEU 38 H LEU 38 -4.934 0.705 1.754 297 HA LEU 38 HA LEU 38 -5.094 2.446 4.133 298 HB2 LEU 38 HB2 LEU 38 -2.940 2.471 2.890 299 HB3 LEU 38 HB3 LEU 38 -3.789 2.999 1.452 300 HG LEU 38 HG LEU 38 -3.825 4.657 3.984 301 HD11 LEU 38 HD11 LEU 38 -1.761 4.767 1.781 302 HD12 LEU 38 HD12 LEU 38 -1.482 4.281 3.453 303 HD13 LEU 38 HD13 LEU 38 -1.938 5.944 3.084 304 HD21 LEU 38 HD21 LEU 38 -5.450 5.299 2.295 305 HD22 LEU 38 HD22 LEU 38 -4.191 5.355 1.061 306 HD23 LEU 38 HD23 LEU 38 -4.177 6.514 2.391 307 H ASN 39 H ASN 39 -7.028 3.391 4.322 308 HA ASN 39 HA ASN 39 -8.269 4.500 1.891 309 HB2 ASN 39 HB2 ASN 39 -10.520 3.950 3.117 310 HB3 ASN 39 HB3 ASN 39 -9.693 2.713 2.181 311 HD21 ASN 39 HD21 ASN 39 -10.639 3.733 5.340 312 HD22 ASN 39 HD22 ASN 39 -10.171 2.284 6.153 313 H ALA 40 H ALA 40 -8.265 6.609 2.037 314 HA ALA 40 HA ALA 40 -8.213 7.965 4.604 315 HB1 ALA 40 HB1 ALA 40 -6.726 8.686 2.791 316 HB2 ALA 40 HB2 ALA 40 -7.808 9.984 3.295 317 HB3 ALA 40 HB3 ALA 40 -8.126 9.098 1.802 318 H LYS 41 H LYS 41 -9.768 9.111 5.501 319 HA LYS 41 HA LYS 41 -12.331 9.454 4.096 320 HB2 LYS 41 HB2 LYS 41 -13.484 9.190 6.236 321 HB3 LYS 41 HB3 LYS 41 -12.527 7.766 5.872 322 HG2 LYS 41 HG2 LYS 41 -11.594 9.950 7.725 323 HG3 LYS 41 HG3 LYS 41 -12.500 8.542 8.267 324 HD2 LYS 41 HD2 LYS 41 -9.804 8.505 6.895 325 HD3 LYS 41 HD3 LYS 41 -10.095 8.237 8.613 326 HE2 LYS 41 HE2 LYS 41 -11.061 6.501 6.336 327 HE3 LYS 41 HE3 LYS 41 -9.764 6.118 7.462 328 HZ1 LYS 41 HZ1 LYS 41 -12.653 6.383 8.080 329 HZ2 LYS 41 HZ2 LYS 41 -11.453 6.229 9.260 330 HZ3 LYS 41 HZ3 LYS 41 -11.712 4.981 8.152 331 H ASP 42 H ASP 42 -13.230 10.987 6.567 332 HA ASP 42 HA ASP 42 -12.910 13.563 5.668 333 HB2 ASP 42 HB2 ASP 42 -13.278 12.741 8.556 334 HB3 ASP 42 HB3 ASP 42 -13.760 14.271 7.825 335 H GLY 43 H GLY 43 -10.669 13.873 5.109 336 HA2 GLY 43 HA2 GLY 43 -8.692 14.992 5.452 337 HA3 GLY 43 HA3 GLY 43 -9.290 15.426 7.041 338 H ILE 44 H ILE 44 -9.259 12.065 6.731 339 HA ILE 44 HA ILE 44 -6.532 11.843 7.857 340 HB ILE 44 HB ILE 44 -8.773 10.158 8.959 341 HG12 ILE 44 HG12 ILE 44 -7.984 12.916 9.932 342 HG13 ILE 44 HG13 ILE 44 -9.556 12.409 9.320 343 HG21 ILE 44 HG21 ILE 44 -6.151 11.080 10.147 344 HG22 ILE 44 HG22 ILE 44 -6.453 9.502 9.418 345 HG23 ILE 44 HG23 ILE 44 -7.301 9.966 10.893 346 HD11 ILE 44 HD11 ILE 44 -9.834 10.934 11.240 347 HD12 ILE 44 HD12 ILE 44 -9.565 12.604 11.740 348 HD13 ILE 44 HD13 ILE 44 -8.253 11.429 11.849 349 H PHE 45 H PHE 45 -5.651 9.609 7.747 350 HA PHE 45 HA PHE 45 -7.102 7.823 5.909 351 HB2 PHE 45 HB2 PHE 45 -5.132 7.286 4.657 352 HB3 PHE 45 HB3 PHE 45 -5.263 9.040 4.689 353 HD1 PHE 45 HD1 PHE 45 -3.395 6.133 5.942 354 HD2 PHE 45 HD2 PHE 45 -3.608 10.391 5.824 355 HE1 PHE 45 HE1 PHE 45 -1.106 6.271 6.827 356 HE2 PHE 45 HE2 PHE 45 -1.319 10.526 6.710 357 HZ PHE 45 HZ PHE 45 -0.073 8.465 7.217 358 H THR 46 H THR 46 -6.774 5.600 6.208 359 HA THR 46 HA THR 46 -5.137 4.813 8.539 360 HB THR 46 HB THR 46 -7.345 4.582 9.358 361 HG1 THR 46 HG1 THR 46 -6.990 1.940 8.444 362 HG21 THR 46 HG21 THR 46 -8.071 3.142 6.804 363 HG22 THR 46 HG22 THR 46 -8.554 4.781 7.240 364 HG23 THR 46 HG23 THR 46 -9.139 3.409 8.181 365 H CYS 47 H CYS 47 -3.461 3.703 7.793 366 HA CYS 47 HA CYS 47 -3.797 1.910 5.474 367 HB2 CYS 47 HB2 CYS 47 -2.040 3.626 5.275 368 HB3 CYS 47 HB3 CYS 47 -1.255 2.993 6.718 369 HG CYS 47 HG CYS 47 -0.570 2.233 3.717 370 H ASN 48 H ASN 48 -4.093 -0.178 5.939 371 HA ASN 48 HA ASN 48 -3.052 -1.309 8.438 372 HB2 ASN 48 HB2 ASN 48 -4.965 -2.505 6.409 373 HB3 ASN 48 HB3 ASN 48 -4.506 -3.241 7.942 374 HD21 ASN 48 HD21 ASN 48 -7.131 -2.506 7.001 375 HD22 ASN 48 HD22 ASN 48 -7.760 -1.355 8.120 376 H LEU 49 H LEU 49 -1.071 -2.185 8.321 377 HA LEU 49 HA LEU 49 -0.149 -3.433 5.830 378 HB2 LEU 49 HB2 LEU 49 1.395 -1.854 6.765 379 HB3 LEU 49 HB3 LEU 49 1.289 -2.598 8.350 380 HG LEU 49 HG LEU 49 2.431 -4.600 7.510 381 HD11 LEU 49 HD11 LEU 49 3.433 -4.600 5.261 382 HD12 LEU 49 HD12 LEU 49 2.567 -3.109 4.891 383 HD13 LEU 49 HD13 LEU 49 1.671 -4.591 5.217 384 HD21 LEU 49 HD21 LEU 49 3.922 -2.057 6.853 385 HD22 LEU 49 HD22 LEU 49 4.644 -3.629 7.198 386 HD23 LEU 49 HD23 LEU 49 3.758 -2.771 8.458 387 H MET 50 H MET 50 -0.216 -5.570 5.587 388 HA MET 50 HA MET 50 -0.305 -7.279 7.995 389 HB2 MET 50 HB2 MET 50 -1.513 -7.853 5.285 390 HB3 MET 50 HB3 MET 50 -1.639 -8.864 6.720 391 HG2 MET 50 HG2 MET 50 -2.800 -6.108 6.354 392 HG3 MET 50 HG3 MET 50 -3.680 -7.633 6.387 393 HE1 MET 50 HE1 MET 50 -1.786 -8.982 8.781 394 HE2 MET 50 HE2 MET 50 -3.517 -9.277 8.597 395 HE3 MET 50 HE3 MET 50 -2.876 -8.724 10.143 396 H ILE 51 H ILE 51 1.605 -8.193 8.272 397 HA ILE 51 HA ILE 51 2.963 -9.484 6.013 398 HB ILE 51 HB ILE 51 5.180 -8.587 6.920 399 HG12 ILE 51 HG12 ILE 51 4.716 -6.150 7.901 400 HG13 ILE 51 HG13 ILE 51 3.234 -6.912 8.476 401 HG21 ILE 51 HG21 ILE 51 4.287 -7.865 4.795 402 HG22 ILE 51 HG22 ILE 51 5.015 -6.495 5.633 403 HG23 ILE 51 HG23 ILE 51 3.260 -6.674 5.594 404 HD11 ILE 51 HD11 ILE 51 4.924 -6.946 10.188 405 HD12 ILE 51 HD12 ILE 51 6.060 -7.757 9.110 406 HD13 ILE 51 HD13 ILE 51 4.599 -8.593 9.650 407 H PHE 52 H PHE 52 4.683 -10.995 6.709 408 HA PHE 52 HA PHE 52 3.878 -12.368 9.163 409 HB2 PHE 52 HB2 PHE 52 5.449 -13.204 6.736 410 HB3 PHE 52 HB3 PHE 52 5.538 -14.146 8.220 411 HD1 PHE 52 HD2 PHE 52 3.562 -15.291 9.087 412 HD2 PHE 52 HD1 PHE 52 3.460 -13.230 5.361 413 HE1 PHE 52 HE2 PHE 52 1.485 -16.472 8.500 414 HE2 PHE 52 HE1 PHE 52 1.382 -14.406 4.767 415 HZ PHE 52 HZ PHE 52 0.394 -16.029 6.333 416 H VAL 53 H VAL 53 5.186 -12.705 10.911 417 HA VAL 53 HA VAL 53 7.956 -11.692 10.806 418 HB VAL 53 HB VAL 53 7.780 -10.584 12.914 419 HG11 VAL 53 HG11 VAL 53 5.380 -9.881 11.229 420 HG12 VAL 53 HG12 VAL 53 7.011 -9.221 11.078 421 HG13 VAL 53 HG13 VAL 53 6.045 -8.873 12.515 422 HG21 VAL 53 HG21 VAL 53 5.686 -10.498 14.214 423 HG22 VAL 53 HG22 VAL 53 6.355 -12.125 14.103 424 HG23 VAL 53 HG23 VAL 53 4.974 -11.671 13.104 425 H LYS 54 H LYS 54 9.460 -12.859 11.939 426 HA LYS 54 HA LYS 54 8.752 -15.480 12.899 427 HB2 LYS 54 HB2 LYS 54 11.312 -13.959 12.537 428 HB3 LYS 54 HB3 LYS 54 11.316 -15.428 13.503 429 HG2 LYS 54 HG2 LYS 54 10.811 -16.782 11.698 430 HG3 LYS 54 HG3 LYS 54 10.120 -15.459 10.764 431 HD2 LYS 54 HD2 LYS 54 13.054 -15.635 11.439 432 HD3 LYS 54 HD3 LYS 54 12.361 -16.331 9.972 433 HE2 LYS 54 HE2 LYS 54 12.194 -13.419 10.769 434 HE3 LYS 54 HE3 LYS 54 13.325 -14.088 9.597 435 HZ1 LYS 54 HZ1 LYS 54 10.362 -14.183 9.342 436 HZ2 LYS 54 HZ2 LYS 54 11.483 -14.734 8.201 437 HZ3 LYS 54 HZ3 LYS 54 11.377 -13.082 8.547 438 H ASN 55 H ASN 55 8.955 -12.424 14.360 439 HA ASN 55 HA ASN 55 8.517 -13.496 16.989 440 HB2 ASN 55 HB2 ASN 55 10.480 -12.213 17.987 441 HB3 ASN 55 HB3 ASN 55 10.885 -13.675 17.095 442 HD21 ASN 55 HD21 ASN 55 11.929 -13.508 15.126 443 HD22 ASN 55 HD22 ASN 55 12.683 -12.045 14.597 444 H THR 56 H THR 56 7.851 -11.910 18.527 445 HA THR 56 HA THR 56 6.299 -9.817 17.423 446 HB THR 56 HB THR 56 5.870 -9.119 19.761 447 HG1 THR 56 HG1 THR 56 6.871 -10.344 21.444 448 HG21 THR 56 HG21 THR 56 5.785 -12.120 19.388 449 HG22 THR 56 HG22 THR 56 4.590 -10.980 18.767 450 HG23 THR 56 HG23 THR 56 4.798 -11.177 20.508 451 H ASP 57 H ASP 57 9.556 -9.863 18.687 452 HA ASP 57 HA ASP 57 9.998 -7.152 19.178 453 HB2 ASP 57 HB2 ASP 57 11.607 -8.922 19.757 454 HB3 ASP 57 HB3 ASP 57 11.927 -9.203 18.049 455 H LYS 58 H LYS 58 10.240 -8.984 16.152 456 HA LYS 58 HA LYS 58 11.020 -6.945 14.418 457 HB2 LYS 58 HB2 LYS 58 11.030 -9.064 13.456 458 HB3 LYS 58 HB3 LYS 58 9.466 -9.493 14.128 459 HG2 LYS 58 HG2 LYS 58 9.303 -9.283 11.732 460 HG3 LYS 58 HG3 LYS 58 8.368 -8.008 12.517 461 HD2 LYS 58 HD2 LYS 58 9.519 -6.996 10.696 462 HD3 LYS 58 HD3 LYS 58 10.357 -6.490 12.166 463 HE2 LYS 58 HE2 LYS 58 12.001 -8.332 11.771 464 HE3 LYS 58 HE3 LYS 58 11.205 -8.639 10.224 465 HZ1 LYS 58 HZ1 LYS 58 13.195 -7.206 10.088 466 HZ2 LYS 58 HZ2 LYS 58 12.377 -6.023 10.984 467 HZ3 LYS 58 HZ3 LYS 58 11.798 -6.490 9.462 468 H LEU 59 H LEU 59 7.721 -7.965 15.304 469 HA LEU 59 HA LEU 59 6.319 -6.154 13.695 470 HB2 LEU 59 HB2 LEU 59 5.251 -8.075 14.684 471 HB3 LEU 59 HB3 LEU 59 5.566 -7.473 16.300 472 HG LEU 59 HG LEU 59 4.013 -5.599 15.908 473 HD11 LEU 59 HD11 LEU 59 2.577 -5.563 13.945 474 HD12 LEU 59 HD12 LEU 59 3.435 -6.948 13.269 475 HD13 LEU 59 HD13 LEU 59 4.270 -5.410 13.480 476 HD21 LEU 59 HD21 LEU 59 1.955 -6.916 15.955 477 HD22 LEU 59 HD22 LEU 59 3.213 -7.655 16.944 478 HD23 LEU 59 HD23 LEU 59 2.835 -8.325 15.357 479 H THR 60 H THR 60 7.259 -5.840 17.138 480 HA THR 60 HA THR 60 6.085 -3.297 17.532 481 HB THR 60 HB THR 60 7.551 -3.092 19.517 482 HG1 THR 60 HG1 THR 60 8.708 -5.406 19.708 483 HG21 THR 60 HG21 THR 60 5.469 -4.365 19.700 484 HG22 THR 60 HG22 THR 60 6.722 -5.079 20.715 485 HG23 THR 60 HG23 THR 60 6.301 -5.829 19.175 486 H THR 61 H THR 61 9.283 -4.260 16.370 487 HA THR 61 HA THR 61 10.462 -1.684 16.353 488 HB THR 61 HB THR 61 11.062 -4.027 14.522 489 HG1 THR 61 HG1 THR 61 11.785 -4.825 16.352 490 HG21 THR 61 HG21 THR 61 13.256 -2.964 14.210 491 HG22 THR 61 HG22 THR 61 12.736 -1.593 15.190 492 HG23 THR 61 HG23 THR 61 11.958 -1.914 13.640 493 H LEU 62 H LEU 62 8.695 -3.488 13.823 494 HA LEU 62 HA LEU 62 8.855 -1.567 11.794 495 HB2 LEU 62 HB2 LEU 62 6.684 -3.572 12.401 496 HB3 LEU 62 HB3 LEU 62 6.703 -2.583 10.953 497 HG LEU 62 HG LEU 62 8.662 -4.744 11.727 498 HD11 LEU 62 HD11 LEU 62 6.579 -5.511 10.737 499 HD12 LEU 62 HD12 LEU 62 7.920 -5.741 9.615 500 HD13 LEU 62 HD13 LEU 62 6.795 -4.400 9.383 501 HD21 LEU 62 HD21 LEU 62 8.813 -2.801 9.422 502 HD22 LEU 62 HD22 LEU 62 9.846 -4.215 9.641 503 HD23 LEU 62 HD23 LEU 62 9.922 -2.884 10.792 504 H MET 63 H MET 63 6.330 -1.987 14.282 505 HA MET 63 HA MET 63 4.750 0.176 13.431 506 HB2 MET 63 HB2 MET 63 4.978 -1.053 16.186 507 HB3 MET 63 HB3 MET 63 3.727 0.087 15.698 508 HG2 MET 63 HG2 MET 63 3.235 -1.602 13.811 509 HG3 MET 63 HG3 MET 63 4.156 -2.736 14.794 510 HE1 MET 63 HE1 MET 63 2.007 -2.898 18.060 511 HE2 MET 63 HE2 MET 63 3.391 -1.848 17.757 512 HE3 MET 63 HE3 MET 63 3.422 -3.526 17.217 513 H ASP 64 H ASP 64 7.505 0.081 15.691 514 HA ASP 64 HA ASP 64 7.355 2.795 16.474 515 HB2 ASP 64 HB2 ASP 64 8.816 1.104 17.586 516 HB3 ASP 64 HB3 ASP 64 9.874 1.136 16.180 517 H LYS 65 H LYS 65 9.137 1.231 13.801 518 HA LYS 65 HA LYS 65 10.297 3.439 12.608 519 HB2 LYS 65 HB2 LYS 65 9.037 1.011 11.323 520 HB3 LYS 65 HB3 LYS 65 9.992 2.181 10.426 521 HG2 LYS 65 HG2 LYS 65 11.870 1.671 12.079 522 HG3 LYS 65 HG3 LYS 65 10.894 0.292 12.585 523 HD2 LYS 65 HD2 LYS 65 12.501 -0.440 10.929 524 HD3 LYS 65 HD3 LYS 65 10.881 -0.509 10.230 525 HE2 LYS 65 HE2 LYS 65 11.256 1.561 9.045 526 HE3 LYS 65 HE3 LYS 65 12.811 1.780 9.844 527 HZ1 LYS 65 HZ1 LYS 65 13.561 -0.277 8.744 528 HZ2 LYS 65 HZ2 LYS 65 13.168 0.952 7.652 529 HZ3 LYS 65 HZ3 LYS 65 12.103 -0.337 7.889 530 H LEU 66 H LEU 66 6.968 2.308 12.354 531 HA LEU 66 HA LEU 66 6.129 4.353 10.519 532 HB2 LEU 66 HB2 LEU 66 4.479 2.563 12.315 533 HB3 LEU 66 HB3 LEU 66 3.888 3.468 10.928 534 HG LEU 66 HG LEU 66 5.982 1.296 10.725 535 HD11 LEU 66 HD11 LEU 66 3.928 0.304 11.545 536 HD12 LEU 66 HD12 LEU 66 4.207 -0.153 9.866 537 HD13 LEU 66 HD13 LEU 66 3.011 1.083 10.254 538 HD21 LEU 66 HD21 LEU 66 4.297 2.669 8.627 539 HD22 LEU 66 HD22 LEU 66 5.426 1.344 8.338 540 HD23 LEU 66 HD23 LEU 66 6.025 2.905 8.897 541 H ARG 67 H ARG 67 6.254 4.023 14.006 542 HA ARG 67 HA ARG 67 4.605 6.232 14.698 543 HB2 ARG 67 HB2 ARG 67 6.879 4.895 16.183 544 HB3 ARG 67 HB3 ARG 67 5.876 6.154 16.883 545 HG2 ARG 67 HG2 ARG 67 4.309 3.957 15.770 546 HG3 ARG 67 HG3 ARG 67 5.429 3.434 17.026 547 HD2 ARG 67 HD2 ARG 67 3.292 3.996 18.009 548 HD3 ARG 67 HD3 ARG 67 4.510 5.153 18.535 549 HE ARG 67 HE ARG 67 2.463 5.700 16.484 550 HH11 ARG 67 HH11 ARG 67 4.619 6.787 18.937 551 HH12 ARG 67 HH12 ARG 67 3.921 8.368 19.000 552 HH21 ARG 67 HH21 ARG 67 1.590 7.748 16.566 553 HH22 ARG 67 HH22 ARG 67 2.235 8.909 17.668 554 H LYS 68 H LYS 68 7.764 6.082 13.351 555 HA LYS 68 HA LYS 68 8.879 8.429 14.536 556 HB2 LYS 68 HB2 LYS 68 9.637 7.140 11.908 557 HB3 LYS 68 HB3 LYS 68 10.620 8.244 12.855 558 HG2 LYS 68 HG2 LYS 68 9.790 5.468 13.685 559 HG3 LYS 68 HG3 LYS 68 11.365 5.931 13.053 560 HD2 LYS 68 HD2 LYS 68 11.800 5.920 15.303 561 HD3 LYS 68 HD3 LYS 68 11.353 7.605 15.085 562 HE2 LYS 68 HE2 LYS 68 9.352 7.351 16.197 563 HE3 LYS 68 HE3 LYS 68 9.215 5.642 15.787 564 HZ1 LYS 68 HZ1 LYS 68 9.689 6.017 18.148 565 HZ2 LYS 68 HZ2 LYS 68 11.153 6.757 17.739 566 HZ3 LYS 68 HZ3 LYS 68 10.905 5.120 17.388 567 H VAL 69 H VAL 69 6.505 8.022 12.124 568 HA VAL 69 HA VAL 69 7.212 10.277 10.487 569 HB VAL 69 HB VAL 69 4.643 8.680 10.555 570 HG11 VAL 69 HG11 VAL 69 4.290 10.839 9.515 571 HG12 VAL 69 HG12 VAL 69 4.301 9.585 8.278 572 HG13 VAL 69 HG13 VAL 69 5.713 10.618 8.494 573 HG21 VAL 69 HG21 VAL 69 5.558 7.479 8.628 574 HG22 VAL 69 HG22 VAL 69 6.596 7.287 10.041 575 HG23 VAL 69 HG23 VAL 69 7.056 8.400 8.753 576 H GLN 70 H GLN 70 6.775 12.321 10.880 577 HA GLN 70 HA GLN 70 5.476 13.255 13.187 578 HB2 GLN 70 HB2 GLN 70 5.706 15.492 12.162 579 HB3 GLN 70 HB3 GLN 70 7.187 14.548 12.059 580 HG2 GLN 70 HG2 GLN 70 6.634 13.980 9.719 581 HG3 GLN 70 HG3 GLN 70 5.198 14.995 9.835 582 HE21 GLN 70 HE21 GLN 70 5.900 16.342 8.184 583 HE22 GLN 70 HE22 GLN 70 7.185 17.478 8.409 584 H GLY 71 H GLY 71 4.196 12.568 10.010 585 HA2 GLY 71 HA2 GLY 71 1.787 14.132 10.358 586 HA3 GLY 71 HA3 GLY 71 2.150 13.057 9.023 587 H VAL 72 H VAL 72 2.710 11.024 11.430 588 HA VAL 72 HA VAL 72 -0.065 10.039 11.450 589 HB VAL 72 HB VAL 72 2.500 8.638 12.251 590 HG11 VAL 72 HG11 VAL 72 1.147 6.586 12.334 591 HG12 VAL 72 HG12 VAL 72 -0.310 7.528 12.015 592 HG13 VAL 72 HG13 VAL 72 0.584 7.770 13.516 593 HG21 VAL 72 HG21 VAL 72 2.373 9.058 9.854 594 HG22 VAL 72 HG22 VAL 72 0.764 8.336 9.793 595 HG23 VAL 72 HG23 VAL 72 2.164 7.340 10.190 596 H PHE 73 H PHE 73 -1.185 9.562 13.351 597 HA PHE 73 HA PHE 73 0.106 10.436 15.853 598 HB2 PHE 73 HB2 PHE 73 -2.548 10.603 16.476 599 HB3 PHE 73 HB3 PHE 73 -1.543 11.945 15.966 600 HD1 PHE 73 HD2 PHE 73 -1.673 12.809 13.678 601 HD2 PHE 73 HD1 PHE 73 -4.290 9.743 15.058 602 HE1 PHE 73 HE2 PHE 73 -3.179 13.249 11.789 603 HE2 PHE 73 HE1 PHE 73 -5.801 10.182 13.167 604 HZ PHE 73 HZ PHE 73 -5.244 11.939 11.531 605 H THR 74 H THR 74 -1.919 7.943 14.369 606 HA THR 74 HA THR 74 -1.596 6.372 16.860 607 HB THR 74 HB THR 74 -3.634 5.330 16.598 608 HG1 THR 74 HG1 THR 74 -4.627 4.955 14.661 609 HG21 THR 74 HG21 THR 74 -4.025 7.733 16.979 610 HG22 THR 74 HG22 THR 74 -5.338 6.994 16.061 611 HG23 THR 74 HG23 THR 74 -4.129 7.977 15.235 612 H VAL 75 H VAL 75 -0.430 4.575 16.766 613 HA VAL 75 HA VAL 75 -0.357 3.030 14.267 614 HB VAL 75 HB VAL 75 2.115 3.523 15.959 615 HG11 VAL 75 HG11 VAL 75 2.089 1.310 14.939 616 HG12 VAL 75 HG12 VAL 75 3.297 2.329 14.155 617 HG13 VAL 75 HG13 VAL 75 1.753 2.018 13.359 618 HG21 VAL 75 HG21 VAL 75 1.420 4.608 13.221 619 HG22 VAL 75 HG22 VAL 75 2.987 4.773 14.014 620 HG23 VAL 75 HG23 VAL 75 1.560 5.543 14.712 621 H GLU 76 H GLU 76 -1.432 1.240 14.856 622 HA GLU 76 HA GLU 76 -0.949 0.095 17.548 623 HB2 GLU 76 HB2 GLU 76 -3.590 0.106 16.069 624 HB3 GLU 76 HB3 GLU 76 -3.305 -0.450 17.710 625 HG2 GLU 76 HG2 GLU 76 -3.000 2.406 16.793 626 HG3 GLU 76 HG3 GLU 76 -4.441 1.749 17.560 627 H ARG 77 H ARG 77 -1.102 -2.189 17.746 628 HA ARG 77 HA ARG 77 -0.726 -3.717 15.314 629 HB2 ARG 77 HB2 ARG 77 0.596 -4.520 17.095 630 HB3 ARG 77 HB3 ARG 77 -0.739 -4.449 18.238 631 HG2 ARG 77 HG2 ARG 77 -1.830 -6.321 17.116 632 HG3 ARG 77 HG3 ARG 77 -0.533 -6.382 15.925 633 HD2 ARG 77 HD2 ARG 77 1.052 -7.063 17.583 634 HD3 ARG 77 HD3 ARG 77 -0.091 -6.747 18.885 635 HE ARG 77 HE ARG 77 -0.918 -8.839 18.582 636 HH11 ARG 77 HH11 ARG 77 0.544 -7.903 15.599 637 HH12 ARG 77 HH12 ARG 77 0.309 -9.451 14.878 638 HH21 ARG 77 HH21 ARG 77 -1.201 -10.818 17.638 639 HH22 ARG 77 HH22 ARG 77 -0.668 -11.085 16.018 640 H LEU 78 H LEU 78 -2.305 -4.642 14.175 641 HA LEU 78 HA LEU 78 -5.009 -4.795 15.139 642 HB2 LEU 78 HB2 LEU 78 -3.714 -5.925 12.646 643 HB3 LEU 78 HB3 LEU 78 -5.437 -5.965 12.975 644 HG LEU 78 HG LEU 78 -3.784 -3.453 12.624 645 HD11 LEU 78 HD11 LEU 78 -5.027 -3.189 10.525 646 HD12 LEU 78 HD12 LEU 78 -5.784 -4.764 10.778 647 HD13 LEU 78 HD13 LEU 78 -4.040 -4.652 10.524 648 HD21 LEU 78 HD21 LEU 78 -5.944 -2.291 12.636 649 HD22 LEU 78 HD22 LEU 78 -5.650 -3.121 14.162 650 HD23 LEU 78 HD23 LEU 78 -6.763 -3.815 12.985 651 H SER 79 H SER 79 -5.148 -6.143 16.887 652 HA SER 79 HA SER 79 -3.850 -8.692 17.039 653 HB2 SER 79 HB2 SER 79 -5.120 -8.988 19.123 654 HB3 SER 79 HB3 SER 79 -4.392 -7.383 19.059 655 HG SER 79 HG SER 79 -6.867 -7.883 19.539 656 H ASN 80 H ASN 80 -7.322 -7.843 16.890 657 HA ASN 80 HA ASN 80 -7.999 -10.494 15.914 658 HB2 ASN 80 HB2 ASN 80 -9.487 -9.262 17.488 659 HB3 ASN 80 HB3 ASN 80 -9.768 -8.052 16.241 660 HD21 ASN 80 HD21 ASN 80 -10.320 -11.352 17.193 661 HD22 ASN 80 HD22 ASN 80 -11.626 -11.651 16.104 662 H LEU 81 H LEU 81 -7.564 -10.947 13.831 663 HA LEU 81 HA LEU 81 -7.268 -8.794 11.912 664 HB2 LEU 81 HB2 LEU 81 -6.824 -11.764 11.602 665 HB3 LEU 81 HB3 LEU 81 -6.437 -10.554 10.392 666 HG LEU 81 HG LEU 81 -5.123 -10.935 13.083 667 HD11 LEU 81 HD11 LEU 81 -3.106 -11.294 11.745 668 HD12 LEU 81 HD12 LEU 81 -4.046 -11.096 10.264 669 HD13 LEU 81 HD13 LEU 81 -4.366 -12.458 11.339 670 HD21 LEU 81 HD21 LEU 81 -3.701 -9.018 12.503 671 HD22 LEU 81 HD22 LEU 81 -5.390 -8.551 12.703 672 HD23 LEU 81 HD23 LEU 81 -4.706 -8.711 11.085 673 H GLU 82 H GLU 82 -8.282 -8.630 9.931 674 HA GLU 82 HA GLU 82 -10.988 -9.702 9.737 675 HB2 GLU 82 HB2 GLU 82 -11.093 -8.141 7.745 676 HB3 GLU 82 HB3 GLU 82 -10.775 -7.357 9.288 677 HG2 GLU 82 HG2 GLU 82 -8.390 -7.247 8.751 678 HG3 GLU 82 HG3 GLU 82 -8.695 -8.047 7.210 679 H HIS 83 H HIS 83 -8.381 -11.258 9.242 680 HA HIS 83 HA HIS 83 -8.503 -11.834 6.391 681 HB2 HIS 83 HB2 HIS 83 -6.577 -12.675 8.561 682 HB3 HIS 83 HB3 HIS 83 -6.493 -13.295 6.915 683 HD1 HIS 83 HD1 HIS 83 -4.763 -12.091 5.626 684 HD2 HIS 83 HD2 HIS 83 -6.695 -9.590 8.322 685 HE1 HIS 83 HE1 HIS 83 -3.746 -9.829 5.295 686 HE2 HIS 83 HE2 HIS 83 -5.168 -8.296 6.695 687 H HIS 84 H HIS 84 -10.691 -12.720 6.709 688 HA HIS 84 HA HIS 84 -11.168 -15.188 7.962 689 HB2 HIS 84 HB2 HIS 84 -13.068 -15.323 6.189 690 HB3 HIS 84 HB3 HIS 84 -13.104 -14.028 7.381 691 HD1 HIS 84 HD1 HIS 84 -12.574 -11.615 6.537 692 HD2 HIS 84 HD2 HIS 84 -12.744 -14.496 3.540 693 HE1 HIS 84 HE1 HIS 84 -12.671 -10.339 4.374 694 HE2 HIS 84 HE2 HIS 84 -12.632 -12.097 2.579 695 H HIS 85 H HIS 85 -9.771 -16.820 7.590 696 HA HIS 85 HA HIS 85 -8.594 -17.589 5.191 697 HB2 HIS 85 HB2 HIS 85 -8.551 -19.937 6.283 698 HB3 HIS 85 HB3 HIS 85 -7.714 -18.624 7.102 699 HD1 HIS 85 HD1 HIS 85 -10.800 -20.769 7.377 700 HD2 HIS 85 HD2 HIS 85 -8.681 -17.979 9.613 701 HE1 HIS 85 HE1 HIS 85 -11.793 -20.853 9.678 702 HE2 HIS 85 HE2 HIS 85 -10.420 -19.248 11.033 703 H HIS 86 H HIS 86 -9.210 -18.797 3.454 704 HA HIS 86 HA HIS 86 -12.078 -19.482 3.297 705 HB2 HIS 86 HB2 HIS 86 -11.969 -18.700 0.906 706 HB3 HIS 86 HB3 HIS 86 -11.762 -17.422 2.101 707 HD1 HIS 86 HD1 HIS 86 -9.972 -19.217 -0.642 708 HD2 HIS 86 HD2 HIS 86 -9.162 -16.300 2.212 709 HE1 HIS 86 HE1 HIS 86 -7.790 -18.197 -1.323 710 HE2 HIS 86 HE2 HIS 86 -7.216 -16.603 0.531 711 H HIS 87 H HIS 87 -12.460 -20.713 1.107 712 HA HIS 87 HA HIS 87 -10.389 -22.769 0.698 713 HB2 HIS 87 HB2 HIS 87 -12.118 -24.524 0.694 714 HB3 HIS 87 HB3 HIS 87 -12.066 -23.697 2.248 715 HD1 HIS 87 HD1 HIS 87 -14.220 -24.100 -0.811 716 HD2 HIS 87 HD2 HIS 87 -14.369 -22.288 2.930 717 HE1 HIS 87 HE1 HIS 87 -16.612 -23.417 -0.485 718 HE2 HIS 87 HE2 HIS 87 -16.637 -22.166 1.698 719 H HIS 88 H HIS 88 -11.331 -24.280 -1.217 720 HA HIS 88 HA HIS 88 -11.569 -22.543 -3.507 721 HB2 HIS 88 HB2 HIS 88 -11.606 -25.567 -3.319 722 HB3 HIS 88 HB3 HIS 88 -11.529 -24.648 -4.819 723 HD1 HIS 88 HD1 HIS 88 -9.291 -23.362 -5.298 724 HD2 HIS 88 HD2 HIS 88 -9.197 -25.828 -1.956 725 HE1 HIS 88 HE1 HIS 88 -6.868 -23.606 -4.717 726 HE2 HIS 88 HE2 HIS 88 -6.853 -24.938 -2.589 727 H1 MET 1 H1 MET 1 -8.362 20.257 -8.839 728 H2 MET 1 H2 MET 1 -7.646 21.699 -8.332 729 H3 MET 1 H3 MET 1 -6.905 20.759 -9.530 730 HA MET 1 HA MET 1 -9.529 22.109 -9.781 731 HB2 MET 1 HB2 MET 1 -8.364 23.605 -11.385 732 HB3 MET 1 HB3 MET 1 -7.739 23.748 -9.749 733 HG2 MET 1 HG2 MET 1 -5.826 22.355 -10.350 734 HG3 MET 1 HG3 MET 1 -6.455 22.192 -11.989 735 HE1 MET 1 HE1 MET 1 -3.486 23.201 -11.300 736 HE2 MET 1 HE2 MET 1 -3.329 24.523 -12.457 737 HE3 MET 1 HE3 MET 1 -4.106 23.017 -12.942 738 H THR 2 H THR 2 -10.821 21.112 -11.212 739 HA THR 2 HA THR 2 -11.577 19.935 -13.009 740 HB THR 2 HB THR 2 -8.867 20.400 -14.288 741 HG1 THR 2 HG1 THR 2 -11.137 22.112 -14.521 742 HG21 THR 2 HG21 THR 2 -10.160 20.400 -16.390 743 HG22 THR 2 HG22 THR 2 -11.630 20.047 -15.484 744 HG23 THR 2 HG23 THR 2 -10.320 18.867 -15.536 745 H ASP 3 H ASP 3 -10.009 18.619 -10.831 746 HA ASP 3 HA ASP 3 -8.862 16.288 -12.183 747 HB2 ASP 3 HB2 ASP 3 -8.136 15.647 -9.871 748 HB3 ASP 3 HB3 ASP 3 -7.501 17.194 -10.424 749 H PHE 4 H PHE 4 -9.337 14.119 -11.123 750 HA PHE 4 HA PHE 4 -11.904 13.831 -9.825 751 HB2 PHE 4 HB2 PHE 4 -12.831 12.255 -11.435 752 HB3 PHE 4 HB3 PHE 4 -12.540 13.804 -12.209 753 HD1 PHE 4 HD1 PHE 4 -11.458 10.300 -11.979 754 HD2 PHE 4 HD2 PHE 4 -10.911 14.022 -13.988 755 HE1 PHE 4 HE1 PHE 4 -10.178 9.158 -13.738 756 HE2 PHE 4 HE2 PHE 4 -9.633 12.878 -15.752 757 HZ PHE 4 HZ PHE 4 -9.257 10.443 -15.623 758 H LEU 5 H LEU 5 -12.215 11.732 -8.892 759 HA LEU 5 HA LEU 5 -9.738 10.497 -8.099 760 HB2 LEU 5 HB2 LEU 5 -11.544 10.836 -6.493 761 HB3 LEU 5 HB3 LEU 5 -12.599 9.805 -7.437 762 HG LEU 5 HG LEU 5 -11.187 7.862 -6.942 763 HD11 LEU 5 HD11 LEU 5 -9.526 9.794 -5.319 764 HD12 LEU 5 HD12 LEU 5 -9.022 8.934 -6.775 765 HD13 LEU 5 HD13 LEU 5 -9.365 8.036 -5.297 766 HD21 LEU 5 HD21 LEU 5 -13.021 8.370 -5.427 767 HD22 LEU 5 HD22 LEU 5 -11.969 9.423 -4.479 768 HD23 LEU 5 HD23 LEU 5 -11.657 7.689 -4.541 769 H ALA 6 H ALA 6 -8.777 9.262 -9.593 770 HA ALA 6 HA ALA 6 -10.332 7.440 -11.269 771 HB1 ALA 6 HB1 ALA 6 -8.639 8.866 -12.324 772 HB2 ALA 6 HB2 ALA 6 -8.271 7.155 -12.529 773 HB3 ALA 6 HB3 ALA 6 -7.389 8.108 -11.336 774 H GLY 7 H GLY 7 -9.928 5.192 -11.369 775 HA2 GLY 7 HA2 GLY 7 -8.485 4.092 -9.025 776 HA3 GLY 7 HA3 GLY 7 -10.003 3.430 -9.608 777 H ILE 8 H ILE 8 -7.280 2.253 -9.270 778 HA ILE 8 HA ILE 8 -7.059 1.059 -11.953 779 HB ILE 8 HB ILE 8 -4.671 1.660 -10.173 780 HG12 ILE 8 HG12 ILE 8 -5.527 3.058 -12.728 781 HG13 ILE 8 HG13 ILE 8 -5.622 3.742 -11.109 782 HG21 ILE 8 HG21 ILE 8 -4.821 0.601 -13.004 783 HG22 ILE 8 HG22 ILE 8 -4.367 -0.317 -11.567 784 HG23 ILE 8 HG23 ILE 8 -3.338 0.998 -12.134 785 HD11 ILE 8 HD11 ILE 8 -3.099 2.971 -12.559 786 HD12 ILE 8 HD12 ILE 8 -3.185 3.632 -10.926 787 HD13 ILE 8 HD13 ILE 8 -3.707 4.606 -12.301 788 H ARG 9 H ARG 9 -6.481 -1.157 -11.969 789 HA ARG 9 HA ARG 9 -6.271 -2.478 -9.346 790 HB2 ARG 9 HB2 ARG 9 -8.551 -2.769 -10.190 791 HB3 ARG 9 HB3 ARG 9 -7.923 -3.436 -11.692 792 HG2 ARG 9 HG2 ARG 9 -6.960 -5.321 -10.447 793 HG3 ARG 9 HG3 ARG 9 -7.604 -4.649 -8.946 794 HD2 ARG 9 HD2 ARG 9 -9.870 -4.891 -9.777 795 HD3 ARG 9 HD3 ARG 9 -9.263 -5.473 -11.328 796 HE ARG 9 HE ARG 9 -8.537 -6.995 -8.948 797 HH11 ARG 9 HH11 ARG 9 -10.501 -6.672 -11.764 798 HH12 ARG 9 HH12 ARG 9 -10.981 -8.333 -11.757 799 HH21 ARG 9 HH21 ARG 9 -9.154 -9.142 -8.960 800 HH22 ARG 9 HH22 ARG 9 -10.229 -9.711 -10.184 801 H ILE 10 H ILE 10 -4.559 -3.740 -9.172 802 HA ILE 10 HA ILE 10 -3.132 -4.607 -11.618 803 HB ILE 10 HB ILE 10 -1.948 -4.105 -8.874 804 HG12 ILE 10 HG12 ILE 10 -1.781 -2.268 -11.276 805 HG13 ILE 10 HG13 ILE 10 -2.907 -2.031 -9.944 806 HG21 ILE 10 HG21 ILE 10 -0.657 -5.642 -10.249 807 HG22 ILE 10 HG22 ILE 10 0.199 -4.112 -10.068 808 HG23 ILE 10 HG23 ILE 10 -0.644 -4.478 -11.573 809 HD11 ILE 10 HD11 ILE 10 -0.970 -0.620 -9.688 810 HD12 ILE 10 HD12 ILE 10 0.096 -2.025 -9.754 811 HD13 ILE 10 HD13 ILE 10 -1.019 -1.825 -8.401 812 H VAL 11 H VAL 11 -3.329 -6.812 -11.899 813 HA VAL 11 HA VAL 11 -3.225 -8.474 -9.456 814 HB VAL 11 HB VAL 11 -4.682 -9.016 -12.046 815 HG11 VAL 11 HG11 VAL 11 -3.529 -11.069 -11.389 816 HG12 VAL 11 HG12 VAL 11 -5.270 -11.216 -11.149 817 HG13 VAL 11 HG13 VAL 11 -4.209 -10.940 -9.767 818 HG21 VAL 11 HG21 VAL 11 -5.605 -8.889 -9.166 819 HG22 VAL 11 HG22 VAL 11 -6.629 -9.228 -10.566 820 HG23 VAL 11 HG23 VAL 11 -5.866 -7.647 -10.395 821 H GLY 12 H GLY 12 -1.369 -9.400 -9.167 822 HA2 GLY 12 HA2 GLY 12 0.053 -10.624 -11.439 823 HA3 GLY 12 HA3 GLY 12 0.919 -9.506 -10.394 824 H GLU 13 H GLU 13 1.971 -11.953 -10.594 825 HA GLU 13 HA GLU 13 0.891 -13.900 -8.826 826 HB2 GLU 13 HB2 GLU 13 3.019 -15.069 -9.137 827 HB3 GLU 13 HB3 GLU 13 2.369 -14.498 -10.669 828 HG2 GLU 13 HG2 GLU 13 3.926 -12.595 -10.605 829 HG3 GLU 13 HG3 GLU 13 4.594 -13.203 -9.090 830 H ASP 14 H ASP 14 1.216 -14.288 -6.688 831 HA ASP 14 HA ASP 14 2.432 -12.218 -5.096 832 HB2 ASP 14 HB2 ASP 14 0.356 -13.251 -4.345 833 HB3 ASP 14 HB3 ASP 14 1.125 -14.834 -4.300 834 H LYS 15 H LYS 15 4.639 -12.522 -5.962 835 HA LYS 15 HA LYS 15 6.116 -14.668 -4.682 836 HB2 LYS 15 HB2 LYS 15 6.724 -12.635 -6.756 837 HB3 LYS 15 HB3 LYS 15 8.066 -13.183 -5.756 838 HG2 LYS 15 HG2 LYS 15 7.536 -15.503 -6.342 839 HG3 LYS 15 HG3 LYS 15 6.243 -14.926 -7.398 840 HD2 LYS 15 HD2 LYS 15 7.772 -13.896 -8.873 841 HD3 LYS 15 HD3 LYS 15 9.097 -14.030 -7.709 842 HE2 LYS 15 HE2 LYS 15 9.346 -15.682 -9.457 843 HE3 LYS 15 HE3 LYS 15 9.019 -16.459 -7.912 844 HZ1 LYS 15 HZ1 LYS 15 6.737 -16.777 -8.577 845 HZ2 LYS 15 HZ2 LYS 15 7.766 -17.463 -9.728 846 HZ3 LYS 15 HZ3 LYS 15 7.012 -15.985 -10.043 847 H ASN 16 H ASN 16 8.179 -14.088 -3.626 848 HA ASN 16 HA ASN 16 7.550 -12.622 -1.244 849 HB2 ASN 16 HB2 ASN 16 10.224 -13.827 -1.981 850 HB3 ASN 16 HB3 ASN 16 9.541 -13.600 -0.372 851 HD21 ASN 16 HD21 ASN 16 9.514 -15.514 -3.253 852 HD22 ASN 16 HD22 ASN 16 8.589 -16.826 -2.624 853 H GLY 17 H GLY 17 7.391 -10.675 -2.959 854 HA2 GLY 17 HA2 GLY 17 9.050 -8.629 -2.269 855 HA3 GLY 17 HA3 GLY 17 9.901 -9.394 -3.602 856 H MET 18 H MET 18 7.321 -10.135 -4.912 857 HA MET 18 HA MET 18 7.011 -7.974 -6.656 858 HB2 MET 18 HB2 MET 18 5.458 -10.456 -6.069 859 HB3 MET 18 HB3 MET 18 4.656 -9.216 -7.021 860 HG2 MET 18 HG2 MET 18 7.328 -10.422 -7.712 861 HG3 MET 18 HG3 MET 18 5.783 -10.960 -8.370 862 HE1 MET 18 HE1 MET 18 4.579 -7.682 -10.210 863 HE2 MET 18 HE2 MET 18 4.318 -8.030 -8.502 864 HE3 MET 18 HE3 MET 18 4.136 -9.311 -9.701 865 H THR 19 H THR 19 4.826 -8.925 -3.991 866 HA THR 19 HA THR 19 2.994 -6.830 -4.222 867 HB THR 19 HB THR 19 2.518 -7.255 -1.799 868 HG1 THR 19 HG1 THR 19 3.723 -8.990 -0.838 869 HG21 THR 19 HG21 THR 19 1.443 -8.614 -3.537 870 HG22 THR 19 HG22 THR 19 1.783 -9.579 -2.100 871 HG23 THR 19 HG23 THR 19 2.814 -9.724 -3.522 872 H ASN 20 H ASN 20 6.144 -6.925 -2.668 873 HA ASN 20 HA ASN 20 5.902 -4.438 -1.273 874 HB2 ASN 20 HB2 ASN 20 8.338 -6.070 -2.059 875 HB3 ASN 20 HB3 ASN 20 8.382 -4.662 -1.001 876 HD21 ASN 20 HD21 ASN 20 7.799 -4.881 1.101 877 HD22 ASN 20 HD22 ASN 20 7.389 -6.390 1.832 878 H GLN 21 H GLN 21 7.467 -5.450 -4.301 879 HA GLN 21 HA GLN 21 8.535 -2.912 -4.932 880 HB2 GLN 21 HB2 GLN 21 9.152 -3.815 -7.027 881 HB3 GLN 21 HB3 GLN 21 9.293 -5.130 -5.878 882 HG2 GLN 21 HG2 GLN 21 7.230 -6.095 -6.655 883 HG3 GLN 21 HG3 GLN 21 6.937 -4.713 -7.708 884 HE21 GLN 21 HE21 GLN 21 8.836 -7.592 -7.237 885 HE22 GLN 21 HE22 GLN 21 9.453 -7.677 -8.846 886 H ILE 22 H ILE 22 5.457 -4.452 -5.696 887 HA ILE 22 HA ILE 22 4.622 -2.717 -7.743 888 HB ILE 22 HB ILE 22 3.135 -4.508 -5.843 889 HG12 ILE 22 HG12 ILE 22 4.396 -5.539 -7.676 890 HG13 ILE 22 HG13 ILE 22 2.665 -5.754 -7.919 891 HG21 ILE 22 HG21 ILE 22 1.615 -2.649 -6.211 892 HG22 ILE 22 HG22 ILE 22 1.055 -4.070 -7.092 893 HG23 ILE 22 HG23 ILE 22 1.861 -2.761 -7.955 894 HD11 ILE 22 HD11 ILE 22 3.789 -5.195 -9.994 895 HD12 ILE 22 HD12 ILE 22 4.389 -3.699 -9.280 896 HD13 ILE 22 HD13 ILE 22 2.658 -3.926 -9.529 897 H THR 23 H THR 23 3.716 -2.639 -4.262 898 HA THR 23 HA THR 23 2.388 -0.124 -4.568 899 HB THR 23 HB THR 23 3.376 -1.232 -1.930 900 HG1 THR 23 HG1 THR 23 1.319 -2.109 -3.611 901 HG21 THR 23 HG21 THR 23 2.499 1.043 -1.863 902 HG22 THR 23 HG22 THR 23 1.395 -0.070 -1.055 903 HG23 THR 23 HG23 THR 23 1.028 0.511 -2.679 904 H GLY 24 H GLY 24 5.646 -1.121 -3.811 905 HA2 GLY 24 HA2 GLY 24 6.744 1.302 -2.920 906 HA3 GLY 24 HA3 GLY 24 7.615 0.062 -3.811 907 H VAL 25 H VAL 25 6.435 0.087 -6.274 908 HA VAL 25 HA VAL 25 7.436 2.433 -7.510 909 HB VAL 25 HB VAL 25 5.586 0.304 -8.624 910 HG11 VAL 25 HG11 VAL 25 7.126 2.458 -10.086 911 HG12 VAL 25 HG12 VAL 25 5.371 2.346 -9.935 912 HG13 VAL 25 HG13 VAL 25 6.257 1.125 -10.847 913 HG21 VAL 25 HG21 VAL 25 7.628 -0.564 -9.691 914 HG22 VAL 25 HG22 VAL 25 7.756 -0.567 -7.932 915 HG23 VAL 25 HG23 VAL 25 8.577 0.679 -8.872 916 H ILE 26 H ILE 26 4.147 1.423 -6.627 917 HA ILE 26 HA ILE 26 2.710 3.523 -7.778 918 HB ILE 26 HB ILE 26 2.151 1.970 -5.247 919 HG12 ILE 26 HG12 ILE 26 1.020 1.740 -8.052 920 HG13 ILE 26 HG13 ILE 26 2.203 0.652 -7.335 921 HG21 ILE 26 HG21 ILE 26 0.328 3.864 -6.734 922 HG22 ILE 26 HG22 ILE 26 0.959 4.075 -5.099 923 HG23 ILE 26 HG23 ILE 26 -0.178 2.772 -5.444 924 HD11 ILE 26 HD11 ILE 26 -0.639 1.048 -6.429 925 HD12 ILE 26 HD12 ILE 26 0.543 -0.006 -5.649 926 HD13 ILE 26 HD13 ILE 26 0.011 -0.343 -7.297 927 H SER 27 H SER 27 4.321 3.384 -4.596 928 HA SER 27 HA SER 27 3.481 5.943 -3.716 929 HB2 SER 27 HB2 SER 27 5.191 5.788 -2.009 930 HB3 SER 27 HB3 SER 27 4.457 4.199 -2.211 931 HG SER 27 HG SER 27 6.255 3.542 -3.376 932 H LYS 28 H LYS 28 5.882 4.988 -6.005 933 HA LYS 28 HA LYS 28 7.397 7.448 -5.913 934 HB2 LYS 28 HB2 LYS 28 7.391 5.286 -8.037 935 HB3 LYS 28 HB3 LYS 28 8.592 6.558 -7.850 936 HG2 LYS 28 HG2 LYS 28 9.244 5.610 -5.676 937 HG3 LYS 28 HG3 LYS 28 8.047 4.332 -5.885 938 HD2 LYS 28 HD2 LYS 28 10.210 3.466 -6.487 939 HD3 LYS 28 HD3 LYS 28 9.238 3.618 -7.950 940 HE2 LYS 28 HE2 LYS 28 11.477 4.394 -8.404 941 HE3 LYS 28 HE3 LYS 28 10.375 5.771 -8.434 942 HZ1 LYS 28 HZ1 LYS 28 12.409 6.286 -7.244 943 HZ2 LYS 28 HZ2 LYS 28 12.138 5.013 -6.167 944 HZ3 LYS 28 HZ3 LYS 28 11.086 6.336 -6.193 945 H PHE 29 H PHE 29 4.340 6.825 -7.038 946 HA PHE 29 HA PHE 29 4.363 8.195 -9.538 947 HB2 PHE 29 HB2 PHE 29 2.113 7.571 -7.616 948 HB3 PHE 29 HB3 PHE 29 1.858 8.390 -9.149 949 HD1 PHE 29 HD1 PHE 29 4.236 6.482 -10.348 950 HD2 PHE 29 HD2 PHE 29 0.461 5.911 -8.445 951 HE1 PHE 29 HE1 PHE 29 3.994 4.309 -11.471 952 HE2 PHE 29 HE2 PHE 29 0.224 3.737 -9.569 953 HZ PHE 29 HZ PHE 29 1.991 2.935 -11.083 954 H ASP 30 H ASP 30 3.159 10.206 -9.967 955 HA ASP 30 HA ASP 30 4.150 12.355 -8.323 956 HB2 ASP 30 HB2 ASP 30 2.187 12.868 -10.517 957 HB3 ASP 30 HB3 ASP 30 3.670 13.728 -10.116 958 H THR 31 H THR 31 1.277 10.541 -8.396 959 HA THR 31 HA THR 31 -0.446 12.754 -7.533 960 HB THR 31 HB THR 31 -1.362 11.499 -9.356 961 HG1 THR 31 HG1 THR 31 -3.281 11.494 -8.461 962 HG21 THR 31 HG21 THR 31 -1.027 9.040 -7.630 963 HG22 THR 31 HG22 THR 31 -0.118 9.420 -9.094 964 HG23 THR 31 HG23 THR 31 -1.847 9.091 -9.191 965 H ASN 32 H ASN 32 -1.963 12.455 -5.800 966 HA ASN 32 HA ASN 32 -0.712 11.265 -3.467 967 HB2 ASN 32 HB2 ASN 32 -1.661 13.543 -3.379 968 HB3 ASN 32 HB3 ASN 32 -3.257 12.892 -3.738 969 HD21 ASN 32 HD21 ASN 32 -0.876 11.440 -1.579 970 HD22 ASN 32 HD22 ASN 32 -1.814 11.643 -0.144 971 H ILE 33 H ILE 33 -1.254 9.357 -2.587 972 HA ILE 33 HA ILE 33 -3.278 7.712 -3.796 973 HB ILE 33 HB ILE 33 -1.574 7.188 -1.349 974 HG12 ILE 33 HG12 ILE 33 -1.225 6.254 -4.214 975 HG13 ILE 33 HG13 ILE 33 -0.289 7.536 -3.453 976 HG21 ILE 33 HG21 ILE 33 -3.587 5.795 -1.369 977 HG22 ILE 33 HG22 ILE 33 -2.146 4.828 -1.673 978 HG23 ILE 33 HG23 ILE 33 -3.212 5.263 -3.008 979 HD11 ILE 33 HD11 ILE 33 -0.329 4.648 -2.604 980 HD12 ILE 33 HD12 ILE 33 0.622 5.936 -1.862 981 HD13 ILE 33 HD13 ILE 33 0.946 5.446 -3.526 982 H ARG 34 H ARG 34 -5.344 8.419 -3.393 983 HA ARG 34 HA ARG 34 -6.201 9.246 -0.772 984 HB2 ARG 34 HB2 ARG 34 -7.197 10.173 -2.836 985 HB3 ARG 34 HB3 ARG 34 -7.838 8.588 -3.237 986 HG2 ARG 34 HG2 ARG 34 -9.556 10.041 -2.303 987 HG3 ARG 34 HG3 ARG 34 -9.270 8.643 -1.264 988 HD2 ARG 34 HD2 ARG 34 -7.837 10.061 0.183 989 HD3 ARG 34 HD3 ARG 34 -8.214 11.446 -0.842 990 HE ARG 34 HE ARG 34 -10.551 10.158 0.198 991 HH11 ARG 34 HH11 ARG 34 -8.066 12.420 0.960 992 HH12 ARG 34 HH12 ARG 34 -9.053 13.287 2.082 993 HH21 ARG 34 HH21 ARG 34 -11.803 11.273 1.653 994 HH22 ARG 34 HH22 ARG 34 -11.138 12.634 2.487 995 H THR 35 H THR 35 -6.160 6.274 -2.582 996 HA THR 35 HA THR 35 -6.754 4.742 -0.200 997 HB THR 35 HB THR 35 -8.510 4.205 -2.602 998 HG1 THR 35 HG1 THR 35 -8.965 5.923 -0.403 999 HG21 THR 35 HG21 THR 35 -8.178 2.320 -1.097 1000 HG22 THR 35 HG22 THR 35 -9.840 2.902 -0.992 1001 HG23 THR 35 HG23 THR 35 -8.681 3.305 0.277 1002 H ILE 36 H ILE 36 -5.941 2.615 -0.358 1003 HA ILE 36 HA ILE 36 -5.500 1.446 -2.942 1004 HB ILE 36 HB ILE 36 -3.413 2.771 -2.633 1005 HG12 ILE 36 HG12 ILE 36 -3.007 -0.234 -2.608 1006 HG13 ILE 36 HG13 ILE 36 -3.537 0.695 -4.008 1007 HG21 ILE 36 HG21 ILE 36 -1.721 1.978 -1.018 1008 HG22 ILE 36 HG22 ILE 36 -2.919 0.887 -0.320 1009 HG23 ILE 36 HG23 ILE 36 -3.153 2.632 -0.218 1010 HD11 ILE 36 HD11 ILE 36 -1.181 0.176 -4.126 1011 HD12 ILE 36 HD12 ILE 36 -0.908 0.991 -2.587 1012 HD13 ILE 36 HD13 ILE 36 -1.441 1.915 -3.994 1013 H VAL 37 H VAL 37 -5.536 -0.708 -2.917 1014 HA VAL 37 HA VAL 37 -5.465 -2.135 -0.336 1015 HB VAL 37 HB VAL 37 -7.479 -2.524 -2.577 1016 HG11 VAL 37 HG11 VAL 37 -8.493 -4.257 -1.176 1017 HG12 VAL 37 HG12 VAL 37 -7.180 -4.084 -0.008 1018 HG13 VAL 37 HG13 VAL 37 -6.844 -4.678 -1.634 1019 HG21 VAL 37 HG21 VAL 37 -9.159 -1.891 -0.908 1020 HG22 VAL 37 HG22 VAL 37 -7.987 -0.597 -1.164 1021 HG23 VAL 37 HG23 VAL 37 -7.881 -1.611 0.275 1022 H LEU 38 H LEU 38 -4.525 -4.191 -0.421 1023 HA LEU 38 HA LEU 38 -3.960 -5.367 -3.045 1024 HB2 LEU 38 HB2 LEU 38 -1.943 -4.087 -2.367 1025 HB3 LEU 38 HB3 LEU 38 -1.844 -5.042 -0.902 1026 HG LEU 38 HG LEU 38 -1.731 -6.398 -3.589 1027 HD11 LEU 38 HD11 LEU 38 0.718 -6.207 -3.544 1028 HD12 LEU 38 HD12 LEU 38 0.606 -5.133 -2.149 1029 HD13 LEU 38 HD13 LEU 38 -0.057 -4.629 -3.703 1030 HD21 LEU 38 HD21 LEU 38 -0.521 -7.064 -0.896 1031 HD22 LEU 38 HD22 LEU 38 -0.397 -8.045 -2.359 1032 HD23 LEU 38 HD23 LEU 38 -1.964 -7.802 -1.590 1033 H ASN 39 H ASN 39 -5.005 -7.246 -2.956 1034 HA ASN 39 HA ASN 39 -4.933 -8.810 -0.443 1035 HB2 ASN 39 HB2 ASN 39 -6.959 -8.981 -2.684 1036 HB3 ASN 39 HB3 ASN 39 -7.014 -9.855 -1.158 1037 HD21 ASN 39 HD21 ASN 39 -8.952 -8.071 -2.322 1038 HD22 ASN 39 HD22 ASN 39 -9.197 -6.805 -1.174 1039 H ALA 40 H ALA 40 -3.317 -10.299 -0.645 1040 HA ALA 40 HA ALA 40 -2.940 -11.739 -3.170 1041 HB1 ALA 40 HB1 ALA 40 -1.018 -12.783 -2.040 1042 HB2 ALA 40 HB2 ALA 40 -1.449 -11.959 -0.541 1043 HB3 ALA 40 HB3 ALA 40 -0.948 -11.022 -1.948 1044 H LYS 41 H LYS 41 -4.459 -13.228 -3.517 1045 HA LYS 41 HA LYS 41 -5.095 -15.177 -1.384 1046 HB2 LYS 41 HB2 LYS 41 -7.376 -15.303 -2.250 1047 HB3 LYS 41 HB3 LYS 41 -6.989 -13.641 -1.815 1048 HG2 LYS 41 HG2 LYS 41 -6.502 -13.177 -4.203 1049 HG3 LYS 41 HG3 LYS 41 -7.032 -14.816 -4.589 1050 HD2 LYS 41 HD2 LYS 41 -9.259 -14.327 -3.745 1051 HD3 LYS 41 HD3 LYS 41 -8.741 -12.713 -3.248 1052 HE2 LYS 41 HE2 LYS 41 -8.321 -12.112 -5.573 1053 HE3 LYS 41 HE3 LYS 41 -8.759 -13.742 -6.091 1054 HZ1 LYS 41 HZ1 LYS 41 -10.607 -11.899 -4.682 1055 HZ2 LYS 41 HZ2 LYS 41 -10.991 -13.383 -5.398 1056 HZ3 LYS 41 HZ3 LYS 41 -10.542 -12.072 -6.361 1057 H ASP 42 H ASP 42 -5.135 -17.337 -1.986 1058 HA ASP 42 HA ASP 42 -4.893 -19.227 -3.220 1059 HB2 ASP 42 HB2 ASP 42 -6.591 -18.419 -4.736 1060 HB3 ASP 42 HB3 ASP 42 -5.426 -17.396 -5.570 1061 H GLY 43 H GLY 43 -2.978 -16.449 -4.105 1062 HA2 GLY 43 HA2 GLY 43 -0.477 -17.109 -4.130 1063 HA3 GLY 43 HA3 GLY 43 -0.983 -18.104 -5.492 1064 H ILE 44 H ILE 44 -2.944 -15.493 -5.589 1065 HA ILE 44 HA ILE 44 -1.077 -13.791 -7.129 1066 HB ILE 44 HB ILE 44 -4.029 -13.999 -7.735 1067 HG12 ILE 44 HG12 ILE 44 -1.795 -15.625 -8.980 1068 HG13 ILE 44 HG13 ILE 44 -3.120 -16.241 -7.994 1069 HG21 ILE 44 HG21 ILE 44 -3.348 -13.106 -9.922 1070 HG22 ILE 44 HG22 ILE 44 -1.670 -13.071 -9.382 1071 HG23 ILE 44 HG23 ILE 44 -2.868 -12.037 -8.603 1072 HD11 ILE 44 HD11 ILE 44 -3.476 -16.630 -10.380 1073 HD12 ILE 44 HD12 ILE 44 -3.419 -14.890 -10.664 1074 HD13 ILE 44 HD13 ILE 44 -4.716 -15.584 -9.690 1075 H PHE 45 H PHE 45 -1.555 -11.493 -7.039 1076 HA PHE 45 HA PHE 45 -3.268 -10.760 -4.741 1077 HB2 PHE 45 HB2 PHE 45 -1.766 -8.971 -4.158 1078 HB3 PHE 45 HB3 PHE 45 -0.840 -10.461 -4.267 1079 HD1 PHE 45 HD2 PHE 45 -1.533 -7.222 -5.876 1080 HD2 PHE 45 HD1 PHE 45 0.882 -10.732 -5.916 1081 HE1 PHE 45 HE2 PHE 45 0.022 -6.132 -7.439 1082 HE2 PHE 45 HE1 PHE 45 2.440 -9.643 -7.475 1083 HZ PHE 45 HZ PHE 45 2.003 -7.347 -8.240 1084 H THR 46 H THR 46 -4.684 -9.097 -4.956 1085 HA THR 46 HA THR 46 -4.730 -7.676 -7.552 1086 HB THR 46 HB THR 46 -6.756 -8.898 -7.405 1087 HG1 THR 46 HG1 THR 46 -7.547 -6.352 -6.422 1088 HG21 THR 46 HG21 THR 46 -8.282 -8.822 -5.491 1089 HG22 THR 46 HG22 THR 46 -7.139 -7.805 -4.615 1090 HG23 THR 46 HG23 THR 46 -6.705 -9.464 -5.030 1091 H CYS 47 H CYS 47 -3.557 -5.873 -7.141 1092 HA CYS 47 HA CYS 47 -3.990 -4.303 -4.742 1093 HB2 CYS 47 HB2 CYS 47 -1.716 -4.561 -5.651 1094 HB3 CYS 47 HB3 CYS 47 -2.216 -3.747 -7.131 1095 HG CYS 47 HG CYS 47 -2.684 -2.053 -4.248 1096 H ASN 48 H ASN 48 -5.782 -3.103 -4.665 1097 HA ASN 48 HA ASN 48 -6.817 -1.748 -7.043 1098 HB2 ASN 48 HB2 ASN 48 -7.909 -1.966 -4.224 1099 HB3 ASN 48 HB3 ASN 48 -8.728 -1.163 -5.558 1100 HD21 ASN 48 HD21 ASN 48 -9.725 -2.382 -7.111 1101 HD22 ASN 48 HD22 ASN 48 -9.940 -4.088 -6.968 1102 H LEU 49 H LEU 49 -5.751 0.118 -7.493 1103 HA LEU 49 HA LEU 49 -4.912 1.896 -5.311 1104 HB2 LEU 49 HB2 LEU 49 -3.206 1.345 -6.941 1105 HB3 LEU 49 HB3 LEU 49 -4.245 1.847 -8.260 1106 HG LEU 49 HG LEU 49 -4.130 4.185 -7.435 1107 HD11 LEU 49 HD11 LEU 49 -2.445 4.791 -5.761 1108 HD12 LEU 49 HD12 LEU 49 -2.133 3.079 -5.466 1109 HD13 LEU 49 HD13 LEU 49 -3.711 3.767 -5.084 1110 HD21 LEU 49 HD21 LEU 49 -2.615 3.425 -9.189 1111 HD22 LEU 49 HD22 LEU 49 -1.448 2.902 -7.973 1112 HD23 LEU 49 HD23 LEU 49 -1.834 4.614 -8.149 1113 H MET 50 H MET 50 -5.738 3.930 -5.019 1114 HA MET 50 HA MET 50 -7.624 4.990 -7.030 1115 HB2 MET 50 HB2 MET 50 -7.994 5.106 -4.031 1116 HB3 MET 50 HB3 MET 50 -9.043 5.864 -5.219 1117 HG2 MET 50 HG2 MET 50 -8.597 2.903 -4.887 1118 HG3 MET 50 HG3 MET 50 -10.013 3.807 -4.361 1119 HE1 MET 50 HE1 MET 50 -9.964 5.859 -7.031 1120 HE2 MET 50 HE2 MET 50 -11.425 5.323 -6.199 1121 HE3 MET 50 HE3 MET 50 -11.267 5.090 -7.940 1122 H ILE 51 H ILE 51 -6.784 6.810 -7.811 1123 HA ILE 51 HA ILE 51 -5.544 8.746 -5.987 1124 HB ILE 51 HB ILE 51 -3.719 9.121 -7.749 1125 HG12 ILE 51 HG12 ILE 51 -3.152 6.821 -8.883 1126 HG13 ILE 51 HG13 ILE 51 -4.872 6.501 -8.694 1127 HG21 ILE 51 HG21 ILE 51 -3.700 6.563 -6.149 1128 HG22 ILE 51 HG22 ILE 51 -3.282 8.170 -5.555 1129 HG23 ILE 51 HG23 ILE 51 -2.280 7.397 -6.782 1130 HD11 ILE 51 HD11 ILE 51 -5.374 8.489 -10.030 1131 HD12 ILE 51 HD12 ILE 51 -4.364 7.340 -10.907 1132 HD13 ILE 51 HD13 ILE 51 -3.646 8.795 -10.217 1133 H PHE 52 H PHE 52 -5.282 10.910 -6.941 1134 HA PHE 52 HA PHE 52 -7.583 11.505 -8.650 1135 HB2 PHE 52 HB2 PHE 52 -5.946 13.095 -6.710 1136 HB3 PHE 52 HB3 PHE 52 -6.828 13.950 -7.970 1137 HD1 PHE 52 HD2 PHE 52 -9.276 13.845 -8.064 1138 HD2 PHE 52 HD1 PHE 52 -7.110 12.083 -4.844 1139 HE1 PHE 52 HE2 PHE 52 -11.342 13.754 -6.731 1140 HE2 PHE 52 HE1 PHE 52 -9.171 11.994 -3.508 1141 HZ PHE 52 HZ PHE 52 -11.289 12.831 -4.444 1142 H VAL 53 H VAL 53 -7.463 12.244 -10.688 1143 HA VAL 53 HA VAL 53 -4.912 13.323 -11.711 1144 HB VAL 53 HB VAL 53 -4.920 12.051 -13.690 1145 HG11 VAL 53 HG11 VAL 53 -4.160 10.720 -11.795 1146 HG12 VAL 53 HG12 VAL 53 -4.940 9.708 -13.014 1147 HG13 VAL 53 HG13 VAL 53 -5.807 10.138 -11.539 1148 HG21 VAL 53 HG21 VAL 53 -6.743 10.549 -14.374 1149 HG22 VAL 53 HG22 VAL 53 -7.257 12.232 -14.277 1150 HG23 VAL 53 HG23 VAL 53 -7.695 11.102 -12.996 1151 H LYS 54 H LYS 54 -5.193 14.696 -13.652 1152 HA LYS 54 HA LYS 54 -7.841 15.967 -13.699 1153 HB2 LYS 54 HB2 LYS 54 -5.176 16.876 -14.804 1154 HB3 LYS 54 HB3 LYS 54 -6.679 17.770 -14.998 1155 HG2 LYS 54 HG2 LYS 54 -6.862 17.963 -12.554 1156 HG3 LYS 54 HG3 LYS 54 -5.323 17.114 -12.386 1157 HD2 LYS 54 HD2 LYS 54 -5.659 19.688 -13.933 1158 HD3 LYS 54 HD3 LYS 54 -5.189 19.625 -12.235 1159 HE2 LYS 54 HE2 LYS 54 -3.682 18.321 -14.504 1160 HE3 LYS 54 HE3 LYS 54 -3.259 19.861 -13.759 1161 HZ1 LYS 54 HZ1 LYS 54 -3.315 17.224 -12.400 1162 HZ2 LYS 54 HZ2 LYS 54 -2.977 18.696 -11.645 1163 HZ3 LYS 54 HZ3 LYS 54 -1.939 18.098 -12.833 1164 H ASN 55 H ASN 55 -5.926 13.850 -15.593 1165 HA ASN 55 HA ASN 55 -7.821 14.091 -17.833 1166 HB2 ASN 55 HB2 ASN 55 -4.813 13.885 -18.155 1167 HB3 ASN 55 HB3 ASN 55 -5.993 13.913 -19.463 1168 HD21 ASN 55 HD21 ASN 55 -4.367 15.760 -17.036 1169 HD22 ASN 55 HD22 ASN 55 -4.818 17.315 -17.627 1170 H THR 56 H THR 56 -8.367 12.184 -18.829 1171 HA THR 56 HA THR 56 -7.986 9.727 -17.503 1172 HB THR 56 HB THR 56 -8.946 8.656 -19.516 1173 HG1 THR 56 HG1 THR 56 -8.787 9.623 -21.389 1174 HG21 THR 56 HG21 THR 56 -10.320 11.240 -18.749 1175 HG22 THR 56 HG22 THR 56 -10.457 9.704 -17.892 1176 HG23 THR 56 HG23 THR 56 -11.092 9.858 -19.531 1177 H ASP 57 H ASP 57 -6.138 11.286 -20.020 1178 HA ASP 57 HA ASP 57 -4.655 9.060 -20.937 1179 HB2 ASP 57 HB2 ASP 57 -4.840 11.275 -22.098 1180 HB3 ASP 57 HB3 ASP 57 -3.788 11.968 -20.865 1181 H LYS 58 H LYS 58 -4.116 11.415 -18.372 1182 HA LYS 58 HA LYS 58 -1.620 10.594 -17.443 1183 HB2 LYS 58 HB2 LYS 58 -2.518 12.608 -16.579 1184 HB3 LYS 58 HB3 LYS 58 -4.017 11.833 -16.091 1185 HG2 LYS 58 HG2 LYS 58 -2.645 12.387 -14.169 1186 HG3 LYS 58 HG3 LYS 58 -2.848 10.640 -14.331 1187 HD2 LYS 58 HD2 LYS 58 -0.616 10.483 -15.360 1188 HD3 LYS 58 HD3 LYS 58 -0.422 12.229 -15.200 1189 HE2 LYS 58 HE2 LYS 58 -0.586 12.009 -12.760 1190 HE3 LYS 58 HE3 LYS 58 -0.750 10.261 -12.935 1191 HZ1 LYS 58 HZ1 LYS 58 1.530 10.955 -12.408 1192 HZ2 LYS 58 HZ2 LYS 58 1.593 11.839 -13.845 1193 HZ3 LYS 58 HZ3 LYS 58 1.438 10.158 -13.896 1194 H LEU 59 H LEU 59 -4.853 9.345 -16.725 1195 HA LEU 59 HA LEU 59 -4.103 7.499 -14.720 1196 HB2 LEU 59 HB2 LEU 59 -6.402 8.244 -15.035 1197 HB3 LEU 59 HB3 LEU 59 -6.456 7.488 -16.617 1198 HG LEU 59 HG LEU 59 -6.248 5.271 -15.566 1199 HD11 LEU 59 HD11 LEU 59 -6.472 5.044 -13.132 1200 HD12 LEU 59 HD12 LEU 59 -6.341 6.795 -12.964 1201 HD13 LEU 59 HD13 LEU 59 -4.980 5.863 -13.590 1202 HD21 LEU 59 HD21 LEU 59 -8.466 6.167 -16.023 1203 HD22 LEU 59 HD22 LEU 59 -8.488 6.961 -14.448 1204 HD23 LEU 59 HD23 LEU 59 -8.480 5.200 -14.548 1205 H THR 60 H THR 60 -4.606 7.055 -18.237 1206 HA THR 60 HA THR 60 -4.020 4.283 -18.278 1207 HB THR 60 HB THR 60 -3.806 4.455 -20.672 1208 HG1 THR 60 HG1 THR 60 -3.979 6.822 -21.455 1209 HG21 THR 60 HG21 THR 60 -5.883 5.634 -21.267 1210 HG22 THR 60 HG22 THR 60 -5.890 6.418 -19.687 1211 HG23 THR 60 HG23 THR 60 -6.087 4.669 -19.805 1212 H THR 61 H THR 61 -1.976 7.142 -18.475 1213 HA THR 61 HA THR 61 0.416 5.962 -19.298 1214 HB THR 61 HB THR 61 -0.005 8.305 -17.421 1215 HG1 THR 61 HG1 THR 61 -0.711 8.922 -19.400 1216 HG21 THR 61 HG21 THR 61 2.245 7.401 -17.079 1217 HG22 THR 61 HG22 THR 61 2.321 8.943 -17.930 1218 HG23 THR 61 HG23 THR 61 2.537 7.436 -18.818 1219 H LEU 62 H LEU 62 -0.956 6.264 -16.031 1220 HA LEU 62 HA LEU 62 1.186 5.070 -14.637 1221 HB2 LEU 62 HB2 LEU 62 -1.763 5.098 -13.978 1222 HB3 LEU 62 HB3 LEU 62 -0.501 4.592 -12.870 1223 HG LEU 62 HG LEU 62 -0.874 7.375 -14.002 1224 HD11 LEU 62 HD11 LEU 62 -1.374 7.983 -11.687 1225 HD12 LEU 62 HD12 LEU 62 -1.222 6.291 -11.208 1226 HD13 LEU 62 HD13 LEU 62 -2.515 6.787 -12.302 1227 HD21 LEU 62 HD21 LEU 62 1.495 6.888 -13.726 1228 HD22 LEU 62 HD22 LEU 62 1.208 6.321 -12.081 1229 HD23 LEU 62 HD23 LEU 62 0.953 8.019 -12.486 1230 H MET 63 H MET 63 -1.653 3.670 -16.234 1231 HA MET 63 HA MET 63 -1.371 1.007 -15.461 1232 HB2 MET 63 HB2 MET 63 -2.213 2.005 -18.195 1233 HB3 MET 63 HB3 MET 63 -2.542 0.412 -17.529 1234 HG2 MET 63 HG2 MET 63 -3.947 1.402 -15.812 1235 HG3 MET 63 HG3 MET 63 -3.592 3.014 -16.434 1236 HE1 MET 63 HE1 MET 63 -6.587 2.163 -16.050 1237 HE2 MET 63 HE2 MET 63 -7.255 2.748 -17.575 1238 HE3 MET 63 HE3 MET 63 -6.026 3.693 -16.732 1239 H ASP 64 H ASP 64 -0.011 2.595 -18.363 1240 HA ASP 64 HA ASP 64 1.479 0.483 -19.366 1241 HB2 ASP 64 HB2 ASP 64 1.100 2.647 -20.520 1242 HB3 ASP 64 HB3 ASP 64 2.233 3.416 -19.415 1243 H LYS 65 H LYS 65 2.423 2.884 -16.924 1244 HA LYS 65 HA LYS 65 5.060 2.052 -16.463 1245 HB2 LYS 65 HB2 LYS 65 3.013 3.267 -14.596 1246 HB3 LYS 65 HB3 LYS 65 4.698 3.038 -14.152 1247 HG2 LYS 65 HG2 LYS 65 5.372 4.521 -15.995 1248 HG3 LYS 65 HG3 LYS 65 3.673 4.756 -16.413 1249 HD2 LYS 65 HD2 LYS 65 4.463 6.635 -15.087 1250 HD3 LYS 65 HD3 LYS 65 3.276 5.712 -14.167 1251 HE2 LYS 65 HE2 LYS 65 5.182 6.374 -12.780 1252 HE3 LYS 65 HE3 LYS 65 5.062 4.621 -12.920 1253 HZ1 LYS 65 HZ1 LYS 65 6.821 4.637 -14.538 1254 HZ2 LYS 65 HZ2 LYS 65 7.342 5.446 -13.149 1255 HZ3 LYS 65 HZ3 LYS 65 6.892 6.326 -14.516 1256 H LEU 66 H LEU 66 2.035 0.958 -14.964 1257 HA LEU 66 HA LEU 66 3.271 -0.921 -13.198 1258 HB2 LEU 66 HB2 LEU 66 0.406 -0.690 -14.137 1259 HB3 LEU 66 HB3 LEU 66 0.953 -1.672 -12.788 1260 HG LEU 66 HG LEU 66 1.298 1.330 -12.888 1261 HD11 LEU 66 HD11 LEU 66 -0.626 1.475 -11.380 1262 HD12 LEU 66 HD12 LEU 66 -0.911 -0.253 -11.580 1263 HD13 LEU 66 HD13 LEU 66 -1.079 0.833 -12.958 1264 HD21 LEU 66 HD21 LEU 66 1.488 -0.662 -10.623 1265 HD22 LEU 66 HD22 LEU 66 1.631 1.088 -10.465 1266 HD23 LEU 66 HD23 LEU 66 2.833 0.189 -11.388 1267 H ARG 67 H ARG 67 2.128 -1.056 -16.479 1268 HA ARG 67 HA ARG 67 2.019 -3.912 -16.686 1269 HB2 ARG 67 HB2 ARG 67 2.106 -1.732 -18.791 1270 HB3 ARG 67 HB3 ARG 67 1.921 -3.444 -19.166 1271 HG2 ARG 67 HG2 ARG 67 -0.159 -3.542 -17.946 1272 HG3 ARG 67 HG3 ARG 67 0.036 -1.878 -17.404 1273 HD2 ARG 67 HD2 ARG 67 -0.151 -1.110 -19.739 1274 HD3 ARG 67 HD3 ARG 67 -0.356 -2.785 -20.265 1275 HE ARG 67 HE ARG 67 -2.343 -2.589 -18.527 1276 HH11 ARG 67 HH11 ARG 67 -1.399 -0.404 -21.025 1277 HH12 ARG 67 HH12 ARG 67 -2.987 0.256 -21.188 1278 HH21 ARG 67 HH21 ARG 67 -4.376 -1.749 -18.762 1279 HH22 ARG 67 HH22 ARG 67 -4.654 -0.499 -19.931 1280 H LYS 68 H LYS 68 4.611 -1.772 -16.464 1281 HA LYS 68 HA LYS 68 6.493 -3.216 -18.099 1282 HB2 LYS 68 HB2 LYS 68 6.987 -1.215 -15.878 1283 HB3 LYS 68 HB3 LYS 68 8.203 -1.815 -16.998 1284 HG2 LYS 68 HG2 LYS 68 5.792 -0.140 -17.683 1285 HG3 LYS 68 HG3 LYS 68 7.478 0.382 -17.673 1286 HD2 LYS 68 HD2 LYS 68 7.976 -1.214 -19.478 1287 HD3 LYS 68 HD3 LYS 68 6.287 -1.726 -19.487 1288 HE2 LYS 68 HE2 LYS 68 5.662 0.644 -20.020 1289 HE3 LYS 68 HE3 LYS 68 7.381 0.995 -20.207 1290 HZ1 LYS 68 HZ1 LYS 68 5.852 -1.014 -21.771 1291 HZ2 LYS 68 HZ2 LYS 68 7.492 -0.649 -21.973 1292 HZ3 LYS 68 HZ3 LYS 68 6.316 0.513 -22.327 1293 H VAL 69 H VAL 69 5.121 -3.793 -15.046 1294 HA VAL 69 HA VAL 69 7.400 -5.003 -13.778 1295 HB VAL 69 HB VAL 69 4.479 -5.256 -13.032 1296 HG11 VAL 69 HG11 VAL 69 5.867 -6.980 -12.013 1297 HG12 VAL 69 HG12 VAL 69 5.353 -5.812 -10.797 1298 HG13 VAL 69 HG13 VAL 69 6.997 -5.754 -11.434 1299 HG21 VAL 69 HG21 VAL 69 6.549 -3.282 -12.050 1300 HG22 VAL 69 HG22 VAL 69 4.903 -3.444 -11.436 1301 HG23 VAL 69 HG23 VAL 69 5.176 -2.908 -13.094 1302 H GLN 70 H GLN 70 8.184 -6.872 -14.217 1303 HA GLN 70 HA GLN 70 7.350 -8.701 -16.080 1304 HB2 GLN 70 HB2 GLN 70 8.958 -10.267 -14.981 1305 HB3 GLN 70 HB3 GLN 70 9.612 -8.663 -15.285 1306 HG2 GLN 70 HG2 GLN 70 8.394 -9.121 -12.624 1307 HG3 GLN 70 HG3 GLN 70 9.910 -9.954 -12.957 1308 HE21 GLN 70 HE21 GLN 70 10.985 -8.746 -11.398 1309 HE22 GLN 70 HE22 GLN 70 11.398 -7.088 -11.646 1310 H GLY 71 H GLY 71 6.399 -8.583 -12.684 1311 HA2 GLY 71 HA2 GLY 71 5.297 -11.292 -12.805 1312 HA3 GLY 71 HA3 GLY 71 5.458 -10.301 -11.369 1313 H VAL 72 H VAL 72 4.062 -8.293 -13.603 1314 HA VAL 72 HA VAL 72 1.364 -8.980 -12.622 1315 HB VAL 72 HB VAL 72 2.374 -6.345 -13.715 1316 HG11 VAL 72 HG11 VAL 72 -0.348 -7.080 -12.615 1317 HG12 VAL 72 HG12 VAL 72 0.023 -6.684 -14.294 1318 HG13 VAL 72 HG13 VAL 72 0.179 -5.451 -13.042 1319 HG21 VAL 72 HG21 VAL 72 2.011 -5.546 -11.404 1320 HG22 VAL 72 HG22 VAL 72 3.243 -6.804 -11.496 1321 HG23 VAL 72 HG23 VAL 72 1.624 -7.197 -10.913 1322 H PHE 73 H PHE 73 -0.185 -9.610 -13.965 1323 HA PHE 73 HA PHE 73 0.355 -9.470 -16.857 1324 HB2 PHE 73 HB2 PHE 73 -1.512 -11.425 -16.713 1325 HB3 PHE 73 HB3 PHE 73 0.219 -11.705 -16.644 1326 HD1 PHE 73 HD1 PHE 73 -2.890 -11.635 -14.691 1327 HD2 PHE 73 HD2 PHE 73 1.311 -12.351 -14.599 1328 HE1 PHE 73 HE1 PHE 73 -3.124 -12.758 -12.511 1329 HE2 PHE 73 HE2 PHE 73 1.079 -13.469 -12.424 1330 HZ PHE 73 HZ PHE 73 -1.137 -13.674 -11.378 1331 H THR 74 H THR 74 -1.854 -8.422 -14.419 1332 HA THR 74 HA THR 74 -3.560 -7.339 -16.579 1333 HB THR 74 HB THR 74 -5.556 -7.691 -15.456 1334 HG1 THR 74 HG1 THR 74 -5.736 -7.543 -13.359 1335 HG21 THR 74 HG21 THR 74 -4.629 -9.858 -16.189 1336 HG22 THR 74 HG22 THR 74 -5.661 -10.028 -14.770 1337 HG23 THR 74 HG23 THR 74 -3.907 -10.072 -14.592 1338 H VAL 75 H VAL 75 -3.660 -5.202 -16.610 1339 HA VAL 75 HA VAL 75 -3.660 -3.717 -14.069 1340 HB VAL 75 HB VAL 75 -2.201 -2.765 -16.553 1341 HG11 VAL 75 HG11 VAL 75 -1.350 -0.993 -15.066 1342 HG12 VAL 75 HG12 VAL 75 -2.370 -1.609 -13.765 1343 HG13 VAL 75 HG13 VAL 75 -3.106 -0.942 -15.223 1344 HG21 VAL 75 HG21 VAL 75 -0.123 -3.114 -15.282 1345 HG22 VAL 75 HG22 VAL 75 -0.985 -4.630 -15.550 1346 HG23 VAL 75 HG23 VAL 75 -1.053 -3.847 -13.971 1347 H GLU 76 H GLU 76 -5.696 -2.963 -13.966 1348 HA GLU 76 HA GLU 76 -7.015 -2.001 -16.444 1349 HB2 GLU 76 HB2 GLU 76 -8.257 -3.536 -14.142 1350 HB3 GLU 76 HB3 GLU 76 -9.118 -2.949 -15.557 1351 HG2 GLU 76 HG2 GLU 76 -8.011 -4.487 -16.983 1352 HG3 GLU 76 HG3 GLU 76 -6.842 -4.912 -15.734 1353 H ARG 77 H ARG 77 -8.966 -0.584 -15.963 1354 HA ARG 77 HA ARG 77 -8.445 1.202 -13.702 1355 HB2 ARG 77 HB2 ARG 77 -8.822 2.315 -15.825 1356 HB3 ARG 77 HB3 ARG 77 -10.348 1.464 -16.046 1357 HG2 ARG 77 HG2 ARG 77 -11.248 2.604 -14.050 1358 HG3 ARG 77 HG3 ARG 77 -9.732 3.483 -13.889 1359 HD2 ARG 77 HD2 ARG 77 -10.103 4.579 -16.022 1360 HD3 ARG 77 HD3 ARG 77 -11.573 3.636 -16.278 1361 HE ARG 77 HE ARG 77 -12.042 4.875 -13.921 1362 HH11 ARG 77 HH11 ARG 77 -11.098 6.049 -17.028 1363 HH12 ARG 77 HH12 ARG 77 -11.869 7.581 -16.786 1364 HH21 ARG 77 HH21 ARG 77 -12.998 6.835 -13.634 1365 HH22 ARG 77 HH22 ARG 77 -12.915 8.024 -14.893 1366 H LEU 78 H LEU 78 -9.833 1.512 -12.019 1367 HA LEU 78 HA LEU 78 -12.017 -0.378 -11.646 1368 HB2 LEU 78 HB2 LEU 78 -10.828 1.748 -9.858 1369 HB3 LEU 78 HB3 LEU 78 -12.167 0.713 -9.386 1370 HG LEU 78 HG LEU 78 -9.419 -0.292 -10.155 1371 HD11 LEU 78 HD11 LEU 78 -10.630 0.074 -7.415 1372 HD12 LEU 78 HD12 LEU 78 -9.285 0.989 -8.097 1373 HD13 LEU 78 HD13 LEU 78 -9.101 -0.733 -7.769 1374 HD21 LEU 78 HD21 LEU 78 -11.183 -1.917 -10.570 1375 HD22 LEU 78 HD22 LEU 78 -11.794 -1.703 -8.928 1376 HD23 LEU 78 HD23 LEU 78 -10.200 -2.410 -9.192 1377 H SER 79 H SER 79 -13.935 0.096 -12.512 1378 HA SER 79 HA SER 79 -14.592 2.849 -13.231 1379 HB2 SER 79 HB2 SER 79 -16.426 1.823 -14.536 1380 HB3 SER 79 HB3 SER 79 -14.861 1.113 -14.928 1381 HG SER 79 HG SER 79 -16.913 -0.244 -14.361 1382 H ASN 80 H ASN 80 -15.993 0.237 -11.279 1383 HA ASN 80 HA ASN 80 -18.163 2.007 -10.413 1384 HB2 ASN 80 HB2 ASN 80 -18.664 -0.325 -11.169 1385 HB3 ASN 80 HB3 ASN 80 -17.734 -0.931 -9.803 1386 HD21 ASN 80 HD21 ASN 80 -19.463 -1.958 -8.860 1387 HD22 ASN 80 HD22 ASN 80 -20.780 -1.106 -8.139 1388 H LEU 81 H LEU 81 -17.434 3.365 -8.844 1389 HA LEU 81 HA LEU 81 -15.569 2.370 -6.824 1390 HB2 LEU 81 HB2 LEU 81 -16.532 5.182 -7.349 1391 HB3 LEU 81 HB3 LEU 81 -15.276 4.724 -6.214 1392 HG LEU 81 HG LEU 81 -15.168 4.581 -9.228 1393 HD11 LEU 81 HD11 LEU 81 -13.500 6.088 -7.205 1394 HD12 LEU 81 HD12 LEU 81 -14.741 6.780 -8.255 1395 HD13 LEU 81 HD13 LEU 81 -13.272 6.103 -8.957 1396 HD21 LEU 81 HD21 LEU 81 -13.153 3.516 -7.241 1397 HD22 LEU 81 HD22 LEU 81 -12.913 3.644 -8.983 1398 HD23 LEU 81 HD23 LEU 81 -14.142 2.555 -8.343 1399 H GLU 82 H GLU 82 -15.982 2.200 -4.696 1400 HA GLU 82 HA GLU 82 -18.738 2.493 -3.784 1401 HB2 GLU 82 HB2 GLU 82 -17.809 1.300 -1.724 1402 HB3 GLU 82 HB3 GLU 82 -17.887 0.392 -3.226 1403 HG2 GLU 82 HG2 GLU 82 -15.829 -0.123 -2.209 1404 HG3 GLU 82 HG3 GLU 82 -15.462 0.916 -3.573 1405 H HIS 83 H HIS 83 -16.653 4.718 -4.150 1406 HA HIS 83 HA HIS 83 -16.094 5.671 -1.492 1407 HB2 HIS 83 HB2 HIS 83 -15.705 6.975 -4.193 1408 HB3 HIS 83 HB3 HIS 83 -15.103 7.615 -2.669 1409 HD1 HIS 83 HD1 HIS 83 -12.768 6.990 -2.153 1410 HD2 HIS 83 HD2 HIS 83 -14.582 4.216 -4.650 1411 HE1 HIS 83 HE1 HIS 83 -10.965 5.362 -2.769 1412 HE2 HIS 83 HE2 HIS 83 -12.166 3.558 -4.037 1413 H HIS 84 H HIS 84 -18.886 5.685 -3.225 1414 HA HIS 84 HA HIS 84 -19.876 8.308 -2.931 1415 HB2 HIS 84 HB2 HIS 84 -21.373 5.675 -3.015 1416 HB3 HIS 84 HB3 HIS 84 -22.126 7.261 -3.151 1417 HD1 HIS 84 HD1 HIS 84 -20.347 4.688 -5.113 1418 HD2 HIS 84 HD2 HIS 84 -21.503 8.655 -5.574 1419 HE1 HIS 84 HE1 HIS 84 -20.132 5.170 -7.560 1420 HE2 HIS 84 HE2 HIS 84 -20.700 7.608 -7.795 1421 H HIS 85 H HIS 85 -20.806 5.460 -0.962 1422 HA HIS 85 HA HIS 85 -21.704 7.192 1.174 1423 HB2 HIS 85 HB2 HIS 85 -21.591 4.171 0.996 1424 HB3 HIS 85 HB3 HIS 85 -22.346 5.078 2.303 1425 HD1 HIS 85 HD1 HIS 85 -23.319 3.277 -0.523 1426 HD2 HIS 85 HD2 HIS 85 -24.361 7.022 0.953 1427 HE1 HIS 85 HE1 HIS 85 -25.526 3.829 -1.581 1428 HE2 HIS 85 HE2 HIS 85 -26.231 5.985 -0.497 1429 H HIS 86 H HIS 86 -19.386 8.039 1.239 1430 HA HIS 86 HA HIS 86 -17.390 6.523 2.589 1431 HB2 HIS 86 HB2 HIS 86 -16.348 8.828 2.988 1432 HB3 HIS 86 HB3 HIS 86 -16.596 8.352 1.312 1433 HD1 HIS 86 HD1 HIS 86 -17.775 10.784 3.898 1434 HD2 HIS 86 HD2 HIS 86 -18.490 9.884 -0.095 1435 HE1 HIS 86 HE1 HIS 86 -19.136 12.695 3.009 1436 HE2 HIS 86 HE2 HIS 86 -19.648 12.080 0.629 1437 H HIS 87 H HIS 87 -18.581 5.597 4.329 1438 HA HIS 87 HA HIS 87 -18.617 7.139 6.765 1439 HB2 HIS 87 HB2 HIS 87 -20.728 7.867 5.766 1440 HB3 HIS 87 HB3 HIS 87 -21.219 6.195 5.528 1441 HD1 HIS 87 HD1 HIS 87 -22.390 5.055 7.438 1442 HD2 HIS 87 HD2 HIS 87 -20.714 8.701 8.536 1443 HE1 HIS 87 HE1 HIS 87 -23.279 5.546 9.731 1444 HE2 HIS 87 HE2 HIS 87 -22.158 7.679 10.426 1445 H HIS 88 H HIS 88 -18.784 5.817 8.633 1446 HA HIS 88 HA HIS 88 -18.259 3.006 8.280 1447 HB2 HIS 88 HB2 HIS 88 -18.625 4.700 10.760 1448 HB3 HIS 88 HB3 HIS 88 -18.249 2.981 10.809 1449 HD1 HIS 88 HD1 HIS 88 -16.691 6.277 10.545 1450 HD2 HIS 88 HD2 HIS 88 -15.645 2.356 9.640 1451 HE1 HIS 88 HE1 HIS 88 -14.196 6.287 10.292 1452 HE2 HIS 88 HE2 HIS 88 -13.575 3.886 9.880 Start of MODEL 11 1 H1 MET 1 H1 MET 1 11.335 -17.789 17.074 2 H2 MET 1 H2 MET 1 11.797 -19.401 16.888 3 H3 MET 1 H3 MET 1 10.968 -18.916 18.279 4 HA MET 1 HA MET 1 9.504 -20.095 16.796 5 HB2 MET 1 HB2 MET 1 8.996 -17.134 17.126 6 HB3 MET 1 HB3 MET 1 7.775 -18.237 16.502 7 HG2 MET 1 HG2 MET 1 9.095 -18.414 19.204 8 HG3 MET 1 HG3 MET 1 7.471 -17.803 18.880 9 HE1 MET 1 HE1 MET 1 8.025 -20.093 21.027 10 HE2 MET 1 HE2 MET 1 6.702 -21.198 20.653 11 HE3 MET 1 HE3 MET 1 6.422 -19.458 20.643 12 H THR 2 H THR 2 8.187 -19.981 14.831 13 HA THR 2 HA THR 2 9.758 -19.184 12.507 14 HB THR 2 HB THR 2 8.701 -21.422 12.547 15 HG1 THR 2 HG1 THR 2 7.309 -20.802 10.466 16 HG21 THR 2 HG21 THR 2 6.074 -19.922 12.431 17 HG22 THR 2 HG22 THR 2 6.669 -20.837 13.818 18 HG23 THR 2 HG23 THR 2 6.282 -21.670 12.313 19 H ASP 3 H ASP 3 7.883 -18.566 10.603 20 HA ASP 3 HA ASP 3 7.294 -15.834 11.310 21 HB2 ASP 3 HB2 ASP 3 6.694 -15.565 8.963 22 HB3 ASP 3 HB3 ASP 3 8.211 -16.449 9.097 23 H PHE 4 H PHE 4 5.317 -14.858 11.582 24 HA PHE 4 HA PHE 4 2.884 -16.391 11.023 25 HB2 PHE 4 HB2 PHE 4 1.818 -15.699 13.085 26 HB3 PHE 4 HB3 PHE 4 3.302 -16.560 13.462 27 HD1 PHE 4 HD1 PHE 4 1.685 -13.242 13.385 28 HD2 PHE 4 HD2 PHE 4 5.096 -15.475 14.633 29 HE1 PHE 4 HE1 PHE 4 2.395 -11.361 14.797 30 HE2 PHE 4 HE2 PHE 4 5.807 -13.590 16.050 31 HZ PHE 4 HZ PHE 4 4.460 -11.527 16.120 32 H LEU 5 H LEU 5 0.977 -15.022 10.762 33 HA LEU 5 HA LEU 5 1.697 -12.643 9.284 34 HB2 LEU 5 HB2 LEU 5 0.104 -14.234 8.362 35 HB3 LEU 5 HB3 LEU 5 -0.957 -13.996 9.736 36 HG LEU 5 HG LEU 5 -1.385 -11.684 9.039 37 HD11 LEU 5 HD11 LEU 5 0.782 -11.191 8.018 38 HD12 LEU 5 HD12 LEU 5 -0.542 -10.832 6.912 39 HD13 LEU 5 HD13 LEU 5 0.417 -12.296 6.692 40 HD21 LEU 5 HD21 LEU 5 -1.750 -13.679 6.802 41 HD22 LEU 5 HD22 LEU 5 -2.633 -12.164 6.988 42 HD23 LEU 5 HD23 LEU 5 -2.829 -13.449 8.179 43 H ALA 6 H ALA 6 2.044 -10.849 10.403 44 HA ALA 6 HA ALA 6 0.410 -10.208 12.755 45 HB1 ALA 6 HB1 ALA 6 2.851 -10.189 13.018 46 HB2 ALA 6 HB2 ALA 6 2.147 -8.598 13.304 47 HB3 ALA 6 HB3 ALA 6 2.970 -8.938 11.780 48 H GLY 7 H GLY 7 -0.424 -8.031 13.030 49 HA2 GLY 7 HA2 GLY 7 -0.891 -6.589 10.486 50 HA3 GLY 7 HA3 GLY 7 -2.197 -6.917 11.611 51 H ILE 8 H ILE 8 -1.109 -4.376 10.561 52 HA ILE 8 HA ILE 8 -0.702 -2.990 13.132 53 HB ILE 8 HB ILE 8 0.796 -2.274 10.585 54 HG12 ILE 8 HG12 ILE 8 1.845 -3.648 13.083 55 HG13 ILE 8 HG13 ILE 8 1.650 -4.402 11.504 56 HG21 ILE 8 HG21 ILE 8 0.347 -0.369 12.030 57 HG22 ILE 8 HG22 ILE 8 2.067 -0.761 12.038 58 HG23 ILE 8 HG23 ILE 8 1.050 -1.222 13.405 59 HD11 ILE 8 HD11 ILE 8 3.532 -2.144 12.169 60 HD12 ILE 8 HD12 ILE 8 3.333 -2.886 10.581 61 HD13 ILE 8 HD13 ILE 8 3.969 -3.834 11.925 62 H ARG 9 H ARG 9 -1.597 -0.834 13.188 63 HA ARG 9 HA ARG 9 -3.046 0.026 10.767 64 HB2 ARG 9 HB2 ARG 9 -4.624 -0.965 12.447 65 HB3 ARG 9 HB3 ARG 9 -4.160 0.314 13.567 66 HG2 ARG 9 HG2 ARG 9 -4.968 1.999 11.982 67 HG3 ARG 9 HG3 ARG 9 -5.422 0.721 10.859 68 HD2 ARG 9 HD2 ARG 9 -6.961 -0.164 12.639 69 HD3 ARG 9 HD3 ARG 9 -6.610 1.296 13.570 70 HE ARG 9 HE ARG 9 -7.451 1.901 10.918 71 HH11 ARG 9 HH11 ARG 9 -8.620 1.071 14.052 72 HH12 ARG 9 HH12 ARG 9 -10.190 1.730 13.752 73 HH21 ARG 9 HH21 ARG 9 -9.447 2.728 10.546 74 HH22 ARG 9 HH22 ARG 9 -10.660 2.663 11.773 75 H ILE 10 H ILE 10 -2.982 2.178 10.298 76 HA ILE 10 HA ILE 10 -1.380 3.922 12.081 77 HB ILE 10 HB ILE 10 -1.224 3.829 9.056 78 HG12 ILE 10 HG12 ILE 10 0.846 2.803 11.017 79 HG13 ILE 10 HG13 ILE 10 -0.309 1.767 10.186 80 HG21 ILE 10 HG21 ILE 10 0.472 5.287 11.084 81 HG22 ILE 10 HG22 ILE 10 -0.694 6.014 9.978 82 HG23 ILE 10 HG23 ILE 10 0.762 5.247 9.344 83 HD11 ILE 10 HD11 ILE 10 0.624 2.484 8.031 84 HD12 ILE 10 HD12 ILE 10 1.821 1.710 9.069 85 HD13 ILE 10 HD13 ILE 10 1.812 3.465 8.893 86 H VAL 11 H VAL 11 -2.662 5.664 12.687 87 HA VAL 11 HA VAL 11 -4.289 6.896 10.543 88 HB VAL 11 HB VAL 11 -4.821 6.863 13.520 89 HG11 VAL 11 HG11 VAL 11 -6.734 8.343 13.084 90 HG12 VAL 11 HG12 VAL 11 -6.209 8.521 11.410 91 HG13 VAL 11 HG13 VAL 11 -5.202 9.138 12.720 92 HG21 VAL 11 HG21 VAL 11 -6.529 6.018 11.171 93 HG22 VAL 11 HG22 VAL 11 -6.947 5.866 12.878 94 HG23 VAL 11 HG23 VAL 11 -5.613 4.922 12.213 95 H GLY 12 H GLY 12 -3.428 8.658 9.756 96 HA2 GLY 12 HA2 GLY 12 -2.130 10.605 11.541 97 HA3 GLY 12 HA3 GLY 12 -1.222 9.996 10.167 98 H GLU 13 H GLU 13 -1.579 12.663 10.336 99 HA GLU 13 HA GLU 13 -3.954 13.647 9.124 100 HB2 GLU 13 HB2 GLU 13 -2.653 15.768 8.877 101 HB3 GLU 13 HB3 GLU 13 -2.661 15.109 10.509 102 HG2 GLU 13 HG2 GLU 13 -0.420 14.143 10.089 103 HG3 GLU 13 HG3 GLU 13 -0.415 14.916 8.506 104 H ASP 14 H ASP 14 -4.514 13.947 7.056 105 HA ASP 14 HA ASP 14 -2.946 12.721 4.975 106 HB2 ASP 14 HB2 ASP 14 -5.339 12.383 4.980 107 HB3 ASP 14 HB3 ASP 14 -5.630 14.121 4.951 108 H LYS 15 H LYS 15 -1.097 14.089 4.837 109 HA LYS 15 HA LYS 15 -1.525 16.745 3.700 110 HB2 LYS 15 HB2 LYS 15 0.803 15.354 4.950 111 HB3 LYS 15 HB3 LYS 15 1.088 16.716 3.877 112 HG2 LYS 15 HG2 LYS 15 -0.370 18.103 5.261 113 HG3 LYS 15 HG3 LYS 15 -0.598 16.743 6.367 114 HD2 LYS 15 HD2 LYS 15 1.529 16.898 7.212 115 HD3 LYS 15 HD3 LYS 15 2.192 17.561 5.714 116 HE2 LYS 15 HE2 LYS 15 2.202 19.267 7.400 117 HE3 LYS 15 HE3 LYS 15 1.014 19.664 6.162 118 HZ1 LYS 15 HZ1 LYS 15 0.127 20.092 8.352 119 HZ2 LYS 15 HZ2 LYS 15 0.428 18.498 8.829 120 HZ3 LYS 15 HZ3 LYS 15 -0.723 18.817 7.638 121 H ASN 16 H ASN 16 0.170 17.401 2.100 122 HA ASN 16 HA ASN 16 -0.392 16.383 -0.378 123 HB2 ASN 16 HB2 ASN 16 1.535 17.780 -1.143 124 HB3 ASN 16 HB3 ASN 16 0.432 18.609 -0.047 125 HD21 ASN 16 HD21 ASN 16 1.821 20.063 0.800 126 HD22 ASN 16 HD22 ASN 16 3.216 19.654 1.727 127 H GLY 17 H GLY 17 1.831 14.945 1.822 128 HA2 GLY 17 HA2 GLY 17 2.632 13.073 -0.300 129 HA3 GLY 17 HA3 GLY 17 3.902 13.868 0.613 130 H MET 18 H MET 18 1.338 13.348 2.703 131 HA MET 18 HA MET 18 2.815 11.470 4.222 132 HB2 MET 18 HB2 MET 18 0.028 12.577 4.433 133 HB3 MET 18 HB3 MET 18 0.549 11.284 5.504 134 HG2 MET 18 HG2 MET 18 1.993 13.913 5.222 135 HG3 MET 18 HG3 MET 18 0.778 13.574 6.454 136 HE1 MET 18 HE1 MET 18 1.044 11.671 8.291 137 HE2 MET 18 HE2 MET 18 2.479 10.661 8.458 138 HE3 MET 18 HE3 MET 18 1.429 10.473 7.054 139 H THR 19 H THR 19 -0.236 10.970 2.371 140 HA THR 19 HA THR 19 -0.468 8.230 2.957 141 HB THR 19 HB THR 19 -1.911 8.076 0.941 142 HG1 THR 19 HG1 THR 19 -2.256 10.062 -0.231 143 HG21 THR 19 HG21 THR 19 -3.615 9.684 1.675 144 HG22 THR 19 HG22 THR 19 -2.405 10.532 2.637 145 HG23 THR 19 HG23 THR 19 -2.864 8.880 3.052 146 H ASN 20 H ASN 20 1.426 9.896 0.527 147 HA ASN 20 HA ASN 20 2.107 7.553 -0.978 148 HB2 ASN 20 HB2 ASN 20 3.394 10.298 -0.886 149 HB3 ASN 20 HB3 ASN 20 3.792 9.043 -2.054 150 HD21 ASN 20 HD21 ASN 20 2.408 8.637 -3.732 151 HD22 ASN 20 HD22 ASN 20 1.066 9.653 -4.111 152 H GLN 21 H GLN 21 3.749 9.507 1.496 153 HA GLN 21 HA GLN 21 6.150 7.996 1.440 154 HB2 GLN 21 HB2 GLN 21 6.874 9.303 3.274 155 HB3 GLN 21 HB3 GLN 21 5.929 10.367 2.253 156 HG2 GLN 21 HG2 GLN 21 4.032 10.152 3.768 157 HG3 GLN 21 HG3 GLN 21 4.954 9.041 4.779 158 HE21 GLN 21 HE21 GLN 21 4.621 12.342 3.733 159 HE22 GLN 21 HE22 GLN 21 5.598 13.034 4.975 160 H ILE 22 H ILE 22 3.181 7.720 3.298 161 HA ILE 22 HA ILE 22 4.160 6.080 5.374 162 HB ILE 22 HB ILE 22 1.415 6.568 4.253 163 HG12 ILE 22 HG12 ILE 22 2.421 8.302 5.650 164 HG13 ILE 22 HG13 ILE 22 1.060 7.564 6.488 165 HG21 ILE 22 HG21 ILE 22 2.062 4.637 6.489 166 HG22 ILE 22 HG22 ILE 22 1.351 4.236 4.926 167 HG23 ILE 22 HG23 ILE 22 0.447 5.218 6.078 168 HD11 ILE 22 HD11 ILE 22 2.611 6.206 7.796 169 HD12 ILE 22 HD12 ILE 22 2.912 7.931 7.999 170 HD13 ILE 22 HD13 ILE 22 3.969 6.968 6.967 171 H THR 23 H THR 23 2.340 5.122 2.429 172 HA THR 23 HA THR 23 2.802 2.342 2.926 173 HB THR 23 HB THR 23 2.069 3.453 0.210 174 HG1 THR 23 HG1 THR 23 0.524 3.302 2.578 175 HG21 THR 23 HG21 THR 23 0.798 1.354 0.060 176 HG22 THR 23 HG22 THR 23 1.345 0.908 1.676 177 HG23 THR 23 HG23 THR 23 2.509 1.048 0.358 178 H GLY 24 H GLY 24 4.489 4.862 1.194 179 HA2 GLY 24 HA2 GLY 24 6.363 3.351 -0.240 180 HA3 GLY 24 HA3 GLY 24 6.648 4.954 0.424 181 H VAL 25 H VAL 25 6.677 4.659 3.086 182 HA VAL 25 HA VAL 25 9.116 3.401 3.701 183 HB VAL 25 HB VAL 25 6.867 4.248 5.547 184 HG11 VAL 25 HG11 VAL 25 8.514 4.149 7.365 185 HG12 VAL 25 HG12 VAL 25 9.705 3.473 6.255 186 HG13 VAL 25 HG13 VAL 25 8.249 2.558 6.651 187 HG21 VAL 25 HG21 VAL 25 8.276 6.209 5.976 188 HG22 VAL 25 HG22 VAL 25 7.882 6.076 4.262 189 HG23 VAL 25 HG23 VAL 25 9.479 5.600 4.837 190 H ILE 26 H ILE 26 5.776 2.283 4.059 191 HA ILE 26 HA ILE 26 6.236 -0.136 5.376 192 HB ILE 26 HB ILE 26 4.124 0.618 3.352 193 HG12 ILE 26 HG12 ILE 26 4.042 0.352 6.374 194 HG13 ILE 26 HG13 ILE 26 4.096 1.866 5.478 195 HG21 ILE 26 HG21 ILE 26 4.359 -1.796 3.296 196 HG22 ILE 26 HG22 ILE 26 2.860 -1.355 4.113 197 HG23 ILE 26 HG23 ILE 26 4.258 -1.871 5.057 198 HD11 ILE 26 HD11 ILE 26 1.913 1.343 4.491 199 HD12 ILE 26 HD12 ILE 26 1.857 1.407 6.252 200 HD13 ILE 26 HD13 ILE 26 1.862 -0.152 5.427 201 H SER 27 H SER 27 6.266 0.536 1.864 202 HA SER 27 HA SER 27 6.860 -2.145 1.104 203 HB2 SER 27 HB2 SER 27 7.353 -1.271 -1.111 204 HB3 SER 27 HB3 SER 27 5.914 -0.477 -0.480 205 HG SER 27 HG SER 27 7.315 1.284 0.126 206 H LYS 28 H LYS 28 8.807 0.429 2.319 207 HA LYS 28 HA LYS 28 11.330 -0.574 1.388 208 HB2 LYS 28 HB2 LYS 28 10.711 1.357 3.641 209 HB3 LYS 28 HB3 LYS 28 12.311 1.050 2.974 210 HG2 LYS 28 HG2 LYS 28 11.567 1.918 0.803 211 HG3 LYS 28 HG3 LYS 28 9.971 2.231 1.485 212 HD2 LYS 28 HD2 LYS 28 10.972 3.802 3.093 213 HD3 LYS 28 HD3 LYS 28 12.563 3.501 2.391 214 HE2 LYS 28 HE2 LYS 28 11.695 4.329 0.210 215 HE3 LYS 28 HE3 LYS 28 10.179 4.738 1.012 216 HZ1 LYS 28 HZ1 LYS 28 11.666 6.645 0.799 217 HZ2 LYS 28 HZ2 LYS 28 12.838 5.855 1.727 218 HZ3 LYS 28 HZ3 LYS 28 11.357 6.284 2.419 219 H PHE 29 H PHE 29 9.194 -1.746 3.705 220 HA PHE 29 HA PHE 29 11.014 -2.594 5.723 221 HB2 PHE 29 HB2 PHE 29 8.257 -3.580 4.974 222 HB3 PHE 29 HB3 PHE 29 9.172 -4.235 6.328 223 HD1 PHE 29 HD2 PHE 29 10.356 -1.290 6.874 224 HD2 PHE 29 HD1 PHE 29 6.461 -2.995 6.558 225 HE1 PHE 29 HE2 PHE 29 9.465 0.473 8.342 226 HE2 PHE 29 HE1 PHE 29 5.571 -1.231 8.025 227 HZ PHE 29 HZ PHE 29 7.073 0.504 8.916 228 H ASP 30 H ASP 30 11.964 -4.561 6.109 229 HA ASP 30 HA ASP 30 12.942 -6.065 3.950 230 HB2 ASP 30 HB2 ASP 30 13.725 -7.636 5.790 231 HB3 ASP 30 HB3 ASP 30 14.223 -5.954 5.958 232 H THR 31 H THR 31 9.996 -6.376 5.724 233 HA THR 31 HA THR 31 9.615 -9.188 5.077 234 HB THR 31 HB THR 31 8.833 -8.477 7.247 235 HG1 THR 31 HG1 THR 31 7.224 -9.814 7.005 236 HG21 THR 31 HG21 THR 31 6.985 -6.876 7.508 237 HG22 THR 31 HG22 THR 31 7.014 -6.562 5.772 238 HG23 THR 31 HG23 THR 31 8.399 -6.120 6.770 239 H ASN 32 H ASN 32 7.376 -9.812 4.220 240 HA ASN 32 HA ASN 32 7.032 -8.422 1.665 241 HB2 ASN 32 HB2 ASN 32 6.199 -11.159 2.635 242 HB3 ASN 32 HB3 ASN 32 5.673 -10.499 1.089 243 HD21 ASN 32 HD21 ASN 32 7.160 -10.242 -0.552 244 HD22 ASN 32 HD22 ASN 32 8.707 -10.996 -0.520 245 H ILE 33 H ILE 33 5.404 -7.047 1.368 246 HA ILE 33 HA ILE 33 3.228 -6.703 3.138 247 HB ILE 33 HB ILE 33 3.424 -5.821 0.246 248 HG12 ILE 33 HG12 ILE 33 4.181 -4.342 2.788 249 HG13 ILE 33 HG13 ILE 33 5.313 -4.989 1.602 250 HG21 ILE 33 HG21 ILE 33 1.672 -4.798 2.490 251 HG22 ILE 33 HG22 ILE 33 1.135 -5.741 1.099 252 HG23 ILE 33 HG23 ILE 33 1.772 -4.114 0.866 253 HD11 ILE 33 HD11 ILE 33 5.024 -2.594 1.342 254 HD12 ILE 33 HD12 ILE 33 3.291 -2.816 1.103 255 HD13 ILE 33 HD13 ILE 33 4.434 -3.459 -0.075 256 H ARG 34 H ARG 34 2.062 -8.589 3.457 257 HA ARG 34 HA ARG 34 1.130 -10.154 1.214 258 HB2 ARG 34 HB2 ARG 34 1.759 -11.228 3.342 259 HB3 ARG 34 HB3 ARG 34 0.463 -10.370 4.163 260 HG2 ARG 34 HG2 ARG 34 -0.048 -12.748 3.633 261 HG3 ARG 34 HG3 ARG 34 -1.207 -11.594 2.972 262 HD2 ARG 34 HD2 ARG 34 -0.650 -13.361 1.356 263 HD3 ARG 34 HD3 ARG 34 -0.169 -11.768 0.779 264 HE ARG 34 HE ARG 34 1.879 -13.399 2.079 265 HH11 ARG 34 HH11 ARG 34 0.567 -12.077 -0.815 266 HH12 ARG 34 HH12 ARG 34 1.918 -12.554 -1.783 267 HH21 ARG 34 HH21 ARG 34 3.638 -13.970 0.814 268 HH22 ARG 34 HH22 ARG 34 3.621 -13.605 -0.880 269 H THR 35 H THR 35 -0.197 -7.740 3.391 270 HA THR 35 HA THR 35 -2.308 -7.184 1.483 271 HB THR 35 HB THR 35 -3.080 -7.906 4.330 272 HG1 THR 35 HG1 THR 35 -3.111 -9.327 1.935 273 HG21 THR 35 HG21 THR 35 -4.784 -7.028 1.993 274 HG22 THR 35 HG22 THR 35 -4.454 -6.086 3.447 275 HG23 THR 35 HG23 THR 35 -5.395 -7.575 3.555 276 H ILE 36 H ILE 36 -2.783 -5.017 1.446 277 HA ILE 36 HA ILE 36 -2.099 -3.400 3.811 278 HB ILE 36 HB ILE 36 -0.227 -3.211 2.166 279 HG12 ILE 36 HG12 ILE 36 -0.172 -0.707 2.122 280 HG13 ILE 36 HG13 ILE 36 -1.857 -0.692 2.628 281 HG21 ILE 36 HG21 ILE 36 -1.448 -3.465 0.085 282 HG22 ILE 36 HG22 ILE 36 -0.592 -1.920 0.089 283 HG23 ILE 36 HG23 ILE 36 -2.329 -1.967 0.391 284 HD11 ILE 36 HD11 ILE 36 -1.238 -1.786 4.716 285 HD12 ILE 36 HD12 ILE 36 -0.368 -0.269 4.488 286 HD13 ILE 36 HD13 ILE 36 0.451 -1.806 4.206 287 H VAL 37 H VAL 37 -3.434 -1.669 4.207 288 HA VAL 37 HA VAL 37 -5.446 -0.928 2.181 289 HB VAL 37 HB VAL 37 -6.016 -1.360 5.133 290 HG11 VAL 37 HG11 VAL 37 -8.348 -0.749 4.587 291 HG12 VAL 37 HG12 VAL 37 -7.845 -0.341 2.946 292 HG13 VAL 37 HG13 VAL 37 -7.231 0.589 4.313 293 HG21 VAL 37 HG21 VAL 37 -7.054 -2.824 2.696 294 HG22 VAL 37 HG22 VAL 37 -7.588 -3.090 4.357 295 HG23 VAL 37 HG23 VAL 37 -5.926 -3.458 3.895 296 H LEU 38 H LEU 38 -5.736 1.254 1.974 297 HA LEU 38 HA LEU 38 -5.110 3.006 4.230 298 HB2 LEU 38 HB2 LEU 38 -3.066 2.918 2.795 299 HB3 LEU 38 HB3 LEU 38 -4.011 3.517 1.448 300 HG LEU 38 HG LEU 38 -3.733 5.121 3.997 301 HD11 LEU 38 HD11 LEU 38 -1.869 6.325 2.971 302 HD12 LEU 38 HD12 LEU 38 -1.884 5.205 1.608 303 HD13 LEU 38 HD13 LEU 38 -1.467 4.625 3.222 304 HD21 LEU 38 HD21 LEU 38 -4.307 5.907 1.132 305 HD22 LEU 38 HD22 LEU 38 -4.168 7.016 2.497 306 HD23 LEU 38 HD23 LEU 38 -5.479 5.841 2.451 307 H ASN 39 H ASN 39 -6.765 4.399 4.517 308 HA ASN 39 HA ASN 39 -8.151 5.463 2.177 309 HB2 ASN 39 HB2 ASN 39 -10.380 5.084 3.457 310 HB3 ASN 39 HB3 ASN 39 -9.667 3.748 2.565 311 HD21 ASN 39 HD21 ASN 39 -11.526 3.657 4.790 312 HD22 ASN 39 HD22 ASN 39 -10.740 2.739 6.021 313 H ALA 40 H ALA 40 -8.238 7.574 2.303 314 HA ALA 40 HA ALA 40 -7.984 8.909 4.928 315 HB1 ALA 40 HB1 ALA 40 -7.370 9.958 2.158 316 HB2 ALA 40 HB2 ALA 40 -6.188 9.354 3.319 317 HB3 ALA 40 HB3 ALA 40 -7.103 10.819 3.675 318 H LYS 41 H LYS 41 -9.727 9.853 5.744 319 HA LYS 41 HA LYS 41 -11.652 11.136 3.904 320 HB2 LYS 41 HB2 LYS 41 -13.532 10.436 5.239 321 HB3 LYS 41 HB3 LYS 41 -12.613 9.016 4.768 322 HG2 LYS 41 HG2 LYS 41 -12.264 10.330 7.453 323 HG3 LYS 41 HG3 LYS 41 -13.500 9.109 7.154 324 HD2 LYS 41 HD2 LYS 41 -11.730 7.519 6.468 325 HD3 LYS 41 HD3 LYS 41 -10.512 8.744 6.831 326 HE2 LYS 41 HE2 LYS 41 -11.089 8.720 9.161 327 HE3 LYS 41 HE3 LYS 41 -12.489 7.689 8.858 328 HZ1 LYS 41 HZ1 LYS 41 -10.966 5.933 8.158 329 HZ2 LYS 41 HZ2 LYS 41 -10.673 6.419 9.753 330 HZ3 LYS 41 HZ3 LYS 41 -9.642 6.930 8.515 331 H ASP 42 H ASP 42 -12.435 13.120 4.503 332 HA ASP 42 HA ASP 42 -12.832 15.023 5.667 333 HB2 ASP 42 HB2 ASP 42 -13.626 13.562 7.474 334 HB3 ASP 42 HB3 ASP 42 -11.983 13.441 8.103 335 H GLY 43 H GLY 43 -9.728 13.500 6.043 336 HA2 GLY 43 HA2 GLY 43 -7.952 15.333 5.478 337 HA3 GLY 43 HA3 GLY 43 -8.490 15.969 7.027 338 H ILE 44 H ILE 44 -8.834 12.771 7.414 339 HA ILE 44 HA ILE 44 -6.014 12.279 8.166 340 HB ILE 44 HB ILE 44 -8.263 10.935 9.639 341 HG12 ILE 44 HG12 ILE 44 -7.184 13.691 10.292 342 HG13 ILE 44 HG13 ILE 44 -8.824 13.308 9.773 343 HG21 ILE 44 HG21 ILE 44 -6.606 10.906 11.468 344 HG22 ILE 44 HG22 ILE 44 -5.463 11.762 10.434 345 HG23 ILE 44 HG23 ILE 44 -5.995 10.136 10.004 346 HD11 ILE 44 HD11 ILE 44 -9.177 12.024 11.806 347 HD12 ILE 44 HD12 ILE 44 -8.703 13.682 12.175 348 HD13 ILE 44 HD13 ILE 44 -7.528 12.374 12.325 349 H PHE 45 H PHE 45 -5.335 10.054 8.041 350 HA PHE 45 HA PHE 45 -7.076 8.351 6.363 351 HB2 PHE 45 HB2 PHE 45 -5.141 7.508 5.169 352 HB3 PHE 45 HB3 PHE 45 -5.178 9.260 5.050 353 HD1 PHE 45 HD1 PHE 45 -3.466 6.385 6.580 354 HD2 PHE 45 HD2 PHE 45 -3.438 10.606 5.997 355 HE1 PHE 45 HE1 PHE 45 -1.156 6.480 7.408 356 HE2 PHE 45 HE2 PHE 45 -1.124 10.704 6.827 357 HZ PHE 45 HZ PHE 45 0.016 8.636 7.535 358 H THR 46 H THR 46 -6.953 6.098 6.669 359 HA THR 46 HA THR 46 -5.407 5.197 9.028 360 HB THR 46 HB THR 46 -7.633 5.062 9.784 361 HG1 THR 46 HG1 THR 46 -6.992 2.471 8.733 362 HG21 THR 46 HG21 THR 46 -8.753 5.392 7.618 363 HG22 THR 46 HG22 THR 46 -9.474 4.071 8.539 364 HG23 THR 46 HG23 THR 46 -8.397 3.719 7.189 365 H CYS 47 H CYS 47 -3.696 4.200 8.143 366 HA CYS 47 HA CYS 47 -4.062 2.374 5.880 367 HB2 CYS 47 HB2 CYS 47 -2.242 4.052 5.765 368 HB3 CYS 47 HB3 CYS 47 -1.499 3.327 7.186 369 HG CYS 47 HG CYS 47 -2.058 1.206 4.640 370 H ASN 48 H ASN 48 -4.382 0.274 6.266 371 HA ASN 48 HA ASN 48 -3.441 -0.909 8.797 372 HB2 ASN 48 HB2 ASN 48 -5.540 -1.841 6.822 373 HB3 ASN 48 HB3 ASN 48 -5.034 -2.766 8.231 374 HD21 ASN 48 HD21 ASN 48 -7.057 -2.725 9.150 375 HD22 ASN 48 HD22 ASN 48 -7.753 -1.298 9.827 376 H LEU 49 H LEU 49 -1.586 -2.020 8.677 377 HA LEU 49 HA LEU 49 -0.732 -3.170 6.109 378 HB2 LEU 49 HB2 LEU 49 0.848 -1.630 7.074 379 HB3 LEU 49 HB3 LEU 49 0.804 -2.471 8.612 380 HG LEU 49 HG LEU 49 1.905 -4.419 7.604 381 HD11 LEU 49 HD11 LEU 49 1.975 -2.768 5.079 382 HD12 LEU 49 HD12 LEU 49 1.051 -4.248 5.337 383 HD13 LEU 49 HD13 LEU 49 2.813 -4.300 5.328 384 HD21 LEU 49 HD21 LEU 49 3.292 -2.680 8.611 385 HD22 LEU 49 HD22 LEU 49 3.369 -1.829 7.067 386 HD23 LEU 49 HD23 LEU 49 4.108 -3.422 7.235 387 H MET 50 H MET 50 -0.438 -5.307 5.804 388 HA MET 50 HA MET 50 -0.479 -7.114 8.142 389 HB2 MET 50 HB2 MET 50 -1.723 -7.632 5.436 390 HB3 MET 50 HB3 MET 50 -1.667 -8.774 6.771 391 HG2 MET 50 HG2 MET 50 -3.153 -6.152 6.718 392 HG3 MET 50 HG3 MET 50 -3.856 -7.765 6.604 393 HE1 MET 50 HE1 MET 50 -3.416 -9.612 8.633 394 HE2 MET 50 HE2 MET 50 -2.758 -9.145 10.201 395 HE3 MET 50 HE3 MET 50 -1.724 -9.132 8.772 396 H ILE 51 H ILE 51 1.454 -8.043 8.329 397 HA ILE 51 HA ILE 51 2.866 -9.031 5.954 398 HB ILE 51 HB ILE 51 5.041 -8.073 7.005 399 HG12 ILE 51 HG12 ILE 51 4.524 -5.756 8.056 400 HG13 ILE 51 HG13 ILE 51 2.921 -6.408 8.375 401 HG21 ILE 51 HG21 ILE 51 4.136 -7.384 4.841 402 HG22 ILE 51 HG22 ILE 51 4.847 -6.021 5.704 403 HG23 ILE 51 HG23 ILE 51 3.093 -6.210 5.643 404 HD11 ILE 51 HD11 ILE 51 3.924 -8.186 9.718 405 HD12 ILE 51 HD12 ILE 51 4.344 -6.583 10.319 406 HD13 ILE 51 HD13 ILE 51 5.526 -7.514 9.400 407 H PHE 52 H PHE 52 4.801 -10.398 6.579 408 HA PHE 52 HA PHE 52 4.043 -12.068 8.870 409 HB2 PHE 52 HB2 PHE 52 5.605 -12.580 6.361 410 HB3 PHE 52 HB3 PHE 52 5.837 -13.627 7.756 411 HD1 PHE 52 HD2 PHE 52 4.038 -15.022 8.584 412 HD2 PHE 52 HD1 PHE 52 3.541 -12.641 5.088 413 HE1 PHE 52 HE2 PHE 52 2.044 -16.329 7.987 414 HE2 PHE 52 HE1 PHE 52 1.543 -13.945 4.481 415 HZ PHE 52 HZ PHE 52 0.790 -15.789 5.931 416 H VAL 53 H VAL 53 5.264 -12.340 10.634 417 HA VAL 53 HA VAL 53 8.040 -11.326 10.635 418 HB VAL 53 HB VAL 53 7.822 -10.238 12.734 419 HG11 VAL 53 HG11 VAL 53 5.353 -9.553 11.144 420 HG12 VAL 53 HG12 VAL 53 6.972 -8.898 10.881 421 HG13 VAL 53 HG13 VAL 53 6.102 -8.537 12.375 422 HG21 VAL 53 HG21 VAL 53 5.032 -11.367 12.928 423 HG22 VAL 53 HG22 VAL 53 5.761 -10.235 14.067 424 HG23 VAL 53 HG23 VAL 53 6.432 -11.855 13.886 425 H LYS 54 H LYS 54 9.450 -12.338 12.173 426 HA LYS 54 HA LYS 54 8.658 -15.077 12.818 427 HB2 LYS 54 HB2 LYS 54 11.341 -13.693 13.016 428 HB3 LYS 54 HB3 LYS 54 11.060 -15.402 13.330 429 HG2 LYS 54 HG2 LYS 54 10.317 -15.699 11.009 430 HG3 LYS 54 HG3 LYS 54 10.634 -13.991 10.700 431 HD2 LYS 54 HD2 LYS 54 12.468 -15.421 9.906 432 HD3 LYS 54 HD3 LYS 54 13.001 -14.318 11.177 433 HE2 LYS 54 HE2 LYS 54 12.869 -16.110 12.818 434 HE3 LYS 54 HE3 LYS 54 12.248 -17.217 11.591 435 HZ1 LYS 54 HZ1 LYS 54 14.595 -17.566 11.952 436 HZ2 LYS 54 HZ2 LYS 54 14.933 -15.950 11.598 437 HZ3 LYS 54 HZ3 LYS 54 14.343 -16.972 10.390 438 H ASN 55 H ASN 55 8.470 -12.204 14.438 439 HA ASN 55 HA ASN 55 7.977 -13.411 16.962 440 HB2 ASN 55 HB2 ASN 55 9.807 -12.172 18.216 441 HB3 ASN 55 HB3 ASN 55 10.335 -13.550 17.257 442 HD21 ASN 55 HD21 ASN 55 11.554 -13.190 15.394 443 HD22 ASN 55 HD22 ASN 55 12.320 -11.678 15.076 444 H THR 56 H THR 56 7.002 -11.995 18.464 445 HA THR 56 HA THR 56 5.550 -9.858 17.359 446 HB THR 56 HB THR 56 4.808 -9.338 19.652 447 HG1 THR 56 HG1 THR 56 5.885 -10.022 21.365 448 HG21 THR 56 HG21 THR 56 3.840 -11.535 20.200 449 HG22 THR 56 HG22 THR 56 4.963 -12.303 19.077 450 HG23 THR 56 HG23 THR 56 3.736 -11.189 18.472 451 H ASP 57 H ASP 57 8.670 -9.878 18.917 452 HA ASP 57 HA ASP 57 8.888 -7.145 19.589 453 HB2 ASP 57 HB2 ASP 57 11.133 -8.970 18.680 454 HB3 ASP 57 HB3 ASP 57 11.278 -7.529 19.685 455 H LYS 58 H LYS 58 9.763 -8.940 16.669 456 HA LYS 58 HA LYS 58 10.686 -6.861 15.056 457 HB2 LYS 58 HB2 LYS 58 10.993 -9.074 14.288 458 HB3 LYS 58 HB3 LYS 58 9.297 -9.477 14.496 459 HG2 LYS 58 HG2 LYS 58 9.823 -9.330 12.155 460 HG3 LYS 58 HG3 LYS 58 8.730 -8.021 12.609 461 HD2 LYS 58 HD2 LYS 58 10.630 -6.466 12.695 462 HD3 LYS 58 HD3 LYS 58 11.727 -7.780 12.255 463 HE2 LYS 58 HE2 LYS 58 10.529 -8.045 10.124 464 HE3 LYS 58 HE3 LYS 58 9.461 -6.711 10.566 465 HZ1 LYS 58 HZ1 LYS 58 11.279 -6.032 9.096 466 HZ2 LYS 58 HZ2 LYS 58 12.402 -6.500 10.261 467 HZ3 LYS 58 HZ3 LYS 58 11.338 -5.230 10.582 468 H LEU 59 H LEU 59 7.376 -8.001 15.628 469 HA LEU 59 HA LEU 59 6.040 -6.311 13.824 470 HB2 LEU 59 HB2 LEU 59 4.944 -8.215 14.828 471 HB3 LEU 59 HB3 LEU 59 5.124 -7.529 16.431 472 HG LEU 59 HG LEU 59 3.538 -5.750 15.883 473 HD11 LEU 59 HD11 LEU 59 2.291 -5.787 13.767 474 HD12 LEU 59 HD12 LEU 59 3.336 -7.080 13.181 475 HD13 LEU 59 HD13 LEU 59 4.012 -5.488 13.513 476 HD21 LEU 59 HD21 LEU 59 2.514 -8.517 15.212 477 HD22 LEU 59 HD22 LEU 59 1.513 -7.138 15.668 478 HD23 LEU 59 HD23 LEU 59 2.659 -7.813 16.825 479 H THR 60 H THR 60 6.763 -5.821 17.306 480 HA THR 60 HA THR 60 5.615 -3.234 17.461 481 HB THR 60 HB THR 60 6.881 -2.920 19.538 482 HG1 THR 60 HG1 THR 60 8.617 -4.614 18.429 483 HG21 THR 60 HG21 THR 60 4.834 -4.278 19.599 484 HG22 THR 60 HG22 THR 60 6.009 -4.838 20.789 485 HG23 THR 60 HG23 THR 60 5.785 -5.729 19.284 486 H THR 61 H THR 61 8.786 -4.359 16.454 487 HA THR 61 HA THR 61 10.153 -1.896 16.436 488 HB THR 61 HB THR 61 10.546 -4.284 14.610 489 HG1 THR 61 HG1 THR 61 11.826 -3.519 17.054 490 HG21 THR 61 HG21 THR 61 12.369 -1.937 15.178 491 HG22 THR 61 HG22 THR 61 11.600 -2.322 13.639 492 HG23 THR 61 HG23 THR 61 12.838 -3.392 14.297 493 H LEU 62 H LEU 62 8.237 -3.499 13.886 494 HA LEU 62 HA LEU 62 8.591 -1.528 11.904 495 HB2 LEU 62 HB2 LEU 62 6.285 -3.423 12.354 496 HB3 LEU 62 HB3 LEU 62 6.480 -2.433 10.918 497 HG LEU 62 HG LEU 62 8.287 -4.677 11.827 498 HD11 LEU 62 HD11 LEU 62 6.527 -4.356 9.400 499 HD12 LEU 62 HD12 LEU 62 6.203 -5.393 10.791 500 HD13 LEU 62 HD13 LEU 62 7.581 -5.730 9.745 501 HD21 LEU 62 HD21 LEU 62 9.629 -2.874 10.879 502 HD22 LEU 62 HD22 LEU 62 8.585 -2.828 9.458 503 HD23 LEU 62 HD23 LEU 62 9.570 -4.255 9.784 504 H MET 63 H MET 63 5.957 -1.930 14.291 505 HA MET 63 HA MET 63 4.469 0.321 13.579 506 HB2 MET 63 HB2 MET 63 4.829 -0.929 16.314 507 HB3 MET 63 HB3 MET 63 3.620 0.293 15.938 508 HG2 MET 63 HG2 MET 63 2.820 -1.322 14.122 509 HG3 MET 63 HG3 MET 63 3.790 -2.534 14.953 510 HE1 MET 63 HE1 MET 63 3.480 -1.840 17.999 511 HE2 MET 63 HE2 MET 63 3.262 -3.470 17.359 512 HE3 MET 63 HE3 MET 63 2.047 -2.776 18.432 513 H ASP 64 H ASP 64 7.271 0.066 15.737 514 HA ASP 64 HA ASP 64 7.347 2.753 16.575 515 HB2 ASP 64 HB2 ASP 64 8.702 0.863 17.539 516 HB3 ASP 64 HB3 ASP 64 9.738 0.950 16.118 517 H LYS 65 H LYS 65 8.920 1.145 13.804 518 HA LYS 65 HA LYS 65 10.228 3.329 12.669 519 HB2 LYS 65 HB2 LYS 65 8.924 0.960 11.304 520 HB3 LYS 65 HB3 LYS 65 10.009 2.080 10.498 521 HG2 LYS 65 HG2 LYS 65 11.779 1.443 12.130 522 HG3 LYS 65 HG3 LYS 65 10.679 0.228 12.777 523 HD2 LYS 65 HD2 LYS 65 11.974 -1.003 11.286 524 HD3 LYS 65 HD3 LYS 65 10.551 -0.620 10.322 525 HE2 LYS 65 HE2 LYS 65 13.124 0.965 10.254 526 HE3 LYS 65 HE3 LYS 65 12.733 -0.326 9.124 527 HZ1 LYS 65 HZ1 LYS 65 11.162 2.173 9.475 528 HZ2 LYS 65 HZ2 LYS 65 10.842 0.946 8.357 529 HZ3 LYS 65 HZ3 LYS 65 12.249 1.864 8.218 530 H LEU 66 H LEU 66 6.869 2.307 12.333 531 HA LEU 66 HA LEU 66 6.136 4.282 10.398 532 HB2 LEU 66 HB2 LEU 66 4.442 2.648 12.296 533 HB3 LEU 66 HB3 LEU 66 3.827 3.576 10.938 534 HG LEU 66 HG LEU 66 5.792 1.296 10.644 535 HD11 LEU 66 HD11 LEU 66 3.740 0.409 11.575 536 HD12 LEU 66 HD12 LEU 66 3.879 -0.050 9.878 537 HD13 LEU 66 HD13 LEU 66 2.788 1.252 10.354 538 HD21 LEU 66 HD21 LEU 66 4.076 2.756 8.629 539 HD22 LEU 66 HD22 LEU 66 5.111 1.368 8.287 540 HD23 LEU 66 HD23 LEU 66 5.827 2.891 8.809 541 H ARG 67 H ARG 67 6.141 4.158 13.915 542 HA ARG 67 HA ARG 67 4.647 6.559 14.331 543 HB2 ARG 67 HB2 ARG 67 6.548 5.029 16.119 544 HB3 ARG 67 HB3 ARG 67 5.623 6.427 16.656 545 HG2 ARG 67 HG2 ARG 67 3.549 5.273 16.263 546 HG3 ARG 67 HG3 ARG 67 4.401 3.909 15.542 547 HD2 ARG 67 HD2 ARG 67 5.514 3.504 17.718 548 HD3 ARG 67 HD3 ARG 67 4.562 4.815 18.419 549 HE ARG 67 HE ARG 67 2.625 3.274 17.481 550 HH11 ARG 67 HH11 ARG 67 5.467 2.383 19.192 551 HH12 ARG 67 HH12 ARG 67 4.737 0.990 19.905 552 HH21 ARG 67 HH21 ARG 67 1.693 1.481 18.397 553 HH22 ARG 67 HH22 ARG 67 2.624 0.491 19.471 554 H LYS 68 H LYS 68 7.752 6.074 13.131 555 HA LYS 68 HA LYS 68 8.983 8.453 14.205 556 HB2 LYS 68 HB2 LYS 68 9.801 6.671 11.901 557 HB3 LYS 68 HB3 LYS 68 10.778 7.975 12.554 558 HG2 LYS 68 HG2 LYS 68 9.911 5.525 14.088 559 HG3 LYS 68 HG3 LYS 68 11.484 5.747 13.331 560 HD2 LYS 68 HD2 LYS 68 12.001 6.384 15.463 561 HD3 LYS 68 HD3 LYS 68 11.510 7.944 14.814 562 HE2 LYS 68 HE2 LYS 68 10.531 7.597 17.007 563 HE3 LYS 68 HE3 LYS 68 9.262 7.611 15.783 564 HZ1 LYS 68 HZ1 LYS 68 9.260 5.180 15.843 565 HZ2 LYS 68 HZ2 LYS 68 8.913 5.833 17.363 566 HZ3 LYS 68 HZ3 LYS 68 10.445 5.193 17.050 567 H VAL 69 H VAL 69 6.628 7.975 11.870 568 HA VAL 69 HA VAL 69 7.477 9.935 9.949 569 HB VAL 69 HB VAL 69 4.791 8.585 10.296 570 HG11 VAL 69 HG11 VAL 69 5.853 10.222 7.986 571 HG12 VAL 69 HG12 VAL 69 4.562 10.696 9.090 572 HG13 VAL 69 HG13 VAL 69 4.332 9.330 7.997 573 HG21 VAL 69 HG21 VAL 69 7.061 7.982 8.388 574 HG22 VAL 69 HG22 VAL 69 5.494 7.171 8.420 575 HG23 VAL 69 HG23 VAL 69 6.597 7.009 9.786 576 H GLN 70 H GLN 70 6.982 12.013 9.847 577 HA GLN 70 HA GLN 70 6.503 13.516 12.077 578 HB2 GLN 70 HB2 GLN 70 6.182 15.418 10.567 579 HB3 GLN 70 HB3 GLN 70 7.497 14.380 10.030 580 HG2 GLN 70 HG2 GLN 70 6.085 13.401 8.324 581 HG3 GLN 70 HG3 GLN 70 4.701 14.331 8.895 582 HE21 GLN 70 HE21 GLN 70 4.631 16.548 8.481 583 HE22 GLN 70 HE22 GLN 70 5.616 17.279 7.267 584 H GLY 71 H GLY 71 4.021 12.617 9.664 585 HA2 GLY 71 HA2 GLY 71 2.044 14.240 11.080 586 HA3 GLY 71 HA3 GLY 71 1.853 13.511 9.502 587 H VAL 72 H VAL 72 2.996 11.077 11.471 588 HA VAL 72 HA VAL 72 0.260 10.058 11.793 589 HB VAL 72 HB VAL 72 2.886 8.596 12.134 590 HG11 VAL 72 HG11 VAL 72 1.469 6.563 12.151 591 HG12 VAL 72 HG12 VAL 72 0.031 7.585 12.164 592 HG13 VAL 72 HG13 VAL 72 1.146 7.616 13.530 593 HG21 VAL 72 HG21 VAL 72 2.269 7.486 10.020 594 HG22 VAL 72 HG22 VAL 72 2.497 9.223 9.816 595 HG23 VAL 72 HG23 VAL 72 0.867 8.551 9.883 596 H PHE 73 H PHE 73 -0.749 10.001 13.678 597 HA PHE 73 HA PHE 73 0.833 10.413 16.119 598 HB2 PHE 73 HB2 PHE 73 -1.689 10.938 16.956 599 HB3 PHE 73 HB3 PHE 73 -0.586 12.140 16.317 600 HD1 PHE 73 HD2 PHE 73 -0.853 13.040 14.076 601 HD2 PHE 73 HD1 PHE 73 -3.645 10.254 15.684 602 HE1 PHE 73 HE2 PHE 73 -2.466 13.653 12.326 603 HE2 PHE 73 HE1 PHE 73 -5.263 10.866 13.934 604 HZ PHE 73 HZ PHE 73 -4.674 12.571 12.254 605 H THR 74 H THR 74 -1.331 8.157 14.570 606 HA THR 74 HA THR 74 -1.152 6.479 17.006 607 HB THR 74 HB THR 74 -3.290 5.596 16.729 608 HG1 THR 74 HG1 THR 74 -4.497 5.811 14.828 609 HG21 THR 74 HG21 THR 74 -4.836 7.486 16.592 610 HG22 THR 74 HG22 THR 74 -3.575 8.474 15.856 611 HG23 THR 74 HG23 THR 74 -3.405 7.925 17.524 612 H VAL 75 H VAL 75 -0.138 4.620 16.746 613 HA VAL 75 HA VAL 75 -0.461 3.104 14.255 614 HB VAL 75 HB VAL 75 2.230 3.367 15.631 615 HG11 VAL 75 HG11 VAL 75 1.442 2.031 13.037 616 HG12 VAL 75 HG12 VAL 75 1.876 1.213 14.539 617 HG13 VAL 75 HG13 VAL 75 3.083 2.163 13.671 618 HG21 VAL 75 HG21 VAL 75 1.340 4.604 13.018 619 HG22 VAL 75 HG22 VAL 75 2.972 4.653 13.684 620 HG23 VAL 75 HG23 VAL 75 1.653 5.479 14.519 621 H GLU 76 H GLU 76 -1.583 1.377 15.005 622 HA GLU 76 HA GLU 76 -0.807 0.221 17.619 623 HB2 GLU 76 HB2 GLU 76 -3.568 0.236 16.378 624 HB3 GLU 76 HB3 GLU 76 -3.141 -0.407 17.957 625 HG2 GLU 76 HG2 GLU 76 -2.469 1.907 18.629 626 HG3 GLU 76 HG3 GLU 76 -3.118 2.477 17.091 627 H ARG 77 H ARG 77 -1.338 -2.075 17.922 628 HA ARG 77 HA ARG 77 -0.707 -3.678 15.581 629 HB2 ARG 77 HB2 ARG 77 0.430 -4.227 17.636 630 HB3 ARG 77 HB3 ARG 77 -1.094 -4.354 18.506 631 HG2 ARG 77 HG2 ARG 77 -1.687 -6.330 17.203 632 HG3 ARG 77 HG3 ARG 77 -0.178 -6.196 16.299 633 HD2 ARG 77 HD2 ARG 77 -0.061 -7.881 18.103 634 HD3 ARG 77 HD3 ARG 77 1.107 -6.576 18.314 635 HE ARG 77 HE ARG 77 0.012 -5.936 20.229 636 HH11 ARG 77 HH11 ARG 77 -1.934 -8.224 18.544 637 HH12 ARG 77 HH12 ARG 77 -3.076 -8.366 19.827 638 HH21 ARG 77 HH21 ARG 77 -1.423 -6.151 21.881 639 HH22 ARG 77 HH22 ARG 77 -2.777 -7.220 21.721 640 H LEU 78 H LEU 78 -2.044 -5.282 14.688 641 HA LEU 78 HA LEU 78 -4.905 -5.085 15.355 642 HB2 LEU 78 HB2 LEU 78 -3.534 -6.111 12.861 643 HB3 LEU 78 HB3 LEU 78 -5.268 -6.135 13.125 644 HG LEU 78 HG LEU 78 -3.558 -3.645 12.948 645 HD11 LEU 78 HD11 LEU 78 -5.542 -4.795 10.982 646 HD12 LEU 78 HD12 LEU 78 -3.789 -4.770 10.792 647 HD13 LEU 78 HD13 LEU 78 -4.693 -3.257 10.821 648 HD21 LEU 78 HD21 LEU 78 -6.556 -3.945 13.194 649 HD22 LEU 78 HD22 LEU 78 -5.687 -2.430 12.943 650 HD23 LEU 78 HD23 LEU 78 -5.467 -3.334 14.441 651 H SER 79 H SER 79 -5.848 -6.724 16.388 652 HA SER 79 HA SER 79 -4.390 -9.273 16.644 653 HB2 SER 79 HB2 SER 79 -6.630 -8.107 18.321 654 HB3 SER 79 HB3 SER 79 -5.879 -9.675 18.606 655 HG SER 79 HG SER 79 -4.908 -7.111 19.082 656 H ASN 80 H ASN 80 -7.640 -7.994 16.001 657 HA ASN 80 HA ASN 80 -8.720 -10.609 15.367 658 HB2 ASN 80 HB2 ASN 80 -9.961 -7.857 15.082 659 HB3 ASN 80 HB3 ASN 80 -10.817 -9.393 14.983 660 HD21 ASN 80 HD21 ASN 80 -11.183 -10.564 16.854 661 HD22 ASN 80 HD22 ASN 80 -10.985 -9.877 18.428 662 H LEU 81 H LEU 81 -8.051 -11.489 13.467 663 HA LEU 81 HA LEU 81 -7.853 -9.726 11.103 664 HB2 LEU 81 HB2 LEU 81 -6.433 -12.338 11.636 665 HB3 LEU 81 HB3 LEU 81 -6.243 -11.344 10.205 666 HG LEU 81 HG LEU 81 -5.396 -10.635 13.020 667 HD11 LEU 81 HD11 LEU 81 -3.806 -11.163 10.506 668 HD12 LEU 81 HD12 LEU 81 -3.915 -12.220 11.916 669 HD13 LEU 81 HD13 LEU 81 -3.139 -10.642 12.055 670 HD21 LEU 81 HD21 LEU 81 -5.223 -8.977 10.497 671 HD22 LEU 81 HD22 LEU 81 -4.485 -8.570 12.047 672 HD23 LEU 81 HD23 LEU 81 -6.240 -8.642 11.899 673 H GLU 82 H GLU 82 -8.858 -10.251 9.214 674 HA GLU 82 HA GLU 82 -11.016 -12.189 9.327 675 HB2 GLU 82 HB2 GLU 82 -11.727 -11.217 7.214 676 HB3 GLU 82 HB3 GLU 82 -11.291 -9.917 8.319 677 HG2 GLU 82 HG2 GLU 82 -9.114 -9.701 7.223 678 HG3 GLU 82 HG3 GLU 82 -9.532 -11.009 6.121 679 H HIS 83 H HIS 83 -7.947 -12.784 8.918 680 HA HIS 83 HA HIS 83 -7.768 -13.779 6.229 681 HB2 HIS 83 HB2 HIS 83 -5.851 -13.920 8.559 682 HB3 HIS 83 HB3 HIS 83 -5.463 -14.415 6.914 683 HD1 HIS 83 HD1 HIS 83 -4.326 -12.650 5.597 684 HD2 HIS 83 HD2 HIS 83 -6.768 -11.031 8.533 685 HE1 HIS 83 HE1 HIS 83 -3.978 -10.170 5.469 686 HE2 HIS 83 HE2 HIS 83 -5.669 -9.215 7.066 687 H HIS 84 H HIS 84 -8.645 -15.174 9.270 688 HA HIS 84 HA HIS 84 -8.543 -17.867 8.067 689 HB2 HIS 84 HB2 HIS 84 -8.604 -16.947 10.935 690 HB3 HIS 84 HB3 HIS 84 -9.114 -18.578 10.507 691 HD1 HIS 84 HD1 HIS 84 -6.092 -16.452 10.906 692 HD2 HIS 84 HD2 HIS 84 -7.048 -20.253 9.524 693 HE1 HIS 84 HE1 HIS 84 -3.908 -17.678 10.736 694 HE2 HIS 84 HE2 HIS 84 -4.495 -19.906 9.736 695 H HIS 85 H HIS 85 -10.341 -18.137 6.906 696 HA HIS 85 HA HIS 85 -12.939 -17.397 8.081 697 HB2 HIS 85 HB2 HIS 85 -13.806 -17.665 5.731 698 HB3 HIS 85 HB3 HIS 85 -12.650 -16.358 5.946 699 HD1 HIS 85 HD1 HIS 85 -12.640 -19.980 4.740 700 HD2 HIS 85 HD2 HIS 85 -10.654 -16.379 4.116 701 HE1 HIS 85 HE1 HIS 85 -11.055 -20.404 2.843 702 HE2 HIS 85 HE2 HIS 85 -10.042 -18.159 2.343 703 H HIS 86 H HIS 86 -14.459 -18.929 8.525 704 HA HIS 86 HA HIS 86 -13.566 -21.716 8.430 705 HB2 HIS 86 HB2 HIS 86 -16.036 -20.599 9.779 706 HB3 HIS 86 HB3 HIS 86 -15.255 -22.147 10.088 707 HD1 HIS 86 HD1 HIS 86 -12.816 -21.973 11.250 708 HD2 HIS 86 HD2 HIS 86 -15.137 -18.528 11.325 709 HE1 HIS 86 HE1 HIS 86 -11.795 -20.517 13.012 710 HE2 HIS 86 HE2 HIS 86 -13.109 -18.375 12.921 711 H HIS 87 H HIS 87 -14.492 -23.283 7.168 712 HA HIS 87 HA HIS 87 -16.320 -22.606 5.101 713 HB2 HIS 87 HB2 HIS 87 -14.717 -24.431 4.833 714 HB3 HIS 87 HB3 HIS 87 -15.482 -25.324 6.142 715 HD1 HIS 87 HD1 HIS 87 -16.866 -27.161 5.275 716 HD2 HIS 87 HD2 HIS 87 -16.901 -23.899 2.701 717 HE1 HIS 87 HE1 HIS 87 -18.333 -27.837 3.359 718 HE2 HIS 87 HE2 HIS 87 -18.464 -25.798 1.896 719 H HIS 88 H HIS 88 -16.734 -23.971 8.307 720 HA HIS 88 HA HIS 88 -19.580 -24.451 7.925 721 HB2 HIS 88 HB2 HIS 88 -18.356 -26.010 9.327 722 HB3 HIS 88 HB3 HIS 88 -17.798 -24.702 10.364 723 HD1 HIS 88 HD1 HIS 88 -19.646 -23.552 11.877 724 HD2 HIS 88 HD2 HIS 88 -20.824 -27.064 9.998 725 HE1 HIS 88 HE1 HIS 88 -21.723 -24.289 13.077 726 HE2 HIS 88 HE2 HIS 88 -22.524 -26.295 11.794 727 H1 MET 1 H1 MET 1 -8.652 20.827 -16.047 728 H2 MET 1 H2 MET 1 -7.501 21.978 -16.505 729 H3 MET 1 H3 MET 1 -8.495 22.267 -15.171 730 HA MET 1 HA MET 1 -6.494 20.085 -15.372 731 HB2 MET 1 HB2 MET 1 -5.140 21.376 -13.796 732 HB3 MET 1 HB3 MET 1 -5.427 22.298 -15.266 733 HG2 MET 1 HG2 MET 1 -7.182 23.570 -14.115 734 HG3 MET 1 HG3 MET 1 -6.864 22.658 -12.640 735 HE1 MET 1 HE1 MET 1 -5.398 26.175 -11.750 736 HE2 MET 1 HE2 MET 1 -6.516 24.896 -11.277 737 HE3 MET 1 HE3 MET 1 -6.834 25.855 -12.724 738 H THR 2 H THR 2 -9.451 20.433 -14.394 739 HA THR 2 HA THR 2 -9.307 19.996 -11.559 740 HB THR 2 HB THR 2 -11.624 19.577 -13.471 741 HG1 THR 2 HG1 THR 2 -12.292 21.607 -12.684 742 HG21 THR 2 HG21 THR 2 -13.039 19.606 -11.463 743 HG22 THR 2 HG22 THR 2 -11.604 19.702 -10.443 744 HG23 THR 2 HG23 THR 2 -11.902 18.257 -11.412 745 H ASP 3 H ASP 3 -8.394 18.207 -10.819 746 HA ASP 3 HA ASP 3 -8.336 15.742 -12.258 747 HB2 ASP 3 HB2 ASP 3 -7.195 14.900 -10.169 748 HB3 ASP 3 HB3 ASP 3 -6.437 16.294 -10.930 749 H PHE 4 H PHE 4 -9.449 13.861 -11.937 750 HA PHE 4 HA PHE 4 -11.649 13.898 -9.983 751 HB2 PHE 4 HB2 PHE 4 -12.894 12.411 -11.448 752 HB3 PHE 4 HB3 PHE 4 -12.417 13.844 -12.346 753 HD1 PHE 4 HD1 PHE 4 -11.766 10.237 -11.869 754 HD2 PHE 4 HD2 PHE 4 -10.979 13.681 -14.260 755 HE1 PHE 4 HE1 PHE 4 -10.758 8.807 -13.595 756 HE2 PHE 4 HE2 PHE 4 -9.977 12.246 -15.989 757 HZ PHE 4 HZ PHE 4 -9.851 9.808 -15.647 758 H LEU 5 H LEU 5 -12.200 11.824 -9.039 759 HA LEU 5 HA LEU 5 -9.828 10.428 -8.188 760 HB2 LEU 5 HB2 LEU 5 -11.536 11.031 -6.591 761 HB3 LEU 5 HB3 LEU 5 -12.737 10.125 -7.488 762 HG LEU 5 HG LEU 5 -11.590 8.023 -6.915 763 HD11 LEU 5 HD11 LEU 5 -9.766 8.021 -5.269 764 HD12 LEU 5 HD12 LEU 5 -9.714 9.784 -5.331 765 HD13 LEU 5 HD13 LEU 5 -9.303 8.838 -6.762 766 HD21 LEU 5 HD21 LEU 5 -12.140 7.991 -4.544 767 HD22 LEU 5 HD22 LEU 5 -13.362 8.873 -5.459 768 HD23 LEU 5 HD23 LEU 5 -12.163 9.755 -4.512 769 H ALA 6 H ALA 6 -8.989 8.909 -9.457 770 HA ALA 6 HA ALA 6 -10.759 7.125 -10.999 771 HB1 ALA 6 HB1 ALA 6 -8.867 6.769 -12.477 772 HB2 ALA 6 HB2 ALA 6 -7.850 7.781 -11.449 773 HB3 ALA 6 HB3 ALA 6 -9.215 8.490 -12.314 774 H GLY 7 H GLY 7 -10.178 4.864 -11.185 775 HA2 GLY 7 HA2 GLY 7 -8.566 3.850 -8.916 776 HA3 GLY 7 HA3 GLY 7 -10.110 3.141 -9.355 777 H ILE 8 H ILE 8 -7.356 2.007 -9.212 778 HA ILE 8 HA ILE 8 -7.259 0.820 -11.914 779 HB ILE 8 HB ILE 8 -4.808 1.504 -10.253 780 HG12 ILE 8 HG12 ILE 8 -5.813 2.837 -12.788 781 HG13 ILE 8 HG13 ILE 8 -5.867 3.543 -11.176 782 HG21 ILE 8 HG21 ILE 8 -5.051 0.410 -13.061 783 HG22 ILE 8 HG22 ILE 8 -4.508 -0.480 -11.638 784 HG23 ILE 8 HG23 ILE 8 -3.543 0.858 -12.260 785 HD11 ILE 8 HD11 ILE 8 -3.422 3.523 -11.088 786 HD12 ILE 8 HD12 ILE 8 -4.021 4.446 -12.466 787 HD13 ILE 8 HD13 ILE 8 -3.372 2.824 -12.707 788 H ARG 9 H ARG 9 -6.929 -1.418 -11.953 789 HA ARG 9 HA ARG 9 -6.405 -2.723 -9.351 790 HB2 ARG 9 HB2 ARG 9 -8.714 -3.132 -10.189 791 HB3 ARG 9 HB3 ARG 9 -8.032 -3.883 -11.628 792 HG2 ARG 9 HG2 ARG 9 -6.980 -5.604 -10.244 793 HG3 ARG 9 HG3 ARG 9 -7.631 -4.842 -8.792 794 HD2 ARG 9 HD2 ARG 9 -9.921 -5.239 -9.673 795 HD3 ARG 9 HD3 ARG 9 -9.208 -6.108 -11.035 796 HE ARG 9 HE ARG 9 -8.209 -7.265 -8.714 797 HH11 ARG 9 HH11 ARG 9 -11.258 -6.917 -10.289 798 HH12 ARG 9 HH12 ARG 9 -11.917 -8.342 -9.566 799 HH21 ARG 9 HH21 ARG 9 -9.062 -9.108 -7.820 800 HH22 ARG 9 HH22 ARG 9 -10.679 -9.581 -8.196 801 H ILE 10 H ILE 10 -4.674 -3.975 -9.220 802 HA ILE 10 HA ILE 10 -3.251 -4.752 -11.701 803 HB ILE 10 HB ILE 10 -2.012 -4.311 -8.974 804 HG12 ILE 10 HG12 ILE 10 -1.980 -2.334 -11.268 805 HG13 ILE 10 HG13 ILE 10 -3.092 -2.219 -9.907 806 HG21 ILE 10 HG21 ILE 10 -0.720 -5.722 -10.488 807 HG22 ILE 10 HG22 ILE 10 0.091 -4.180 -10.225 808 HG23 ILE 10 HG23 ILE 10 -0.782 -4.469 -11.729 809 HD11 ILE 10 HD11 ILE 10 -1.178 -0.754 -9.621 810 HD12 ILE 10 HD12 ILE 10 -0.088 -2.137 -9.735 811 HD13 ILE 10 HD13 ILE 10 -1.210 -2.005 -8.379 812 H VAL 11 H VAL 11 -3.370 -6.976 -12.020 813 HA VAL 11 HA VAL 11 -3.084 -8.658 -9.599 814 HB VAL 11 HB VAL 11 -4.540 -9.353 -12.160 815 HG11 VAL 11 HG11 VAL 11 -4.043 -11.075 -9.727 816 HG12 VAL 11 HG12 VAL 11 -3.336 -11.307 -11.326 817 HG13 VAL 11 HG13 VAL 11 -5.074 -11.496 -11.096 818 HG21 VAL 11 HG21 VAL 11 -5.810 -7.893 -10.660 819 HG22 VAL 11 HG22 VAL 11 -5.534 -9.012 -9.322 820 HG23 VAL 11 HG23 VAL 11 -6.513 -9.511 -10.703 821 H GLY 12 H GLY 12 -1.220 -9.625 -9.415 822 HA2 GLY 12 HA2 GLY 12 0.196 -10.592 -11.815 823 HA3 GLY 12 HA3 GLY 12 1.046 -9.565 -10.670 824 H GLU 13 H GLU 13 2.021 -12.072 -11.243 825 HA GLU 13 HA GLU 13 1.052 -14.094 -9.490 826 HB2 GLU 13 HB2 GLU 13 3.145 -15.293 -10.087 827 HB3 GLU 13 HB3 GLU 13 2.236 -14.724 -11.480 828 HG2 GLU 13 HG2 GLU 13 3.774 -12.832 -11.721 829 HG3 GLU 13 HG3 GLU 13 4.682 -13.389 -10.317 830 H ASP 14 H ASP 14 1.626 -14.664 -7.463 831 HA ASP 14 HA ASP 14 2.906 -12.744 -5.797 832 HB2 ASP 14 HB2 ASP 14 1.084 -14.113 -4.949 833 HB3 ASP 14 HB3 ASP 14 2.017 -15.582 -5.217 834 H LYS 15 H LYS 15 4.992 -12.494 -6.617 835 HA LYS 15 HA LYS 15 6.846 -14.736 -6.595 836 HB2 LYS 15 HB2 LYS 15 7.218 -11.811 -7.240 837 HB3 LYS 15 HB3 LYS 15 8.530 -12.972 -7.255 838 HG2 LYS 15 HG2 LYS 15 6.084 -13.074 -9.010 839 HG3 LYS 15 HG3 LYS 15 7.679 -12.480 -9.476 840 HD2 LYS 15 HD2 LYS 15 7.105 -15.295 -8.557 841 HD3 LYS 15 HD3 LYS 15 7.222 -14.792 -10.243 842 HE2 LYS 15 HE2 LYS 15 9.538 -14.019 -9.812 843 HE3 LYS 15 HE3 LYS 15 9.409 -14.639 -8.165 844 HZ1 LYS 15 HZ1 LYS 15 10.527 -16.209 -9.609 845 HZ2 LYS 15 HZ2 LYS 15 9.194 -16.254 -10.647 846 HZ3 LYS 15 HZ3 LYS 15 9.058 -16.852 -9.071 847 H ASN 16 H ASN 16 9.092 -14.054 -5.791 848 HA ASN 16 HA ASN 16 9.414 -14.173 -3.116 849 HB2 ASN 16 HB2 ASN 16 11.153 -12.731 -5.119 850 HB3 ASN 16 HB3 ASN 16 11.694 -13.315 -3.542 851 HD21 ASN 16 HD21 ASN 16 12.161 -13.962 -6.528 852 HD22 ASN 16 HD22 ASN 16 12.138 -15.691 -6.556 853 H GLY 17 H GLY 17 8.976 -11.176 -4.971 854 HA2 GLY 17 HA2 GLY 17 8.299 -9.752 -2.515 855 HA3 GLY 17 HA3 GLY 17 9.748 -9.186 -3.325 856 H MET 18 H MET 18 7.084 -10.365 -5.239 857 HA MET 18 HA MET 18 6.904 -8.010 -6.762 858 HB2 MET 18 HB2 MET 18 5.382 -10.548 -6.576 859 HB3 MET 18 HB3 MET 18 4.539 -9.203 -7.322 860 HG2 MET 18 HG2 MET 18 7.252 -10.168 -8.185 861 HG3 MET 18 HG3 MET 18 5.733 -10.692 -8.911 862 HE1 MET 18 HE1 MET 18 4.089 -9.080 -10.235 863 HE2 MET 18 HE2 MET 18 4.344 -7.337 -10.355 864 HE3 MET 18 HE3 MET 18 4.017 -8.076 -8.788 865 H THR 19 H THR 19 4.637 -9.209 -4.258 866 HA THR 19 HA THR 19 2.767 -7.145 -4.367 867 HB THR 19 HB THR 19 2.164 -7.711 -2.065 868 HG1 THR 19 HG1 THR 19 3.525 -8.711 -0.727 869 HG21 THR 19 HG21 THR 19 2.992 -10.157 -3.640 870 HG22 THR 19 HG22 THR 19 1.469 -9.284 -3.803 871 HG23 THR 19 HG23 THR 19 1.837 -10.141 -2.306 872 H ASN 20 H ASN 20 5.919 -7.230 -2.826 873 HA ASN 20 HA ASN 20 5.585 -4.834 -1.304 874 HB2 ASN 20 HB2 ASN 20 7.106 -6.658 -0.629 875 HB3 ASN 20 HB3 ASN 20 8.078 -6.382 -2.068 876 HD21 ASN 20 HD21 ASN 20 7.207 -5.202 1.062 877 HD22 ASN 20 HD22 ASN 20 8.460 -4.035 1.184 878 H GLN 21 H GLN 21 7.322 -5.685 -4.305 879 HA GLN 21 HA GLN 21 8.399 -3.098 -4.721 880 HB2 GLN 21 HB2 GLN 21 9.154 -3.891 -6.832 881 HB3 GLN 21 HB3 GLN 21 9.296 -5.231 -5.712 882 HG2 GLN 21 HG2 GLN 21 7.265 -6.220 -6.617 883 HG3 GLN 21 HG3 GLN 21 7.066 -4.847 -7.703 884 HE21 GLN 21 HE21 GLN 21 8.918 -7.715 -7.035 885 HE22 GLN 21 HE22 GLN 21 9.682 -7.809 -8.578 886 H ILE 22 H ILE 22 5.437 -4.662 -5.828 887 HA ILE 22 HA ILE 22 4.687 -2.893 -7.855 888 HB ILE 22 HB ILE 22 3.123 -4.711 -6.042 889 HG12 ILE 22 HG12 ILE 22 4.451 -5.719 -7.833 890 HG13 ILE 22 HG13 ILE 22 2.731 -5.926 -8.154 891 HG21 ILE 22 HG21 ILE 22 1.908 -2.969 -8.191 892 HG22 ILE 22 HG22 ILE 22 1.622 -2.834 -6.455 893 HG23 ILE 22 HG23 ILE 22 1.088 -4.270 -7.326 894 HD11 ILE 22 HD11 ILE 22 4.502 -3.840 -9.404 895 HD12 ILE 22 HD12 ILE 22 2.792 -4.105 -9.752 896 HD13 ILE 22 HD13 ILE 22 3.978 -5.344 -10.164 897 H THR 23 H THR 23 3.629 -2.842 -4.437 898 HA THR 23 HA THR 23 2.295 -0.334 -4.764 899 HB THR 23 HB THR 23 3.108 -1.588 -2.126 900 HG1 THR 23 HG1 THR 23 1.790 -3.142 -2.776 901 HG21 THR 23 HG21 THR 23 0.881 0.310 -2.884 902 HG22 THR 23 HG22 THR 23 2.326 0.718 -1.957 903 HG23 THR 23 HG23 THR 23 1.128 -0.389 -1.284 904 H GLY 24 H GLY 24 5.508 -1.332 -3.825 905 HA2 GLY 24 HA2 GLY 24 6.502 1.092 -2.809 906 HA3 GLY 24 HA3 GLY 24 7.458 -0.131 -3.632 907 H VAL 25 H VAL 25 6.204 -0.026 -6.176 908 HA VAL 25 HA VAL 25 7.401 2.310 -7.310 909 HB VAL 25 HB VAL 25 5.548 0.273 -8.581 910 HG11 VAL 25 HG11 VAL 25 6.430 1.085 -10.730 911 HG12 VAL 25 HG12 VAL 25 7.323 2.348 -9.882 912 HG13 VAL 25 HG13 VAL 25 5.559 2.352 -9.863 913 HG21 VAL 25 HG21 VAL 25 8.562 0.494 -8.578 914 HG22 VAL 25 HG22 VAL 25 7.628 -0.679 -9.510 915 HG23 VAL 25 HG23 VAL 25 7.605 -0.732 -7.747 916 H ILE 26 H ILE 26 4.089 1.372 -6.520 917 HA ILE 26 HA ILE 26 2.677 3.450 -7.718 918 HB ILE 26 HB ILE 26 2.127 1.972 -5.142 919 HG12 ILE 26 HG12 ILE 26 0.981 1.699 -7.937 920 HG13 ILE 26 HG13 ILE 26 2.135 0.601 -7.189 921 HG21 ILE 26 HG21 ILE 26 0.273 3.817 -6.652 922 HG22 ILE 26 HG22 ILE 26 0.971 4.119 -5.061 923 HG23 ILE 26 HG23 ILE 26 -0.177 2.799 -5.283 924 HD11 ILE 26 HD11 ILE 26 0.464 -0.004 -5.513 925 HD12 ILE 26 HD12 ILE 26 -0.104 -0.318 -7.151 926 HD13 ILE 26 HD13 ILE 26 -0.691 1.092 -6.271 927 H SER 27 H SER 27 4.298 3.413 -4.545 928 HA SER 27 HA SER 27 3.497 5.984 -3.703 929 HB2 SER 27 HB2 SER 27 5.307 5.895 -2.089 930 HB3 SER 27 HB3 SER 27 4.573 4.297 -2.205 931 HG SER 27 HG SER 27 6.305 3.617 -3.453 932 H LYS 28 H LYS 28 5.742 5.034 -6.130 933 HA LYS 28 HA LYS 28 7.201 7.565 -6.100 934 HB2 LYS 28 HB2 LYS 28 7.496 5.244 -8.022 935 HB3 LYS 28 HB3 LYS 28 8.623 6.574 -7.786 936 HG2 LYS 28 HG2 LYS 28 8.922 5.762 -5.417 937 HG3 LYS 28 HG3 LYS 28 7.991 4.334 -5.875 938 HD2 LYS 28 HD2 LYS 28 9.637 3.787 -7.591 939 HD3 LYS 28 HD3 LYS 28 10.557 5.239 -7.191 940 HE2 LYS 28 HE2 LYS 28 10.054 2.869 -5.383 941 HE3 LYS 28 HE3 LYS 28 11.582 3.293 -6.154 942 HZ1 LYS 28 HZ1 LYS 28 10.159 4.830 -4.051 943 HZ2 LYS 28 HZ2 LYS 28 11.519 5.400 -4.877 944 HZ3 LYS 28 HZ3 LYS 28 11.639 4.025 -3.902 945 H PHE 29 H PHE 29 4.246 7.160 -6.966 946 HA PHE 29 HA PHE 29 4.301 7.891 -9.766 947 HB2 PHE 29 HB2 PHE 29 2.075 7.430 -7.798 948 HB3 PHE 29 HB3 PHE 29 1.758 8.125 -9.382 949 HD1 PHE 29 HD1 PHE 29 4.319 6.159 -10.262 950 HD2 PHE 29 HD2 PHE 29 0.374 5.729 -8.706 951 HE1 PHE 29 HE1 PHE 29 4.176 3.910 -11.241 952 HE2 PHE 29 HE2 PHE 29 0.234 3.479 -9.690 953 HZ PHE 29 HZ PHE 29 2.137 2.571 -10.958 954 H ASP 30 H ASP 30 2.975 9.682 -10.560 955 HA ASP 30 HA ASP 30 3.759 12.198 -9.364 956 HB2 ASP 30 HB2 ASP 30 4.043 11.864 -11.743 957 HB3 ASP 30 HB3 ASP 30 2.353 11.429 -11.935 958 H THR 31 H THR 31 1.429 10.334 -8.353 959 HA THR 31 HA THR 31 -0.488 12.531 -7.920 960 HB THR 31 HB THR 31 -1.530 11.169 -9.614 961 HG1 THR 31 HG1 THR 31 -3.386 11.167 -8.581 962 HG21 THR 31 HG21 THR 31 -1.996 8.784 -9.282 963 HG22 THR 31 HG22 THR 31 -1.103 8.820 -7.759 964 HG23 THR 31 HG23 THR 31 -0.261 9.100 -9.284 965 H ASN 32 H ASN 32 -1.995 12.080 -6.072 966 HA ASN 32 HA ASN 32 -0.433 10.951 -3.858 967 HB2 ASN 32 HB2 ASN 32 -2.831 12.799 -3.821 968 HB3 ASN 32 HB3 ASN 32 -1.949 12.248 -2.398 969 HD21 ASN 32 HD21 ASN 32 0.260 12.868 -2.197 970 HD22 ASN 32 HD22 ASN 32 0.805 14.347 -2.898 971 H ILE 33 H ILE 33 -1.097 9.275 -2.633 972 HA ILE 33 HA ILE 33 -3.104 7.536 -3.688 973 HB ILE 33 HB ILE 33 -1.543 7.323 -1.101 974 HG12 ILE 33 HG12 ILE 33 -1.024 6.096 -3.832 975 HG13 ILE 33 HG13 ILE 33 -0.099 7.405 -3.104 976 HG21 ILE 33 HG21 ILE 33 -3.536 5.933 -1.032 977 HG22 ILE 33 HG22 ILE 33 -2.104 4.920 -1.210 978 HG23 ILE 33 HG23 ILE 33 -3.137 5.239 -2.604 979 HD11 ILE 33 HD11 ILE 33 -0.292 4.583 -2.072 980 HD12 ILE 33 HD12 ILE 33 0.616 5.891 -1.313 981 HD13 ILE 33 HD13 ILE 33 1.082 5.303 -2.910 982 H ARG 34 H ARG 34 -5.235 7.675 -3.312 983 HA ARG 34 HA ARG 34 -6.192 8.821 -0.782 984 HB2 ARG 34 HB2 ARG 34 -7.549 8.233 -3.410 985 HB3 ARG 34 HB3 ARG 34 -8.471 8.606 -1.959 986 HG2 ARG 34 HG2 ARG 34 -6.386 10.392 -3.210 987 HG3 ARG 34 HG3 ARG 34 -8.135 10.582 -3.365 988 HD2 ARG 34 HD2 ARG 34 -8.358 10.962 -0.997 989 HD3 ARG 34 HD3 ARG 34 -6.656 10.591 -0.732 990 HE ARG 34 HE ARG 34 -7.413 12.895 -2.385 991 HH11 ARG 34 HH11 ARG 34 -5.913 11.583 0.414 992 HH12 ARG 34 HH12 ARG 34 -5.203 13.081 0.886 993 HH21 ARG 34 HH21 ARG 34 -6.487 14.822 -1.789 994 HH22 ARG 34 HH22 ARG 34 -5.500 14.895 -0.370 995 H THR 35 H THR 35 -6.217 5.837 -2.630 996 HA THR 35 HA THR 35 -6.633 4.369 -0.165 997 HB THR 35 HB THR 35 -8.493 3.847 -2.500 998 HG1 THR 35 HG1 THR 35 -8.839 5.280 -0.088 999 HG21 THR 35 HG21 THR 35 -7.937 1.829 -1.222 1000 HG22 THR 35 HG22 THR 35 -9.621 2.295 -0.976 1001 HG23 THR 35 HG23 THR 35 -8.419 2.638 0.268 1002 H ILE 36 H ILE 36 -5.349 2.600 -0.138 1003 HA ILE 36 HA ILE 36 -4.752 1.262 -2.690 1004 HB ILE 36 HB ILE 36 -2.764 2.615 -2.056 1005 HG12 ILE 36 HG12 ILE 36 -1.098 0.736 -2.170 1006 HG13 ILE 36 HG13 ILE 36 -2.424 -0.396 -1.931 1007 HG21 ILE 36 HG21 ILE 36 -2.686 0.856 0.395 1008 HG22 ILE 36 HG22 ILE 36 -2.957 2.599 0.355 1009 HG23 ILE 36 HG23 ILE 36 -1.392 1.939 -0.121 1010 HD11 ILE 36 HD11 ILE 36 -2.158 1.522 -4.234 1011 HD12 ILE 36 HD12 ILE 36 -3.443 0.334 -4.009 1012 HD13 ILE 36 HD13 ILE 36 -1.783 -0.199 -4.276 1013 H VAL 37 H VAL 37 -5.435 -0.767 -2.613 1014 HA VAL 37 HA VAL 37 -5.307 -2.237 -0.057 1015 HB VAL 37 HB VAL 37 -7.633 -2.301 -1.991 1016 HG11 VAL 37 HG11 VAL 37 -7.232 -4.499 -1.006 1017 HG12 VAL 37 HG12 VAL 37 -8.707 -3.789 -0.351 1018 HG13 VAL 37 HG13 VAL 37 -7.228 -3.791 0.610 1019 HG21 VAL 37 HG21 VAL 37 -7.618 -0.266 -0.640 1020 HG22 VAL 37 HG22 VAL 37 -7.469 -1.228 0.830 1021 HG23 VAL 37 HG23 VAL 37 -8.934 -1.331 -0.146 1022 H LEU 38 H LEU 38 -3.733 -3.679 -0.456 1023 HA LEU 38 HA LEU 38 -3.879 -5.291 -2.928 1024 HB2 LEU 38 HB2 LEU 38 -1.798 -3.960 -2.616 1025 HB3 LEU 38 HB3 LEU 38 -1.496 -4.809 -1.115 1026 HG LEU 38 HG LEU 38 -1.672 -6.292 -3.742 1027 HD11 LEU 38 HD11 LEU 38 0.792 -5.027 -2.541 1028 HD12 LEU 38 HD12 LEU 38 0.012 -4.573 -4.056 1029 HD13 LEU 38 HD13 LEU 38 0.776 -6.155 -3.897 1030 HD21 LEU 38 HD21 LEU 38 -1.762 -7.682 -1.747 1031 HD22 LEU 38 HD22 LEU 38 -0.303 -6.918 -1.116 1032 HD23 LEU 38 HD23 LEU 38 -0.221 -7.911 -2.572 1033 H ASN 39 H ASN 39 -4.348 -7.426 -2.729 1034 HA ASN 39 HA ASN 39 -3.651 -8.808 -0.246 1035 HB2 ASN 39 HB2 ASN 39 -5.829 -9.851 -0.004 1036 HB3 ASN 39 HB3 ASN 39 -6.021 -8.102 0.010 1037 HD21 ASN 39 HD21 ASN 39 -6.935 -7.093 -1.809 1038 HD22 ASN 39 HD22 ASN 39 -7.894 -7.981 -2.933 1039 H ALA 40 H ALA 40 -3.012 -10.898 -0.534 1040 HA ALA 40 HA ALA 40 -3.040 -11.943 -3.306 1041 HB1 ALA 40 HB1 ALA 40 -1.060 -13.212 -2.726 1042 HB2 ALA 40 HB2 ALA 40 -1.154 -12.656 -1.055 1043 HB3 ALA 40 HB3 ALA 40 -0.808 -11.507 -2.347 1044 H LYS 41 H LYS 41 -4.412 -13.502 -3.676 1045 HA LYS 41 HA LYS 41 -4.785 -15.668 -1.766 1046 HB2 LYS 41 HB2 LYS 41 -7.103 -15.454 -1.499 1047 HB3 LYS 41 HB3 LYS 41 -6.545 -13.792 -1.388 1048 HG2 LYS 41 HG2 LYS 41 -7.758 -15.081 -3.824 1049 HG3 LYS 41 HG3 LYS 41 -8.580 -13.993 -2.711 1050 HD2 LYS 41 HD2 LYS 41 -7.204 -12.153 -3.371 1051 HD3 LYS 41 HD3 LYS 41 -6.118 -13.211 -4.278 1052 HE2 LYS 41 HE2 LYS 41 -9.015 -12.645 -4.923 1053 HE3 LYS 41 HE3 LYS 41 -7.611 -12.017 -5.790 1054 HZ1 LYS 41 HZ1 LYS 41 -8.252 -14.907 -5.528 1055 HZ2 LYS 41 HZ2 LYS 41 -7.042 -14.214 -6.491 1056 HZ3 LYS 41 HZ3 LYS 41 -8.670 -13.957 -6.864 1057 H ASP 42 H ASP 42 -5.743 -17.577 -2.762 1058 HA ASP 42 HA ASP 42 -5.874 -19.142 -4.416 1059 HB2 ASP 42 HB2 ASP 42 -6.454 -16.767 -6.213 1060 HB3 ASP 42 HB3 ASP 42 -6.681 -18.456 -6.656 1061 H GLY 43 H GLY 43 -3.333 -17.596 -3.841 1062 HA2 GLY 43 HA2 GLY 43 -1.142 -18.073 -4.492 1063 HA3 GLY 43 HA3 GLY 43 -1.749 -18.772 -5.980 1064 H ILE 44 H ILE 44 -3.265 -15.885 -5.844 1065 HA ILE 44 HA ILE 44 -1.073 -14.438 -7.233 1066 HB ILE 44 HB ILE 44 -3.954 -14.019 -7.998 1067 HG12 ILE 44 HG12 ILE 44 -2.158 -16.192 -9.119 1068 HG13 ILE 44 HG13 ILE 44 -3.612 -16.437 -8.152 1069 HG21 ILE 44 HG21 ILE 44 -2.962 -13.398 -10.161 1070 HG22 ILE 44 HG22 ILE 44 -1.359 -13.778 -9.532 1071 HG23 ILE 44 HG23 ILE 44 -2.286 -12.451 -8.835 1072 HD11 ILE 44 HD11 ILE 44 -4.060 -16.822 -10.497 1073 HD12 ILE 44 HD12 ILE 44 -3.489 -15.200 -10.894 1074 HD13 ILE 44 HD13 ILE 44 -4.949 -15.410 -9.926 1075 H PHE 45 H PHE 45 -1.394 -12.015 -7.226 1076 HA PHE 45 HA PHE 45 -2.997 -11.174 -4.888 1077 HB2 PHE 45 HB2 PHE 45 -1.352 -9.624 -4.184 1078 HB3 PHE 45 HB3 PHE 45 -0.492 -11.122 -4.502 1079 HD1 PHE 45 HD2 PHE 45 -1.057 -7.678 -5.625 1080 HD2 PHE 45 HD1 PHE 45 1.090 -11.290 -6.324 1081 HE1 PHE 45 HE2 PHE 45 0.490 -6.470 -7.109 1082 HE2 PHE 45 HE1 PHE 45 2.640 -10.083 -7.806 1083 HZ PHE 45 HZ PHE 45 2.335 -7.673 -8.200 1084 H THR 46 H THR 46 -4.145 -9.293 -4.997 1085 HA THR 46 HA THR 46 -4.081 -7.833 -7.561 1086 HB THR 46 HB THR 46 -6.147 -9.098 -7.477 1087 HG1 THR 46 HG1 THR 46 -6.034 -6.413 -7.625 1088 HG21 THR 46 HG21 THR 46 -6.733 -7.672 -4.872 1089 HG22 THR 46 HG22 THR 46 -6.356 -9.389 -5.051 1090 HG23 THR 46 HG23 THR 46 -7.840 -8.734 -5.745 1091 H CYS 47 H CYS 47 -3.142 -5.933 -7.203 1092 HA CYS 47 HA CYS 47 -3.556 -4.503 -4.688 1093 HB2 CYS 47 HB2 CYS 47 -1.282 -4.626 -5.673 1094 HB3 CYS 47 HB3 CYS 47 -1.856 -3.746 -7.083 1095 HG CYS 47 HG CYS 47 -0.449 -2.472 -4.552 1096 H ASN 48 H ASN 48 -4.929 -2.853 -4.446 1097 HA ASN 48 HA ASN 48 -6.387 -1.860 -6.813 1098 HB2 ASN 48 HB2 ASN 48 -7.709 -3.117 -5.115 1099 HB3 ASN 48 HB3 ASN 48 -7.271 -1.913 -3.910 1100 HD21 ASN 48 HD21 ASN 48 -9.870 -2.755 -5.000 1101 HD22 ASN 48 HD22 ASN 48 -10.619 -1.301 -5.551 1102 H LEU 49 H LEU 49 -5.773 0.127 -7.427 1103 HA LEU 49 HA LEU 49 -4.716 1.982 -5.390 1104 HB2 LEU 49 HB2 LEU 49 -3.040 1.344 -7.004 1105 HB3 LEU 49 HB3 LEU 49 -4.103 1.764 -8.337 1106 HG LEU 49 HG LEU 49 -3.994 4.138 -7.674 1107 HD11 LEU 49 HD11 LEU 49 -2.059 3.160 -5.571 1108 HD12 LEU 49 HD12 LEU 49 -3.642 3.887 -5.289 1109 HD13 LEU 49 HD13 LEU 49 -2.342 4.851 -5.988 1110 HD21 LEU 49 HD21 LEU 49 -1.658 4.535 -8.323 1111 HD22 LEU 49 HD22 LEU 49 -2.425 3.307 -9.329 1112 HD23 LEU 49 HD23 LEU 49 -1.302 2.826 -8.058 1113 H MET 50 H MET 50 -6.048 3.566 -4.877 1114 HA MET 50 HA MET 50 -7.762 4.775 -6.950 1115 HB2 MET 50 HB2 MET 50 -8.068 4.746 -3.946 1116 HB3 MET 50 HB3 MET 50 -9.103 5.650 -5.037 1117 HG2 MET 50 HG2 MET 50 -8.785 2.654 -5.005 1118 HG3 MET 50 HG3 MET 50 -10.141 3.561 -4.332 1119 HE1 MET 50 HE1 MET 50 -10.020 5.886 -6.791 1120 HE2 MET 50 HE2 MET 50 -11.478 5.372 -5.941 1121 HE3 MET 50 HE3 MET 50 -11.418 5.305 -7.700 1122 H ILE 51 H ILE 51 -6.933 6.597 -7.732 1123 HA ILE 51 HA ILE 51 -5.737 8.571 -5.924 1124 HB ILE 51 HB ILE 51 -3.900 8.932 -7.701 1125 HG12 ILE 51 HG12 ILE 51 -3.242 6.646 -8.752 1126 HG13 ILE 51 HG13 ILE 51 -4.922 6.195 -8.479 1127 HG21 ILE 51 HG21 ILE 51 -3.438 8.112 -5.459 1128 HG22 ILE 51 HG22 ILE 51 -2.419 7.293 -6.642 1129 HG23 ILE 51 HG23 ILE 51 -3.822 6.465 -5.963 1130 HD11 ILE 51 HD11 ILE 51 -4.554 6.947 -10.751 1131 HD12 ILE 51 HD12 ILE 51 -3.955 8.498 -10.159 1132 HD13 ILE 51 HD13 ILE 51 -5.641 8.044 -9.899 1133 H PHE 52 H PHE 52 -5.378 10.706 -7.056 1134 HA PHE 52 HA PHE 52 -7.672 11.249 -8.789 1135 HB2 PHE 52 HB2 PHE 52 -5.910 12.952 -7.058 1136 HB3 PHE 52 HB3 PHE 52 -6.815 13.704 -8.368 1137 HD1 PHE 52 HD1 PHE 52 -7.067 12.010 -5.128 1138 HD2 PHE 52 HD2 PHE 52 -9.218 13.835 -8.312 1139 HE1 PHE 52 HE1 PHE 52 -9.076 12.123 -3.707 1140 HE2 PHE 52 HE2 PHE 52 -11.227 13.956 -6.899 1141 HZ PHE 52 HZ PHE 52 -11.157 13.100 -4.593 1142 H VAL 53 H VAL 53 -7.561 11.938 -10.857 1143 HA VAL 53 HA VAL 53 -4.905 12.459 -12.051 1144 HB VAL 53 HB VAL 53 -5.479 11.208 -14.041 1145 HG11 VAL 53 HG11 VAL 53 -4.446 9.889 -12.300 1146 HG12 VAL 53 HG12 VAL 53 -5.649 8.915 -13.155 1147 HG13 VAL 53 HG13 VAL 53 -6.022 9.581 -11.565 1148 HG21 VAL 53 HG21 VAL 53 -7.869 11.643 -14.096 1149 HG22 VAL 53 HG22 VAL 53 -8.108 10.588 -12.702 1150 HG23 VAL 53 HG23 VAL 53 -7.543 9.916 -14.233 1151 H LYS 54 H LYS 54 -4.844 14.102 -13.576 1152 HA LYS 54 HA LYS 54 -7.049 15.917 -13.617 1153 HB2 LYS 54 HB2 LYS 54 -5.591 17.238 -15.200 1154 HB3 LYS 54 HB3 LYS 54 -4.911 16.897 -13.620 1155 HG2 LYS 54 HG2 LYS 54 -3.112 16.503 -14.992 1156 HG3 LYS 54 HG3 LYS 54 -3.779 14.881 -14.814 1157 HD2 LYS 54 HD2 LYS 54 -3.174 15.318 -17.131 1158 HD3 LYS 54 HD3 LYS 54 -4.919 15.123 -16.976 1159 HE2 LYS 54 HE2 LYS 54 -4.345 16.989 -18.461 1160 HE3 LYS 54 HE3 LYS 54 -5.216 17.543 -17.032 1161 HZ1 LYS 54 HZ1 LYS 54 -3.121 18.227 -16.060 1162 HZ2 LYS 54 HZ2 LYS 54 -3.347 18.975 -17.557 1163 HZ3 LYS 54 HZ3 LYS 54 -2.272 17.678 -17.415 1164 H ASN 55 H ASN 55 -6.359 13.215 -15.534 1165 HA ASN 55 HA ASN 55 -8.807 13.394 -16.886 1166 HB2 ASN 55 HB2 ASN 55 -8.066 13.604 -19.229 1167 HB3 ASN 55 HB3 ASN 55 -7.740 15.064 -18.304 1168 HD21 ASN 55 HD21 ASN 55 -6.124 15.782 -19.631 1169 HD22 ASN 55 HD22 ASN 55 -4.591 14.994 -19.760 1170 H THR 56 H THR 56 -8.784 11.640 -18.841 1171 HA THR 56 HA THR 56 -8.223 9.204 -17.465 1172 HB THR 56 HB THR 56 -9.086 8.050 -19.459 1173 HG1 THR 56 HG1 THR 56 -9.192 9.033 -21.338 1174 HG21 THR 56 HG21 THR 56 -11.348 8.988 -19.420 1175 HG22 THR 56 HG22 THR 56 -10.733 10.466 -18.678 1176 HG23 THR 56 HG23 THR 56 -10.665 8.939 -17.795 1177 H ASP 57 H ASP 57 -6.588 10.896 -20.099 1178 HA ASP 57 HA ASP 57 -4.842 8.823 -20.892 1179 HB2 ASP 57 HB2 ASP 57 -4.312 11.811 -20.913 1180 HB3 ASP 57 HB3 ASP 57 -3.477 10.598 -21.880 1181 H LYS 58 H LYS 58 -4.547 11.359 -18.474 1182 HA LYS 58 HA LYS 58 -2.047 10.774 -17.387 1183 HB2 LYS 58 HB2 LYS 58 -3.069 12.792 -16.730 1184 HB3 LYS 58 HB3 LYS 58 -4.577 12.001 -16.307 1185 HG2 LYS 58 HG2 LYS 58 -3.423 12.775 -14.329 1186 HG3 LYS 58 HG3 LYS 58 -3.526 11.016 -14.347 1187 HD2 LYS 58 HD2 LYS 58 -1.195 10.915 -15.169 1188 HD3 LYS 58 HD3 LYS 58 -1.110 12.679 -15.092 1189 HE2 LYS 58 HE2 LYS 58 -1.497 12.599 -12.684 1190 HE3 LYS 58 HE3 LYS 58 -1.628 10.840 -12.751 1191 HZ1 LYS 58 HZ1 LYS 58 0.775 12.452 -13.397 1192 HZ2 LYS 58 HZ2 LYS 58 0.663 10.774 -13.569 1193 HZ3 LYS 58 HZ3 LYS 58 0.557 11.477 -12.037 1194 H LEU 59 H LEU 59 -5.230 9.383 -16.691 1195 HA LEU 59 HA LEU 59 -4.431 7.692 -14.565 1196 HB2 LEU 59 HB2 LEU 59 -6.753 8.257 -14.906 1197 HB3 LEU 59 HB3 LEU 59 -6.740 7.533 -16.502 1198 HG LEU 59 HG LEU 59 -6.446 5.304 -15.499 1199 HD11 LEU 59 HD11 LEU 59 -5.242 5.905 -13.487 1200 HD12 LEU 59 HD12 LEU 59 -6.704 5.013 -13.072 1201 HD13 LEU 59 HD13 LEU 59 -6.653 6.763 -12.867 1202 HD21 LEU 59 HD21 LEU 59 -8.785 6.858 -14.384 1203 HD22 LEU 59 HD22 LEU 59 -8.687 5.101 -14.524 1204 HD23 LEU 59 HD23 LEU 59 -8.696 6.100 -15.976 1205 H THR 60 H THR 60 -4.825 7.066 -18.051 1206 HA THR 60 HA THR 60 -4.169 4.314 -17.921 1207 HB THR 60 HB THR 60 -3.874 4.416 -20.373 1208 HG1 THR 60 HG1 THR 60 -4.715 6.993 -20.685 1209 HG21 THR 60 HG21 THR 60 -6.125 4.153 -19.468 1210 HG22 THR 60 HG22 THR 60 -6.161 5.133 -20.935 1211 HG23 THR 60 HG23 THR 60 -6.301 5.904 -19.355 1212 H THR 61 H THR 61 -2.186 7.188 -18.156 1213 HA THR 61 HA THR 61 0.214 6.061 -19.059 1214 HB THR 61 HB THR 61 -0.131 8.304 -17.044 1215 HG1 THR 61 HG1 THR 61 -1.018 8.452 -19.336 1216 HG21 THR 61 HG21 THR 61 2.152 7.395 -16.996 1217 HG22 THR 61 HG22 THR 61 2.127 9.009 -17.706 1218 HG23 THR 61 HG23 THR 61 2.271 7.592 -18.746 1219 H LEU 62 H LEU 62 -1.126 6.251 -15.789 1220 HA LEU 62 HA LEU 62 1.047 5.109 -14.407 1221 HB2 LEU 62 HB2 LEU 62 -1.900 5.009 -13.744 1222 HB3 LEU 62 HB3 LEU 62 -0.598 4.622 -12.632 1223 HG LEU 62 HG LEU 62 -1.128 7.336 -13.861 1224 HD11 LEU 62 HD11 LEU 62 -1.687 8.004 -11.578 1225 HD12 LEU 62 HD12 LEU 62 -1.462 6.341 -11.034 1226 HD13 LEU 62 HD13 LEU 62 -2.761 6.732 -12.161 1227 HD21 LEU 62 HD21 LEU 62 0.647 8.136 -12.365 1228 HD22 LEU 62 HD22 LEU 62 1.260 6.973 -13.540 1229 HD23 LEU 62 HD23 LEU 62 0.976 6.474 -11.872 1230 H MET 63 H MET 63 -1.681 3.650 -16.095 1231 HA MET 63 HA MET 63 -1.375 0.992 -15.251 1232 HB2 MET 63 HB2 MET 63 -2.247 1.938 -17.992 1233 HB3 MET 63 HB3 MET 63 -2.575 0.364 -17.280 1234 HG2 MET 63 HG2 MET 63 -3.968 1.389 -15.585 1235 HG3 MET 63 HG3 MET 63 -3.589 2.993 -16.216 1236 HE1 MET 63 HE1 MET 63 -7.303 2.666 -17.278 1237 HE2 MET 63 HE2 MET 63 -6.085 3.653 -16.466 1238 HE3 MET 63 HE3 MET 63 -6.571 2.102 -15.775 1239 H ASP 64 H ASP 64 -0.030 2.621 -18.121 1240 HA ASP 64 HA ASP 64 1.553 0.546 -19.099 1241 HB2 ASP 64 HB2 ASP 64 1.089 2.648 -20.310 1242 HB3 ASP 64 HB3 ASP 64 2.113 3.522 -19.181 1243 H LYS 65 H LYS 65 2.391 3.081 -16.741 1244 HA LYS 65 HA LYS 65 5.038 2.397 -16.216 1245 HB2 LYS 65 HB2 LYS 65 2.904 3.506 -14.386 1246 HB3 LYS 65 HB3 LYS 65 4.599 3.391 -13.930 1247 HG2 LYS 65 HG2 LYS 65 5.205 4.888 -15.764 1248 HG3 LYS 65 HG3 LYS 65 3.512 4.979 -16.255 1249 HD2 LYS 65 HD2 LYS 65 4.132 6.947 -14.951 1250 HD3 LYS 65 HD3 LYS 65 2.938 5.981 -14.085 1251 HE2 LYS 65 HE2 LYS 65 4.694 6.780 -12.587 1252 HE3 LYS 65 HE3 LYS 65 4.700 5.022 -12.697 1253 HZ1 LYS 65 HZ1 LYS 65 6.556 5.157 -14.228 1254 HZ2 LYS 65 HZ2 LYS 65 6.930 5.941 -12.779 1255 HZ3 LYS 65 HZ3 LYS 65 6.535 6.842 -14.149 1256 H LEU 66 H LEU 66 2.084 1.093 -14.742 1257 HA LEU 66 HA LEU 66 3.423 -0.689 -12.952 1258 HB2 LEU 66 HB2 LEU 66 0.581 -0.640 -13.985 1259 HB3 LEU 66 HB3 LEU 66 1.144 -1.684 -12.692 1260 HG LEU 66 HG LEU 66 1.359 1.322 -12.522 1261 HD11 LEU 66 HD11 LEU 66 -0.698 1.288 -11.176 1262 HD12 LEU 66 HD12 LEU 66 -0.927 -0.413 -11.584 1263 HD13 LEU 66 HD13 LEU 66 -0.988 0.814 -12.848 1264 HD21 LEU 66 HD21 LEU 66 2.776 0.048 -11.000 1265 HD22 LEU 66 HD22 LEU 66 1.374 -0.857 -10.427 1266 HD23 LEU 66 HD23 LEU 66 1.495 0.874 -10.115 1267 H ARG 67 H ARG 67 2.219 -0.963 -16.234 1268 HA ARG 67 HA ARG 67 2.358 -3.800 -16.418 1269 HB2 ARG 67 HB2 ARG 67 2.230 -1.645 -18.540 1270 HB3 ARG 67 HB3 ARG 67 2.210 -3.368 -18.912 1271 HG2 ARG 67 HG2 ARG 67 0.171 -3.642 -17.596 1272 HG3 ARG 67 HG3 ARG 67 0.192 -1.928 -17.189 1273 HD2 ARG 67 HD2 ARG 67 -0.058 -1.381 -19.584 1274 HD3 ARG 67 HD3 ARG 67 -0.119 -3.107 -19.956 1275 HE ARG 67 HE ARG 67 -2.073 -2.419 -18.024 1276 HH11 ARG 67 HH11 ARG 67 -1.430 -2.211 -21.400 1277 HH12 ARG 67 HH12 ARG 67 -3.107 -2.175 -21.822 1278 HH21 ARG 67 HH21 ARG 67 -4.206 -2.375 -18.564 1279 HH22 ARG 67 HH22 ARG 67 -4.666 -2.271 -20.226 1280 H LYS 68 H LYS 68 4.845 -1.535 -16.247 1281 HA LYS 68 HA LYS 68 6.748 -2.792 -17.975 1282 HB2 LYS 68 HB2 LYS 68 7.324 -1.094 -15.532 1283 HB3 LYS 68 HB3 LYS 68 8.429 -1.439 -16.856 1284 HG2 LYS 68 HG2 LYS 68 5.937 0.246 -16.942 1285 HG3 LYS 68 HG3 LYS 68 7.608 0.783 -17.125 1286 HD2 LYS 68 HD2 LYS 68 7.793 -0.463 -19.217 1287 HD3 LYS 68 HD3 LYS 68 6.143 -1.062 -19.023 1288 HE2 LYS 68 HE2 LYS 68 5.423 1.378 -18.985 1289 HE3 LYS 68 HE3 LYS 68 7.051 1.763 -19.539 1290 HZ1 LYS 68 HZ1 LYS 68 5.249 -0.116 -20.950 1291 HZ2 LYS 68 HZ2 LYS 68 6.703 0.536 -21.518 1292 HZ3 LYS 68 HZ3 LYS 68 5.346 1.533 -21.316 1293 H VAL 69 H VAL 69 5.440 -3.674 -14.949 1294 HA VAL 69 HA VAL 69 7.762 -5.131 -14.008 1295 HB VAL 69 HB VAL 69 4.922 -5.175 -12.949 1296 HG11 VAL 69 HG11 VAL 69 7.515 -6.147 -11.731 1297 HG12 VAL 69 HG12 VAL 69 6.150 -7.140 -12.244 1298 HG13 VAL 69 HG13 VAL 69 5.975 -6.043 -10.878 1299 HG21 VAL 69 HG21 VAL 69 7.308 -3.546 -12.049 1300 HG22 VAL 69 HG22 VAL 69 5.750 -3.619 -11.226 1301 HG23 VAL 69 HG23 VAL 69 5.860 -2.927 -12.843 1302 H GLN 70 H GLN 70 8.303 -7.081 -14.679 1303 HA GLN 70 HA GLN 70 6.854 -8.549 -16.597 1304 HB2 GLN 70 HB2 GLN 70 8.590 -10.276 -16.288 1305 HB3 GLN 70 HB3 GLN 70 9.282 -8.664 -16.430 1306 HG2 GLN 70 HG2 GLN 70 9.457 -8.581 -13.950 1307 HG3 GLN 70 HG3 GLN 70 8.910 -10.254 -13.896 1308 HE21 GLN 70 HE21 GLN 70 11.422 -9.053 -13.024 1309 HE22 GLN 70 HE22 GLN 70 12.670 -9.909 -13.852 1310 H GLY 71 H GLY 71 6.644 -8.592 -13.156 1311 HA2 GLY 71 HA2 GLY 71 5.590 -11.269 -12.931 1312 HA3 GLY 71 HA3 GLY 71 5.660 -10.065 -11.659 1313 H VAL 72 H VAL 72 4.185 -8.172 -13.637 1314 HA VAL 72 HA VAL 72 1.518 -9.015 -12.768 1315 HB VAL 72 HB VAL 72 2.344 -6.420 -14.099 1316 HG11 VAL 72 HG11 VAL 72 -0.226 -7.205 -12.712 1317 HG12 VAL 72 HG12 VAL 72 -0.018 -6.893 -14.437 1318 HG13 VAL 72 HG13 VAL 72 0.173 -5.581 -13.272 1319 HG21 VAL 72 HG21 VAL 72 1.884 -7.045 -11.178 1320 HG22 VAL 72 HG22 VAL 72 2.165 -5.439 -11.849 1321 HG23 VAL 72 HG23 VAL 72 3.430 -6.663 -11.935 1322 H PHE 73 H PHE 73 -0.221 -9.379 -14.141 1323 HA PHE 73 HA PHE 73 0.364 -9.343 -17.030 1324 HB2 PHE 73 HB2 PHE 73 -1.496 -11.280 -16.973 1325 HB3 PHE 73 HB3 PHE 73 0.226 -11.586 -16.863 1326 HD1 PHE 73 HD2 PHE 73 1.259 -12.243 -14.773 1327 HD2 PHE 73 HD1 PHE 73 -2.952 -11.628 -15.050 1328 HE1 PHE 73 HE2 PHE 73 0.945 -13.457 -12.662 1329 HE2 PHE 73 HE1 PHE 73 -3.265 -12.847 -12.928 1330 HZ PHE 73 HZ PHE 73 -1.310 -13.762 -11.738 1331 H THR 74 H THR 74 -1.880 -8.454 -14.531 1332 HA THR 74 HA THR 74 -3.580 -7.248 -16.634 1333 HB THR 74 HB THR 74 -5.572 -7.612 -15.437 1334 HG1 THR 74 HG1 THR 74 -5.624 -8.282 -13.290 1335 HG21 THR 74 HG21 THR 74 -3.921 -10.104 -15.012 1336 HG22 THR 74 HG22 THR 74 -4.753 -9.671 -16.506 1337 HG23 THR 74 HG23 THR 74 -5.682 -10.026 -15.048 1338 H VAL 75 H VAL 75 -3.505 -5.103 -16.582 1339 HA VAL 75 HA VAL 75 -3.720 -3.758 -13.968 1340 HB VAL 75 HB VAL 75 -2.110 -2.652 -16.287 1341 HG11 VAL 75 HG11 VAL 75 -3.120 -0.939 -14.885 1342 HG12 VAL 75 HG12 VAL 75 -1.372 -0.969 -14.660 1343 HG13 VAL 75 HG13 VAL 75 -2.429 -1.684 -13.442 1344 HG21 VAL 75 HG21 VAL 75 -0.945 -4.585 -15.341 1345 HG22 VAL 75 HG22 VAL 75 -1.092 -3.893 -13.723 1346 HG23 VAL 75 HG23 VAL 75 -0.102 -3.086 -14.941 1347 H GLU 76 H GLU 76 -5.763 -3.046 -13.990 1348 HA GLU 76 HA GLU 76 -6.932 -2.036 -16.520 1349 HB2 GLU 76 HB2 GLU 76 -8.322 -3.608 -14.334 1350 HB3 GLU 76 HB3 GLU 76 -9.058 -3.040 -15.824 1351 HG2 GLU 76 HG2 GLU 76 -6.791 -5.023 -15.703 1352 HG3 GLU 76 HG3 GLU 76 -8.495 -5.463 -15.803 1353 H ARG 77 H ARG 77 -8.942 -0.708 -16.156 1354 HA ARG 77 HA ARG 77 -8.647 1.102 -13.872 1355 HB2 ARG 77 HB2 ARG 77 -8.915 2.244 -15.962 1356 HB3 ARG 77 HB3 ARG 77 -10.294 1.248 -16.406 1357 HG2 ARG 77 HG2 ARG 77 -11.631 2.273 -14.644 1358 HG3 ARG 77 HG3 ARG 77 -10.247 3.240 -14.135 1359 HD2 ARG 77 HD2 ARG 77 -10.260 4.457 -16.198 1360 HD3 ARG 77 HD3 ARG 77 -11.474 3.380 -16.891 1361 HE ARG 77 HE ARG 77 -12.798 4.315 -14.793 1362 HH11 ARG 77 HH11 ARG 77 -10.862 6.024 -17.090 1363 HH12 ARG 77 HH12 ARG 77 -11.817 7.461 -16.967 1364 HH21 ARG 77 HH21 ARG 77 -14.003 6.156 -14.663 1365 HH22 ARG 77 HH22 ARG 77 -13.573 7.537 -15.611 1366 H LEU 78 H LEU 78 -10.235 1.412 -12.331 1367 HA LEU 78 HA LEU 78 -12.213 -0.720 -12.056 1368 HB2 LEU 78 HB2 LEU 78 -11.231 1.427 -10.177 1369 HB3 LEU 78 HB3 LEU 78 -12.530 0.318 -9.769 1370 HG LEU 78 HG LEU 78 -9.692 -0.498 -10.432 1371 HD11 LEU 78 HD11 LEU 78 -9.508 -1.032 -8.051 1372 HD12 LEU 78 HD12 LEU 78 -11.118 -0.364 -7.776 1373 HD13 LEU 78 HD13 LEU 78 -9.806 0.685 -8.310 1374 HD21 LEU 78 HD21 LEU 78 -11.339 -2.201 -11.043 1375 HD22 LEU 78 HD22 LEU 78 -12.028 -2.126 -9.421 1376 HD23 LEU 78 HD23 LEU 78 -10.382 -2.710 -9.653 1377 H SER 79 H SER 79 -14.314 -0.458 -12.521 1378 HA SER 79 HA SER 79 -15.275 2.169 -13.340 1379 HB2 SER 79 HB2 SER 79 -17.221 0.972 -14.225 1380 HB3 SER 79 HB3 SER 79 -15.732 0.201 -14.764 1381 HG SER 79 HG SER 79 -17.248 -1.336 -14.036 1382 H ASN 80 H ASN 80 -16.462 -0.407 -11.138 1383 HA ASN 80 HA ASN 80 -18.122 1.602 -9.777 1384 HB2 ASN 80 HB2 ASN 80 -18.141 -1.419 -9.610 1385 HB3 ASN 80 HB3 ASN 80 -19.194 -0.364 -8.670 1386 HD21 ASN 80 HD21 ASN 80 -18.494 -1.647 -11.809 1387 HD22 ASN 80 HD22 ASN 80 -19.952 -1.105 -12.568 1388 H LEU 81 H LEU 81 -17.137 2.640 -8.183 1389 HA LEU 81 HA LEU 81 -15.001 1.392 -6.636 1390 HB2 LEU 81 HB2 LEU 81 -16.121 4.192 -6.425 1391 HB3 LEU 81 HB3 LEU 81 -14.607 3.611 -5.759 1392 HG LEU 81 HG LEU 81 -15.244 3.925 -8.695 1393 HD11 LEU 81 HD11 LEU 81 -13.441 5.509 -6.861 1394 HD12 LEU 81 HD12 LEU 81 -14.940 6.065 -7.610 1395 HD13 LEU 81 HD13 LEU 81 -13.537 5.701 -8.614 1396 HD21 LEU 81 HD21 LEU 81 -13.756 2.045 -8.366 1397 HD22 LEU 81 HD22 LEU 81 -12.710 3.015 -7.329 1398 HD23 LEU 81 HD23 LEU 81 -12.857 3.403 -9.043 1399 H GLU 82 H GLU 82 -15.014 2.084 -4.197 1400 HA GLU 82 HA GLU 82 -17.689 1.590 -3.060 1401 HB2 GLU 82 HB2 GLU 82 -16.216 1.155 -0.914 1402 HB3 GLU 82 HB3 GLU 82 -16.474 -0.093 -2.120 1403 HG2 GLU 82 HG2 GLU 82 -14.136 0.184 -1.251 1404 HG3 GLU 82 HG3 GLU 82 -14.319 0.137 -2.996 1405 H HIS 83 H HIS 83 -16.022 4.182 -3.822 1406 HA HIS 83 HA HIS 83 -15.702 5.572 -1.355 1407 HB2 HIS 83 HB2 HIS 83 -15.724 6.550 -4.213 1408 HB3 HIS 83 HB3 HIS 83 -15.372 7.589 -2.833 1409 HD1 HIS 83 HD1 HIS 83 -12.974 7.710 -2.188 1410 HD2 HIS 83 HD2 HIS 83 -13.846 4.264 -4.320 1411 HE1 HIS 83 HE1 HIS 83 -10.777 6.541 -2.515 1412 HE2 HIS 83 HE2 HIS 83 -11.407 4.324 -3.514 1413 H HIS 84 H HIS 84 -18.485 4.968 -3.246 1414 HA HIS 84 HA HIS 84 -19.976 7.205 -2.075 1415 HB2 HIS 84 HB2 HIS 84 -20.940 4.950 -3.863 1416 HB3 HIS 84 HB3 HIS 84 -21.891 6.347 -3.367 1417 HD1 HIS 84 HD1 HIS 84 -19.585 5.191 -5.947 1418 HD2 HIS 84 HD2 HIS 84 -20.907 8.850 -4.485 1419 HE1 HIS 84 HE1 HIS 84 -18.968 6.878 -7.698 1420 HE2 HIS 84 HE2 HIS 84 -19.962 9.039 -6.884 1421 H HIS 85 H HIS 85 -18.749 4.918 -0.552 1422 HA HIS 85 HA HIS 85 -20.510 3.089 0.458 1423 HB2 HIS 85 HB2 HIS 85 -18.249 2.917 1.092 1424 HB3 HIS 85 HB3 HIS 85 -18.203 4.559 1.715 1425 HD1 HIS 85 HD1 HIS 85 -17.582 4.199 4.082 1426 HD2 HIS 85 HD2 HIS 85 -20.692 1.705 2.913 1427 HE1 HIS 85 HE1 HIS 85 -18.355 3.066 6.178 1428 HE2 HIS 85 HE2 HIS 85 -20.388 1.772 5.485 1429 H HIS 86 H HIS 86 -22.599 3.844 0.690 1430 HA HIS 86 HA HIS 86 -23.158 5.654 2.938 1431 HB2 HIS 86 HB2 HIS 86 -25.057 4.311 0.983 1432 HB3 HIS 86 HB3 HIS 86 -25.499 5.521 2.184 1433 HD1 HIS 86 HD1 HIS 86 -24.674 5.212 -1.289 1434 HD2 HIS 86 HD2 HIS 86 -24.047 8.093 1.642 1435 HE1 HIS 86 HE1 HIS 86 -24.183 7.338 -2.528 1436 HE2 HIS 86 HE2 HIS 86 -23.663 9.027 -0.738 1437 H HIS 87 H HIS 87 -25.668 4.355 3.659 1438 HA HIS 87 HA HIS 87 -24.687 1.779 4.728 1439 HB2 HIS 87 HB2 HIS 87 -25.290 3.451 6.469 1440 HB3 HIS 87 HB3 HIS 87 -26.934 3.491 5.834 1441 HD1 HIS 87 HD1 HIS 87 -28.497 1.586 6.507 1442 HD2 HIS 87 HD2 HIS 87 -24.589 1.030 7.808 1443 HE1 HIS 87 HE1 HIS 87 -28.577 -0.392 8.049 1444 HE2 HIS 87 HE2 HIS 87 -26.190 -0.767 8.751 1445 H HIS 88 H HIS 88 -25.245 0.499 2.974 1446 HA HIS 88 HA HIS 88 -28.117 -0.017 2.665 1447 HB2 HIS 88 HB2 HIS 88 -27.567 1.553 0.860 1448 HB3 HIS 88 HB3 HIS 88 -26.267 0.495 0.319 1449 HD1 HIS 88 HD1 HIS 88 -27.092 -1.930 -0.548 1450 HD2 HIS 88 HD2 HIS 88 -30.004 1.018 -0.278 1451 HE1 HIS 88 HE1 HIS 88 -29.003 -2.750 -1.945 1452 HE2 HIS 88 HE2 HIS 88 -30.810 -1.032 -1.641 Start of MODEL 12 1 H1 MET 1 H1 MET 1 8.900 -18.453 16.873 2 H2 MET 1 H2 MET 1 9.642 -19.554 17.916 3 H3 MET 1 H3 MET 1 8.492 -20.092 16.801 4 HA MET 1 HA MET 1 11.168 -18.972 16.189 5 HB2 MET 1 HB2 MET 1 10.033 -21.762 15.852 6 HB3 MET 1 HB3 MET 1 11.598 -21.245 15.241 7 HG2 MET 1 HG2 MET 1 10.763 -21.355 18.131 8 HG3 MET 1 HG3 MET 1 11.842 -22.480 17.308 9 HE1 MET 1 HE1 MET 1 13.572 -20.498 15.467 10 HE2 MET 1 HE2 MET 1 14.263 -21.821 16.407 11 HE3 MET 1 HE3 MET 1 14.945 -20.201 16.535 12 H THR 2 H THR 2 8.162 -20.343 14.799 13 HA THR 2 HA THR 2 8.915 -19.598 12.109 14 HB THR 2 HB THR 2 7.479 -21.561 12.444 15 HG1 THR 2 HG1 THR 2 7.219 -20.563 10.450 16 HG21 THR 2 HG21 THR 2 5.142 -21.325 13.115 17 HG22 THR 2 HG22 THR 2 5.371 -19.596 13.368 18 HG23 THR 2 HG23 THR 2 6.208 -20.755 14.400 19 H ASP 3 H ASP 3 7.832 -18.055 10.782 20 HA ASP 3 HA ASP 3 7.235 -15.605 12.161 21 HB2 ASP 3 HB2 ASP 3 6.945 -14.704 9.821 22 HB3 ASP 3 HB3 ASP 3 8.514 -15.430 10.152 23 H PHE 4 H PHE 4 5.292 -14.470 12.216 24 HA PHE 4 HA PHE 4 2.882 -15.991 11.462 25 HB2 PHE 4 HB2 PHE 4 1.736 -15.043 13.403 26 HB3 PHE 4 HB3 PHE 4 3.167 -15.927 13.912 27 HD1 PHE 4 HD2 PHE 4 5.100 -14.752 14.828 28 HD2 PHE 4 HD1 PHE 4 1.596 -12.635 13.647 29 HE1 PHE 4 HE2 PHE 4 5.883 -12.772 16.054 30 HE2 PHE 4 HE1 PHE 4 2.382 -10.651 14.868 31 HZ PHE 4 HZ PHE 4 4.537 -10.710 16.062 32 H LEU 5 H LEU 5 1.026 -14.713 10.887 33 HA LEU 5 HA LEU 5 1.766 -12.385 9.344 34 HB2 LEU 5 HB2 LEU 5 0.280 -14.058 8.410 35 HB3 LEU 5 HB3 LEU 5 -0.853 -13.818 9.724 36 HG LEU 5 HG LEU 5 -1.424 -11.607 8.907 37 HD11 LEU 5 HD11 LEU 5 0.774 -10.913 8.115 38 HD12 LEU 5 HD12 LEU 5 -0.443 -10.691 6.861 39 HD13 LEU 5 HD13 LEU 5 0.670 -12.059 6.779 40 HD21 LEU 5 HD21 LEU 5 -1.373 -13.634 6.667 41 HD22 LEU 5 HD22 LEU 5 -2.388 -12.190 6.725 42 HD23 LEU 5 HD23 LEU 5 -2.617 -13.476 7.908 43 H ALA 6 H ALA 6 2.089 -10.598 10.502 44 HA ALA 6 HA ALA 6 0.328 -9.891 12.730 45 HB1 ALA 6 HB1 ALA 6 2.017 -8.205 13.252 46 HB2 ALA 6 HB2 ALA 6 2.901 -8.624 11.785 47 HB3 ALA 6 HB3 ALA 6 2.746 -9.803 13.086 48 H GLY 7 H GLY 7 -0.586 -7.767 12.897 49 HA2 GLY 7 HA2 GLY 7 -0.935 -6.349 10.324 50 HA3 GLY 7 HA3 GLY 7 -2.288 -6.667 11.397 51 H ILE 8 H ILE 8 -0.977 -4.142 10.371 52 HA ILE 8 HA ILE 8 -0.773 -2.796 12.993 53 HB ILE 8 HB ILE 8 0.863 -2.029 10.554 54 HG12 ILE 8 HG12 ILE 8 1.811 -3.405 13.087 55 HG13 ILE 8 HG13 ILE 8 1.642 -4.184 11.516 56 HG21 ILE 8 HG21 ILE 8 0.352 -0.137 11.981 57 HG22 ILE 8 HG22 ILE 8 2.057 -0.558 12.142 58 HG23 ILE 8 HG23 ILE 8 0.914 -1.020 13.403 59 HD11 ILE 8 HD11 ILE 8 3.525 -1.926 12.181 60 HD12 ILE 8 HD12 ILE 8 3.352 -2.689 10.599 61 HD13 ILE 8 HD13 ILE 8 3.957 -3.621 11.968 62 H ARG 9 H ARG 9 -1.990 -0.935 13.169 63 HA ARG 9 HA ARG 9 -3.249 0.102 10.703 64 HB2 ARG 9 HB2 ARG 9 -4.795 -0.779 12.498 65 HB3 ARG 9 HB3 ARG 9 -4.220 0.512 13.544 66 HG2 ARG 9 HG2 ARG 9 -5.047 2.175 11.932 67 HG3 ARG 9 HG3 ARG 9 -5.641 0.872 10.904 68 HD2 ARG 9 HD2 ARG 9 -7.500 1.697 12.143 69 HD3 ARG 9 HD3 ARG 9 -7.075 0.132 12.835 70 HE ARG 9 HE ARG 9 -5.918 2.459 14.122 71 HH11 ARG 9 HH11 ARG 9 -8.450 0.107 14.136 72 HH12 ARG 9 HH12 ARG 9 -8.861 0.419 15.785 73 HH21 ARG 9 HH21 ARG 9 -6.460 2.828 16.230 74 HH22 ARG 9 HH22 ARG 9 -7.765 1.943 16.951 75 H ILE 10 H ILE 10 -2.403 1.953 9.994 76 HA ILE 10 HA ILE 10 -1.008 3.740 11.890 77 HB ILE 10 HB ILE 10 -0.878 3.781 8.864 78 HG12 ILE 10 HG12 ILE 10 1.118 2.484 10.747 79 HG13 ILE 10 HG13 ILE 10 -0.089 1.593 9.825 80 HG21 ILE 10 HG21 ILE 10 -0.204 5.861 9.916 81 HG22 ILE 10 HG22 ILE 10 1.207 5.048 9.243 82 HG23 ILE 10 HG23 ILE 10 0.906 4.999 10.981 83 HD11 ILE 10 HD11 ILE 10 2.073 1.512 8.740 84 HD12 ILE 10 HD12 ILE 10 2.126 3.274 8.671 85 HD13 ILE 10 HD13 ILE 10 0.912 2.389 7.745 86 H VAL 11 H VAL 11 -2.209 5.485 12.543 87 HA VAL 11 HA VAL 11 -4.058 6.673 10.569 88 HB VAL 11 HB VAL 11 -4.325 6.534 13.574 89 HG11 VAL 11 HG11 VAL 11 -6.378 7.858 13.347 90 HG12 VAL 11 HG12 VAL 11 -6.035 8.095 11.632 91 HG13 VAL 11 HG13 VAL 11 -4.961 8.783 12.851 92 HG21 VAL 11 HG21 VAL 11 -6.082 5.538 11.322 93 HG22 VAL 11 HG22 VAL 11 -6.447 5.406 13.045 94 HG23 VAL 11 HG23 VAL 11 -5.064 4.544 12.371 95 H GLY 12 H GLY 12 -3.333 8.469 9.746 96 HA2 GLY 12 HA2 GLY 12 -2.080 10.496 11.476 97 HA3 GLY 12 HA3 GLY 12 -1.212 9.962 10.044 98 H GLU 13 H GLU 13 -1.779 12.606 10.278 99 HA GLU 13 HA GLU 13 -4.292 13.409 9.259 100 HB2 GLU 13 HB2 GLU 13 -3.179 15.610 8.865 101 HB3 GLU 13 HB3 GLU 13 -2.983 14.980 10.493 102 HG2 GLU 13 HG2 GLU 13 -0.718 14.198 9.897 103 HG3 GLU 13 HG3 GLU 13 -0.923 14.904 8.292 104 H ASP 14 H ASP 14 -5.070 13.710 7.260 105 HA ASP 14 HA ASP 14 -3.741 12.498 5.035 106 HB2 ASP 14 HB2 ASP 14 -6.108 12.252 5.183 107 HB3 ASP 14 HB3 ASP 14 -6.350 13.991 5.333 108 H LYS 15 H LYS 15 -2.125 13.491 4.017 109 HA LYS 15 HA LYS 15 -2.537 16.222 3.052 110 HB2 LYS 15 HB2 LYS 15 -0.255 15.238 4.690 111 HB3 LYS 15 HB3 LYS 15 0.079 16.417 3.428 112 HG2 LYS 15 HG2 LYS 15 -1.470 17.972 4.383 113 HG3 LYS 15 HG3 LYS 15 -1.981 16.785 5.588 114 HD2 LYS 15 HD2 LYS 15 0.270 16.794 6.554 115 HD3 LYS 15 HD3 LYS 15 0.790 17.971 5.342 116 HE2 LYS 15 HE2 LYS 15 -0.797 19.585 6.176 117 HE3 LYS 15 HE3 LYS 15 -1.439 18.406 7.320 118 HZ1 LYS 15 HZ1 LYS 15 0.105 19.984 8.350 119 HZ2 LYS 15 HZ2 LYS 15 1.345 19.435 7.341 120 HZ3 LYS 15 HZ3 LYS 15 0.651 18.389 8.472 121 H ASN 16 H ASN 16 -0.959 16.890 1.438 122 HA ASN 16 HA ASN 16 -0.932 15.079 -0.755 123 HB2 ASN 16 HB2 ASN 16 0.160 16.984 -1.934 124 HB3 ASN 16 HB3 ASN 16 -1.315 17.435 -1.084 125 HD21 ASN 16 HD21 ASN 16 -1.158 18.687 0.815 126 HD22 ASN 16 HD22 ASN 16 0.263 19.607 1.157 127 H GLY 17 H GLY 17 0.407 13.594 0.827 128 HA2 GLY 17 HA2 GLY 17 2.766 12.857 -0.307 129 HA3 GLY 17 HA3 GLY 17 3.261 14.056 0.875 130 H MET 18 H MET 18 1.175 13.296 2.807 131 HA MET 18 HA MET 18 2.641 11.478 4.343 132 HB2 MET 18 HB2 MET 18 -0.163 12.543 4.481 133 HB3 MET 18 HB3 MET 18 0.312 11.253 5.573 134 HG2 MET 18 HG2 MET 18 1.775 13.873 5.335 135 HG3 MET 18 HG3 MET 18 0.512 13.544 6.521 136 HE1 MET 18 HE1 MET 18 2.105 10.590 8.561 137 HE2 MET 18 HE2 MET 18 1.144 10.411 7.095 138 HE3 MET 18 HE3 MET 18 0.672 11.589 8.319 139 H THR 19 H THR 19 -0.390 10.819 2.540 140 HA THR 19 HA THR 19 -0.588 8.098 3.186 141 HB THR 19 HB THR 19 -1.982 7.904 1.117 142 HG1 THR 19 HG1 THR 19 -2.178 9.649 -0.237 143 HG21 THR 19 HG21 THR 19 -2.992 8.697 3.214 144 HG22 THR 19 HG22 THR 19 -3.730 9.481 1.816 145 HG23 THR 19 HG23 THR 19 -2.557 10.356 2.801 146 H ASN 20 H ASN 20 1.266 9.739 0.702 147 HA ASN 20 HA ASN 20 2.009 7.368 -0.727 148 HB2 ASN 20 HB2 ASN 20 3.177 10.164 -0.789 149 HB3 ASN 20 HB3 ASN 20 3.602 8.873 -1.910 150 HD21 ASN 20 HD21 ASN 20 2.885 9.976 -3.697 151 HD22 ASN 20 HD22 ASN 20 1.214 10.247 -4.019 152 H GLN 21 H GLN 21 3.567 9.423 1.711 153 HA GLN 21 HA GLN 21 6.074 8.082 1.560 154 HB2 GLN 21 HB2 GLN 21 6.801 9.477 3.308 155 HB3 GLN 21 HB3 GLN 21 5.696 10.455 2.369 156 HG2 GLN 21 HG2 GLN 21 3.969 10.175 4.022 157 HG3 GLN 21 HG3 GLN 21 4.972 9.042 4.928 158 HE21 GLN 21 HE21 GLN 21 4.458 12.376 4.112 159 HE22 GLN 21 HE22 GLN 21 5.523 13.028 5.300 160 H ILE 22 H ILE 22 3.239 7.758 3.613 161 HA ILE 22 HA ILE 22 4.307 6.081 5.591 162 HB ILE 22 HB ILE 22 1.528 6.573 4.565 163 HG12 ILE 22 HG12 ILE 22 2.560 8.278 5.975 164 HG13 ILE 22 HG13 ILE 22 1.230 7.511 6.837 165 HG21 ILE 22 HG21 ILE 22 0.602 5.173 6.362 166 HG22 ILE 22 HG22 ILE 22 2.225 4.591 6.738 167 HG23 ILE 22 HG23 ILE 22 1.495 4.223 5.176 168 HD11 ILE 22 HD11 ILE 22 4.155 6.907 7.214 169 HD12 ILE 22 HD12 ILE 22 2.823 6.147 8.083 170 HD13 ILE 22 HD13 ILE 22 3.144 7.869 8.290 171 H THR 23 H THR 23 2.397 5.124 2.699 172 HA THR 23 HA THR 23 2.935 2.350 3.118 173 HB THR 23 HB THR 23 2.072 3.574 0.479 174 HG1 THR 23 HG1 THR 23 0.452 4.251 1.747 175 HG21 THR 23 HG21 THR 23 2.723 1.215 0.386 176 HG22 THR 23 HG22 THR 23 0.985 1.402 0.153 177 HG23 THR 23 HG23 THR 23 1.611 0.852 1.707 178 H GLY 24 H GLY 24 4.531 4.935 1.407 179 HA2 GLY 24 HA2 GLY 24 6.414 3.509 -0.097 180 HA3 GLY 24 HA3 GLY 24 6.670 5.102 0.600 181 H VAL 25 H VAL 25 6.611 4.575 3.317 182 HA VAL 25 HA VAL 25 9.150 3.420 3.828 183 HB VAL 25 HB VAL 25 6.896 4.061 5.753 184 HG11 VAL 25 HG11 VAL 25 8.407 2.396 6.730 185 HG12 VAL 25 HG12 VAL 25 8.589 3.958 7.529 186 HG13 VAL 25 HG13 VAL 25 9.793 3.421 6.356 187 HG21 VAL 25 HG21 VAL 25 8.302 6.047 6.277 188 HG22 VAL 25 HG22 VAL 25 7.704 6.032 4.619 189 HG23 VAL 25 HG23 VAL 25 9.378 5.589 4.954 190 H ILE 26 H ILE 26 5.855 2.178 4.136 191 HA ILE 26 HA ILE 26 6.352 -0.258 5.378 192 HB ILE 26 HB ILE 26 4.289 0.509 3.313 193 HG12 ILE 26 HG12 ILE 26 4.142 0.094 6.317 194 HG13 ILE 26 HG13 ILE 26 4.161 1.650 5.490 195 HG21 ILE 26 HG21 ILE 26 4.604 -1.895 3.147 196 HG22 ILE 26 HG22 ILE 26 3.065 -1.538 3.926 197 HG23 ILE 26 HG23 ILE 26 4.442 -2.061 4.895 198 HD11 ILE 26 HD11 ILE 26 2.005 -0.441 5.277 199 HD12 ILE 26 HD12 ILE 26 2.018 1.117 4.449 200 HD13 ILE 26 HD13 ILE 26 1.927 1.054 6.209 201 H SER 27 H SER 27 6.479 0.482 1.877 202 HA SER 27 HA SER 27 7.186 -2.134 1.047 203 HB2 SER 27 HB2 SER 27 7.870 -1.143 -1.071 204 HB3 SER 27 HB3 SER 27 6.378 -0.383 -0.526 205 HG SER 27 HG SER 27 8.114 1.162 0.475 206 H LYS 28 H LYS 28 9.005 0.331 2.603 207 HA LYS 28 HA LYS 28 11.610 -0.703 1.818 208 HB2 LYS 28 HB2 LYS 28 10.936 1.421 3.876 209 HB3 LYS 28 HB3 LYS 28 12.522 1.102 3.185 210 HG2 LYS 28 HG2 LYS 28 11.703 1.805 0.984 211 HG3 LYS 28 HG3 LYS 28 10.113 2.113 1.680 212 HD2 LYS 28 HD2 LYS 28 11.082 3.827 3.149 213 HD3 LYS 28 HD3 LYS 28 12.675 3.526 2.448 214 HE2 LYS 28 HE2 LYS 28 11.870 4.245 0.263 215 HE3 LYS 28 HE3 LYS 28 10.249 4.477 0.916 216 HZ1 LYS 28 HZ1 LYS 28 11.519 6.550 0.706 217 HZ2 LYS 28 HZ2 LYS 28 12.655 5.970 1.814 218 HZ3 LYS 28 HZ3 LYS 28 11.056 6.241 2.301 219 H PHE 29 H PHE 29 9.478 -2.134 3.663 220 HA PHE 29 HA PHE 29 11.049 -2.558 6.068 221 HB2 PHE 29 HB2 PHE 29 8.387 -3.622 5.139 222 HB3 PHE 29 HB3 PHE 29 9.188 -4.265 6.567 223 HD1 PHE 29 HD2 PHE 29 10.299 -1.186 6.950 224 HD2 PHE 29 HD1 PHE 29 6.524 -3.150 6.780 225 HE1 PHE 29 HE2 PHE 29 9.312 0.602 8.318 226 HE2 PHE 29 HE1 PHE 29 5.531 -1.361 8.150 227 HZ PHE 29 HZ PHE 29 6.927 0.513 8.922 228 H ASP 30 H ASP 30 11.103 -4.953 6.819 229 HA ASP 30 HA ASP 30 12.831 -6.342 4.915 230 HB2 ASP 30 HB2 ASP 30 12.439 -7.486 7.621 231 HB3 ASP 30 HB3 ASP 30 13.928 -7.150 6.745 232 H THR 31 H THR 31 9.668 -6.385 5.168 233 HA THR 31 HA THR 31 9.373 -9.320 5.060 234 HB THR 31 HB THR 31 8.526 -8.757 7.200 235 HG1 THR 31 HG1 THR 31 6.765 -9.869 6.874 236 HG21 THR 31 HG21 THR 31 6.904 -6.572 5.888 237 HG22 THR 31 HG22 THR 31 8.323 -6.339 6.911 238 HG23 THR 31 HG23 THR 31 6.848 -7.021 7.595 239 H ASN 32 H ASN 32 7.221 -9.988 4.103 240 HA ASN 32 HA ASN 32 6.893 -8.471 1.608 241 HB2 ASN 32 HB2 ASN 32 6.164 -11.340 2.246 242 HB3 ASN 32 HB3 ASN 32 5.998 -10.568 0.671 243 HD21 ASN 32 HD21 ASN 32 7.915 -9.896 -0.406 244 HD22 ASN 32 HD22 ASN 32 9.408 -10.707 -0.102 245 H ILE 33 H ILE 33 5.157 -7.256 1.370 246 HA ILE 33 HA ILE 33 2.926 -7.119 3.019 247 HB ILE 33 HB ILE 33 3.105 -6.387 0.083 248 HG12 ILE 33 HG12 ILE 33 3.559 -4.714 2.576 249 HG13 ILE 33 HG13 ILE 33 4.813 -5.274 1.473 250 HG21 ILE 33 HG21 ILE 33 0.780 -6.536 0.822 251 HG22 ILE 33 HG22 ILE 33 1.235 -4.856 0.541 252 HG23 ILE 33 HG23 ILE 33 1.130 -5.478 2.190 253 HD11 ILE 33 HD11 ILE 33 2.597 -3.346 0.814 254 HD12 ILE 33 HD12 ILE 33 3.825 -3.922 -0.313 255 HD13 ILE 33 HD13 ILE 33 4.294 -2.948 1.080 256 H ARG 34 H ARG 34 1.370 -8.598 3.383 257 HA ARG 34 HA ARG 34 0.589 -10.452 1.228 258 HB2 ARG 34 HB2 ARG 34 -0.083 -10.501 4.182 259 HB3 ARG 34 HB3 ARG 34 -0.561 -11.722 3.011 260 HG2 ARG 34 HG2 ARG 34 2.295 -11.044 3.711 261 HG3 ARG 34 HG3 ARG 34 1.378 -12.381 4.404 262 HD2 ARG 34 HD2 ARG 34 2.749 -13.269 2.660 263 HD3 ARG 34 HD3 ARG 34 1.083 -13.282 2.088 264 HE ARG 34 HE ARG 34 2.575 -10.948 1.303 265 HH11 ARG 34 HH11 ARG 34 1.784 -14.195 0.462 266 HH12 ARG 34 HH12 ARG 34 2.073 -13.942 -1.226 267 HH21 ARG 34 HH21 ARG 34 2.944 -10.651 -0.872 268 HH22 ARG 34 HH22 ARG 34 2.718 -11.979 -1.961 269 H THR 35 H THR 35 -0.587 -7.887 3.261 270 HA THR 35 HA THR 35 -2.788 -7.369 1.449 271 HB THR 35 HB THR 35 -3.423 -7.751 4.387 272 HG1 THR 35 HG1 THR 35 -3.569 -9.558 2.233 273 HG21 THR 35 HG21 THR 35 -4.864 -6.157 3.198 274 HG22 THR 35 HG22 THR 35 -5.756 -7.604 3.662 275 HG23 THR 35 HG23 THR 35 -5.234 -7.390 1.992 276 H ILE 36 H ILE 36 -3.383 -5.165 1.515 277 HA ILE 36 HA ILE 36 -2.709 -3.619 3.865 278 HB ILE 36 HB ILE 36 -0.626 -3.600 2.397 279 HG12 ILE 36 HG12 ILE 36 -1.836 -0.886 2.962 280 HG13 ILE 36 HG13 ILE 36 -1.208 -1.949 4.217 281 HG21 ILE 36 HG21 ILE 36 -1.652 -3.345 0.207 282 HG22 ILE 36 HG22 ILE 36 -0.599 -1.965 0.541 283 HG23 ILE 36 HG23 ILE 36 -2.350 -1.799 0.686 284 HD11 ILE 36 HD11 ILE 36 0.403 -0.247 3.595 285 HD12 ILE 36 HD12 ILE 36 0.372 -0.815 1.925 286 HD13 ILE 36 HD13 ILE 36 0.992 -1.863 3.203 287 H VAL 37 H VAL 37 -3.866 -1.764 4.111 288 HA VAL 37 HA VAL 37 -5.743 -0.942 1.993 289 HB VAL 37 HB VAL 37 -6.481 -1.473 4.892 290 HG11 VAL 37 HG11 VAL 37 -8.759 -0.762 4.279 291 HG12 VAL 37 HG12 VAL 37 -8.173 -0.289 2.683 292 HG13 VAL 37 HG13 VAL 37 -7.593 0.552 4.121 293 HG21 VAL 37 HG21 VAL 37 -8.056 -3.113 3.979 294 HG22 VAL 37 HG22 VAL 37 -6.395 -3.504 3.534 295 HG23 VAL 37 HG23 VAL 37 -7.474 -2.772 2.347 296 H LEU 38 H LEU 38 -5.838 1.244 1.771 297 HA LEU 38 HA LEU 38 -5.233 2.914 4.117 298 HB2 LEU 38 HB2 LEU 38 -3.228 2.790 2.630 299 HB3 LEU 38 HB3 LEU 38 -4.180 3.483 1.336 300 HG LEU 38 HG LEU 38 -3.798 4.958 3.941 301 HD11 LEU 38 HD11 LEU 38 -1.908 6.143 2.915 302 HD12 LEU 38 HD12 LEU 38 -1.975 5.042 1.537 303 HD13 LEU 38 HD13 LEU 38 -1.569 4.426 3.138 304 HD21 LEU 38 HD21 LEU 38 -5.533 5.814 2.465 305 HD22 LEU 38 HD22 LEU 38 -4.391 5.881 1.123 306 HD23 LEU 38 HD23 LEU 38 -4.174 6.934 2.523 307 H ASN 39 H ASN 39 -7.081 3.911 4.538 308 HA ASN 39 HA ASN 39 -8.539 5.192 2.315 309 HB2 ASN 39 HB2 ASN 39 -10.668 4.679 3.625 310 HB3 ASN 39 HB3 ASN 39 -9.892 3.318 2.824 311 HD21 ASN 39 HD21 ASN 39 -11.713 3.322 5.094 312 HD22 ASN 39 HD22 ASN 39 -10.866 2.551 6.388 313 H ALA 40 H ALA 40 -8.888 7.298 2.580 314 HA ALA 40 HA ALA 40 -8.293 8.503 5.209 315 HB1 ALA 40 HB1 ALA 40 -8.294 9.787 2.469 316 HB2 ALA 40 HB2 ALA 40 -6.872 9.191 3.325 317 HB3 ALA 40 HB3 ALA 40 -7.790 10.546 3.982 318 H LYS 41 H LYS 41 -9.961 9.118 6.380 319 HA LYS 41 HA LYS 41 -12.245 10.455 5.113 320 HB2 LYS 41 HB2 LYS 41 -13.859 9.261 6.432 321 HB3 LYS 41 HB3 LYS 41 -12.871 8.085 5.582 322 HG2 LYS 41 HG2 LYS 41 -12.564 8.856 8.481 323 HG3 LYS 41 HG3 LYS 41 -13.387 7.416 7.888 324 HD2 LYS 41 HD2 LYS 41 -11.211 6.726 6.823 325 HD3 LYS 41 HD3 LYS 41 -10.447 8.079 7.659 326 HE2 LYS 41 HE2 LYS 41 -11.800 5.683 8.903 327 HE3 LYS 41 HE3 LYS 41 -10.085 6.087 8.945 328 HZ1 LYS 41 HZ1 LYS 41 -10.612 8.035 10.267 329 HZ2 LYS 41 HZ2 LYS 41 -11.167 6.635 11.026 330 HZ3 LYS 41 HZ3 LYS 41 -12.257 7.651 10.230 331 H ASP 42 H ASP 42 -13.273 12.044 6.415 332 HA ASP 42 HA ASP 42 -13.444 13.671 8.002 333 HB2 ASP 42 HB2 ASP 42 -13.711 11.706 9.507 334 HB3 ASP 42 HB3 ASP 42 -11.974 11.704 9.781 335 H GLY 43 H GLY 43 -10.858 13.211 6.344 336 HA2 GLY 43 HA2 GLY 43 -9.054 14.662 5.976 337 HA3 GLY 43 HA3 GLY 43 -9.323 15.373 7.558 338 H ILE 44 H ILE 44 -9.262 12.018 7.736 339 HA ILE 44 HA ILE 44 -6.360 11.916 8.312 340 HB ILE 44 HB ILE 44 -8.408 10.367 9.908 341 HG12 ILE 44 HG12 ILE 44 -7.207 13.047 10.655 342 HG13 ILE 44 HG13 ILE 44 -8.885 12.767 10.196 343 HG21 ILE 44 HG21 ILE 44 -6.585 10.207 11.548 344 HG22 ILE 44 HG22 ILE 44 -5.540 11.133 10.471 345 HG23 ILE 44 HG23 ILE 44 -6.119 9.540 9.984 346 HD11 ILE 44 HD11 ILE 44 -9.151 11.297 12.141 347 HD12 ILE 44 HD12 ILE 44 -8.684 12.938 12.594 348 HD13 ILE 44 HD13 ILE 44 -7.486 11.643 12.608 349 H PHE 45 H PHE 45 -5.456 9.705 8.122 350 HA PHE 45 HA PHE 45 -7.168 7.884 6.544 351 HB2 PHE 45 HB2 PHE 45 -5.364 7.339 5.045 352 HB3 PHE 45 HB3 PHE 45 -5.556 9.088 5.055 353 HD1 PHE 45 HD2 PHE 45 -3.852 10.525 6.074 354 HD2 PHE 45 HD1 PHE 45 -3.383 6.288 5.934 355 HE1 PHE 45 HE2 PHE 45 -1.462 10.765 6.613 356 HE2 PHE 45 HE1 PHE 45 -0.999 6.530 6.470 357 HZ PHE 45 HZ PHE 45 -0.039 8.766 6.815 358 H THR 46 H THR 46 -6.924 5.694 6.898 359 HA THR 46 HA THR 46 -4.990 4.910 8.992 360 HB THR 46 HB THR 46 -7.051 4.507 10.015 361 HG1 THR 46 HG1 THR 46 -6.637 1.989 8.759 362 HG21 THR 46 HG21 THR 46 -8.951 3.380 8.954 363 HG22 THR 46 HG22 THR 46 -8.054 3.306 7.436 364 HG23 THR 46 HG23 THR 46 -8.520 4.869 8.109 365 H CYS 47 H CYS 47 -3.304 4.057 7.966 366 HA CYS 47 HA CYS 47 -3.661 2.286 5.686 367 HB2 CYS 47 HB2 CYS 47 -1.806 3.878 5.637 368 HB3 CYS 47 HB3 CYS 47 -1.132 3.167 7.097 369 HG CYS 47 HG CYS 47 -0.777 2.231 3.937 370 H ASN 48 H ASN 48 -4.527 0.391 6.318 371 HA ASN 48 HA ASN 48 -3.554 -1.094 8.606 372 HB2 ASN 48 HB2 ASN 48 -5.570 -1.782 6.450 373 HB3 ASN 48 HB3 ASN 48 -5.208 -2.809 7.834 374 HD21 ASN 48 HD21 ASN 48 -5.971 -2.243 9.837 375 HD22 ASN 48 HD22 ASN 48 -7.138 -0.996 10.071 376 H LEU 49 H LEU 49 -1.561 -1.960 8.370 377 HA LEU 49 HA LEU 49 -0.787 -3.224 5.837 378 HB2 LEU 49 HB2 LEU 49 0.812 -1.658 6.694 379 HB3 LEU 49 HB3 LEU 49 0.782 -2.407 8.280 380 HG LEU 49 HG LEU 49 1.841 -4.433 7.331 381 HD11 LEU 49 HD11 LEU 49 1.971 -2.818 4.788 382 HD12 LEU 49 HD12 LEU 49 1.067 -4.311 5.053 383 HD13 LEU 49 HD13 LEU 49 2.829 -4.330 5.079 384 HD21 LEU 49 HD21 LEU 49 4.069 -3.482 7.033 385 HD22 LEU 49 HD22 LEU 49 3.215 -2.690 8.358 386 HD23 LEU 49 HD23 LEU 49 3.366 -1.882 6.798 387 H MET 50 H MET 50 -0.628 -5.375 5.586 388 HA MET 50 HA MET 50 -0.578 -7.098 7.988 389 HB2 MET 50 HB2 MET 50 -1.884 -7.682 5.322 390 HB3 MET 50 HB3 MET 50 -1.783 -8.805 6.671 391 HG2 MET 50 HG2 MET 50 -3.272 -6.186 6.631 392 HG3 MET 50 HG3 MET 50 -3.977 -7.801 6.573 393 HE1 MET 50 HE1 MET 50 -3.407 -9.618 8.630 394 HE2 MET 50 HE2 MET 50 -2.673 -9.098 10.147 395 HE3 MET 50 HE3 MET 50 -1.719 -9.100 8.664 396 H ILE 51 H ILE 51 1.362 -8.004 8.200 397 HA ILE 51 HA ILE 51 2.731 -9.149 5.878 398 HB ILE 51 HB ILE 51 4.923 -8.084 6.788 399 HG12 ILE 51 HG12 ILE 51 4.453 -5.698 7.630 400 HG13 ILE 51 HG13 ILE 51 2.823 -6.261 7.984 401 HG21 ILE 51 HG21 ILE 51 2.911 -6.446 5.245 402 HG22 ILE 51 HG22 ILE 51 4.053 -7.615 4.581 403 HG23 ILE 51 HG23 ILE 51 4.645 -6.125 5.315 404 HD11 ILE 51 HD11 ILE 51 3.729 -7.915 9.523 405 HD12 ILE 51 HD12 ILE 51 4.235 -6.283 9.956 406 HD13 ILE 51 HD13 ILE 51 5.366 -7.371 9.150 407 H PHE 52 H PHE 52 4.597 -10.536 6.496 408 HA PHE 52 HA PHE 52 4.002 -11.974 8.971 409 HB2 PHE 52 HB2 PHE 52 5.586 -12.619 6.501 410 HB3 PHE 52 HB3 PHE 52 5.845 -13.547 7.972 411 HD1 PHE 52 HD2 PHE 52 3.915 -14.761 8.999 412 HD2 PHE 52 HD1 PHE 52 3.725 -13.053 5.103 413 HE1 PHE 52 HE2 PHE 52 2.000 -16.207 8.460 414 HE2 PHE 52 HE1 PHE 52 1.809 -14.498 4.560 415 HZ PHE 52 HZ PHE 52 0.945 -16.081 6.237 416 H VAL 53 H VAL 53 5.229 -11.926 10.772 417 HA VAL 53 HA VAL 53 7.999 -10.912 10.555 418 HB VAL 53 HB VAL 53 7.857 -9.680 12.581 419 HG11 VAL 53 HG11 VAL 53 6.939 -8.494 10.662 420 HG12 VAL 53 HG12 VAL 53 6.112 -8.022 12.149 421 HG13 VAL 53 HG13 VAL 53 5.335 -9.136 11.022 422 HG21 VAL 53 HG21 VAL 53 5.841 -9.583 13.978 423 HG22 VAL 53 HG22 VAL 53 6.520 -11.208 13.901 424 HG23 VAL 53 HG23 VAL 53 5.087 -10.805 12.955 425 H LYS 54 H LYS 54 9.521 -11.839 11.971 426 HA LYS 54 HA LYS 54 8.990 -14.591 12.546 427 HB2 LYS 54 HB2 LYS 54 11.343 -14.699 13.210 428 HB3 LYS 54 HB3 LYS 54 11.131 -13.898 11.659 429 HG2 LYS 54 HG2 LYS 54 11.255 -11.702 12.933 430 HG3 LYS 54 HG3 LYS 54 11.807 -12.655 14.314 431 HD2 LYS 54 HD2 LYS 54 13.127 -12.496 11.597 432 HD3 LYS 54 HD3 LYS 54 13.715 -11.763 13.091 433 HE2 LYS 54 HE2 LYS 54 14.135 -13.908 14.063 434 HE3 LYS 54 HE3 LYS 54 13.314 -14.734 12.739 435 HZ1 LYS 54 HZ1 LYS 54 15.682 -14.888 12.469 436 HZ2 LYS 54 HZ2 LYS 54 15.855 -13.208 12.551 437 HZ3 LYS 54 HZ3 LYS 54 15.047 -13.912 11.243 438 H ASN 55 H ASN 55 8.842 -11.738 14.494 439 HA ASN 55 HA ASN 55 7.824 -13.228 16.708 440 HB2 ASN 55 HB2 ASN 55 9.514 -12.482 18.382 441 HB3 ASN 55 HB3 ASN 55 10.158 -13.614 17.199 442 HD21 ASN 55 HD21 ASN 55 12.273 -12.979 17.404 443 HD22 ASN 55 HD22 ASN 55 12.846 -11.425 16.910 444 H THR 56 H THR 56 7.273 -11.747 18.606 445 HA THR 56 HA THR 56 5.696 -9.623 17.602 446 HB THR 56 HB THR 56 5.180 -9.079 19.956 447 HG1 THR 56 HG1 THR 56 6.217 -10.722 21.489 448 HG21 THR 56 HG21 THR 56 3.951 -10.904 18.894 449 HG22 THR 56 HG22 THR 56 4.221 -11.259 20.601 450 HG23 THR 56 HG23 THR 56 5.206 -12.049 19.369 451 H ASP 57 H ASP 57 8.948 -9.674 18.863 452 HA ASP 57 HA ASP 57 9.150 -6.900 19.509 453 HB2 ASP 57 HB2 ASP 57 10.742 -8.564 20.398 454 HB3 ASP 57 HB3 ASP 57 11.332 -8.876 18.768 455 H LYS 58 H LYS 58 9.889 -8.843 16.680 456 HA LYS 58 HA LYS 58 10.941 -6.909 14.977 457 HB2 LYS 58 HB2 LYS 58 11.024 -9.284 14.473 458 HB3 LYS 58 HB3 LYS 58 9.269 -9.371 14.409 459 HG2 LYS 58 HG2 LYS 58 10.048 -9.388 12.181 460 HG3 LYS 58 HG3 LYS 58 9.339 -7.803 12.492 461 HD2 LYS 58 HD2 LYS 58 11.647 -6.929 12.924 462 HD3 LYS 58 HD3 LYS 58 12.285 -8.503 12.453 463 HE2 LYS 58 HE2 LYS 58 12.498 -7.234 10.513 464 HE3 LYS 58 HE3 LYS 58 11.000 -8.123 10.245 465 HZ1 LYS 58 HZ1 LYS 58 9.745 -6.194 10.857 466 HZ2 LYS 58 HZ2 LYS 58 10.863 -5.752 9.662 467 HZ3 LYS 58 HZ3 LYS 58 11.147 -5.347 11.277 468 H LEU 59 H LEU 59 7.605 -7.708 15.778 469 HA LEU 59 HA LEU 59 6.374 -6.007 13.847 470 HB2 LEU 59 HB2 LEU 59 5.191 -7.884 14.864 471 HB3 LEU 59 HB3 LEU 59 5.331 -7.143 16.447 472 HG LEU 59 HG LEU 59 3.866 -5.294 15.715 473 HD11 LEU 59 HD11 LEU 59 3.631 -6.859 13.147 474 HD12 LEU 59 HD12 LEU 59 4.406 -5.286 13.344 475 HD13 LEU 59 HD13 LEU 59 2.667 -5.451 13.587 476 HD21 LEU 59 HD21 LEU 59 2.859 -7.202 16.822 477 HD22 LEU 59 HD22 LEU 59 2.727 -8.060 15.286 478 HD23 LEU 59 HD23 LEU 59 1.779 -6.599 15.566 479 H THR 60 H THR 60 7.039 -5.608 17.351 480 HA THR 60 HA THR 60 6.018 -2.986 17.581 481 HB THR 60 HB THR 60 7.279 -2.754 19.639 482 HG1 THR 60 HG1 THR 60 8.734 -5.012 18.682 483 HG21 THR 60 HG21 THR 60 5.305 -4.207 19.722 484 HG22 THR 60 HG22 THR 60 6.547 -4.767 20.841 485 HG23 THR 60 HG23 THR 60 6.304 -5.600 19.305 486 H THR 61 H THR 61 9.113 -4.178 16.451 487 HA THR 61 HA THR 61 10.554 -1.769 16.399 488 HB THR 61 HB THR 61 10.744 -4.032 14.385 489 HG1 THR 61 HG1 THR 61 11.741 -3.721 17.005 490 HG21 THR 61 HG21 THR 61 13.053 -3.259 14.053 491 HG22 THR 61 HG22 THR 61 12.773 -1.931 15.179 492 HG23 THR 61 HG23 THR 61 11.895 -1.989 13.650 493 H LEU 62 H LEU 62 8.464 -3.252 13.930 494 HA LEU 62 HA LEU 62 8.762 -1.303 11.936 495 HB2 LEU 62 HB2 LEU 62 6.381 -3.066 12.537 496 HB3 LEU 62 HB3 LEU 62 6.605 -2.156 11.053 497 HG LEU 62 HG LEU 62 8.363 -4.415 12.028 498 HD11 LEU 62 HD11 LEU 62 6.217 -5.193 11.205 499 HD12 LEU 62 HD12 LEU 62 7.501 -5.609 10.073 500 HD13 LEU 62 HD13 LEU 62 6.422 -4.255 9.724 501 HD21 LEU 62 HD21 LEU 62 8.529 -2.775 9.500 502 HD22 LEU 62 HD22 LEU 62 9.498 -4.202 9.868 503 HD23 LEU 62 HD23 LEU 62 9.676 -2.743 10.841 504 H MET 63 H MET 63 6.554 -1.441 14.695 505 HA MET 63 HA MET 63 4.899 0.731 14.137 506 HB2 MET 63 HB2 MET 63 6.017 -0.074 16.835 507 HB3 MET 63 HB3 MET 63 4.620 0.962 16.576 508 HG2 MET 63 HG2 MET 63 3.397 -0.868 15.592 509 HG3 MET 63 HG3 MET 63 4.812 -1.915 15.713 510 HE1 MET 63 HE1 MET 63 2.026 -2.841 16.857 511 HE2 MET 63 HE2 MET 63 2.540 -3.517 18.405 512 HE3 MET 63 HE3 MET 63 3.525 -3.769 16.962 513 H ASP 64 H ASP 64 7.963 0.737 15.959 514 HA ASP 64 HA ASP 64 8.165 3.489 16.391 515 HB2 ASP 64 HB2 ASP 64 9.551 1.718 17.480 516 HB3 ASP 64 HB3 ASP 64 10.443 1.537 15.977 517 H LYS 65 H LYS 65 9.329 1.509 13.689 518 HA LYS 65 HA LYS 65 10.678 3.490 12.238 519 HB2 LYS 65 HB2 LYS 65 9.146 1.094 11.211 520 HB3 LYS 65 HB3 LYS 65 10.328 2.006 10.281 521 HG2 LYS 65 HG2 LYS 65 12.028 1.380 12.037 522 HG3 LYS 65 HG3 LYS 65 10.810 0.305 12.722 523 HD2 LYS 65 HD2 LYS 65 11.949 -1.161 11.360 524 HD3 LYS 65 HD3 LYS 65 10.681 -0.622 10.259 525 HE2 LYS 65 HE2 LYS 65 13.510 0.439 10.379 526 HE3 LYS 65 HE3 LYS 65 12.864 -0.650 9.157 527 HZ1 LYS 65 HZ1 LYS 65 11.897 2.111 9.643 528 HZ2 LYS 65 HZ2 LYS 65 11.395 1.072 8.402 529 HZ3 LYS 65 HZ3 LYS 65 12.976 1.662 8.424 530 H LEU 66 H LEU 66 7.252 2.578 12.211 531 HA LEU 66 HA LEU 66 6.488 4.473 10.194 532 HB2 LEU 66 HB2 LEU 66 4.831 3.014 12.264 533 HB3 LEU 66 HB3 LEU 66 4.183 3.900 10.895 534 HG LEU 66 HG LEU 66 6.031 1.529 10.589 535 HD11 LEU 66 HD11 LEU 66 3.014 1.576 10.541 536 HD12 LEU 66 HD12 LEU 66 4.037 0.765 11.727 537 HD13 LEU 66 HD13 LEU 66 4.023 0.215 10.052 538 HD21 LEU 66 HD21 LEU 66 5.124 1.500 8.293 539 HD22 LEU 66 HD22 LEU 66 5.978 2.999 8.660 540 HD23 LEU 66 HD23 LEU 66 4.214 2.969 8.650 541 H ARG 67 H ARG 67 6.800 4.533 13.667 542 HA ARG 67 HA ARG 67 5.332 6.940 14.116 543 HB2 ARG 67 HB2 ARG 67 7.318 5.422 15.818 544 HB3 ARG 67 HB3 ARG 67 6.490 6.876 16.371 545 HG2 ARG 67 HG2 ARG 67 4.350 5.812 16.171 546 HG3 ARG 67 HG3 ARG 67 5.072 4.398 15.408 547 HD2 ARG 67 HD2 ARG 67 6.268 3.885 17.481 548 HD3 ARG 67 HD3 ARG 67 5.561 5.312 18.245 549 HE ARG 67 HE ARG 67 3.383 3.964 17.435 550 HH11 ARG 67 HH11 ARG 67 6.149 2.943 19.233 551 HH12 ARG 67 HH12 ARG 67 5.257 1.732 20.091 552 HH21 ARG 67 HH21 ARG 67 2.276 2.393 18.543 553 HH22 ARG 67 HH22 ARG 67 3.114 1.439 19.722 554 H LYS 68 H LYS 68 8.321 6.442 12.648 555 HA LYS 68 HA LYS 68 9.670 8.818 13.501 556 HB2 LYS 68 HB2 LYS 68 10.023 7.377 10.863 557 HB3 LYS 68 HB3 LYS 68 11.168 8.462 11.638 558 HG2 LYS 68 HG2 LYS 68 10.365 5.701 12.528 559 HG3 LYS 68 HG3 LYS 68 11.937 6.226 11.930 560 HD2 LYS 68 HD2 LYS 68 12.182 7.680 13.912 561 HD3 LYS 68 HD3 LYS 68 10.629 7.094 14.516 562 HE2 LYS 68 HE2 LYS 68 11.623 4.759 14.395 563 HE3 LYS 68 HE3 LYS 68 13.182 5.539 14.127 564 HZ1 LYS 68 HZ1 LYS 68 11.434 5.893 16.499 565 HZ2 LYS 68 HZ2 LYS 68 12.905 6.691 16.249 566 HZ3 LYS 68 HZ3 LYS 68 12.873 5.011 16.444 567 H VAL 69 H VAL 69 6.897 8.382 11.650 568 HA VAL 69 HA VAL 69 7.273 10.788 10.030 569 HB VAL 69 HB VAL 69 4.898 8.909 10.157 570 HG11 VAL 69 HG11 VAL 69 4.274 11.132 9.383 571 HG12 VAL 69 HG12 VAL 69 4.219 9.979 8.049 572 HG13 VAL 69 HG13 VAL 69 5.571 11.101 8.189 573 HG21 VAL 69 HG21 VAL 69 5.739 8.024 8.015 574 HG22 VAL 69 HG22 VAL 69 6.879 7.755 9.332 575 HG23 VAL 69 HG23 VAL 69 7.171 9.044 8.165 576 H GLN 70 H GLN 70 6.887 12.672 10.999 577 HA GLN 70 HA GLN 70 5.624 13.045 13.455 578 HB2 GLN 70 HB2 GLN 70 5.672 15.462 12.906 579 HB3 GLN 70 HB3 GLN 70 7.202 14.654 12.587 580 HG2 GLN 70 HG2 GLN 70 6.684 14.574 10.206 581 HG3 GLN 70 HG3 GLN 70 5.128 15.346 10.510 582 HE21 GLN 70 HE21 GLN 70 8.576 15.799 10.412 583 HE22 GLN 70 HE22 GLN 70 8.548 17.528 10.427 584 H GLY 71 H GLY 71 4.219 13.012 10.240 585 HA2 GLY 71 HA2 GLY 71 1.776 14.320 10.896 586 HA3 GLY 71 HA3 GLY 71 2.067 13.319 9.486 587 H VAL 72 H VAL 72 2.869 11.124 11.595 588 HA VAL 72 HA VAL 72 0.140 10.080 11.848 589 HB VAL 72 HB VAL 72 2.785 8.710 12.378 590 HG11 VAL 72 HG11 VAL 72 1.478 6.630 12.431 591 HG12 VAL 72 HG12 VAL 72 -0.012 7.556 12.260 592 HG13 VAL 72 HG13 VAL 72 0.975 7.735 13.711 593 HG21 VAL 72 HG21 VAL 72 2.366 7.531 10.274 594 HG22 VAL 72 HG22 VAL 72 2.468 9.272 10.017 595 HG23 VAL 72 HG23 VAL 72 0.895 8.473 10.031 596 H PHE 73 H PHE 73 -0.922 9.836 13.740 597 HA PHE 73 HA PHE 73 0.565 10.449 16.210 598 HB2 PHE 73 HB2 PHE 73 -1.974 10.962 16.976 599 HB3 PHE 73 HB3 PHE 73 -0.880 12.165 16.319 600 HD1 PHE 73 HD1 PHE 73 -3.836 10.099 15.629 601 HD2 PHE 73 HD2 PHE 73 -1.200 13.086 14.120 602 HE1 PHE 73 HE1 PHE 73 -5.446 10.622 13.840 603 HE2 PHE 73 HE2 PHE 73 -2.804 13.612 12.333 604 HZ PHE 73 HZ PHE 73 -4.928 12.381 12.191 605 H THR 74 H THR 74 -1.240 8.011 14.614 606 HA THR 74 HA THR 74 -1.016 6.416 17.083 607 HB THR 74 HB THR 74 -3.108 5.509 17.019 608 HG1 THR 74 HG1 THR 74 -3.880 4.689 15.241 609 HG21 THR 74 HG21 THR 74 -3.444 7.937 17.274 610 HG22 THR 74 HG22 THR 74 -4.823 7.162 16.492 611 HG23 THR 74 HG23 THR 74 -3.660 8.078 15.529 612 H VAL 75 H VAL 75 0.245 4.711 16.796 613 HA VAL 75 HA VAL 75 0.048 3.204 14.263 614 HB VAL 75 HB VAL 75 2.598 3.498 15.882 615 HG11 VAL 75 HG11 VAL 75 2.427 1.383 14.680 616 HG12 VAL 75 HG12 VAL 75 3.662 2.411 13.952 617 HG13 VAL 75 HG13 VAL 75 2.085 2.245 13.179 618 HG21 VAL 75 HG21 VAL 75 3.442 4.895 14.042 619 HG22 VAL 75 HG22 VAL 75 2.042 5.636 14.822 620 HG23 VAL 75 HG23 VAL 75 1.861 4.827 13.264 621 H GLU 76 H GLU 76 -1.055 1.418 14.815 622 HA GLU 76 HA GLU 76 -0.674 0.282 17.526 623 HB2 GLU 76 HB2 GLU 76 -3.290 0.545 16.019 624 HB3 GLU 76 HB3 GLU 76 -3.080 -0.014 17.673 625 HG2 GLU 76 HG2 GLU 76 -2.566 2.144 18.457 626 HG3 GLU 76 HG3 GLU 76 -2.271 2.757 16.830 627 H ARG 77 H ARG 77 -1.151 -1.971 17.783 628 HA ARG 77 HA ARG 77 -0.783 -3.580 15.393 629 HB2 ARG 77 HB2 ARG 77 0.440 -4.273 17.353 630 HB3 ARG 77 HB3 ARG 77 -1.029 -4.324 18.317 631 HG2 ARG 77 HG2 ARG 77 -1.862 -6.187 16.949 632 HG3 ARG 77 HG3 ARG 77 -0.376 -6.143 15.997 633 HD2 ARG 77 HD2 ARG 77 0.935 -6.783 17.903 634 HD3 ARG 77 HD3 ARG 77 -0.454 -6.619 18.980 635 HE ARG 77 HE ARG 77 -1.353 -8.475 17.319 636 HH11 ARG 77 HH11 ARG 77 1.726 -8.222 18.857 637 HH12 ARG 77 HH12 ARG 77 1.954 -9.933 18.898 638 HH21 ARG 77 HH21 ARG 77 -1.034 -10.670 17.386 639 HH22 ARG 77 HH22 ARG 77 0.428 -11.301 18.061 640 H LEU 78 H LEU 78 -2.277 -4.838 14.410 641 HA LEU 78 HA LEU 78 -5.072 -4.662 15.213 642 HB2 LEU 78 HB2 LEU 78 -3.735 -5.956 12.825 643 HB3 LEU 78 HB3 LEU 78 -5.470 -5.895 13.079 644 HG LEU 78 HG LEU 78 -3.700 -3.461 12.755 645 HD11 LEU 78 HD11 LEU 78 -3.805 -4.802 10.697 646 HD12 LEU 78 HD12 LEU 78 -4.634 -3.256 10.527 647 HD13 LEU 78 HD13 LEU 78 -5.568 -4.736 10.753 648 HD21 LEU 78 HD21 LEU 78 -5.699 -3.006 14.068 649 HD22 LEU 78 HD22 LEU 78 -6.707 -3.753 12.828 650 HD23 LEU 78 HD23 LEU 78 -5.832 -2.265 12.473 651 H SER 79 H SER 79 -5.690 -6.040 16.779 652 HA SER 79 HA SER 79 -4.320 -8.503 17.306 653 HB2 SER 79 HB2 SER 79 -6.032 -8.797 19.096 654 HB3 SER 79 HB3 SER 79 -5.215 -7.236 19.166 655 HG SER 79 HG SER 79 -7.808 -7.686 19.037 656 H ASN 80 H ASN 80 -7.779 -7.917 16.566 657 HA ASN 80 HA ASN 80 -8.117 -10.713 15.861 658 HB2 ASN 80 HB2 ASN 80 -10.123 -8.446 15.783 659 HB3 ASN 80 HB3 ASN 80 -10.489 -10.166 15.633 660 HD21 ASN 80 HD21 ASN 80 -10.249 -11.497 17.461 661 HD22 ASN 80 HD22 ASN 80 -10.210 -10.838 19.057 662 H LEU 81 H LEU 81 -7.775 -11.485 13.895 663 HA LEU 81 HA LEU 81 -8.076 -9.697 11.558 664 HB2 LEU 81 HB2 LEU 81 -6.308 -12.137 11.827 665 HB3 LEU 81 HB3 LEU 81 -6.415 -11.092 10.424 666 HG LEU 81 HG LEU 81 -5.322 -10.310 13.134 667 HD11 LEU 81 HD11 LEU 81 -3.920 -10.778 10.500 668 HD12 LEU 81 HD12 LEU 81 -3.858 -11.834 11.914 669 HD13 LEU 81 HD13 LEU 81 -3.165 -10.216 11.995 670 HD21 LEU 81 HD21 LEU 81 -6.393 -8.407 12.048 671 HD22 LEU 81 HD22 LEU 81 -5.485 -8.719 10.568 672 HD23 LEU 81 HD23 LEU 81 -4.638 -8.222 12.035 673 H GLU 82 H GLU 82 -8.037 -11.536 9.530 674 HA GLU 82 HA GLU 82 -10.037 -13.602 10.067 675 HB2 GLU 82 HB2 GLU 82 -11.503 -12.853 8.244 676 HB3 GLU 82 HB3 GLU 82 -11.378 -11.633 9.506 677 HG2 GLU 82 HG2 GLU 82 -9.918 -10.291 8.176 678 HG3 GLU 82 HG3 GLU 82 -9.746 -11.569 6.973 679 H HIS 83 H HIS 83 -7.159 -13.459 9.157 680 HA HIS 83 HA HIS 83 -7.230 -14.112 6.327 681 HB2 HIS 83 HB2 HIS 83 -4.924 -14.039 8.287 682 HB3 HIS 83 HB3 HIS 83 -4.763 -14.315 6.554 683 HD1 HIS 83 HD1 HIS 83 -4.071 -12.256 5.366 684 HD2 HIS 83 HD2 HIS 83 -6.450 -11.394 8.662 685 HE1 HIS 83 HE1 HIS 83 -4.230 -9.755 5.453 686 HE2 HIS 83 HE2 HIS 83 -5.867 -9.281 7.300 687 H HIS 84 H HIS 84 -6.264 -16.076 5.443 688 HA HIS 84 HA HIS 84 -6.251 -18.337 5.173 689 HB2 HIS 84 HB2 HIS 84 -5.675 -18.321 8.152 690 HB3 HIS 84 HB3 HIS 84 -5.557 -19.743 7.126 691 HD1 HIS 84 HD1 HIS 84 -3.743 -19.415 5.062 692 HD2 HIS 84 HD2 HIS 84 -3.331 -16.994 8.413 693 HE1 HIS 84 HE1 HIS 84 -1.374 -18.593 5.007 694 HE2 HIS 84 HE2 HIS 84 -1.083 -17.386 7.194 695 H HIS 85 H HIS 85 -8.799 -16.931 5.897 696 HA HIS 85 HA HIS 85 -10.270 -18.636 7.663 697 HB2 HIS 85 HB2 HIS 85 -12.191 -17.237 7.160 698 HB3 HIS 85 HB3 HIS 85 -10.776 -16.237 7.437 699 HD1 HIS 85 HD1 HIS 85 -10.263 -14.529 5.675 700 HD2 HIS 85 HD2 HIS 85 -12.910 -17.434 4.321 701 HE1 HIS 85 HE1 HIS 85 -11.033 -13.741 3.422 702 HE2 HIS 85 HE2 HIS 85 -12.776 -15.412 2.719 703 H HIS 86 H HIS 86 -9.159 -20.033 5.285 704 HA HIS 86 HA HIS 86 -11.689 -21.016 4.132 705 HB2 HIS 86 HB2 HIS 86 -10.414 -21.849 2.216 706 HB3 HIS 86 HB3 HIS 86 -10.174 -20.120 2.421 707 HD1 HIS 86 HD1 HIS 86 -8.375 -23.301 2.173 708 HD2 HIS 86 HD2 HIS 86 -7.547 -19.439 3.459 709 HE1 HIS 86 HE1 HIS 86 -5.873 -23.153 2.284 710 HE2 HIS 86 HE2 HIS 86 -5.406 -20.868 3.222 711 H HIS 87 H HIS 87 -12.311 -22.612 5.471 712 HA HIS 87 HA HIS 87 -10.584 -24.435 6.770 713 HB2 HIS 87 HB2 HIS 87 -12.835 -23.974 7.599 714 HB3 HIS 87 HB3 HIS 87 -13.540 -24.661 6.140 715 HD1 HIS 87 HD1 HIS 87 -14.091 -27.090 6.223 716 HD2 HIS 87 HD2 HIS 87 -11.445 -25.980 9.231 717 HE1 HIS 87 HE1 HIS 87 -13.811 -29.129 7.662 718 HE2 HIS 87 HE2 HIS 87 -12.129 -28.469 9.408 719 H HIS 88 H HIS 88 -9.627 -26.254 6.074 720 HA HIS 88 HA HIS 88 -9.770 -27.013 3.319 721 HB2 HIS 88 HB2 HIS 88 -8.398 -28.400 5.638 722 HB3 HIS 88 HB3 HIS 88 -8.136 -28.754 3.933 723 HD1 HIS 88 HD1 HIS 88 -6.800 -26.795 6.625 724 HD2 HIS 88 HD2 HIS 88 -7.102 -26.334 2.510 725 HE1 HIS 88 HE1 HIS 88 -5.127 -25.032 6.025 726 HE2 HIS 88 HE2 HIS 88 -5.160 -24.959 3.516 727 H1 MET 1 H1 MET 1 -13.280 21.542 -12.524 728 H2 MET 1 H2 MET 1 -13.290 21.845 -14.188 729 H3 MET 1 H3 MET 1 -12.579 22.956 -13.133 730 HA MET 1 HA MET 1 -10.898 21.682 -14.279 731 HB2 MET 1 HB2 MET 1 -11.137 21.008 -11.334 732 HB3 MET 1 HB3 MET 1 -9.666 20.855 -12.286 733 HG2 MET 1 HG2 MET 1 -9.717 23.280 -12.716 734 HG3 MET 1 HG3 MET 1 -11.151 23.411 -11.699 735 HE1 MET 1 HE1 MET 1 -8.347 25.071 -9.513 736 HE2 MET 1 HE2 MET 1 -9.940 25.285 -10.237 737 HE3 MET 1 HE3 MET 1 -8.514 25.151 -11.266 738 H THR 2 H THR 2 -10.260 19.809 -15.189 739 HA THR 2 HA THR 2 -12.195 17.753 -15.455 740 HB THR 2 HB THR 2 -9.329 17.709 -16.440 741 HG1 THR 2 HG1 THR 2 -11.227 18.445 -18.260 742 HG21 THR 2 HG21 THR 2 -10.512 15.557 -16.655 743 HG22 THR 2 HG22 THR 2 -10.203 16.288 -18.229 744 HG23 THR 2 HG23 THR 2 -11.818 16.365 -17.524 745 H ASP 3 H ASP 3 -9.839 18.095 -13.046 746 HA ASP 3 HA ASP 3 -8.753 15.540 -12.761 747 HB2 ASP 3 HB2 ASP 3 -8.118 17.655 -11.487 748 HB3 ASP 3 HB3 ASP 3 -9.487 17.318 -10.434 749 H PHE 4 H PHE 4 -9.391 13.666 -11.719 750 HA PHE 4 HA PHE 4 -11.927 13.562 -10.298 751 HB2 PHE 4 HB2 PHE 4 -12.827 11.742 -11.701 752 HB3 PHE 4 HB3 PHE 4 -12.653 13.241 -12.606 753 HD1 PHE 4 HD1 PHE 4 -11.430 9.812 -12.191 754 HD2 PHE 4 HD2 PHE 4 -10.996 13.443 -14.381 755 HE1 PHE 4 HE1 PHE 4 -10.087 8.631 -13.880 756 HE2 PHE 4 HE2 PHE 4 -9.659 12.263 -16.074 757 HZ PHE 4 HZ PHE 4 -9.191 9.856 -15.818 758 H LEU 5 H LEU 5 -12.303 11.471 -9.263 759 HA LEU 5 HA LEU 5 -9.848 10.295 -8.300 760 HB2 LEU 5 HB2 LEU 5 -11.670 10.740 -6.757 761 HB3 LEU 5 HB3 LEU 5 -12.743 9.710 -7.684 762 HG LEU 5 HG LEU 5 -11.437 7.737 -7.059 763 HD11 LEU 5 HD11 LEU 5 -9.623 7.903 -5.409 764 HD12 LEU 5 HD12 LEU 5 -9.712 9.662 -5.496 765 HD13 LEU 5 HD13 LEU 5 -9.224 8.732 -6.913 766 HD21 LEU 5 HD21 LEU 5 -13.271 8.420 -5.610 767 HD22 LEU 5 HD22 LEU 5 -12.179 9.458 -4.690 768 HD23 LEU 5 HD23 LEU 5 -11.965 7.708 -4.665 769 H ALA 6 H ALA 6 -8.863 8.951 -9.660 770 HA ALA 6 HA ALA 6 -10.405 7.115 -11.336 771 HB1 ALA 6 HB1 ALA 6 -8.712 8.514 -12.404 772 HB2 ALA 6 HB2 ALA 6 -8.319 6.801 -12.556 773 HB3 ALA 6 HB3 ALA 6 -7.467 7.801 -11.378 774 H GLY 7 H GLY 7 -9.941 4.874 -11.452 775 HA2 GLY 7 HA2 GLY 7 -8.465 3.754 -9.143 776 HA3 GLY 7 HA3 GLY 7 -10.008 3.104 -9.670 777 H ILE 8 H ILE 8 -7.266 1.917 -9.459 778 HA ILE 8 HA ILE 8 -7.147 0.752 -12.168 779 HB ILE 8 HB ILE 8 -4.696 1.378 -10.480 780 HG12 ILE 8 HG12 ILE 8 -5.657 2.782 -12.994 781 HG13 ILE 8 HG13 ILE 8 -5.714 3.457 -11.370 782 HG21 ILE 8 HG21 ILE 8 -4.403 -0.574 -11.892 783 HG22 ILE 8 HG22 ILE 8 -3.437 0.767 -12.509 784 HG23 ILE 8 HG23 ILE 8 -4.952 0.333 -13.304 785 HD11 ILE 8 HD11 ILE 8 -3.217 2.720 -12.890 786 HD12 ILE 8 HD12 ILE 8 -3.269 3.391 -11.258 787 HD13 ILE 8 HD13 ILE 8 -3.837 4.350 -12.625 788 H ARG 9 H ARG 9 -6.800 -1.502 -12.201 789 HA ARG 9 HA ARG 9 -6.341 -2.787 -9.578 790 HB2 ARG 9 HB2 ARG 9 -8.601 -3.247 -10.571 791 HB3 ARG 9 HB3 ARG 9 -7.793 -4.043 -11.919 792 HG2 ARG 9 HG2 ARG 9 -6.746 -5.616 -10.297 793 HG3 ARG 9 HG3 ARG 9 -7.692 -4.861 -9.014 794 HD2 ARG 9 HD2 ARG 9 -9.756 -5.473 -10.305 795 HD3 ARG 9 HD3 ARG 9 -8.722 -6.395 -11.399 796 HE ARG 9 HE ARG 9 -8.722 -6.988 -8.520 797 HH11 ARG 9 HH11 ARG 9 -9.171 -8.022 -11.777 798 HH12 ARG 9 HH12 ARG 9 -9.512 -9.654 -11.320 799 HH21 ARG 9 HH21 ARG 9 -9.161 -9.082 -7.952 800 HH22 ARG 9 HH22 ARG 9 -9.502 -10.246 -9.182 801 H ILE 10 H ILE 10 -4.651 -4.104 -9.371 802 HA ILE 10 HA ILE 10 -3.096 -4.832 -11.786 803 HB ILE 10 HB ILE 10 -2.011 -4.388 -8.992 804 HG12 ILE 10 HG12 ILE 10 -1.816 -2.481 -11.341 805 HG13 ILE 10 HG13 ILE 10 -2.961 -2.295 -10.016 806 HG21 ILE 10 HG21 ILE 10 0.174 -4.346 -10.092 807 HG22 ILE 10 HG22 ILE 10 -0.597 -4.646 -11.650 808 HG23 ILE 10 HG23 ILE 10 -0.659 -5.873 -10.385 809 HD11 ILE 10 HD11 ILE 10 -1.087 -2.109 -8.447 810 HD12 ILE 10 HD12 ILE 10 -1.047 -0.866 -9.696 811 HD13 ILE 10 HD13 ILE 10 0.041 -2.251 -9.796 812 H VAL 11 H VAL 11 -3.215 -7.018 -12.142 813 HA VAL 11 HA VAL 11 -3.096 -8.780 -9.768 814 HB VAL 11 HB VAL 11 -4.630 -9.249 -12.333 815 HG11 VAL 11 HG11 VAL 11 -4.094 -11.198 -10.087 816 HG12 VAL 11 HG12 VAL 11 -3.494 -11.323 -11.741 817 HG13 VAL 11 HG13 VAL 11 -5.223 -11.456 -11.418 818 HG21 VAL 11 HG21 VAL 11 -6.557 -9.442 -10.842 819 HG22 VAL 11 HG22 VAL 11 -5.758 -7.884 -10.623 820 HG23 VAL 11 HG23 VAL 11 -5.515 -9.173 -9.440 821 H GLY 12 H GLY 12 -1.299 -9.837 -9.607 822 HA2 GLY 12 HA2 GLY 12 0.021 -10.943 -11.983 823 HA3 GLY 12 HA3 GLY 12 0.954 -9.887 -10.928 824 H GLU 13 H GLU 13 1.915 -12.373 -11.286 825 HA GLU 13 HA GLU 13 0.882 -14.372 -9.577 826 HB2 GLU 13 HB2 GLU 13 3.026 -15.518 -9.949 827 HB3 GLU 13 HB3 GLU 13 2.349 -14.894 -11.449 828 HG2 GLU 13 HG2 GLU 13 3.890 -12.977 -11.325 829 HG3 GLU 13 HG3 GLU 13 4.588 -13.649 -9.853 830 H ASP 14 H ASP 14 1.167 -14.794 -7.448 831 HA ASP 14 HA ASP 14 2.306 -12.796 -5.755 832 HB2 ASP 14 HB2 ASP 14 0.346 -14.038 -5.039 833 HB3 ASP 14 HB3 ASP 14 1.228 -15.558 -5.134 834 H LYS 15 H LYS 15 4.490 -12.670 -6.314 835 HA LYS 15 HA LYS 15 6.182 -14.960 -5.571 836 HB2 LYS 15 HB2 LYS 15 6.491 -12.691 -7.455 837 HB3 LYS 15 HB3 LYS 15 7.948 -13.201 -6.611 838 HG2 LYS 15 HG2 LYS 15 7.740 -15.430 -7.469 839 HG3 LYS 15 HG3 LYS 15 6.172 -15.050 -8.192 840 HD2 LYS 15 HD2 LYS 15 7.198 -13.488 -9.722 841 HD3 LYS 15 HD3 LYS 15 8.766 -13.684 -8.936 842 HE2 LYS 15 HE2 LYS 15 8.946 -15.943 -9.696 843 HE3 LYS 15 HE3 LYS 15 7.273 -15.945 -10.256 844 HZ1 LYS 15 HZ1 LYS 15 8.873 -15.684 -12.069 845 HZ2 LYS 15 HZ2 LYS 15 9.431 -14.242 -11.383 846 HZ3 LYS 15 HZ3 LYS 15 7.839 -14.353 -11.945 847 H ASN 16 H ASN 16 8.241 -14.449 -4.510 848 HA ASN 16 HA ASN 16 7.780 -13.292 -1.986 849 HB2 ASN 16 HB2 ASN 16 10.179 -13.796 -1.584 850 HB3 ASN 16 HB3 ASN 16 9.295 -15.152 -2.282 851 HD21 ASN 16 HD21 ASN 16 9.754 -15.810 -4.367 852 HD22 ASN 16 HD22 ASN 16 11.152 -15.266 -5.224 853 H GLY 17 H GLY 17 8.240 -11.552 -4.741 854 HA2 GLY 17 HA2 GLY 17 9.115 -9.249 -3.130 855 HA3 GLY 17 HA3 GLY 17 9.945 -9.581 -4.640 856 H MET 18 H MET 18 6.873 -10.479 -5.315 857 HA MET 18 HA MET 18 6.531 -8.206 -7.014 858 HB2 MET 18 HB2 MET 18 4.961 -10.711 -6.503 859 HB3 MET 18 HB3 MET 18 4.238 -9.413 -7.444 860 HG2 MET 18 HG2 MET 18 6.860 -10.749 -8.091 861 HG3 MET 18 HG3 MET 18 5.308 -11.139 -8.835 862 HE1 MET 18 HE1 MET 18 4.076 -8.096 -8.854 863 HE2 MET 18 HE2 MET 18 3.839 -9.282 -10.139 864 HE3 MET 18 HE3 MET 18 4.438 -7.671 -10.527 865 H THR 19 H THR 19 4.508 -9.373 -4.274 866 HA THR 19 HA THR 19 2.638 -7.277 -4.422 867 HB THR 19 HB THR 19 2.033 -7.853 -2.088 868 HG1 THR 19 HG1 THR 19 3.561 -8.668 -0.889 869 HG21 THR 19 HG21 THR 19 1.406 -10.196 -2.505 870 HG22 THR 19 HG22 THR 19 2.514 -10.246 -3.876 871 HG23 THR 19 HG23 THR 19 1.106 -9.182 -3.917 872 H ASN 20 H ASN 20 5.796 -7.432 -2.919 873 HA ASN 20 HA ASN 20 5.509 -5.038 -1.376 874 HB2 ASN 20 HB2 ASN 20 7.075 -6.848 -0.745 875 HB3 ASN 20 HB3 ASN 20 7.997 -6.557 -2.218 876 HD21 ASN 20 HD21 ASN 20 7.209 -5.386 0.939 877 HD22 ASN 20 HD22 ASN 20 8.437 -4.185 1.005 878 H GLN 21 H GLN 21 7.130 -5.893 -4.437 879 HA GLN 21 HA GLN 21 8.200 -3.322 -4.909 880 HB2 GLN 21 HB2 GLN 21 8.841 -4.111 -7.046 881 HB3 GLN 21 HB3 GLN 21 8.987 -5.473 -5.954 882 HG2 GLN 21 HG2 GLN 21 6.867 -6.364 -6.772 883 HG3 GLN 21 HG3 GLN 21 6.702 -4.985 -7.859 884 HE21 GLN 21 HE21 GLN 21 8.407 -7.941 -7.231 885 HE22 GLN 21 HE22 GLN 21 9.128 -8.083 -8.791 886 H ILE 22 H ILE 22 5.136 -4.809 -5.791 887 HA ILE 22 HA ILE 22 4.354 -2.978 -7.781 888 HB ILE 22 HB ILE 22 2.844 -4.900 -6.032 889 HG12 ILE 22 HG12 ILE 22 4.149 -5.801 -7.893 890 HG13 ILE 22 HG13 ILE 22 2.428 -6.003 -8.205 891 HG21 ILE 22 HG21 ILE 22 1.298 -3.047 -6.307 892 HG22 ILE 22 HG22 ILE 22 0.779 -4.412 -7.295 893 HG23 ILE 22 HG23 ILE 22 1.581 -3.032 -8.049 894 HD11 ILE 22 HD11 ILE 22 3.648 -5.301 -10.197 895 HD12 ILE 22 HD12 ILE 22 4.164 -3.835 -9.364 896 HD13 ILE 22 HD13 ILE 22 2.454 -4.100 -9.706 897 H THR 23 H THR 23 3.354 -3.085 -4.328 898 HA THR 23 HA THR 23 1.989 -0.596 -4.493 899 HB THR 23 HB THR 23 3.103 -1.732 -1.917 900 HG1 THR 23 HG1 THR 23 0.977 -2.642 -3.536 901 HG21 THR 23 HG21 THR 23 0.603 -0.152 -2.550 902 HG22 THR 23 HG22 THR 23 2.061 0.485 -1.789 903 HG23 THR 23 HG23 THR 23 1.087 -0.724 -0.953 904 H GLY 24 H GLY 24 5.303 -1.514 -3.849 905 HA2 GLY 24 HA2 GLY 24 6.342 0.957 -3.001 906 HA3 GLY 24 HA3 GLY 24 7.233 -0.270 -3.888 907 H VAL 25 H VAL 25 5.984 -0.323 -6.320 908 HA VAL 25 HA VAL 25 6.909 1.908 -7.727 909 HB VAL 25 HB VAL 25 4.743 -0.067 -8.517 910 HG11 VAL 25 HG11 VAL 25 4.520 1.957 -9.851 911 HG12 VAL 25 HG12 VAL 25 5.159 0.644 -10.839 912 HG13 VAL 25 HG13 VAL 25 6.238 1.910 -10.250 913 HG21 VAL 25 HG21 VAL 25 6.905 -1.123 -8.109 914 HG22 VAL 25 HG22 VAL 25 7.690 0.023 -9.195 915 HG23 VAL 25 HG23 VAL 25 6.526 -1.140 -9.832 916 H ILE 26 H ILE 26 3.631 1.121 -6.628 917 HA ILE 26 HA ILE 26 2.294 3.388 -7.581 918 HB ILE 26 HB ILE 26 1.739 1.688 -5.141 919 HG12 ILE 26 HG12 ILE 26 0.527 1.652 -7.926 920 HG13 ILE 26 HG13 ILE 26 1.701 0.493 -7.311 921 HG21 ILE 26 HG21 ILE 26 0.652 3.850 -4.883 922 HG22 ILE 26 HG22 ILE 26 -0.543 2.593 -5.199 923 HG23 ILE 26 HG23 ILE 26 -0.067 3.702 -6.486 924 HD11 ILE 26 HD11 ILE 26 0.091 -0.247 -5.633 925 HD12 ILE 26 HD12 ILE 26 -0.543 -0.417 -7.271 926 HD13 ILE 26 HD13 ILE 26 -1.083 0.916 -6.250 927 H SER 27 H SER 27 3.876 2.856 -4.427 928 HA SER 27 HA SER 27 3.058 5.284 -3.254 929 HB2 SER 27 HB2 SER 27 4.734 4.862 -1.537 930 HB3 SER 27 HB3 SER 27 3.920 3.356 -1.952 931 HG SER 27 HG SER 27 5.837 3.174 -3.497 932 H LYS 28 H LYS 28 5.647 4.633 -5.504 933 HA LYS 28 HA LYS 28 6.806 7.262 -4.989 934 HB2 LYS 28 HB2 LYS 28 8.653 6.596 -6.434 935 HB3 LYS 28 HB3 LYS 28 8.412 5.510 -5.078 936 HG2 LYS 28 HG2 LYS 28 8.786 4.037 -6.751 937 HG3 LYS 28 HG3 LYS 28 7.031 4.121 -6.797 938 HD2 LYS 28 HD2 LYS 28 7.122 5.669 -8.668 939 HD3 LYS 28 HD3 LYS 28 8.886 5.709 -8.587 940 HE2 LYS 28 HE2 LYS 28 7.211 3.273 -9.183 941 HE3 LYS 28 HE3 LYS 28 8.052 4.249 -10.386 942 HZ1 LYS 28 HZ1 LYS 28 10.152 3.681 -9.259 943 HZ2 LYS 28 HZ2 LYS 28 9.355 2.320 -9.863 944 HZ3 LYS 28 HZ3 LYS 28 9.304 2.662 -8.208 945 H PHE 29 H PHE 29 4.211 6.485 -6.584 946 HA PHE 29 HA PHE 29 4.603 7.655 -9.148 947 HB2 PHE 29 HB2 PHE 29 2.164 7.130 -7.470 948 HB3 PHE 29 HB3 PHE 29 2.031 8.110 -8.923 949 HD1 PHE 29 HD1 PHE 29 4.359 6.274 -10.249 950 HD2 PHE 29 HD2 PHE 29 0.530 5.588 -8.490 951 HE1 PHE 29 HE1 PHE 29 4.096 4.247 -11.609 952 HE2 PHE 29 HE2 PHE 29 0.278 3.556 -9.850 953 HZ PHE 29 HZ PHE 29 2.058 2.884 -11.411 954 H ASP 30 H ASP 30 3.512 9.680 -9.839 955 HA ASP 30 HA ASP 30 4.299 11.875 -8.086 956 HB2 ASP 30 HB2 ASP 30 4.030 13.254 -10.141 957 HB3 ASP 30 HB3 ASP 30 5.167 11.926 -10.340 958 H THR 31 H THR 31 1.588 10.161 -8.283 959 HA THR 31 HA THR 31 -0.192 12.490 -7.926 960 HB THR 31 HB THR 31 -1.037 11.050 -9.674 961 HG1 THR 31 HG1 THR 31 -2.988 11.297 -8.887 962 HG21 THR 31 HG21 THR 31 -1.641 8.698 -9.251 963 HG22 THR 31 HG22 THR 31 -0.927 8.808 -7.642 964 HG23 THR 31 HG23 THR 31 0.093 8.966 -9.072 965 H ASN 32 H ASN 32 -1.868 12.260 -6.237 966 HA ASN 32 HA ASN 32 -0.612 11.336 -3.781 967 HB2 ASN 32 HB2 ASN 32 -1.490 13.569 -3.756 968 HB3 ASN 32 HB3 ASN 32 -3.068 13.017 -4.308 969 HD21 ASN 32 HD21 ASN 32 -0.819 12.989 -1.629 970 HD22 ASN 32 HD22 ASN 32 -1.998 12.675 -0.403 971 H ILE 33 H ILE 33 -1.046 9.450 -2.853 972 HA ILE 33 HA ILE 33 -2.988 7.646 -3.868 973 HB ILE 33 HB ILE 33 -1.401 7.485 -1.298 974 HG12 ILE 33 HG12 ILE 33 -0.876 6.275 -4.033 975 HG13 ILE 33 HG13 ILE 33 -0.001 7.631 -3.331 976 HG21 ILE 33 HG21 ILE 33 -3.357 6.023 -1.229 977 HG22 ILE 33 HG22 ILE 33 -1.881 5.072 -1.379 978 HG23 ILE 33 HG23 ILE 33 -2.912 5.326 -2.788 979 HD11 ILE 33 HD11 ILE 33 0.850 6.200 -1.575 980 HD12 ILE 33 HD12 ILE 33 1.244 5.545 -3.164 981 HD13 ILE 33 HD13 ILE 33 -0.066 4.837 -2.220 982 H ARG 34 H ARG 34 -5.102 7.880 -3.584 983 HA ARG 34 HA ARG 34 -6.141 9.128 -1.157 984 HB2 ARG 34 HB2 ARG 34 -6.933 9.828 -3.414 985 HB3 ARG 34 HB3 ARG 34 -7.616 8.227 -3.643 986 HG2 ARG 34 HG2 ARG 34 -9.214 10.066 -2.959 987 HG3 ARG 34 HG3 ARG 34 -9.274 8.582 -2.009 988 HD2 ARG 34 HD2 ARG 34 -9.326 10.835 -0.763 989 HD3 ARG 34 HD3 ARG 34 -8.251 9.574 -0.164 990 HE ARG 34 HE ARG 34 -6.874 11.288 -1.958 991 HH11 ARG 34 HH11 ARG 34 -8.198 11.251 1.209 992 HH12 ARG 34 HH12 ARG 34 -6.953 12.256 1.861 993 HH21 ARG 34 HH21 ARG 34 -5.258 12.596 -1.076 994 HH22 ARG 34 HH22 ARG 34 -5.327 12.980 0.612 995 H THR 35 H THR 35 -6.200 6.027 -2.838 996 HA THR 35 HA THR 35 -6.667 4.667 -0.331 997 HB THR 35 HB THR 35 -8.676 4.258 -2.568 998 HG1 THR 35 HG1 THR 35 -8.741 5.730 -0.193 999 HG21 THR 35 HG21 THR 35 -8.470 2.941 0.145 1000 HG22 THR 35 HG22 THR 35 -8.197 2.165 -1.416 1001 HG23 THR 35 HG23 THR 35 -9.808 2.740 -0.988 1002 H ILE 36 H ILE 36 -5.514 2.780 -0.321 1003 HA ILE 36 HA ILE 36 -5.058 1.435 -2.912 1004 HB ILE 36 HB ILE 36 -2.962 2.626 -2.179 1005 HG12 ILE 36 HG12 ILE 36 -1.461 0.660 -2.514 1006 HG13 ILE 36 HG13 ILE 36 -2.843 -0.406 -2.281 1007 HG21 ILE 36 HG21 ILE 36 -3.192 2.364 0.236 1008 HG22 ILE 36 HG22 ILE 36 -1.659 1.691 -0.326 1009 HG23 ILE 36 HG23 ILE 36 -3.000 0.616 0.074 1010 HD11 ILE 36 HD11 ILE 36 -3.899 0.537 -4.268 1011 HD12 ILE 36 HD12 ILE 36 -2.314 -0.145 -4.628 1012 HD13 ILE 36 HD13 ILE 36 -2.514 1.603 -4.496 1013 H VAL 37 H VAL 37 -5.367 -0.721 -2.922 1014 HA VAL 37 HA VAL 37 -5.540 -2.171 -0.356 1015 HB VAL 37 HB VAL 37 -7.463 -2.523 -2.678 1016 HG11 VAL 37 HG11 VAL 37 -6.982 -4.630 -1.533 1017 HG12 VAL 37 HG12 VAL 37 -8.636 -4.105 -1.222 1018 HG13 VAL 37 HG13 VAL 37 -7.395 -3.894 0.017 1019 HG21 VAL 37 HG21 VAL 37 -9.187 -1.684 -1.135 1020 HG22 VAL 37 HG22 VAL 37 -7.942 -0.473 -1.445 1021 HG23 VAL 37 HG23 VAL 37 -7.944 -1.367 0.076 1022 H LEU 38 H LEU 38 -4.591 -4.194 -0.375 1023 HA LEU 38 HA LEU 38 -4.049 -5.497 -2.942 1024 HB2 LEU 38 HB2 LEU 38 -2.027 -4.171 -2.437 1025 HB3 LEU 38 HB3 LEU 38 -1.880 -4.972 -0.887 1026 HG LEU 38 HG LEU 38 -1.818 -6.609 -3.417 1027 HD11 LEU 38 HD11 LEU 38 0.628 -6.378 -3.487 1028 HD12 LEU 38 HD12 LEU 38 0.542 -5.142 -2.229 1029 HD13 LEU 38 HD13 LEU 38 -0.188 -4.846 -3.807 1030 HD21 LEU 38 HD21 LEU 38 -1.939 -7.795 -1.280 1031 HD22 LEU 38 HD22 LEU 38 -0.505 -6.944 -0.712 1032 HD23 LEU 38 HD23 LEU 38 -0.384 -8.070 -2.064 1033 H ASN 39 H ASN 39 -4.433 -7.656 -2.843 1034 HA ASN 39 HA ASN 39 -3.849 -9.099 -0.380 1035 HB2 ASN 39 HB2 ASN 39 -6.013 -10.258 -0.317 1036 HB3 ASN 39 HB3 ASN 39 -6.210 -8.523 -0.101 1037 HD21 ASN 39 HD21 ASN 39 -7.177 -7.325 -1.735 1038 HD22 ASN 39 HD22 ASN 39 -8.113 -8.061 -2.981 1039 H ALA 40 H ALA 40 -3.043 -11.088 -0.729 1040 HA ALA 40 HA ALA 40 -2.837 -12.028 -3.516 1041 HB1 ALA 40 HB1 ALA 40 -0.956 -13.373 -2.745 1042 HB2 ALA 40 HB2 ALA 40 -1.256 -12.876 -1.079 1043 HB3 ALA 40 HB3 ALA 40 -0.739 -11.685 -2.271 1044 H LYS 41 H LYS 41 -3.940 -13.726 -4.197 1045 HA LYS 41 HA LYS 41 -4.948 -15.742 -2.319 1046 HB2 LYS 41 HB2 LYS 41 -7.218 -15.565 -3.216 1047 HB3 LYS 41 HB3 LYS 41 -6.711 -14.018 -2.540 1048 HG2 LYS 41 HG2 LYS 41 -6.165 -13.232 -4.816 1049 HG3 LYS 41 HG3 LYS 41 -6.758 -14.765 -5.463 1050 HD2 LYS 41 HD2 LYS 41 -8.989 -14.296 -4.624 1051 HD3 LYS 41 HD3 LYS 41 -8.419 -12.815 -3.850 1052 HE2 LYS 41 HE2 LYS 41 -7.854 -11.884 -6.048 1053 HE3 LYS 41 HE3 LYS 41 -8.411 -13.367 -6.821 1054 HZ1 LYS 41 HZ1 LYS 41 -10.074 -11.606 -6.894 1055 HZ2 LYS 41 HZ2 LYS 41 -10.109 -11.547 -5.204 1056 HZ3 LYS 41 HZ3 LYS 41 -10.629 -12.937 -6.011 1057 H ASP 42 H ASP 42 -5.174 -17.793 -3.218 1058 HA ASP 42 HA ASP 42 -5.110 -19.506 -4.710 1059 HB2 ASP 42 HB2 ASP 42 -6.936 -18.124 -5.749 1060 HB3 ASP 42 HB3 ASP 42 -5.725 -17.422 -6.815 1061 H GLY 43 H GLY 43 -2.692 -17.560 -4.354 1062 HA2 GLY 43 HA2 GLY 43 -0.444 -18.000 -4.977 1063 HA3 GLY 43 HA3 GLY 43 -1.019 -18.807 -6.428 1064 H ILE 44 H ILE 44 -2.794 -16.109 -6.285 1065 HA ILE 44 HA ILE 44 -0.896 -14.442 -7.835 1066 HB ILE 44 HB ILE 44 -3.878 -14.137 -8.096 1067 HG12 ILE 44 HG12 ILE 44 -2.272 -16.273 -9.527 1068 HG13 ILE 44 HG13 ILE 44 -3.516 -16.550 -8.310 1069 HG21 ILE 44 HG21 ILE 44 -1.577 -13.813 -10.028 1070 HG22 ILE 44 HG22 ILE 44 -2.496 -12.526 -9.247 1071 HG23 ILE 44 HG23 ILE 44 -3.275 -13.566 -10.435 1072 HD11 ILE 44 HD11 ILE 44 -3.929 -15.321 -11.026 1073 HD12 ILE 44 HD12 ILE 44 -5.181 -15.564 -9.809 1074 HD13 ILE 44 HD13 ILE 44 -4.376 -16.955 -10.533 1075 H PHE 45 H PHE 45 -1.746 -11.989 -7.739 1076 HA PHE 45 HA PHE 45 -3.148 -11.449 -5.211 1077 HB2 PHE 45 HB2 PHE 45 -1.679 -9.645 -4.594 1078 HB3 PHE 45 HB3 PHE 45 -0.695 -11.077 -4.862 1079 HD1 PHE 45 HD2 PHE 45 -1.686 -7.809 -6.260 1080 HD2 PHE 45 HD1 PHE 45 0.983 -11.117 -6.568 1081 HE1 PHE 45 HE2 PHE 45 -0.292 -6.533 -7.826 1082 HE2 PHE 45 HE1 PHE 45 2.384 -9.836 -8.133 1083 HZ PHE 45 HZ PHE 45 1.739 -7.544 -8.766 1084 H THR 46 H THR 46 -4.173 -9.328 -5.116 1085 HA THR 46 HA THR 46 -4.459 -7.943 -7.700 1086 HB THR 46 HB THR 46 -6.475 -9.183 -7.618 1087 HG1 THR 46 HG1 THR 46 -7.222 -6.672 -6.488 1088 HG21 THR 46 HG21 THR 46 -6.846 -8.265 -4.764 1089 HG22 THR 46 HG22 THR 46 -6.403 -9.892 -5.281 1090 HG23 THR 46 HG23 THR 46 -7.986 -9.234 -5.697 1091 H CYS 47 H CYS 47 -3.717 -5.957 -7.426 1092 HA CYS 47 HA CYS 47 -4.126 -4.584 -4.849 1093 HB2 CYS 47 HB2 CYS 47 -1.773 -4.853 -5.585 1094 HB3 CYS 47 HB3 CYS 47 -2.140 -3.936 -7.041 1095 HG CYS 47 HG CYS 47 -2.854 -2.414 -4.122 1096 H ASN 48 H ASN 48 -5.643 -3.048 -4.783 1097 HA ASN 48 HA ASN 48 -6.596 -1.845 -7.295 1098 HB2 ASN 48 HB2 ASN 48 -7.911 -2.050 -4.571 1099 HB3 ASN 48 HB3 ASN 48 -8.611 -1.210 -5.952 1100 HD21 ASN 48 HD21 ASN 48 -10.399 -2.563 -5.995 1101 HD22 ASN 48 HD22 ASN 48 -10.308 -4.196 -6.540 1102 H LEU 49 H LEU 49 -5.699 0.061 -7.734 1103 HA LEU 49 HA LEU 49 -4.860 1.843 -5.562 1104 HB2 LEU 49 HB2 LEU 49 -3.155 1.364 -7.188 1105 HB3 LEU 49 HB3 LEU 49 -4.222 1.798 -8.511 1106 HG LEU 49 HG LEU 49 -4.181 4.147 -7.807 1107 HD11 LEU 49 HD11 LEU 49 -3.919 3.877 -5.416 1108 HD12 LEU 49 HD12 LEU 49 -2.632 4.901 -6.054 1109 HD13 LEU 49 HD13 LEU 49 -2.297 3.220 -5.641 1110 HD21 LEU 49 HD21 LEU 49 -1.424 2.949 -8.096 1111 HD22 LEU 49 HD22 LEU 49 -1.847 4.640 -8.367 1112 HD23 LEU 49 HD23 LEU 49 -2.515 3.388 -9.412 1113 H MET 50 H MET 50 -5.859 3.708 -5.117 1114 HA MET 50 HA MET 50 -7.747 4.851 -7.087 1115 HB2 MET 50 HB2 MET 50 -7.998 4.919 -4.073 1116 HB3 MET 50 HB3 MET 50 -9.106 5.668 -5.213 1117 HG2 MET 50 HG2 MET 50 -8.605 2.717 -4.893 1118 HG3 MET 50 HG3 MET 50 -10.022 3.607 -4.341 1119 HE1 MET 50 HE1 MET 50 -11.458 5.142 -6.243 1120 HE2 MET 50 HE2 MET 50 -11.276 4.866 -7.975 1121 HE3 MET 50 HE3 MET 50 -9.973 5.631 -7.063 1122 H ILE 51 H ILE 51 -6.933 6.688 -7.855 1123 HA ILE 51 HA ILE 51 -5.757 8.652 -6.035 1124 HB ILE 51 HB ILE 51 -3.888 9.033 -7.789 1125 HG12 ILE 51 HG12 ILE 51 -3.152 6.725 -8.735 1126 HG13 ILE 51 HG13 ILE 51 -4.835 6.262 -8.523 1127 HG21 ILE 51 HG21 ILE 51 -3.476 8.290 -5.515 1128 HG22 ILE 51 HG22 ILE 51 -2.398 7.472 -6.644 1129 HG23 ILE 51 HG23 ILE 51 -3.793 6.619 -5.983 1130 HD11 ILE 51 HD11 ILE 51 -3.794 8.507 -10.232 1131 HD12 ILE 51 HD12 ILE 51 -5.498 8.096 -10.012 1132 HD13 ILE 51 HD13 ILE 51 -4.405 6.951 -10.790 1133 H PHE 52 H PHE 52 -5.517 10.801 -7.008 1134 HA PHE 52 HA PHE 52 -7.713 11.315 -8.867 1135 HB2 PHE 52 HB2 PHE 52 -6.157 13.011 -6.942 1136 HB3 PHE 52 HB3 PHE 52 -7.043 13.780 -8.255 1137 HD1 PHE 52 HD1 PHE 52 -7.336 11.883 -5.129 1138 HD2 PHE 52 HD2 PHE 52 -9.459 13.763 -8.322 1139 HE1 PHE 52 HE1 PHE 52 -9.419 11.749 -3.825 1140 HE2 PHE 52 HE2 PHE 52 -11.541 13.617 -7.027 1141 HZ PHE 52 HZ PHE 52 -11.522 12.616 -4.768 1142 H VAL 53 H VAL 53 -7.507 12.309 -10.849 1143 HA VAL 53 HA VAL 53 -4.813 12.978 -11.817 1144 HB VAL 53 HB VAL 53 -4.988 11.697 -13.830 1145 HG11 VAL 53 HG11 VAL 53 -5.049 9.381 -13.039 1146 HG12 VAL 53 HG12 VAL 53 -5.770 9.920 -11.523 1147 HG13 VAL 53 HG13 VAL 53 -4.130 10.422 -11.949 1148 HG21 VAL 53 HG21 VAL 53 -6.892 10.235 -14.346 1149 HG22 VAL 53 HG22 VAL 53 -7.358 11.934 -14.272 1150 HG23 VAL 53 HG23 VAL 53 -7.742 10.856 -12.930 1151 H LYS 54 H LYS 54 -4.801 14.656 -13.285 1152 HA LYS 54 HA LYS 54 -7.141 16.231 -13.573 1153 HB2 LYS 54 HB2 LYS 54 -4.895 17.182 -13.466 1154 HB3 LYS 54 HB3 LYS 54 -4.475 16.397 -14.982 1155 HG2 LYS 54 HG2 LYS 54 -6.106 17.745 -16.165 1156 HG3 LYS 54 HG3 LYS 54 -6.615 18.491 -14.652 1157 HD2 LYS 54 HD2 LYS 54 -3.826 18.668 -15.794 1158 HD3 LYS 54 HD3 LYS 54 -5.067 19.901 -15.999 1159 HE2 LYS 54 HE2 LYS 54 -3.763 20.663 -14.208 1160 HE3 LYS 54 HE3 LYS 54 -5.190 19.960 -13.453 1161 HZ1 LYS 54 HZ1 LYS 54 -2.599 18.547 -13.743 1162 HZ2 LYS 54 HZ2 LYS 54 -3.954 18.024 -12.875 1163 HZ3 LYS 54 HZ3 LYS 54 -3.084 19.370 -12.350 1164 H ASN 55 H ASN 55 -5.513 13.938 -15.692 1165 HA ASN 55 HA ASN 55 -7.742 14.149 -17.605 1166 HB2 ASN 55 HB2 ASN 55 -4.792 14.139 -18.303 1167 HB3 ASN 55 HB3 ASN 55 -6.085 13.908 -19.477 1168 HD21 ASN 55 HD21 ASN 55 -4.507 16.190 -17.363 1169 HD22 ASN 55 HD22 ASN 55 -5.190 17.603 -18.081 1170 H THR 56 H THR 56 -8.196 12.224 -18.789 1171 HA THR 56 HA THR 56 -7.766 9.790 -17.445 1172 HB THR 56 HB THR 56 -8.719 8.661 -19.402 1173 HG1 THR 56 HG1 THR 56 -8.909 11.137 -20.764 1174 HG21 THR 56 HG21 THR 56 -10.260 9.782 -17.860 1175 HG22 THR 56 HG22 THR 56 -10.867 9.844 -19.514 1176 HG23 THR 56 HG23 THR 56 -10.125 11.272 -18.796 1177 H ASP 57 H ASP 57 -5.964 11.360 -19.995 1178 HA ASP 57 HA ASP 57 -4.330 9.224 -20.837 1179 HB2 ASP 57 HB2 ASP 57 -4.485 11.367 -22.041 1180 HB3 ASP 57 HB3 ASP 57 -3.709 12.193 -20.693 1181 H LYS 58 H LYS 58 -3.988 11.590 -18.247 1182 HA LYS 58 HA LYS 58 -1.522 10.821 -17.200 1183 HB2 LYS 58 HB2 LYS 58 -2.482 12.831 -16.393 1184 HB3 LYS 58 HB3 LYS 58 -3.997 12.042 -15.982 1185 HG2 LYS 58 HG2 LYS 58 -2.730 12.621 -13.991 1186 HG3 LYS 58 HG3 LYS 58 -2.923 10.872 -14.156 1187 HD2 LYS 58 HD2 LYS 58 -0.629 10.791 -15.161 1188 HD3 LYS 58 HD3 LYS 58 -0.456 12.505 -14.787 1189 HE2 LYS 58 HE2 LYS 58 -0.715 12.041 -12.419 1190 HE3 LYS 58 HE3 LYS 58 -0.985 10.331 -12.761 1191 HZ1 LYS 58 HZ1 LYS 58 1.281 10.696 -12.086 1192 HZ2 LYS 58 HZ2 LYS 58 1.502 11.857 -13.287 1193 HZ3 LYS 58 HZ3 LYS 58 1.254 10.241 -13.713 1194 H LEU 59 H LEU 59 -4.761 9.517 -16.625 1195 HA LEU 59 HA LEU 59 -4.022 7.657 -14.607 1196 HB2 LEU 59 HB2 LEU 59 -6.318 8.361 -14.856 1197 HB3 LEU 59 HB3 LEU 59 -6.375 7.749 -16.500 1198 HG LEU 59 HG LEU 59 -6.129 5.441 -15.634 1199 HD11 LEU 59 HD11 LEU 59 -6.286 6.768 -12.929 1200 HD12 LEU 59 HD12 LEU 59 -4.921 5.867 -13.592 1201 HD13 LEU 59 HD13 LEU 59 -6.429 5.034 -13.220 1202 HD21 LEU 59 HD21 LEU 59 -8.426 7.003 -14.450 1203 HD22 LEU 59 HD22 LEU 59 -8.383 5.255 -14.686 1204 HD23 LEU 59 HD23 LEU 59 -8.347 6.333 -16.081 1205 H THR 60 H THR 60 -4.534 7.286 -18.124 1206 HA THR 60 HA THR 60 -4.028 4.511 -18.239 1207 HB THR 60 HB THR 60 -3.673 4.813 -20.651 1208 HG1 THR 60 HG1 THR 60 -2.926 6.653 -21.353 1209 HG21 THR 60 HG21 THR 60 -5.930 6.520 -19.579 1210 HG22 THR 60 HG22 THR 60 -5.976 4.774 -19.819 1211 HG23 THR 60 HG23 THR 60 -5.833 5.852 -21.207 1212 H THR 61 H THR 61 -1.881 7.302 -18.430 1213 HA THR 61 HA THR 61 0.486 5.995 -19.139 1214 HB THR 61 HB THR 61 0.124 8.430 -17.371 1215 HG1 THR 61 HG1 THR 61 -0.562 8.921 -19.417 1216 HG21 THR 61 HG21 THR 61 2.479 8.942 -17.869 1217 HG22 THR 61 HG22 THR 61 2.637 7.399 -18.709 1218 HG23 THR 61 HG23 THR 61 2.327 7.431 -16.971 1219 H LEU 62 H LEU 62 -0.984 6.454 -15.930 1220 HA LEU 62 HA LEU 62 1.073 5.285 -14.401 1221 HB2 LEU 62 HB2 LEU 62 -1.906 5.376 -13.916 1222 HB3 LEU 62 HB3 LEU 62 -0.739 4.822 -12.728 1223 HG LEU 62 HG LEU 62 -0.920 7.614 -13.883 1224 HD11 LEU 62 HD11 LEU 62 -1.553 8.246 -11.607 1225 HD12 LEU 62 HD12 LEU 62 -1.507 6.550 -11.120 1226 HD13 LEU 62 HD13 LEU 62 -2.699 7.096 -12.301 1227 HD21 LEU 62 HD21 LEU 62 0.958 6.508 -11.787 1228 HD22 LEU 62 HD22 LEU 62 0.836 8.196 -12.284 1229 HD23 LEU 62 HD23 LEU 62 1.406 6.981 -13.427 1230 H MET 63 H MET 63 -1.749 3.824 -15.990 1231 HA MET 63 HA MET 63 -1.415 1.175 -15.178 1232 HB2 MET 63 HB2 MET 63 -2.268 2.074 -17.942 1233 HB3 MET 63 HB3 MET 63 -2.645 0.539 -17.172 1234 HG2 MET 63 HG2 MET 63 -4.004 1.681 -15.515 1235 HG3 MET 63 HG3 MET 63 -3.591 3.238 -16.233 1236 HE1 MET 63 HE1 MET 63 -7.270 3.064 -17.306 1237 HE2 MET 63 HE2 MET 63 -5.971 4.052 -16.635 1238 HE3 MET 63 HE3 MET 63 -6.552 2.638 -15.753 1239 H ASP 64 H ASP 64 -0.039 2.841 -17.996 1240 HA ASP 64 HA ASP 64 1.550 0.808 -19.033 1241 HB2 ASP 64 HB2 ASP 64 1.099 3.005 -20.108 1242 HB3 ASP 64 HB3 ASP 64 2.160 3.772 -18.936 1243 H LYS 65 H LYS 65 2.363 3.240 -16.555 1244 HA LYS 65 HA LYS 65 5.019 2.495 -16.072 1245 HB2 LYS 65 HB2 LYS 65 2.972 3.657 -14.169 1246 HB3 LYS 65 HB3 LYS 65 4.700 3.592 -13.847 1247 HG2 LYS 65 HG2 LYS 65 5.078 5.005 -15.859 1248 HG3 LYS 65 HG3 LYS 65 3.330 5.124 -16.054 1249 HD2 LYS 65 HD2 LYS 65 4.104 7.112 -14.939 1250 HD3 LYS 65 HD3 LYS 65 3.201 6.141 -13.779 1251 HE2 LYS 65 HE2 LYS 65 5.183 5.410 -12.705 1252 HE3 LYS 65 HE3 LYS 65 6.203 6.016 -14.009 1253 HZ1 LYS 65 HZ1 LYS 65 4.562 7.743 -12.235 1254 HZ2 LYS 65 HZ2 LYS 65 5.686 8.254 -13.388 1255 HZ3 LYS 65 HZ3 LYS 65 6.208 7.434 -12.005 1256 H LEU 66 H LEU 66 2.021 1.195 -14.728 1257 HA LEU 66 HA LEU 66 3.310 -0.594 -12.882 1258 HB2 LEU 66 HB2 LEU 66 0.486 -0.560 -13.964 1259 HB3 LEU 66 HB3 LEU 66 1.040 -1.555 -12.628 1260 HG LEU 66 HG LEU 66 1.159 1.463 -12.584 1261 HD11 LEU 66 HD11 LEU 66 -0.853 1.381 -11.170 1262 HD12 LEU 66 HD12 LEU 66 -0.996 -0.346 -11.497 1263 HD13 LEU 66 HD13 LEU 66 -1.165 0.817 -12.812 1264 HD21 LEU 66 HD21 LEU 66 2.690 0.358 -11.049 1265 HD22 LEU 66 HD22 LEU 66 1.372 -0.624 -10.408 1266 HD23 LEU 66 HD23 LEU 66 1.374 1.121 -10.156 1267 H ARG 67 H ARG 67 2.175 -0.830 -16.188 1268 HA ARG 67 HA ARG 67 2.195 -3.655 -16.417 1269 HB2 ARG 67 HB2 ARG 67 2.306 -1.446 -18.474 1270 HB3 ARG 67 HB3 ARG 67 2.250 -3.152 -18.913 1271 HG2 ARG 67 HG2 ARG 67 0.117 -3.407 -17.788 1272 HG3 ARG 67 HG3 ARG 67 0.176 -1.729 -17.247 1273 HD2 ARG 67 HD2 ARG 67 0.118 -0.982 -19.584 1274 HD3 ARG 67 HD3 ARG 67 0.051 -2.664 -20.117 1275 HE ARG 67 HE ARG 67 -2.081 -2.636 -18.602 1276 HH11 ARG 67 HH11 ARG 67 -1.008 -0.167 -20.749 1277 HH12 ARG 67 HH12 ARG 67 -2.611 0.403 -21.066 1278 HH21 ARG 67 HH21 ARG 67 -4.133 -1.876 -19.000 1279 HH22 ARG 67 HH22 ARG 67 -4.354 -0.553 -20.097 1280 H LYS 68 H LYS 68 4.792 -1.550 -16.074 1281 HA LYS 68 HA LYS 68 6.675 -2.785 -17.832 1282 HB2 LYS 68 HB2 LYS 68 7.295 -1.237 -15.310 1283 HB3 LYS 68 HB3 LYS 68 8.363 -1.505 -16.681 1284 HG2 LYS 68 HG2 LYS 68 5.872 0.189 -16.624 1285 HG3 LYS 68 HG3 LYS 68 7.541 0.749 -16.728 1286 HD2 LYS 68 HD2 LYS 68 7.754 -0.361 -18.926 1287 HD3 LYS 68 HD3 LYS 68 6.067 -0.870 -18.816 1288 HE2 LYS 68 HE2 LYS 68 5.442 1.552 -18.616 1289 HE3 LYS 68 HE3 LYS 68 7.123 1.952 -18.960 1290 HZ1 LYS 68 HZ1 LYS 68 5.632 2.039 -20.908 1291 HZ2 LYS 68 HZ2 LYS 68 5.395 0.370 -20.777 1292 HZ3 LYS 68 HZ3 LYS 68 6.936 0.980 -21.107 1293 H VAL 69 H VAL 69 5.297 -3.835 -14.916 1294 HA VAL 69 HA VAL 69 7.623 -5.309 -13.977 1295 HB VAL 69 HB VAL 69 4.788 -5.307 -12.910 1296 HG11 VAL 69 HG11 VAL 69 5.816 -6.230 -10.862 1297 HG12 VAL 69 HG12 VAL 69 7.363 -6.337 -11.703 1298 HG13 VAL 69 HG13 VAL 69 5.994 -7.307 -12.247 1299 HG21 VAL 69 HG21 VAL 69 5.669 -3.796 -11.169 1300 HG22 VAL 69 HG22 VAL 69 5.763 -3.082 -12.779 1301 HG23 VAL 69 HG23 VAL 69 7.214 -3.736 -12.019 1302 H GLN 70 H GLN 70 8.137 -7.232 -14.752 1303 HA GLN 70 HA GLN 70 6.634 -8.697 -16.605 1304 HB2 GLN 70 HB2 GLN 70 8.322 -10.506 -16.213 1305 HB3 GLN 70 HB3 GLN 70 9.013 -8.927 -16.558 1306 HG2 GLN 70 HG2 GLN 70 9.515 -8.588 -14.217 1307 HG3 GLN 70 HG3 GLN 70 8.720 -10.104 -13.798 1308 HE21 GLN 70 HE21 GLN 70 9.747 -12.039 -14.241 1309 HE22 GLN 70 HE22 GLN 70 11.418 -12.127 -14.670 1310 H GLY 71 H GLY 71 6.518 -8.800 -13.137 1311 HA2 GLY 71 HA2 GLY 71 5.383 -11.432 -12.927 1312 HA3 GLY 71 HA3 GLY 71 5.457 -10.224 -11.657 1313 H VAL 72 H VAL 72 4.042 -8.369 -13.767 1314 HA VAL 72 HA VAL 72 1.340 -9.160 -12.912 1315 HB VAL 72 HB VAL 72 2.277 -6.537 -14.105 1316 HG11 VAL 72 HG11 VAL 72 -0.081 -6.953 -14.563 1317 HG12 VAL 72 HG12 VAL 72 0.097 -5.668 -13.369 1318 HG13 VAL 72 HG13 VAL 72 -0.374 -7.288 -12.855 1319 HG21 VAL 72 HG21 VAL 72 3.259 -6.895 -11.912 1320 HG22 VAL 72 HG22 VAL 72 1.675 -7.278 -11.237 1321 HG23 VAL 72 HG23 VAL 72 2.016 -5.648 -11.819 1322 H PHE 73 H PHE 73 -0.334 -9.544 -14.317 1323 HA PHE 73 HA PHE 73 0.263 -9.393 -17.203 1324 HB2 PHE 73 HB2 PHE 73 -1.472 -11.448 -17.205 1325 HB3 PHE 73 HB3 PHE 73 0.267 -11.652 -17.092 1326 HD1 PHE 73 HD1 PHE 73 -2.894 -11.726 -15.187 1327 HD2 PHE 73 HD2 PHE 73 1.303 -12.474 -15.110 1328 HE1 PHE 73 HE1 PHE 73 -3.151 -12.984 -13.082 1329 HE2 PHE 73 HE2 PHE 73 1.047 -13.726 -13.014 1330 HZ PHE 73 HZ PHE 73 -1.175 -13.980 -11.997 1331 H THR 74 H THR 74 -1.817 -8.336 -14.767 1332 HA THR 74 HA THR 74 -3.649 -7.326 -16.851 1333 HB THR 74 HB THR 74 -5.614 -7.716 -15.652 1334 HG1 THR 74 HG1 THR 74 -4.873 -6.996 -13.596 1335 HG21 THR 74 HG21 THR 74 -3.894 -10.116 -14.997 1336 HG22 THR 74 HG22 THR 74 -4.719 -9.832 -16.532 1337 HG23 THR 74 HG23 THR 74 -5.658 -10.088 -15.059 1338 H VAL 75 H VAL 75 -3.453 -5.189 -16.896 1339 HA VAL 75 HA VAL 75 -3.685 -3.720 -14.352 1340 HB VAL 75 HB VAL 75 -1.897 -2.810 -16.628 1341 HG11 VAL 75 HG11 VAL 75 -1.153 -1.087 -15.034 1342 HG12 VAL 75 HG12 VAL 75 -2.331 -1.673 -13.858 1343 HG13 VAL 75 HG13 VAL 75 -2.877 -0.965 -15.378 1344 HG21 VAL 75 HG21 VAL 75 -0.871 -4.728 -15.543 1345 HG22 VAL 75 HG22 VAL 75 -1.113 -3.993 -13.957 1346 HG23 VAL 75 HG23 VAL 75 -0.002 -3.254 -15.111 1347 H GLU 76 H GLU 76 -5.681 -2.871 -14.495 1348 HA GLU 76 HA GLU 76 -6.465 -1.437 -16.931 1349 HB2 GLU 76 HB2 GLU 76 -8.666 -2.591 -16.961 1350 HB3 GLU 76 HB3 GLU 76 -7.320 -3.670 -17.297 1351 HG2 GLU 76 HG2 GLU 76 -7.395 -4.448 -14.951 1352 HG3 GLU 76 HG3 GLU 76 -8.804 -3.422 -14.682 1353 H ARG 77 H ARG 77 -8.707 -0.388 -16.577 1354 HA ARG 77 HA ARG 77 -8.494 1.179 -14.150 1355 HB2 ARG 77 HB2 ARG 77 -8.859 2.252 -16.348 1356 HB3 ARG 77 HB3 ARG 77 -10.411 1.434 -16.481 1357 HG2 ARG 77 HG2 ARG 77 -11.217 2.637 -14.509 1358 HG3 ARG 77 HG3 ARG 77 -9.660 3.454 -14.371 1359 HD2 ARG 77 HD2 ARG 77 -11.235 4.924 -15.451 1360 HD3 ARG 77 HD3 ARG 77 -10.009 4.428 -16.617 1361 HE ARG 77 HE ARG 77 -12.408 2.824 -16.641 1362 HH11 ARG 77 HH11 ARG 77 -10.769 5.543 -17.972 1363 HH12 ARG 77 HH12 ARG 77 -11.800 5.635 -19.353 1364 HH21 ARG 77 HH21 ARG 77 -13.729 2.947 -18.421 1365 HH22 ARG 77 HH22 ARG 77 -13.453 4.176 -19.607 1366 H LEU 78 H LEU 78 -10.039 1.400 -12.567 1367 HA LEU 78 HA LEU 78 -12.102 -0.660 -12.378 1368 HB2 LEU 78 HB2 LEU 78 -11.088 1.390 -10.403 1369 HB3 LEU 78 HB3 LEU 78 -12.397 0.271 -10.059 1370 HG LEU 78 HG LEU 78 -9.558 -0.542 -10.733 1371 HD11 LEU 78 HD11 LEU 78 -9.370 -1.162 -8.377 1372 HD12 LEU 78 HD12 LEU 78 -10.980 -0.507 -8.068 1373 HD13 LEU 78 HD13 LEU 78 -9.669 0.565 -8.563 1374 HD21 LEU 78 HD21 LEU 78 -11.205 -2.210 -11.412 1375 HD22 LEU 78 HD22 LEU 78 -11.918 -2.182 -9.799 1376 HD23 LEU 78 HD23 LEU 78 -10.274 -2.776 -10.026 1377 H SER 79 H SER 79 -13.996 -0.220 -13.292 1378 HA SER 79 HA SER 79 -14.738 2.407 -14.120 1379 HB2 SER 79 HB2 SER 79 -16.768 1.313 -15.015 1380 HB3 SER 79 HB3 SER 79 -15.306 0.435 -15.463 1381 HG SER 79 HG SER 79 -16.540 -1.157 -14.716 1382 H ASN 80 H ASN 80 -16.672 0.140 -12.130 1383 HA ASN 80 HA ASN 80 -18.115 2.406 -11.000 1384 HB2 ASN 80 HB2 ASN 80 -19.376 0.432 -11.758 1385 HB3 ASN 80 HB3 ASN 80 -18.534 -0.564 -10.573 1386 HD21 ASN 80 HD21 ASN 80 -19.009 -0.275 -8.363 1387 HD22 ASN 80 HD22 ASN 80 -20.453 0.524 -7.851 1388 H LEU 81 H LEU 81 -17.123 3.422 -9.379 1389 HA LEU 81 HA LEU 81 -15.434 2.016 -7.494 1390 HB2 LEU 81 HB2 LEU 81 -16.271 4.922 -7.484 1391 HB3 LEU 81 HB3 LEU 81 -14.943 4.208 -6.587 1392 HG LEU 81 HG LEU 81 -15.114 4.534 -9.589 1393 HD11 LEU 81 HD11 LEU 81 -13.211 6.041 -9.290 1394 HD12 LEU 81 HD12 LEU 81 -13.300 5.818 -7.541 1395 HD13 LEU 81 HD13 LEU 81 -14.626 6.604 -8.401 1396 HD21 LEU 81 HD21 LEU 81 -14.002 2.438 -9.077 1397 HD22 LEU 81 HD22 LEU 81 -12.952 3.248 -7.913 1398 HD23 LEU 81 HD23 LEU 81 -12.822 3.627 -9.631 1399 H GLU 82 H GLU 82 -15.752 1.942 -5.226 1400 HA GLU 82 HA GLU 82 -18.574 2.061 -4.392 1401 HB2 GLU 82 HB2 GLU 82 -17.919 0.529 -2.575 1402 HB3 GLU 82 HB3 GLU 82 -17.527 -0.132 -4.156 1403 HG2 GLU 82 HG2 GLU 82 -15.184 0.503 -3.854 1404 HG3 GLU 82 HG3 GLU 82 -15.570 1.194 -2.279 1405 H HIS 83 H HIS 83 -16.666 4.367 -4.507 1406 HA HIS 83 HA HIS 83 -15.981 4.997 -1.772 1407 HB2 HIS 83 HB2 HIS 83 -15.839 6.592 -4.337 1408 HB3 HIS 83 HB3 HIS 83 -15.361 7.244 -2.775 1409 HD1 HIS 83 HD1 HIS 83 -12.927 7.128 -2.433 1410 HD2 HIS 83 HD2 HIS 83 -14.302 3.964 -4.756 1411 HE1 HIS 83 HE1 HIS 83 -10.890 5.780 -3.014 1412 HE2 HIS 83 HE2 HIS 83 -11.758 3.814 -4.321 1413 H HIS 84 H HIS 84 -18.734 5.462 -3.792 1414 HA HIS 84 HA HIS 84 -19.914 7.617 -2.339 1415 HB2 HIS 84 HB2 HIS 84 -21.985 7.038 -3.514 1416 HB3 HIS 84 HB3 HIS 84 -20.627 7.051 -4.632 1417 HD1 HIS 84 HD1 HIS 84 -23.315 4.908 -3.319 1418 HD2 HIS 84 HD2 HIS 84 -19.799 4.409 -5.483 1419 HE1 HIS 84 HE1 HIS 84 -23.458 2.610 -4.319 1420 HE2 HIS 84 HE2 HIS 84 -21.375 2.368 -5.705 1421 H HIS 85 H HIS 85 -20.716 7.561 -0.331 1422 HA HIS 85 HA HIS 85 -20.878 5.038 1.066 1423 HB2 HIS 85 HB2 HIS 85 -21.445 6.482 3.053 1424 HB3 HIS 85 HB3 HIS 85 -19.904 6.839 2.288 1425 HD1 HIS 85 HD1 HIS 85 -19.573 9.165 1.347 1426 HD2 HIS 85 HD2 HIS 85 -23.464 8.482 2.633 1427 HE1 HIS 85 HE1 HIS 85 -20.687 11.408 1.334 1428 HE2 HIS 85 HE2 HIS 85 -23.085 10.943 1.932 1429 H HIS 86 H HIS 86 -22.641 3.852 1.480 1430 HA HIS 86 HA HIS 86 -25.252 4.908 0.654 1431 HB2 HIS 86 HB2 HIS 86 -26.007 2.516 0.809 1432 HB3 HIS 86 HB3 HIS 86 -24.744 2.807 -0.377 1433 HD1 HIS 86 HD1 HIS 86 -22.464 1.690 0.021 1434 HD2 HIS 86 HD2 HIS 86 -25.254 0.908 2.997 1435 HE1 HIS 86 HE1 HIS 86 -21.482 -0.166 1.394 1436 HE2 HIS 86 HE2 HIS 86 -23.312 -0.792 2.994 1437 H HIS 87 H HIS 87 -26.134 6.045 2.259 1438 HA HIS 87 HA HIS 87 -27.186 4.821 4.571 1439 HB2 HIS 87 HB2 HIS 87 -24.856 4.852 5.348 1440 HB3 HIS 87 HB3 HIS 87 -24.756 6.581 5.043 1441 HD1 HIS 87 HD1 HIS 87 -26.367 4.091 7.379 1442 HD2 HIS 87 HD2 HIS 87 -25.709 8.187 7.084 1443 HE1 HIS 87 HE1 HIS 87 -26.985 5.038 9.622 1444 HE2 HIS 87 HE2 HIS 87 -26.670 7.522 9.389 1445 H HIS 88 H HIS 88 -28.555 6.244 5.777 1446 HA HIS 88 HA HIS 88 -28.970 8.891 4.520 1447 HB2 HIS 88 HB2 HIS 88 -30.807 7.240 4.152 1448 HB3 HIS 88 HB3 HIS 88 -31.045 7.157 5.894 1449 HD1 HIS 88 HD1 HIS 88 -31.874 9.430 7.051 1450 HD2 HIS 88 HD2 HIS 88 -32.110 9.305 2.904 1451 HE1 HIS 88 HE1 HIS 88 -33.420 11.298 6.408 1452 HE2 HIS 88 HE2 HIS 88 -33.688 11.085 3.918 Start of MODEL 13 1 H1 MET 1 H1 MET 1 12.071 -19.897 13.321 2 H2 MET 1 H2 MET 1 10.744 -19.280 12.476 3 H3 MET 1 H3 MET 1 10.755 -20.895 12.964 4 HA MET 1 HA MET 1 10.708 -20.257 15.280 5 HB2 MET 1 HB2 MET 1 10.417 -17.425 14.230 6 HB3 MET 1 HB3 MET 1 10.433 -17.924 15.918 7 HG2 MET 1 HG2 MET 1 12.721 -18.022 13.969 8 HG3 MET 1 HG3 MET 1 12.557 -16.980 15.384 9 HE1 MET 1 HE1 MET 1 15.490 -19.441 16.320 10 HE2 MET 1 HE2 MET 1 15.021 -17.749 16.157 11 HE3 MET 1 HE3 MET 1 15.119 -18.780 14.728 12 H THR 2 H THR 2 8.593 -18.784 16.213 13 HA THR 2 HA THR 2 6.311 -19.829 14.785 14 HB THR 2 HB THR 2 6.370 -17.873 17.107 15 HG1 THR 2 HG1 THR 2 6.929 -20.451 17.068 16 HG21 THR 2 HG21 THR 2 4.260 -17.730 15.874 17 HG22 THR 2 HG22 THR 2 4.012 -18.511 17.434 18 HG23 THR 2 HG23 THR 2 4.074 -19.484 15.966 19 H ASP 3 H ASP 3 6.693 -18.820 12.715 20 HA ASP 3 HA ASP 3 6.573 -15.949 12.482 21 HB2 ASP 3 HB2 ASP 3 6.210 -17.907 10.214 22 HB3 ASP 3 HB3 ASP 3 6.825 -16.261 10.144 23 H PHE 4 H PHE 4 4.724 -14.817 12.597 24 HA PHE 4 HA PHE 4 2.211 -16.167 11.865 25 HB2 PHE 4 HB2 PHE 4 1.095 -14.882 13.656 26 HB3 PHE 4 HB3 PHE 4 2.325 -15.970 14.283 27 HD1 PHE 4 HD2 PHE 4 4.477 -15.058 15.130 28 HD2 PHE 4 HD1 PHE 4 1.274 -12.513 13.923 29 HE1 PHE 4 HE2 PHE 4 5.517 -13.177 16.331 30 HE2 PHE 4 HE1 PHE 4 2.317 -10.631 15.118 31 HZ PHE 4 HZ PHE 4 4.446 -10.957 16.315 32 H LEU 5 H LEU 5 0.456 -14.705 11.291 33 HA LEU 5 HA LEU 5 1.387 -12.637 9.497 34 HB2 LEU 5 HB2 LEU 5 -0.360 -14.185 8.805 35 HB3 LEU 5 HB3 LEU 5 -1.364 -13.676 10.146 36 HG LEU 5 HG LEU 5 -1.605 -11.445 9.141 37 HD11 LEU 5 HD11 LEU 5 -0.766 -10.999 6.882 38 HD12 LEU 5 HD12 LEU 5 0.071 -12.552 6.887 39 HD13 LEU 5 HD13 LEU 5 0.553 -11.287 8.017 40 HD21 LEU 5 HD21 LEU 5 -2.219 -13.686 7.211 41 HD22 LEU 5 HD22 LEU 5 -2.964 -12.087 7.211 42 HD23 LEU 5 HD23 LEU 5 -3.227 -13.180 8.567 43 H ALA 6 H ALA 6 1.973 -10.796 10.470 44 HA ALA 6 HA ALA 6 0.510 -9.817 12.800 45 HB1 ALA 6 HB1 ALA 6 2.396 -8.289 13.077 46 HB2 ALA 6 HB2 ALA 6 3.097 -8.875 11.567 47 HB3 ALA 6 HB3 ALA 6 2.931 -9.964 12.944 48 H GLY 7 H GLY 7 -0.749 -8.042 12.811 49 HA2 GLY 7 HA2 GLY 7 -0.974 -6.488 10.309 50 HA3 GLY 7 HA3 GLY 7 -2.260 -6.690 11.487 51 H ILE 8 H ILE 8 -0.918 -4.257 10.332 52 HA ILE 8 HA ILE 8 -0.393 -2.924 12.913 53 HB ILE 8 HB ILE 8 1.003 -2.184 10.326 54 HG12 ILE 8 HG12 ILE 8 2.089 -3.753 12.691 55 HG13 ILE 8 HG13 ILE 8 1.808 -4.386 11.073 56 HG21 ILE 8 HG21 ILE 8 0.698 -0.350 11.912 57 HG22 ILE 8 HG22 ILE 8 2.400 -0.794 11.784 58 HG23 ILE 8 HG23 ILE 8 1.455 -1.310 13.184 59 HD11 ILE 8 HD11 ILE 8 3.524 -2.857 10.199 60 HD12 ILE 8 HD12 ILE 8 4.157 -3.961 11.421 61 HD13 ILE 8 HD13 ILE 8 3.820 -2.281 11.842 62 H ARG 9 H ARG 9 -1.473 -1.025 13.216 63 HA ARG 9 HA ARG 9 -3.074 0.015 10.961 64 HB2 ARG 9 HB2 ARG 9 -4.497 -0.870 12.715 65 HB3 ARG 9 HB3 ARG 9 -3.652 0.076 13.933 66 HG2 ARG 9 HG2 ARG 9 -4.489 2.142 12.945 67 HG3 ARG 9 HG3 ARG 9 -5.293 1.221 11.672 68 HD2 ARG 9 HD2 ARG 9 -6.785 0.209 13.245 69 HD3 ARG 9 HD3 ARG 9 -5.878 0.860 14.610 70 HE ARG 9 HE ARG 9 -6.657 3.073 13.259 71 HH11 ARG 9 HH11 ARG 9 -8.371 0.321 14.408 72 HH12 ARG 9 HH12 ARG 9 -9.801 1.216 14.770 73 HH21 ARG 9 HH21 ARG 9 -8.502 4.230 13.739 74 HH22 ARG 9 HH22 ARG 9 -9.883 3.403 14.369 75 H ILE 10 H ILE 10 -2.346 1.865 10.183 76 HA ILE 10 HA ILE 10 -0.917 3.756 11.957 77 HB ILE 10 HB ILE 10 -0.933 3.736 8.925 78 HG12 ILE 10 HG12 ILE 10 1.240 2.622 10.726 79 HG13 ILE 10 HG13 ILE 10 0.055 1.628 9.884 80 HG21 ILE 10 HG21 ILE 10 0.889 5.103 10.912 81 HG22 ILE 10 HG22 ILE 10 -0.353 5.879 9.930 82 HG23 ILE 10 HG23 ILE 10 1.058 5.157 9.157 83 HD11 ILE 10 HD11 ILE 10 0.885 2.497 7.738 84 HD12 ILE 10 HD12 ILE 10 2.130 1.659 8.665 85 HD13 ILE 10 HD13 ILE 10 2.109 3.421 8.610 86 H VAL 11 H VAL 11 -2.222 5.421 12.640 87 HA VAL 11 HA VAL 11 -4.068 6.550 10.630 88 HB VAL 11 HB VAL 11 -4.405 6.405 13.626 89 HG11 VAL 11 HG11 VAL 11 -4.995 8.668 12.955 90 HG12 VAL 11 HG12 VAL 11 -6.445 7.751 13.359 91 HG13 VAL 11 HG13 VAL 11 -6.026 8.037 11.671 92 HG21 VAL 11 HG21 VAL 11 -6.145 5.490 11.326 93 HG22 VAL 11 HG22 VAL 11 -6.525 5.312 13.042 94 HG23 VAL 11 HG23 VAL 11 -5.149 4.452 12.350 95 H GLY 12 H GLY 12 -3.115 8.200 9.744 96 HA2 GLY 12 HA2 GLY 12 -1.911 10.277 11.478 97 HA3 GLY 12 HA3 GLY 12 -1.160 9.790 9.964 98 H GLU 13 H GLU 13 -1.834 12.435 10.446 99 HA GLU 13 HA GLU 13 -4.447 13.025 9.411 100 HB2 GLU 13 HB2 GLU 13 -3.671 15.399 9.556 101 HB3 GLU 13 HB3 GLU 13 -3.558 14.492 11.058 102 HG2 GLU 13 HG2 GLU 13 -1.114 14.121 10.513 103 HG3 GLU 13 HG3 GLU 13 -1.320 15.302 9.216 104 H ASP 14 H ASP 14 -5.063 13.332 7.383 105 HA ASP 14 HA ASP 14 -3.312 12.815 5.199 106 HB2 ASP 14 HB2 ASP 14 -5.613 12.117 5.066 107 HB3 ASP 14 HB3 ASP 14 -6.185 13.758 5.343 108 H LYS 15 H LYS 15 -1.770 14.271 4.675 109 HA LYS 15 HA LYS 15 -2.498 16.816 3.582 110 HB2 LYS 15 HB2 LYS 15 -1.184 18.224 5.127 111 HB3 LYS 15 HB3 LYS 15 -2.550 17.459 5.928 112 HG2 LYS 15 HG2 LYS 15 -1.042 15.770 6.878 113 HG3 LYS 15 HG3 LYS 15 0.328 16.558 6.094 114 HD2 LYS 15 HD2 LYS 15 -1.489 17.840 8.145 115 HD3 LYS 15 HD3 LYS 15 0.108 17.170 8.480 116 HE2 LYS 15 HE2 LYS 15 1.107 18.802 6.935 117 HE3 LYS 15 HE3 LYS 15 -0.494 19.469 6.610 118 HZ1 LYS 15 HZ1 LYS 15 0.777 20.757 8.251 119 HZ2 LYS 15 HZ2 LYS 15 0.801 19.416 9.281 120 HZ3 LYS 15 HZ3 LYS 15 -0.668 20.152 8.889 121 H ASN 16 H ASN 16 -1.063 17.449 2.080 122 HA ASN 16 HA ASN 16 0.814 17.712 0.840 123 HB2 ASN 16 HB2 ASN 16 2.237 17.086 3.434 124 HB3 ASN 16 HB3 ASN 16 2.980 17.808 2.009 125 HD21 ASN 16 HD21 ASN 16 0.870 18.317 4.692 126 HD22 ASN 16 HD22 ASN 16 0.754 20.032 4.538 127 H GLY 17 H GLY 17 -0.237 14.810 1.409 128 HA2 GLY 17 HA2 GLY 17 0.331 12.980 -0.020 129 HA3 GLY 17 HA3 GLY 17 1.990 13.546 -0.051 130 H MET 18 H MET 18 0.418 13.398 3.017 131 HA MET 18 HA MET 18 2.215 11.666 4.237 132 HB2 MET 18 HB2 MET 18 -0.560 12.598 4.863 133 HB3 MET 18 HB3 MET 18 0.088 11.266 5.807 134 HG2 MET 18 HG2 MET 18 1.506 13.898 5.492 135 HG3 MET 18 HG3 MET 18 0.377 13.548 6.801 136 HE1 MET 18 HE1 MET 18 0.704 11.457 8.463 137 HE2 MET 18 HE2 MET 18 2.156 10.458 8.493 138 HE3 MET 18 HE3 MET 18 1.055 10.367 7.120 139 H THR 19 H THR 19 -0.984 10.857 2.889 140 HA THR 19 HA THR 19 -1.086 8.150 3.512 141 HB THR 19 HB THR 19 -2.586 7.894 1.562 142 HG1 THR 19 HG1 THR 19 -2.786 9.507 0.067 143 HG21 THR 19 HG21 THR 19 -3.024 10.478 3.073 144 HG22 THR 19 HG22 THR 19 -3.500 8.867 3.614 145 HG23 THR 19 HG23 THR 19 -4.258 9.583 2.190 146 H ASN 20 H ASN 20 0.497 9.742 0.773 147 HA ASN 20 HA ASN 20 1.119 7.302 -0.577 148 HB2 ASN 20 HB2 ASN 20 0.708 9.611 -1.601 149 HB3 ASN 20 HB3 ASN 20 2.336 10.022 -1.069 150 HD21 ASN 20 HD21 ASN 20 2.777 10.344 -3.324 151 HD22 ASN 20 HD22 ASN 20 3.098 8.985 -4.327 152 H GLN 21 H GLN 21 2.928 9.637 1.419 153 HA GLN 21 HA GLN 21 5.450 8.395 1.086 154 HB2 GLN 21 HB2 GLN 21 6.275 9.830 2.770 155 HB3 GLN 21 HB3 GLN 21 5.057 10.754 1.915 156 HG2 GLN 21 HG2 GLN 21 3.476 10.396 3.707 157 HG3 GLN 21 HG3 GLN 21 4.615 9.341 4.540 158 HE21 GLN 21 HE21 GLN 21 3.936 12.636 3.611 159 HE22 GLN 21 HE22 GLN 21 5.002 13.372 4.752 160 H ILE 22 H ILE 22 2.819 7.869 3.334 161 HA ILE 22 HA ILE 22 4.173 6.359 5.277 162 HB ILE 22 HB ILE 22 1.300 6.611 4.466 163 HG12 ILE 22 HG12 ILE 22 2.285 8.364 5.843 164 HG13 ILE 22 HG13 ILE 22 1.093 7.467 6.777 165 HG21 ILE 22 HG21 ILE 22 0.613 5.117 6.290 166 HG22 ILE 22 HG22 ILE 22 2.296 4.645 6.529 167 HG23 ILE 22 HG23 ILE 22 1.477 4.260 5.015 168 HD11 ILE 22 HD11 ILE 22 3.054 7.956 8.108 169 HD12 ILE 22 HD12 ILE 22 4.080 7.131 6.934 170 HD13 ILE 22 HD13 ILE 22 2.890 6.218 7.862 171 H THR 23 H THR 23 2.223 5.157 2.500 172 HA THR 23 HA THR 23 3.010 2.448 2.961 173 HB THR 23 HB THR 23 1.964 3.559 0.337 174 HG1 THR 23 HG1 THR 23 0.431 4.071 1.878 175 HG21 THR 23 HG21 THR 23 2.884 1.291 0.204 176 HG22 THR 23 HG22 THR 23 1.128 1.270 0.030 177 HG23 THR 23 HG23 THR 23 1.868 0.794 1.558 178 H GLY 24 H GLY 24 4.335 5.109 1.112 179 HA2 GLY 24 HA2 GLY 24 6.362 3.789 -0.304 180 HA3 GLY 24 HA3 GLY 24 6.458 5.436 0.301 181 H VAL 25 H VAL 25 6.228 4.764 3.106 182 HA VAL 25 HA VAL 25 8.912 3.928 3.692 183 HB VAL 25 HB VAL 25 6.562 4.413 5.545 184 HG11 VAL 25 HG11 VAL 25 8.229 4.495 7.361 185 HG12 VAL 25 HG12 VAL 25 9.482 3.992 6.225 186 HG13 VAL 25 HG13 VAL 25 8.154 2.899 6.614 187 HG21 VAL 25 HG21 VAL 25 7.274 6.409 4.360 188 HG22 VAL 25 HG22 VAL 25 8.950 6.117 4.819 189 HG23 VAL 25 HG23 VAL 25 7.752 6.520 6.052 190 H ILE 26 H ILE 26 5.734 2.386 3.832 191 HA ILE 26 HA ILE 26 6.472 0.003 5.132 192 HB ILE 26 HB ILE 26 4.331 0.428 3.031 193 HG12 ILE 26 HG12 ILE 26 4.174 0.421 6.065 194 HG13 ILE 26 HG13 ILE 26 4.077 1.848 5.037 195 HG21 ILE 26 HG21 ILE 26 4.685 -1.852 4.982 196 HG22 ILE 26 HG22 ILE 26 4.886 -1.937 3.232 197 HG23 ILE 26 HG23 ILE 26 3.298 -1.612 3.920 198 HD11 ILE 26 HD11 ILE 26 2.009 0.980 4.050 199 HD12 ILE 26 HD12 ILE 26 1.883 1.180 5.797 200 HD13 ILE 26 HD13 ILE 26 2.105 -0.428 5.109 201 H SER 27 H SER 27 6.680 0.919 1.706 202 HA SER 27 HA SER 27 7.480 -1.600 0.706 203 HB2 SER 27 HB2 SER 27 8.235 -0.460 -1.278 204 HB3 SER 27 HB3 SER 27 6.756 0.322 -0.727 205 HG SER 27 HG SER 27 8.039 1.973 0.171 206 H LYS 28 H LYS 28 9.213 0.709 2.591 207 HA LYS 28 HA LYS 28 11.874 -0.029 1.846 208 HB2 LYS 28 HB2 LYS 28 10.947 1.151 4.476 209 HB3 LYS 28 HB3 LYS 28 12.575 1.197 3.824 210 HG2 LYS 28 HG2 LYS 28 10.258 2.526 2.437 211 HG3 LYS 28 HG3 LYS 28 11.178 3.325 3.707 212 HD2 LYS 28 HD2 LYS 28 12.215 4.084 1.776 213 HD3 LYS 28 HD3 LYS 28 13.247 2.741 2.257 214 HE2 LYS 28 HE2 LYS 28 12.100 1.292 0.644 215 HE3 LYS 28 HE3 LYS 28 11.072 2.644 0.167 216 HZ1 LYS 28 HZ1 LYS 28 14.028 2.558 -0.104 217 HZ2 LYS 28 HZ2 LYS 28 13.021 3.819 -0.602 218 HZ3 LYS 28 HZ3 LYS 28 12.924 2.313 -1.361 219 H PHE 29 H PHE 29 9.522 -1.804 3.446 220 HA PHE 29 HA PHE 29 11.067 -2.821 5.626 221 HB2 PHE 29 HB2 PHE 29 8.404 -3.640 4.481 222 HB3 PHE 29 HB3 PHE 29 9.139 -4.455 5.856 223 HD1 PHE 29 HD2 PHE 29 10.297 -1.403 6.543 224 HD2 PHE 29 HD1 PHE 29 6.514 -3.341 6.168 225 HE1 PHE 29 HE2 PHE 29 9.300 0.253 8.053 226 HE2 PHE 29 HE1 PHE 29 5.521 -1.679 7.683 227 HZ PHE 29 HZ PHE 29 6.911 0.118 8.626 228 H ASP 30 H ASP 30 11.523 -5.039 6.042 229 HA ASP 30 HA ASP 30 12.835 -6.375 3.829 230 HB2 ASP 30 HB2 ASP 30 13.880 -6.062 6.073 231 HB3 ASP 30 HB3 ASP 30 12.654 -7.112 6.767 232 H THR 31 H THR 31 9.762 -6.478 5.165 233 HA THR 31 HA THR 31 9.394 -9.371 4.753 234 HB THR 31 HB THR 31 8.655 -8.647 6.929 235 HG1 THR 31 HG1 THR 31 6.910 -9.847 6.781 236 HG21 THR 31 HG21 THR 31 8.287 -6.276 6.490 237 HG22 THR 31 HG22 THR 31 6.843 -6.988 7.211 238 HG23 THR 31 HG23 THR 31 6.893 -6.658 5.480 239 H ASN 32 H ASN 32 7.021 -9.884 4.000 240 HA ASN 32 HA ASN 32 6.665 -8.431 1.456 241 HB2 ASN 32 HB2 ASN 32 7.284 -10.789 1.234 242 HB3 ASN 32 HB3 ASN 32 5.895 -11.259 2.208 243 HD21 ASN 32 HD21 ASN 32 6.955 -10.078 -0.869 244 HD22 ASN 32 HD22 ASN 32 5.469 -10.359 -1.704 245 H ILE 33 H ILE 33 4.916 -7.195 1.243 246 HA ILE 33 HA ILE 33 2.812 -7.063 3.154 247 HB ILE 33 HB ILE 33 2.857 -5.931 0.344 248 HG12 ILE 33 HG12 ILE 33 3.702 -4.610 2.941 249 HG13 ILE 33 HG13 ILE 33 4.805 -5.195 1.700 250 HG21 ILE 33 HG21 ILE 33 0.619 -5.962 1.306 251 HG22 ILE 33 HG22 ILE 33 1.222 -4.308 1.209 252 HG23 ILE 33 HG23 ILE 33 1.210 -5.152 2.758 253 HD11 ILE 33 HD11 ILE 33 4.511 -2.794 1.556 254 HD12 ILE 33 HD12 ILE 33 2.772 -3.001 1.362 255 HD13 ILE 33 HD13 ILE 33 3.875 -3.589 0.117 256 H ARG 34 H ARG 34 1.442 -8.822 3.343 257 HA ARG 34 HA ARG 34 0.479 -10.136 0.923 258 HB2 ARG 34 HB2 ARG 34 0.888 -10.987 3.580 259 HB3 ARG 34 HB3 ARG 34 -0.852 -11.048 3.333 260 HG2 ARG 34 HG2 ARG 34 0.216 -13.182 2.791 261 HG3 ARG 34 HG3 ARG 34 -0.552 -12.463 1.372 262 HD2 ARG 34 HD2 ARG 34 1.648 -11.600 0.650 263 HD3 ARG 34 HD3 ARG 34 2.396 -12.377 2.046 264 HE ARG 34 HE ARG 34 1.345 -13.686 -0.345 265 HH11 ARG 34 HH11 ARG 34 2.871 -13.957 2.742 266 HH12 ARG 34 HH12 ARG 34 3.336 -15.603 2.477 267 HH21 ARG 34 HH21 ARG 34 1.990 -15.761 -0.675 268 HH22 ARG 34 HH22 ARG 34 2.858 -16.605 0.564 269 H THR 35 H THR 35 -0.559 -7.724 3.135 270 HA THR 35 HA THR 35 -2.810 -7.110 1.433 271 HB THR 35 HB THR 35 -3.340 -7.734 4.358 272 HG1 THR 35 HG1 THR 35 -3.718 -9.178 2.006 273 HG21 THR 35 HG21 THR 35 -5.220 -6.764 2.200 274 HG22 THR 35 HG22 THR 35 -4.665 -5.830 3.588 275 HG23 THR 35 HG23 THR 35 -5.689 -7.243 3.834 276 H ILE 36 H ILE 36 -2.992 -4.934 1.284 277 HA ILE 36 HA ILE 36 -2.332 -3.309 3.644 278 HB ILE 36 HB ILE 36 -0.408 -3.171 2.047 279 HG12 ILE 36 HG12 ILE 36 -0.289 -0.679 1.996 280 HG13 ILE 36 HG13 ILE 36 -1.990 -0.612 2.441 281 HG21 ILE 36 HG21 ILE 36 -1.562 -3.409 -0.068 282 HG22 ILE 36 HG22 ILE 36 -0.681 -1.878 -0.040 283 HG23 ILE 36 HG23 ILE 36 -2.428 -1.896 0.205 284 HD11 ILE 36 HD11 ILE 36 -1.483 -1.700 4.558 285 HD12 ILE 36 HD12 ILE 36 -0.537 -0.227 4.347 286 HD13 ILE 36 HD13 ILE 36 0.218 -1.800 4.102 287 H VAL 37 H VAL 37 -3.796 -1.795 4.110 288 HA VAL 37 HA VAL 37 -5.762 -0.995 2.050 289 HB VAL 37 HB VAL 37 -6.331 -1.521 4.986 290 HG11 VAL 37 HG11 VAL 37 -8.677 -0.994 4.453 291 HG12 VAL 37 HG12 VAL 37 -8.201 -0.542 2.815 292 HG13 VAL 37 HG13 VAL 37 -7.623 0.395 4.193 293 HG21 VAL 37 HG21 VAL 37 -7.334 -2.959 2.518 294 HG22 VAL 37 HG22 VAL 37 -7.804 -3.306 4.181 295 HG23 VAL 37 HG23 VAL 37 -6.142 -3.576 3.662 296 H LEU 38 H LEU 38 -6.086 1.175 1.868 297 HA LEU 38 HA LEU 38 -5.421 2.916 4.125 298 HB2 LEU 38 HB2 LEU 38 -3.406 2.755 2.637 299 HB3 LEU 38 HB3 LEU 38 -4.362 3.443 1.342 300 HG LEU 38 HG LEU 38 -3.972 4.941 3.934 301 HD11 LEU 38 HD11 LEU 38 -1.740 4.371 3.113 302 HD12 LEU 38 HD12 LEU 38 -2.066 6.094 2.922 303 HD13 LEU 38 HD13 LEU 38 -2.148 5.021 1.523 304 HD21 LEU 38 HD21 LEU 38 -5.706 5.766 2.419 305 HD22 LEU 38 HD22 LEU 38 -4.537 5.837 1.101 306 HD23 LEU 38 HD23 LEU 38 -4.357 6.896 2.499 307 H ASN 39 H ASN 39 -7.067 4.201 4.476 308 HA ASN 39 HA ASN 39 -8.540 5.399 2.254 309 HB2 ASN 39 HB2 ASN 39 -10.709 4.862 3.532 310 HB3 ASN 39 HB3 ASN 39 -9.949 3.548 2.641 311 HD21 ASN 39 HD21 ASN 39 -11.769 3.418 4.897 312 HD22 ASN 39 HD22 ASN 39 -10.936 2.530 6.122 313 H ALA 40 H ALA 40 -8.823 7.505 2.583 314 HA ALA 40 HA ALA 40 -8.291 8.600 5.266 315 HB1 ALA 40 HB1 ALA 40 -6.870 9.379 3.411 316 HB2 ALA 40 HB2 ALA 40 -7.786 10.692 4.146 317 HB3 ALA 40 HB3 ALA 40 -8.297 10.022 2.597 318 H LYS 41 H LYS 41 -10.017 8.998 6.444 319 HA LYS 41 HA LYS 41 -12.172 10.644 5.327 320 HB2 LYS 41 HB2 LYS 41 -13.924 9.346 6.213 321 HB3 LYS 41 HB3 LYS 41 -12.850 8.168 5.480 322 HG2 LYS 41 HG2 LYS 41 -13.011 8.820 8.419 323 HG3 LYS 41 HG3 LYS 41 -13.715 7.408 7.634 324 HD2 LYS 41 HD2 LYS 41 -11.529 6.555 7.084 325 HD3 LYS 41 HD3 LYS 41 -10.756 8.040 7.652 326 HE2 LYS 41 HE2 LYS 41 -12.281 6.045 9.341 327 HE3 LYS 41 HE3 LYS 41 -10.534 6.286 9.322 328 HZ1 LYS 41 HZ1 LYS 41 -11.664 7.388 11.203 329 HZ2 LYS 41 HZ2 LYS 41 -12.493 8.376 10.109 330 HZ3 LYS 41 HZ3 LYS 41 -10.809 8.469 10.224 331 H ASP 42 H ASP 42 -13.362 11.842 7.064 332 HA ASP 42 HA ASP 42 -13.314 13.328 8.801 333 HB2 ASP 42 HB2 ASP 42 -11.467 11.313 10.126 334 HB3 ASP 42 HB3 ASP 42 -12.246 12.669 10.931 335 H GLY 43 H GLY 43 -11.119 13.147 6.654 336 HA2 GLY 43 HA2 GLY 43 -9.307 14.458 6.054 337 HA3 GLY 43 HA3 GLY 43 -9.401 15.246 7.621 338 H ILE 44 H ILE 44 -9.330 11.898 7.906 339 HA ILE 44 HA ILE 44 -6.404 11.827 8.345 340 HB ILE 44 HB ILE 44 -8.425 10.381 10.068 341 HG12 ILE 44 HG12 ILE 44 -7.040 13.008 10.674 342 HG13 ILE 44 HG13 ILE 44 -8.753 12.808 10.312 343 HG21 ILE 44 HG21 ILE 44 -5.499 10.993 10.495 344 HG22 ILE 44 HG22 ILE 44 -6.175 9.430 10.040 345 HG23 ILE 44 HG23 ILE 44 -6.549 10.127 11.617 346 HD11 ILE 44 HD11 ILE 44 -7.302 11.645 12.675 347 HD12 ILE 44 HD12 ILE 44 -9.018 11.446 12.317 348 HD13 ILE 44 HD13 ILE 44 -8.374 13.045 12.698 349 H PHE 45 H PHE 45 -5.457 9.670 8.114 350 HA PHE 45 HA PHE 45 -7.192 7.828 6.577 351 HB2 PHE 45 HB2 PHE 45 -5.304 7.182 5.202 352 HB3 PHE 45 HB3 PHE 45 -5.494 8.930 5.138 353 HD1 PHE 45 HD1 PHE 45 -3.404 6.166 6.322 354 HD2 PHE 45 HD2 PHE 45 -3.836 10.401 6.109 355 HE1 PHE 45 HE1 PHE 45 -1.054 6.436 6.987 356 HE2 PHE 45 HE2 PHE 45 -1.487 10.673 6.775 357 HZ PHE 45 HZ PHE 45 -0.099 8.686 7.221 358 H THR 46 H THR 46 -7.072 5.649 6.993 359 HA THR 46 HA THR 46 -5.267 4.811 9.185 360 HB THR 46 HB THR 46 -7.439 4.537 10.049 361 HG1 THR 46 HG1 THR 46 -6.946 1.963 8.937 362 HG21 THR 46 HG21 THR 46 -8.241 3.272 7.427 363 HG22 THR 46 HG22 THR 46 -8.732 4.859 8.017 364 HG23 THR 46 HG23 THR 46 -9.270 3.402 8.853 365 H CYS 47 H CYS 47 -3.539 4.021 8.080 366 HA CYS 47 HA CYS 47 -3.905 2.217 5.828 367 HB2 CYS 47 HB2 CYS 47 -2.079 3.880 5.788 368 HB3 CYS 47 HB3 CYS 47 -1.347 3.107 7.189 369 HG CYS 47 HG CYS 47 -1.887 1.250 4.398 370 H ASN 48 H ASN 48 -4.409 0.172 6.203 371 HA ASN 48 HA ASN 48 -3.502 -1.186 8.644 372 HB2 ASN 48 HB2 ASN 48 -5.571 -1.975 6.571 373 HB3 ASN 48 HB3 ASN 48 -5.185 -2.907 8.017 374 HD21 ASN 48 HD21 ASN 48 -5.979 -2.241 9.973 375 HD22 ASN 48 HD22 ASN 48 -7.119 -0.958 10.150 376 H LEU 49 H LEU 49 -1.550 -2.108 8.406 377 HA LEU 49 HA LEU 49 -0.794 -3.352 5.855 378 HB2 LEU 49 HB2 LEU 49 0.793 -1.765 6.755 379 HB3 LEU 49 HB3 LEU 49 0.818 -2.602 8.296 380 HG LEU 49 HG LEU 49 1.868 -4.560 7.201 381 HD11 LEU 49 HD11 LEU 49 2.771 -4.345 4.936 382 HD12 LEU 49 HD12 LEU 49 1.953 -2.793 4.754 383 HD13 LEU 49 HD13 LEU 49 1.010 -4.273 4.947 384 HD21 LEU 49 HD21 LEU 49 3.359 -1.972 6.760 385 HD22 LEU 49 HD22 LEU 49 4.071 -3.578 6.923 386 HD23 LEU 49 HD23 LEU 49 3.237 -2.841 8.291 387 H MET 50 H MET 50 -0.608 -5.505 5.602 388 HA MET 50 HA MET 50 -0.567 -7.218 8.009 389 HB2 MET 50 HB2 MET 50 -1.855 -7.855 5.347 390 HB3 MET 50 HB3 MET 50 -1.788 -8.928 6.736 391 HG2 MET 50 HG2 MET 50 -3.264 -6.310 6.553 392 HG3 MET 50 HG3 MET 50 -3.967 -7.926 6.583 393 HE1 MET 50 HE1 MET 50 -1.723 -9.086 8.818 394 HE2 MET 50 HE2 MET 50 -3.402 -9.618 8.729 395 HE3 MET 50 HE3 MET 50 -2.748 -9.018 10.252 396 H ILE 51 H ILE 51 1.374 -8.097 8.221 397 HA ILE 51 HA ILE 51 2.700 -9.288 5.890 398 HB ILE 51 HB ILE 51 4.922 -8.350 6.787 399 HG12 ILE 51 HG12 ILE 51 4.559 -5.989 7.779 400 HG13 ILE 51 HG13 ILE 51 2.953 -6.555 8.215 401 HG21 ILE 51 HG21 ILE 51 3.965 -7.676 4.662 402 HG22 ILE 51 HG22 ILE 51 4.695 -6.290 5.473 403 HG23 ILE 51 HG23 ILE 51 2.943 -6.490 5.475 404 HD11 ILE 51 HD11 ILE 51 4.470 -6.719 10.081 405 HD12 ILE 51 HD12 ILE 51 5.569 -7.723 9.136 406 HD13 ILE 51 HD13 ILE 51 3.966 -8.328 9.565 407 H PHE 52 H PHE 52 4.399 -10.839 6.471 408 HA PHE 52 HA PHE 52 3.747 -12.225 8.959 409 HB2 PHE 52 HB2 PHE 52 5.167 -13.017 6.440 410 HB3 PHE 52 HB3 PHE 52 5.484 -13.923 7.916 411 HD1 PHE 52 HD2 PHE 52 3.631 -15.094 9.074 412 HD2 PHE 52 HD1 PHE 52 3.112 -13.305 5.239 413 HE1 PHE 52 HE2 PHE 52 1.593 -16.424 8.736 414 HE2 PHE 52 HE1 PHE 52 1.072 -14.636 4.896 415 HZ PHE 52 HZ PHE 52 0.309 -16.199 6.638 416 H VAL 53 H VAL 53 5.144 -12.604 10.641 417 HA VAL 53 HA VAL 53 7.809 -11.336 10.511 418 HB VAL 53 HB VAL 53 7.557 -10.418 12.762 419 HG11 VAL 53 HG11 VAL 53 5.319 -9.551 10.934 420 HG12 VAL 53 HG12 VAL 53 6.980 -8.954 10.908 421 HG13 VAL 53 HG13 VAL 53 5.944 -8.627 12.301 422 HG21 VAL 53 HG21 VAL 53 5.988 -12.031 13.670 423 HG22 VAL 53 HG22 VAL 53 4.717 -11.422 12.610 424 HG23 VAL 53 HG23 VAL 53 5.374 -10.391 13.881 425 H LYS 54 H LYS 54 9.399 -12.257 11.797 426 HA LYS 54 HA LYS 54 8.946 -15.022 12.525 427 HB2 LYS 54 HB2 LYS 54 11.421 -15.040 12.876 428 HB3 LYS 54 HB3 LYS 54 10.924 -14.529 11.269 429 HG2 LYS 54 HG2 LYS 54 11.157 -12.131 12.150 430 HG3 LYS 54 HG3 LYS 54 12.024 -12.851 13.506 431 HD2 LYS 54 HD2 LYS 54 12.763 -13.098 10.583 432 HD3 LYS 54 HD3 LYS 54 13.573 -12.083 11.776 433 HE2 LYS 54 HE2 LYS 54 14.243 -14.066 13.032 434 HE3 LYS 54 HE3 LYS 54 13.391 -15.098 11.880 435 HZ1 LYS 54 HZ1 LYS 54 15.752 -13.389 11.327 436 HZ2 LYS 54 HZ2 LYS 54 14.886 -14.222 10.139 437 HZ3 LYS 54 HZ3 LYS 54 15.706 -15.077 11.343 438 H ASN 55 H ASN 55 8.956 -12.039 14.192 439 HA ASN 55 HA ASN 55 8.314 -13.335 16.655 440 HB2 ASN 55 HB2 ASN 55 10.118 -12.306 18.035 441 HB3 ASN 55 HB3 ASN 55 10.709 -13.532 16.920 442 HD21 ASN 55 HD21 ASN 55 12.129 -12.965 15.349 443 HD22 ASN 55 HD22 ASN 55 12.807 -11.381 15.193 444 H THR 56 H THR 56 7.959 -11.689 18.456 445 HA THR 56 HA THR 56 6.177 -9.699 17.488 446 HB THR 56 HB THR 56 5.945 -9.015 19.867 447 HG1 THR 56 HG1 THR 56 7.233 -9.913 21.415 448 HG21 THR 56 HG21 THR 56 4.592 -10.871 19.041 449 HG22 THR 56 HG22 THR 56 5.080 -11.174 20.709 450 HG23 THR 56 HG23 THR 56 5.899 -12.006 19.386 451 H ASP 57 H ASP 57 9.479 -9.521 18.730 452 HA ASP 57 HA ASP 57 9.629 -6.712 19.043 453 HB2 ASP 57 HB2 ASP 57 11.244 -8.276 20.058 454 HB3 ASP 57 HB3 ASP 57 11.838 -8.706 18.457 455 H LYS 58 H LYS 58 10.175 -8.858 16.330 456 HA LYS 58 HA LYS 58 11.118 -7.041 14.430 457 HB2 LYS 58 HB2 LYS 58 11.160 -9.359 13.907 458 HB3 LYS 58 HB3 LYS 58 9.443 -9.545 14.233 459 HG2 LYS 58 HG2 LYS 58 9.931 -9.634 11.842 460 HG3 LYS 58 HG3 LYS 58 8.895 -8.266 12.264 461 HD2 LYS 58 HD2 LYS 58 10.865 -6.782 12.218 462 HD3 LYS 58 HD3 LYS 58 11.881 -8.153 11.775 463 HE2 LYS 58 HE2 LYS 58 10.680 -8.401 9.677 464 HE3 LYS 58 HE3 LYS 58 9.575 -7.100 10.130 465 HZ1 LYS 58 HZ1 LYS 58 12.501 -6.820 9.714 466 HZ2 LYS 58 HZ2 LYS 58 11.449 -5.573 10.158 467 HZ3 LYS 58 HZ3 LYS 58 11.299 -6.304 8.643 468 H LEU 59 H LEU 59 7.777 -7.916 15.289 469 HA LEU 59 HA LEU 59 6.488 -6.207 13.448 470 HB2 LEU 59 HB2 LEU 59 5.317 -8.050 14.482 471 HB3 LEU 59 HB3 LEU 59 5.556 -7.363 16.077 472 HG LEU 59 HG LEU 59 4.066 -5.490 15.508 473 HD11 LEU 59 HD11 LEU 59 4.463 -5.343 13.124 474 HD12 LEU 59 HD12 LEU 59 2.742 -5.556 13.439 475 HD13 LEU 59 HD13 LEU 59 3.710 -6.919 12.873 476 HD21 LEU 59 HD21 LEU 59 2.842 -8.199 14.964 477 HD22 LEU 59 HD22 LEU 59 1.969 -6.745 15.452 478 HD23 LEU 59 HD23 LEU 59 3.127 -7.487 16.554 479 H THR 60 H THR 60 7.275 -5.733 16.904 480 HA THR 60 HA THR 60 6.130 -3.174 17.167 481 HB THR 60 HB THR 60 7.580 -2.892 19.159 482 HG1 THR 60 HG1 THR 60 9.430 -3.908 19.077 483 HG21 THR 60 HG21 THR 60 6.734 -4.825 20.426 484 HG22 THR 60 HG22 THR 60 6.327 -5.636 18.912 485 HG23 THR 60 HG23 THR 60 5.492 -4.151 19.368 486 H THR 61 H THR 61 9.351 -4.172 16.086 487 HA THR 61 HA THR 61 10.523 -1.605 15.984 488 HB THR 61 HB THR 61 11.121 -4.054 14.302 489 HG1 THR 61 HG1 THR 61 11.726 -4.496 16.363 490 HG21 THR 61 HG21 THR 61 11.902 -2.062 13.124 491 HG22 THR 61 HG22 THR 61 13.274 -2.948 13.786 492 HG23 THR 61 HG23 THR 61 12.700 -1.486 14.588 493 H LEU 62 H LEU 62 8.704 -3.438 13.512 494 HA LEU 62 HA LEU 62 8.896 -1.574 11.430 495 HB2 LEU 62 HB2 LEU 62 6.631 -3.459 12.106 496 HB3 LEU 62 HB3 LEU 62 6.745 -2.558 10.606 497 HG LEU 62 HG LEU 62 8.633 -4.722 11.549 498 HD11 LEU 62 HD11 LEU 62 6.715 -4.610 9.222 499 HD12 LEU 62 HD12 LEU 62 6.482 -5.528 10.711 500 HD13 LEU 62 HD13 LEU 62 7.800 -5.946 9.615 501 HD21 LEU 62 HD21 LEU 62 9.904 -3.017 10.390 502 HD22 LEU 62 HD22 LEU 62 8.737 -3.003 9.067 503 HD23 LEU 62 HD23 LEU 62 9.729 -4.433 9.354 504 H MET 63 H MET 63 6.460 -1.827 14.015 505 HA MET 63 HA MET 63 4.884 0.358 13.197 506 HB2 MET 63 HB2 MET 63 5.273 -0.821 15.960 507 HB3 MET 63 HB3 MET 63 4.025 0.350 15.543 508 HG2 MET 63 HG2 MET 63 3.264 -1.310 13.781 509 HG3 MET 63 HG3 MET 63 4.318 -2.477 14.571 510 HE1 MET 63 HE1 MET 63 3.931 -3.438 16.979 511 HE2 MET 63 HE2 MET 63 2.687 -2.851 18.085 512 HE3 MET 63 HE3 MET 63 4.030 -1.801 17.633 513 H ASP 64 H ASP 64 7.803 0.226 15.194 514 HA ASP 64 HA ASP 64 7.776 2.970 15.954 515 HB2 ASP 64 HB2 ASP 64 9.130 1.288 17.128 516 HB3 ASP 64 HB3 ASP 64 10.108 1.050 15.685 517 H LYS 65 H LYS 65 9.351 1.212 13.296 518 HA LYS 65 HA LYS 65 10.623 3.293 11.967 519 HB2 LYS 65 HB2 LYS 65 9.245 0.829 10.882 520 HB3 LYS 65 HB3 LYS 65 10.227 1.889 9.884 521 HG2 LYS 65 HG2 LYS 65 12.182 1.397 11.267 522 HG3 LYS 65 HG3 LYS 65 11.193 0.361 12.301 523 HD2 LYS 65 HD2 LYS 65 12.426 -1.017 10.737 524 HD3 LYS 65 HD3 LYS 65 10.710 -1.078 10.338 525 HE2 LYS 65 HE2 LYS 65 12.004 -0.872 8.306 526 HE3 LYS 65 HE3 LYS 65 11.097 0.616 8.574 527 HZ1 LYS 65 HZ1 LYS 65 13.964 0.220 9.247 528 HZ2 LYS 65 HZ2 LYS 65 13.088 1.660 9.408 529 HZ3 LYS 65 HZ3 LYS 65 13.388 1.025 7.875 530 H LEU 66 H LEU 66 7.249 2.252 11.752 531 HA LEU 66 HA LEU 66 6.470 4.192 9.795 532 HB2 LEU 66 HB2 LEU 66 4.830 2.545 11.732 533 HB3 LEU 66 HB3 LEU 66 4.167 3.483 10.405 534 HG LEU 66 HG LEU 66 6.146 1.239 9.993 535 HD11 LEU 66 HD11 LEU 66 3.133 1.112 9.892 536 HD12 LEU 66 HD12 LEU 66 4.185 0.287 11.040 537 HD13 LEU 66 HD13 LEU 66 4.228 -0.153 9.332 538 HD21 LEU 66 HD21 LEU 66 4.274 2.681 8.111 539 HD22 LEU 66 HD22 LEU 66 5.297 1.307 7.685 540 HD23 LEU 66 HD23 LEU 66 6.032 2.835 8.168 541 H ARG 67 H ARG 67 6.533 4.099 13.295 542 HA ARG 67 HA ARG 67 4.904 6.395 13.732 543 HB2 ARG 67 HB2 ARG 67 5.277 4.562 15.392 544 HB3 ARG 67 HB3 ARG 67 6.921 5.146 15.613 545 HG2 ARG 67 HG2 ARG 67 6.113 7.229 16.518 546 HG3 ARG 67 HG3 ARG 67 4.445 6.788 16.146 547 HD2 ARG 67 HD2 ARG 67 6.236 5.272 18.051 548 HD3 ARG 67 HD3 ARG 67 5.058 6.485 18.543 549 HE ARG 67 HE ARG 67 3.321 5.000 17.658 550 HH11 ARG 67 HH11 ARG 67 6.415 3.619 18.285 551 HH12 ARG 67 HH12 ARG 67 5.786 2.019 18.464 552 HH21 ARG 67 HH21 ARG 67 2.523 2.954 17.914 553 HH22 ARG 67 HH22 ARG 67 3.599 1.654 18.289 554 H LYS 68 H LYS 68 8.013 6.167 12.480 555 HA LYS 68 HA LYS 68 9.238 8.452 13.676 556 HB2 LYS 68 HB2 LYS 68 9.805 7.323 10.926 557 HB3 LYS 68 HB3 LYS 68 10.871 8.329 11.892 558 HG2 LYS 68 HG2 LYS 68 10.056 5.487 12.462 559 HG3 LYS 68 HG3 LYS 68 11.636 6.053 11.926 560 HD2 LYS 68 HD2 LYS 68 11.857 7.328 14.042 561 HD3 LYS 68 HD3 LYS 68 10.315 6.654 14.579 562 HE2 LYS 68 HE2 LYS 68 11.316 4.368 14.261 563 HE3 LYS 68 HE3 LYS 68 12.868 5.158 13.986 564 HZ1 LYS 68 HZ1 LYS 68 12.694 6.138 16.202 565 HZ2 LYS 68 HZ2 LYS 68 12.664 4.446 16.264 566 HZ3 LYS 68 HZ3 LYS 68 11.232 5.323 16.456 567 H VAL 69 H VAL 69 6.726 8.142 11.386 568 HA VAL 69 HA VAL 69 7.263 10.561 9.917 569 HB VAL 69 HB VAL 69 4.780 8.830 9.999 570 HG11 VAL 69 HG11 VAL 69 4.132 9.996 7.927 571 HG12 VAL 69 HG12 VAL 69 5.520 11.069 8.105 572 HG13 VAL 69 HG13 VAL 69 4.222 11.102 9.299 573 HG21 VAL 69 HG21 VAL 69 5.582 8.002 7.818 574 HG22 VAL 69 HG22 VAL 69 6.716 7.642 9.120 575 HG23 VAL 69 HG23 VAL 69 7.048 8.966 8.001 576 H GLN 70 H GLN 70 6.898 12.524 10.651 577 HA GLN 70 HA GLN 70 5.797 13.141 13.132 578 HB2 GLN 70 HB2 GLN 70 5.928 15.491 12.404 579 HB3 GLN 70 HB3 GLN 70 7.384 14.590 12.003 580 HG2 GLN 70 HG2 GLN 70 6.515 14.329 9.684 581 HG3 GLN 70 HG3 GLN 70 5.168 15.378 10.118 582 HE21 GLN 70 HE21 GLN 70 5.739 16.949 8.625 583 HE22 GLN 70 HE22 GLN 70 7.128 17.955 8.823 584 H GLY 71 H GLY 71 4.164 12.822 10.050 585 HA2 GLY 71 HA2 GLY 71 1.817 14.302 10.845 586 HA3 GLY 71 HA3 GLY 71 1.991 13.332 9.396 587 H VAL 72 H VAL 72 2.907 11.142 11.539 588 HA VAL 72 HA VAL 72 0.191 10.092 11.863 589 HB VAL 72 HB VAL 72 2.828 8.716 12.437 590 HG11 VAL 72 HG11 VAL 72 1.483 6.651 12.448 591 HG12 VAL 72 HG12 VAL 72 0.015 7.608 12.242 592 HG13 VAL 72 HG13 VAL 72 0.970 7.765 13.717 593 HG21 VAL 72 HG21 VAL 72 2.413 7.505 10.327 594 HG22 VAL 72 HG22 VAL 72 2.638 9.235 10.074 595 HG23 VAL 72 HG23 VAL 72 1.017 8.540 10.022 596 H PHE 73 H PHE 73 -0.734 9.585 13.821 597 HA PHE 73 HA PHE 73 0.761 10.323 16.249 598 HB2 PHE 73 HB2 PHE 73 -1.600 11.054 17.117 599 HB3 PHE 73 HB3 PHE 73 -0.642 12.139 16.123 600 HD1 PHE 73 HD2 PHE 73 -1.274 12.657 13.854 601 HD2 PHE 73 HD1 PHE 73 -3.628 10.022 16.231 602 HE1 PHE 73 HE2 PHE 73 -3.122 12.865 12.247 603 HE2 PHE 73 HE1 PHE 73 -5.479 10.224 14.624 604 HZ PHE 73 HZ PHE 73 -5.225 11.648 12.631 605 H THR 74 H THR 74 -1.006 7.913 14.655 606 HA THR 74 HA THR 74 -0.882 6.315 17.122 607 HB THR 74 HB THR 74 -2.989 5.400 17.016 608 HG1 THR 74 HG1 THR 74 -4.282 5.556 15.014 609 HG21 THR 74 HG21 THR 74 -4.668 7.131 16.624 610 HG22 THR 74 HG22 THR 74 -3.476 8.095 15.749 611 HG23 THR 74 HG23 THR 74 -3.271 7.793 17.476 612 H VAL 75 H VAL 75 0.296 4.556 16.811 613 HA VAL 75 HA VAL 75 -0.006 3.056 14.296 614 HB VAL 75 HB VAL 75 2.662 3.333 15.708 615 HG11 VAL 75 HG11 VAL 75 2.372 1.261 14.456 616 HG12 VAL 75 HG12 VAL 75 3.560 2.301 13.671 617 HG13 VAL 75 HG13 VAL 75 1.928 2.175 13.015 618 HG21 VAL 75 HG21 VAL 75 2.069 5.508 14.769 619 HG22 VAL 75 HG22 VAL 75 1.745 4.761 13.204 620 HG23 VAL 75 HG23 VAL 75 3.386 4.772 13.851 621 H GLU 76 H GLU 76 -1.086 1.281 15.008 622 HA GLU 76 HA GLU 76 -0.301 0.127 17.616 623 HB2 GLU 76 HB2 GLU 76 -3.109 0.406 16.525 624 HB3 GLU 76 HB3 GLU 76 -2.674 -0.351 18.050 625 HG2 GLU 76 HG2 GLU 76 -2.327 2.558 17.331 626 HG3 GLU 76 HG3 GLU 76 -3.537 1.883 18.421 627 H ARG 77 H ARG 77 -0.695 -2.101 17.937 628 HA ARG 77 HA ARG 77 -0.288 -3.701 15.565 629 HB2 ARG 77 HB2 ARG 77 1.034 -4.251 17.473 630 HB3 ARG 77 HB3 ARG 77 -0.378 -4.328 18.516 631 HG2 ARG 77 HG2 ARG 77 -1.153 -6.325 17.293 632 HG3 ARG 77 HG3 ARG 77 0.308 -6.266 16.304 633 HD2 ARG 77 HD2 ARG 77 0.422 -7.879 18.213 634 HD3 ARG 77 HD3 ARG 77 1.700 -6.661 18.208 635 HE ARG 77 HE ARG 77 0.782 -5.696 20.096 636 HH11 ARG 77 HH11 ARG 77 -1.204 -8.331 19.056 637 HH12 ARG 77 HH12 ARG 77 -2.226 -8.238 20.448 638 HH21 ARG 77 HH21 ARG 77 -0.529 -5.629 21.878 639 HH22 ARG 77 HH22 ARG 77 -1.840 -6.746 22.025 640 H LEU 78 H LEU 78 -1.769 -4.901 14.525 641 HA LEU 78 HA LEU 78 -4.501 -5.049 15.562 642 HB2 LEU 78 HB2 LEU 78 -3.373 -5.763 12.850 643 HB3 LEU 78 HB3 LEU 78 -5.067 -5.873 13.289 644 HG LEU 78 HG LEU 78 -3.451 -3.316 13.195 645 HD11 LEU 78 HD11 LEU 78 -5.597 -4.335 11.324 646 HD12 LEU 78 HD12 LEU 78 -3.870 -4.264 10.970 647 HD13 LEU 78 HD13 LEU 78 -4.777 -2.775 11.228 648 HD21 LEU 78 HD21 LEU 78 -6.396 -3.781 13.703 649 HD22 LEU 78 HD22 LEU 78 -5.621 -2.206 13.518 650 HD23 LEU 78 HD23 LEU 78 -5.208 -3.236 14.888 651 H SER 79 H SER 79 -4.731 -6.714 16.962 652 HA SER 79 HA SER 79 -3.556 -9.327 16.384 653 HB2 SER 79 HB2 SER 79 -4.465 -9.997 18.563 654 HB3 SER 79 HB3 SER 79 -3.555 -8.494 18.713 655 HG SER 79 HG SER 79 -6.324 -8.932 18.853 656 H ASN 80 H ASN 80 -6.729 -7.792 16.564 657 HA ASN 80 HA ASN 80 -8.182 -10.188 15.909 658 HB2 ASN 80 HB2 ASN 80 -10.118 -8.583 15.623 659 HB3 ASN 80 HB3 ASN 80 -9.349 -8.554 17.205 660 HD21 ASN 80 HD21 ASN 80 -8.092 -6.758 17.782 661 HD22 ASN 80 HD22 ASN 80 -8.222 -5.255 16.945 662 H LEU 81 H LEU 81 -7.703 -11.080 13.967 663 HA LEU 81 HA LEU 81 -7.581 -9.319 11.605 664 HB2 LEU 81 HB2 LEU 81 -6.554 -12.144 11.921 665 HB3 LEU 81 HB3 LEU 81 -6.355 -11.126 10.506 666 HG LEU 81 HG LEU 81 -5.095 -10.746 13.226 667 HD11 LEU 81 HD11 LEU 81 -3.897 -11.233 10.493 668 HD12 LEU 81 HD12 LEU 81 -4.019 -12.412 11.802 669 HD13 LEU 81 HD13 LEU 81 -2.996 -10.988 11.992 670 HD21 LEU 81 HD21 LEU 81 -4.008 -8.750 12.289 671 HD22 LEU 81 HD22 LEU 81 -5.757 -8.563 12.390 672 HD23 LEU 81 HD23 LEU 81 -4.995 -8.901 10.836 673 H GLU 82 H GLU 82 -8.517 -10.028 9.620 674 HA GLU 82 HA GLU 82 -10.913 -11.733 9.960 675 HB2 GLU 82 HB2 GLU 82 -12.036 -10.214 8.358 676 HB3 GLU 82 HB3 GLU 82 -11.510 -9.374 9.812 677 HG2 GLU 82 HG2 GLU 82 -9.476 -8.632 8.547 678 HG3 GLU 82 HG3 GLU 82 -10.206 -9.310 7.094 679 H HIS 83 H HIS 83 -8.274 -12.593 8.956 680 HA HIS 83 HA HIS 83 -8.471 -12.670 6.062 681 HB2 HIS 83 HB2 HIS 83 -6.469 -13.879 7.979 682 HB3 HIS 83 HB3 HIS 83 -6.362 -14.041 6.229 683 HD1 HIS 83 HD1 HIS 83 -4.932 -12.349 5.156 684 HD2 HIS 83 HD2 HIS 83 -6.555 -10.948 8.716 685 HE1 HIS 83 HE1 HIS 83 -3.976 -10.050 5.476 686 HE2 HIS 83 HE2 HIS 83 -5.151 -9.148 7.507 687 H HIS 84 H HIS 84 -10.549 -13.799 6.002 688 HA HIS 84 HA HIS 84 -10.297 -16.707 6.432 689 HB2 HIS 84 HB2 HIS 84 -12.757 -16.791 6.339 690 HB3 HIS 84 HB3 HIS 84 -12.190 -15.707 7.603 691 HD1 HIS 84 HD1 HIS 84 -14.310 -15.833 4.613 692 HD2 HIS 84 HD2 HIS 84 -12.536 -12.900 6.954 693 HE1 HIS 84 HE1 HIS 84 -15.473 -13.700 4.008 694 HE2 HIS 84 HE2 HIS 84 -14.517 -11.981 5.571 695 H HIS 85 H HIS 85 -9.795 -17.860 4.690 696 HA HIS 85 HA HIS 85 -10.931 -17.072 2.076 697 HB2 HIS 85 HB2 HIS 85 -8.159 -18.119 2.674 698 HB3 HIS 85 HB3 HIS 85 -8.850 -18.119 1.054 699 HD1 HIS 85 HD1 HIS 85 -6.600 -16.227 2.935 700 HD2 HIS 85 HD2 HIS 85 -9.841 -15.220 0.533 701 HE1 HIS 85 HE1 HIS 85 -6.221 -13.841 2.253 702 HE2 HIS 85 HE2 HIS 85 -8.101 -13.315 0.667 703 H HIS 86 H HIS 86 -9.466 -19.853 3.807 704 HA HIS 86 HA HIS 86 -9.864 -22.096 3.729 705 HB2 HIS 86 HB2 HIS 86 -12.652 -21.174 2.975 706 HB3 HIS 86 HB3 HIS 86 -12.235 -22.817 3.443 707 HD1 HIS 86 HD1 HIS 86 -12.082 -23.317 5.919 708 HD2 HIS 86 HD2 HIS 86 -12.532 -19.267 5.112 709 HE1 HIS 86 HE1 HIS 86 -12.548 -22.238 8.134 710 HE2 HIS 86 HE2 HIS 86 -13.061 -19.843 7.575 711 H HIS 87 H HIS 87 -8.958 -20.702 1.281 712 HA HIS 87 HA HIS 87 -10.414 -21.770 -0.954 713 HB2 HIS 87 HB2 HIS 87 -9.228 -19.525 -0.895 714 HB3 HIS 87 HB3 HIS 87 -7.713 -20.412 -1.037 715 HD1 HIS 87 HD1 HIS 87 -10.871 -19.669 -2.938 716 HD2 HIS 87 HD2 HIS 87 -7.084 -21.238 -3.610 717 HE1 HIS 87 HE1 HIS 87 -10.667 -19.884 -5.429 718 HE2 HIS 87 HE2 HIS 87 -8.307 -20.649 -5.814 719 H HIS 88 H HIS 88 -10.206 -24.041 -0.443 720 HA HIS 88 HA HIS 88 -7.916 -25.166 -1.866 721 HB2 HIS 88 HB2 HIS 88 -8.709 -26.007 0.931 722 HB3 HIS 88 HB3 HIS 88 -7.738 -27.023 -0.129 723 HD1 HIS 88 HD1 HIS 88 -7.283 -24.787 2.552 724 HD2 HIS 88 HD2 HIS 88 -5.360 -25.318 -1.095 725 HE1 HIS 88 HE1 HIS 88 -5.035 -23.705 2.811 726 HE2 HIS 88 HE2 HIS 88 -3.943 -23.927 0.561 727 H1 MET 1 H1 MET 1 -12.106 22.224 -17.882 728 H2 MET 1 H2 MET 1 -10.674 22.594 -18.700 729 H3 MET 1 H3 MET 1 -10.887 23.099 -17.101 730 HA MET 1 HA MET 1 -10.706 20.286 -18.010 731 HB2 MET 1 HB2 MET 1 -8.714 22.029 -16.535 732 HB3 MET 1 HB3 MET 1 -8.540 20.293 -16.756 733 HG2 MET 1 HG2 MET 1 -8.481 20.617 -19.189 734 HG3 MET 1 HG3 MET 1 -8.623 22.359 -18.951 735 HE1 MET 1 HE1 MET 1 -6.431 22.739 -20.432 736 HE2 MET 1 HE2 MET 1 -6.314 20.995 -20.670 737 HE3 MET 1 HE3 MET 1 -4.903 21.907 -20.133 738 H THR 2 H THR 2 -10.661 18.726 -16.275 739 HA THR 2 HA THR 2 -11.497 19.605 -13.629 740 HB THR 2 HB THR 2 -13.652 19.537 -14.681 741 HG1 THR 2 HG1 THR 2 -13.948 17.075 -13.527 742 HG21 THR 2 HG21 THR 2 -13.105 18.171 -16.638 743 HG22 THR 2 HG22 THR 2 -14.522 17.529 -15.807 744 HG23 THR 2 HG23 THR 2 -12.955 16.743 -15.613 745 H ASP 3 H ASP 3 -10.751 18.289 -12.079 746 HA ASP 3 HA ASP 3 -9.286 15.907 -12.779 747 HB2 ASP 3 HB2 ASP 3 -8.705 15.841 -10.390 748 HB3 ASP 3 HB3 ASP 3 -8.440 17.446 -11.066 749 H PHE 4 H PHE 4 -9.631 13.806 -11.761 750 HA PHE 4 HA PHE 4 -12.207 13.299 -10.531 751 HB2 PHE 4 HB2 PHE 4 -12.884 11.556 -12.100 752 HB3 PHE 4 HB3 PHE 4 -12.746 13.104 -12.917 753 HD1 PHE 4 HD1 PHE 4 -11.319 9.746 -12.561 754 HD2 PHE 4 HD2 PHE 4 -11.053 13.467 -14.626 755 HE1 PHE 4 HE1 PHE 4 -9.856 8.708 -14.245 756 HE2 PHE 4 HE2 PHE 4 -9.589 12.431 -16.308 757 HZ PHE 4 HZ PHE 4 -8.977 10.048 -16.111 758 H LEU 5 H LEU 5 -12.373 11.224 -9.538 759 HA LEU 5 HA LEU 5 -9.844 10.254 -8.545 760 HB2 LEU 5 HB2 LEU 5 -11.782 10.512 -7.069 761 HB3 LEU 5 HB3 LEU 5 -12.676 9.346 -8.022 762 HG LEU 5 HG LEU 5 -11.114 7.571 -7.335 763 HD11 LEU 5 HD11 LEU 5 -9.469 8.014 -5.552 764 HD12 LEU 5 HD12 LEU 5 -9.820 9.740 -5.678 765 HD13 LEU 5 HD13 LEU 5 -9.095 8.883 -7.041 766 HD21 LEU 5 HD21 LEU 5 -13.128 7.967 -6.014 767 HD22 LEU 5 HD22 LEU 5 -12.259 9.139 -5.021 768 HD23 LEU 5 HD23 LEU 5 -11.795 7.438 -4.990 769 H ALA 6 H ALA 6 -8.695 9.040 -9.902 770 HA ALA 6 HA ALA 6 -10.009 7.126 -11.686 771 HB1 ALA 6 HB1 ALA 6 -8.406 8.738 -12.624 772 HB2 ALA 6 HB2 ALA 6 -7.898 7.068 -12.872 773 HB3 ALA 6 HB3 ALA 6 -7.135 8.044 -11.617 774 H GLY 7 H GLY 7 -9.871 4.961 -11.450 775 HA2 GLY 7 HA2 GLY 7 -8.122 3.904 -9.313 776 HA3 GLY 7 HA3 GLY 7 -9.628 3.169 -9.834 777 H ILE 8 H ILE 8 -6.921 2.030 -9.619 778 HA ILE 8 HA ILE 8 -6.788 0.886 -12.340 779 HB ILE 8 HB ILE 8 -4.328 1.498 -10.667 780 HG12 ILE 8 HG12 ILE 8 -5.285 2.886 -13.193 781 HG13 ILE 8 HG13 ILE 8 -5.332 3.579 -11.576 782 HG21 ILE 8 HG21 ILE 8 -4.614 0.447 -13.489 783 HG22 ILE 8 HG22 ILE 8 -4.095 -0.481 -12.079 784 HG23 ILE 8 HG23 ILE 8 -3.091 0.834 -12.688 785 HD11 ILE 8 HD11 ILE 8 -3.457 4.444 -12.841 786 HD12 ILE 8 HD12 ILE 8 -2.850 2.809 -13.101 787 HD13 ILE 8 HD13 ILE 8 -2.888 3.488 -11.473 788 H ARG 9 H ARG 9 -6.931 -1.329 -12.275 789 HA ARG 9 HA ARG 9 -6.435 -2.653 -9.693 790 HB2 ARG 9 HB2 ARG 9 -8.632 -3.078 -10.776 791 HB3 ARG 9 HB3 ARG 9 -7.791 -3.815 -12.139 792 HG2 ARG 9 HG2 ARG 9 -6.855 -5.519 -10.647 793 HG3 ARG 9 HG3 ARG 9 -7.679 -4.776 -9.279 794 HD2 ARG 9 HD2 ARG 9 -9.848 -5.257 -10.377 795 HD3 ARG 9 HD3 ARG 9 -8.979 -6.079 -11.677 796 HE ARG 9 HE ARG 9 -8.400 -7.052 -9.020 797 HH11 ARG 9 HH11 ARG 9 -10.390 -7.437 -11.818 798 HH12 ARG 9 HH12 ARG 9 -10.809 -9.067 -11.411 799 HH21 ARG 9 HH21 ARG 9 -8.930 -9.126 -8.542 800 HH22 ARG 9 HH22 ARG 9 -9.973 -10.024 -9.588 801 H ILE 10 H ILE 10 -4.903 -4.160 -9.404 802 HA ILE 10 HA ILE 10 -3.174 -4.894 -11.692 803 HB ILE 10 HB ILE 10 -2.293 -4.354 -8.839 804 HG12 ILE 10 HG12 ILE 10 -1.794 -2.677 -11.317 805 HG13 ILE 10 HG13 ILE 10 -2.959 -2.285 -10.057 806 HG21 ILE 10 HG21 ILE 10 -0.672 -4.959 -11.313 807 HG22 ILE 10 HG22 ILE 10 -0.916 -6.030 -9.934 808 HG23 ILE 10 HG23 ILE 10 -0.011 -4.530 -9.736 809 HD11 ILE 10 HD11 ILE 10 0.025 -2.493 -9.702 810 HD12 ILE 10 HD12 ILE 10 -1.141 -2.118 -8.432 811 HD13 ILE 10 HD13 ILE 10 -0.921 -1.007 -9.784 812 H VAL 11 H VAL 11 -3.370 -7.089 -12.016 813 HA VAL 11 HA VAL 11 -3.334 -8.790 -9.595 814 HB VAL 11 HB VAL 11 -4.674 -9.329 -12.251 815 HG11 VAL 11 HG11 VAL 11 -5.192 -11.589 -11.420 816 HG12 VAL 11 HG12 VAL 11 -4.137 -11.309 -10.036 817 HG13 VAL 11 HG13 VAL 11 -3.461 -11.355 -11.663 818 HG21 VAL 11 HG21 VAL 11 -6.657 -9.677 -10.858 819 HG22 VAL 11 HG22 VAL 11 -5.965 -8.081 -10.568 820 HG23 VAL 11 HG23 VAL 11 -5.701 -9.381 -9.403 821 H GLY 12 H GLY 12 -1.436 -9.627 -9.248 822 HA2 GLY 12 HA2 GLY 12 0.152 -10.676 -11.509 823 HA3 GLY 12 HA3 GLY 12 0.902 -9.592 -10.346 824 H GLU 13 H GLU 13 1.990 -12.076 -10.745 825 HA GLU 13 HA GLU 13 0.886 -14.094 -9.078 826 HB2 GLU 13 HB2 GLU 13 3.002 -15.289 -9.460 827 HB3 GLU 13 HB3 GLU 13 2.325 -14.647 -10.954 828 HG2 GLU 13 HG2 GLU 13 3.915 -12.730 -10.766 829 HG3 GLU 13 HG3 GLU 13 4.650 -13.536 -9.381 830 H ASP 14 H ASP 14 1.019 -14.417 -6.953 831 HA ASP 14 HA ASP 14 2.251 -12.519 -5.229 832 HB2 ASP 14 HB2 ASP 14 0.208 -13.617 -4.547 833 HB3 ASP 14 HB3 ASP 14 0.959 -15.203 -4.673 834 H LYS 15 H LYS 15 4.452 -12.447 -5.468 835 HA LYS 15 HA LYS 15 5.971 -14.911 -4.911 836 HB2 LYS 15 HB2 LYS 15 6.436 -12.752 -6.907 837 HB3 LYS 15 HB3 LYS 15 7.841 -13.513 -6.177 838 HG2 LYS 15 HG2 LYS 15 6.903 -15.721 -6.897 839 HG3 LYS 15 HG3 LYS 15 5.687 -14.823 -7.815 840 HD2 LYS 15 HD2 LYS 15 7.492 -15.377 -9.307 841 HD3 LYS 15 HD3 LYS 15 7.552 -13.642 -8.993 842 HE2 LYS 15 HE2 LYS 15 9.330 -13.978 -7.364 843 HE3 LYS 15 HE3 LYS 15 9.255 -15.722 -7.617 844 HZ1 LYS 15 HZ1 LYS 15 9.935 -15.391 -9.905 845 HZ2 LYS 15 HZ2 LYS 15 11.070 -14.707 -8.854 846 HZ3 LYS 15 HZ3 LYS 15 9.982 -13.714 -9.682 847 H ASN 16 H ASN 16 8.229 -14.490 -4.338 848 HA ASN 16 HA ASN 16 8.554 -13.302 -1.862 849 HB2 ASN 16 HB2 ASN 16 11.055 -13.518 -2.486 850 HB3 ASN 16 HB3 ASN 16 10.065 -14.974 -2.464 851 HD21 ASN 16 HD21 ASN 16 11.430 -12.532 -4.606 852 HD22 ASN 16 HD22 ASN 16 11.501 -13.547 -5.997 853 H GLY 17 H GLY 17 7.441 -11.171 -2.609 854 HA2 GLY 17 HA2 GLY 17 8.413 -8.970 -1.907 855 HA3 GLY 17 HA3 GLY 17 9.607 -9.213 -3.167 856 H MET 18 H MET 18 7.108 -10.334 -4.766 857 HA MET 18 HA MET 18 6.812 -8.140 -6.452 858 HB2 MET 18 HB2 MET 18 5.298 -10.679 -6.035 859 HB3 MET 18 HB3 MET 18 4.526 -9.434 -7.005 860 HG2 MET 18 HG2 MET 18 7.265 -10.567 -7.542 861 HG3 MET 18 HG3 MET 18 5.779 -11.087 -8.339 862 HE1 MET 18 HE1 MET 18 4.177 -9.299 -9.629 863 HE2 MET 18 HE2 MET 18 4.695 -7.665 -10.042 864 HE3 MET 18 HE3 MET 18 4.354 -8.083 -8.363 865 H THR 19 H THR 19 4.484 -9.193 -3.956 866 HA THR 19 HA THR 19 2.621 -7.130 -4.261 867 HB THR 19 HB THR 19 1.979 -7.615 -1.907 868 HG1 THR 19 HG1 THR 19 3.204 -9.112 -0.735 869 HG21 THR 19 HG21 THR 19 2.561 -10.085 -3.555 870 HG22 THR 19 HG22 THR 19 1.132 -9.062 -3.697 871 HG23 THR 19 HG23 THR 19 1.415 -9.985 -2.221 872 H ASN 20 H ASN 20 5.654 -7.240 -2.487 873 HA ASN 20 HA ASN 20 5.248 -4.832 -1.005 874 HB2 ASN 20 HB2 ASN 20 6.728 -6.733 -0.299 875 HB3 ASN 20 HB3 ASN 20 7.831 -6.310 -1.601 876 HD21 ASN 20 HD21 ASN 20 6.095 -4.090 0.518 877 HD22 ASN 20 HD22 ASN 20 7.502 -3.441 1.263 878 H GLN 21 H GLN 21 6.966 -5.694 -3.976 879 HA GLN 21 HA GLN 21 8.128 -3.122 -4.357 880 HB2 GLN 21 HB2 GLN 21 8.959 -3.944 -6.425 881 HB3 GLN 21 HB3 GLN 21 9.062 -5.263 -5.276 882 HG2 GLN 21 HG2 GLN 21 7.042 -6.251 -6.235 883 HG3 GLN 21 HG3 GLN 21 6.929 -4.917 -7.381 884 HE21 GLN 21 HE21 GLN 21 8.708 -7.761 -6.476 885 HE22 GLN 21 HE22 GLN 21 9.554 -7.947 -7.965 886 H ILE 22 H ILE 22 5.174 -4.680 -5.464 887 HA ILE 22 HA ILE 22 4.516 -2.910 -7.547 888 HB ILE 22 HB ILE 22 2.890 -4.768 -5.836 889 HG12 ILE 22 HG12 ILE 22 4.323 -5.731 -7.570 890 HG13 ILE 22 HG13 ILE 22 2.628 -5.951 -7.987 891 HG21 ILE 22 HG21 ILE 22 0.909 -4.324 -7.201 892 HG22 ILE 22 HG22 ILE 22 1.759 -3.022 -8.032 893 HG23 ILE 22 HG23 ILE 22 1.401 -2.884 -6.310 894 HD11 ILE 22 HD11 ILE 22 2.749 -4.096 -9.546 895 HD12 ILE 22 HD12 ILE 22 3.961 -5.322 -9.921 896 HD13 ILE 22 HD13 ILE 22 4.437 -3.829 -9.113 897 H THR 23 H THR 23 3.281 -2.931 -4.179 898 HA THR 23 HA THR 23 1.896 -0.471 -4.495 899 HB THR 23 HB THR 23 2.858 -1.437 -1.802 900 HG1 THR 23 HG1 THR 23 0.856 -2.567 -3.477 901 HG21 THR 23 HG21 THR 23 1.588 0.687 -1.956 902 HG22 THR 23 HG22 THR 23 0.708 -0.553 -1.060 903 HG23 THR 23 HG23 THR 23 0.260 -0.186 -2.725 904 H GLY 24 H GLY 24 5.167 -1.313 -3.627 905 HA2 GLY 24 HA2 GLY 24 6.106 1.187 -2.746 906 HA3 GLY 24 HA3 GLY 24 7.076 -0.044 -3.540 907 H VAL 25 H VAL 25 6.048 -0.174 -6.051 908 HA VAL 25 HA VAL 25 7.083 2.073 -7.384 909 HB VAL 25 HB VAL 25 5.189 -0.055 -8.421 910 HG11 VAL 25 HG11 VAL 25 5.080 1.932 -9.844 911 HG12 VAL 25 HG12 VAL 25 5.915 0.619 -10.672 912 HG13 VAL 25 HG13 VAL 25 6.840 1.950 -9.975 913 HG21 VAL 25 HG21 VAL 25 8.196 0.205 -8.615 914 HG22 VAL 25 HG22 VAL 25 7.227 -1.045 -9.399 915 HG23 VAL 25 HG23 VAL 25 7.307 -0.965 -7.639 916 H ILE 26 H ILE 26 3.764 1.216 -6.512 917 HA ILE 26 HA ILE 26 2.393 3.294 -7.781 918 HB ILE 26 HB ILE 26 1.803 1.913 -5.156 919 HG12 ILE 26 HG12 ILE 26 0.688 1.494 -7.947 920 HG13 ILE 26 HG13 ILE 26 1.844 0.442 -7.136 921 HG21 ILE 26 HG21 ILE 26 0.029 3.728 -6.791 922 HG22 ILE 26 HG22 ILE 26 0.646 4.034 -5.166 923 HG23 ILE 26 HG23 ILE 26 -0.512 2.734 -5.438 924 HD11 ILE 26 HD11 ILE 26 -0.389 -0.489 -7.063 925 HD12 ILE 26 HD12 ILE 26 -0.991 0.963 -6.263 926 HD13 ILE 26 HD13 ILE 26 0.165 -0.085 -5.440 927 H SER 27 H SER 27 3.991 3.239 -4.606 928 HA SER 27 HA SER 27 3.300 5.806 -3.710 929 HB2 SER 27 HB2 SER 27 5.972 4.481 -3.185 930 HB3 SER 27 HB3 SER 27 5.107 5.615 -2.148 931 HG SER 27 HG SER 27 4.533 2.912 -2.698 932 H LYS 28 H LYS 28 5.471 4.812 -6.174 933 HA LYS 28 HA LYS 28 7.089 7.226 -6.132 934 HB2 LYS 28 HB2 LYS 28 7.170 4.984 -8.163 935 HB3 LYS 28 HB3 LYS 28 8.444 6.138 -7.780 936 HG2 LYS 28 HG2 LYS 28 8.691 5.141 -5.556 937 HG3 LYS 28 HG3 LYS 28 7.392 4.012 -5.916 938 HD2 LYS 28 HD2 LYS 28 9.502 2.888 -6.196 939 HD3 LYS 28 HD3 LYS 28 8.741 3.087 -7.774 940 HE2 LYS 28 HE2 LYS 28 10.193 5.003 -8.239 941 HE3 LYS 28 HE3 LYS 28 10.930 4.838 -6.644 942 HZ1 LYS 28 HZ1 LYS 28 11.719 2.633 -7.297 943 HZ2 LYS 28 HZ2 LYS 28 12.308 3.828 -8.334 944 HZ3 LYS 28 HZ3 LYS 28 11.042 2.830 -8.834 945 H PHE 29 H PHE 29 4.104 7.113 -6.916 946 HA PHE 29 HA PHE 29 4.227 8.241 -9.608 947 HB2 PHE 29 HB2 PHE 29 1.893 7.686 -7.765 948 HB3 PHE 29 HB3 PHE 29 1.730 8.431 -9.351 949 HD1 PHE 29 HD1 PHE 29 4.190 6.432 -10.241 950 HD2 PHE 29 HD2 PHE 29 0.245 6.023 -8.677 951 HE1 PHE 29 HE1 PHE 29 4.016 4.206 -11.270 952 HE2 PHE 29 HE2 PHE 29 0.070 3.793 -9.704 953 HZ PHE 29 HZ PHE 29 1.959 2.888 -11.001 954 H ASP 30 H ASP 30 3.023 10.268 -10.036 955 HA ASP 30 HA ASP 30 4.105 12.400 -8.442 956 HB2 ASP 30 HB2 ASP 30 2.064 12.879 -10.592 957 HB3 ASP 30 HB3 ASP 30 3.520 13.794 -10.209 958 H THR 31 H THR 31 1.107 10.741 -8.560 959 HA THR 31 HA THR 31 -0.469 12.925 -7.437 960 HB THR 31 HB THR 31 -1.497 11.659 -9.222 961 HG1 THR 31 HG1 THR 31 -3.347 11.803 -8.217 962 HG21 THR 31 HG21 THR 31 -1.193 9.226 -7.454 963 HG22 THR 31 HG22 THR 31 -0.282 9.550 -8.928 964 HG23 THR 31 HG23 THR 31 -2.022 9.280 -9.009 965 H ASN 32 H ASN 32 -2.214 12.009 -5.772 966 HA ASN 32 HA ASN 32 -0.658 10.895 -3.526 967 HB2 ASN 32 HB2 ASN 32 -1.507 13.151 -3.133 968 HB3 ASN 32 HB3 ASN 32 -3.147 12.623 -3.511 969 HD21 ASN 32 HD21 ASN 32 -0.546 12.421 -1.206 970 HD22 ASN 32 HD22 ASN 32 -1.505 11.834 0.112 971 H ILE 33 H ILE 33 -1.145 8.915 -2.813 972 HA ILE 33 HA ILE 33 -3.260 7.352 -3.863 973 HB ILE 33 HB ILE 33 -1.621 6.840 -1.365 974 HG12 ILE 33 HG12 ILE 33 -1.159 5.904 -4.217 975 HG13 ILE 33 HG13 ILE 33 -0.226 7.150 -3.393 976 HG21 ILE 33 HG21 ILE 33 -3.620 5.461 -1.422 977 HG22 ILE 33 HG22 ILE 33 -2.202 4.468 -1.755 978 HG23 ILE 33 HG23 ILE 33 -3.263 4.962 -3.075 979 HD11 ILE 33 HD11 ILE 33 0.530 5.490 -1.764 980 HD12 ILE 33 HD12 ILE 33 0.966 5.049 -3.413 981 HD13 ILE 33 HD13 ILE 33 -0.386 4.244 -2.615 982 H ARG 34 H ARG 34 -5.332 7.980 -3.469 983 HA ARG 34 HA ARG 34 -6.145 8.945 -0.859 984 HB2 ARG 34 HB2 ARG 34 -7.856 8.283 -3.269 985 HB3 ARG 34 HB3 ARG 34 -8.364 9.191 -1.850 986 HG2 ARG 34 HG2 ARG 34 -6.381 10.026 -3.959 987 HG3 ARG 34 HG3 ARG 34 -7.951 10.747 -3.601 988 HD2 ARG 34 HD2 ARG 34 -5.529 10.752 -1.795 989 HD3 ARG 34 HD3 ARG 34 -6.136 12.122 -2.720 990 HE ARG 34 HE ARG 34 -8.260 11.471 -1.196 991 HH11 ARG 34 HH11 ARG 34 -4.938 11.963 -0.416 992 HH12 ARG 34 HH12 ARG 34 -5.288 12.590 1.157 993 HH21 ARG 34 HH21 ARG 34 -8.687 12.284 0.833 994 HH22 ARG 34 HH22 ARG 34 -7.375 12.794 1.839 995 H THR 35 H THR 35 -6.365 5.991 -2.723 996 HA THR 35 HA THR 35 -6.966 4.504 -0.307 997 HB THR 35 HB THR 35 -8.820 4.280 -2.698 998 HG1 THR 35 HG1 THR 35 -8.951 5.740 -0.363 999 HG21 THR 35 HG21 THR 35 -10.090 2.703 -1.296 1000 HG22 THR 35 HG22 THR 35 -8.844 2.812 -0.053 1001 HG23 THR 35 HG23 THR 35 -8.462 2.112 -1.627 1002 H ILE 36 H ILE 36 -5.872 2.605 -0.311 1003 HA ILE 36 HA ILE 36 -5.275 1.320 -2.892 1004 HB ILE 36 HB ILE 36 -3.228 2.538 -2.154 1005 HG12 ILE 36 HG12 ILE 36 -1.671 0.597 -2.341 1006 HG13 ILE 36 HG13 ILE 36 -3.037 -0.491 -2.117 1007 HG21 ILE 36 HG21 ILE 36 -1.960 1.711 -0.216 1008 HG22 ILE 36 HG22 ILE 36 -3.312 0.658 0.207 1009 HG23 ILE 36 HG23 ILE 36 -3.511 2.409 0.252 1010 HD11 ILE 36 HD11 ILE 36 -2.688 1.448 -4.396 1011 HD12 ILE 36 HD12 ILE 36 -4.034 0.326 -4.180 1012 HD13 ILE 36 HD13 ILE 36 -2.407 -0.291 -4.456 1013 H VAL 37 H VAL 37 -5.491 -0.849 -2.915 1014 HA VAL 37 HA VAL 37 -5.811 -2.309 -0.368 1015 HB VAL 37 HB VAL 37 -7.601 -2.597 -2.802 1016 HG11 VAL 37 HG11 VAL 37 -7.635 -4.123 -0.194 1017 HG12 VAL 37 HG12 VAL 37 -7.200 -4.766 -1.778 1018 HG13 VAL 37 HG13 VAL 37 -8.854 -4.240 -1.465 1019 HG21 VAL 37 HG21 VAL 37 -8.142 -0.614 -1.485 1020 HG22 VAL 37 HG22 VAL 37 -8.242 -1.595 -0.022 1021 HG23 VAL 37 HG23 VAL 37 -9.406 -1.834 -1.325 1022 H LEU 38 H LEU 38 -4.890 -4.339 -0.335 1023 HA LEU 38 HA LEU 38 -4.204 -5.641 -2.868 1024 HB2 LEU 38 HB2 LEU 38 -2.224 -4.276 -2.132 1025 HB3 LEU 38 HB3 LEU 38 -2.148 -5.242 -0.674 1026 HG LEU 38 HG LEU 38 -1.901 -6.502 -3.409 1027 HD11 LEU 38 HD11 LEU 38 0.536 -6.371 -3.157 1028 HD12 LEU 38 HD12 LEU 38 0.332 -5.376 -1.715 1029 HD13 LEU 38 HD13 LEU 38 -0.196 -4.771 -3.286 1030 HD21 LEU 38 HD21 LEU 38 -2.321 -8.032 -1.556 1031 HD22 LEU 38 HD22 LEU 38 -0.959 -7.356 -0.666 1032 HD23 LEU 38 HD23 LEU 38 -0.681 -8.239 -2.169 1033 H ASN 39 H ASN 39 -4.680 -7.796 -2.780 1034 HA ASN 39 HA ASN 39 -4.287 -9.236 -0.283 1035 HB2 ASN 39 HB2 ASN 39 -6.488 -10.152 -0.110 1036 HB3 ASN 39 HB3 ASN 39 -6.676 -8.412 -0.255 1037 HD21 ASN 39 HD21 ASN 39 -7.485 -7.564 -2.218 1038 HD22 ASN 39 HD22 ASN 39 -8.375 -8.556 -3.317 1039 H ALA 40 H ALA 40 -4.087 -11.495 -0.534 1040 HA ALA 40 HA ALA 40 -3.458 -12.329 -3.303 1041 HB1 ALA 40 HB1 ALA 40 -1.871 -13.897 -2.326 1042 HB2 ALA 40 HB2 ALA 40 -2.352 -13.414 -0.699 1043 HB3 ALA 40 HB3 ALA 40 -1.536 -12.261 -1.756 1044 H LYS 41 H LYS 41 -4.258 -14.228 -4.078 1045 HA LYS 41 HA LYS 41 -6.364 -15.498 -2.482 1046 HB2 LYS 41 HB2 LYS 41 -7.032 -13.664 -4.128 1047 HB3 LYS 41 HB3 LYS 41 -6.663 -14.825 -5.388 1048 HG2 LYS 41 HG2 LYS 41 -8.457 -16.173 -4.859 1049 HG3 LYS 41 HG3 LYS 41 -8.545 -15.573 -3.198 1050 HD2 LYS 41 HD2 LYS 41 -10.407 -14.694 -4.517 1051 HD3 LYS 41 HD3 LYS 41 -9.315 -13.394 -4.018 1052 HE2 LYS 41 HE2 LYS 41 -9.962 -13.050 -6.324 1053 HE3 LYS 41 HE3 LYS 41 -8.254 -13.476 -6.260 1054 HZ1 LYS 41 HZ1 LYS 41 -9.536 -14.607 -8.038 1055 HZ2 LYS 41 HZ2 LYS 41 -10.413 -15.426 -6.847 1056 HZ3 LYS 41 HZ3 LYS 41 -8.747 -15.670 -6.986 1057 H ASP 42 H ASP 42 -5.841 -16.238 -5.805 1058 HA ASP 42 HA ASP 42 -5.335 -19.018 -5.202 1059 HB2 ASP 42 HB2 ASP 42 -5.424 -17.623 -7.893 1060 HB3 ASP 42 HB3 ASP 42 -5.540 -19.358 -7.609 1061 H GLY 43 H GLY 43 -3.169 -17.657 -4.189 1062 HA2 GLY 43 HA2 GLY 43 -0.859 -17.479 -4.294 1063 HA3 GLY 43 HA3 GLY 43 -0.905 -18.483 -5.739 1064 H ILE 44 H ILE 44 -2.882 -15.723 -5.728 1065 HA ILE 44 HA ILE 44 -0.976 -14.077 -7.259 1066 HB ILE 44 HB ILE 44 -3.878 -14.427 -8.054 1067 HG12 ILE 44 HG12 ILE 44 -1.454 -15.774 -9.274 1068 HG13 ILE 44 HG13 ILE 44 -2.726 -16.567 -8.346 1069 HG21 ILE 44 HG21 ILE 44 -3.189 -13.355 -10.135 1070 HG22 ILE 44 HG22 ILE 44 -1.531 -13.247 -9.543 1071 HG23 ILE 44 HG23 ILE 44 -2.813 -12.334 -8.747 1072 HD11 ILE 44 HD11 ILE 44 -3.093 -15.142 -10.967 1073 HD12 ILE 44 HD12 ILE 44 -4.350 -15.976 -10.051 1074 HD13 ILE 44 HD13 ILE 44 -3.009 -16.890 -10.746 1075 H PHE 45 H PHE 45 -1.414 -11.806 -7.091 1076 HA PHE 45 HA PHE 45 -3.268 -11.166 -4.873 1077 HB2 PHE 45 HB2 PHE 45 -1.832 -9.347 -4.208 1078 HB3 PHE 45 HB3 PHE 45 -0.852 -10.801 -4.343 1079 HD1 PHE 45 HD2 PHE 45 -1.567 -7.508 -5.772 1080 HD2 PHE 45 HD1 PHE 45 0.815 -11.025 -6.080 1081 HE1 PHE 45 HE2 PHE 45 -0.042 -6.334 -7.301 1082 HE2 PHE 45 HE1 PHE 45 2.350 -9.849 -7.606 1083 HZ PHE 45 HZ PHE 45 1.907 -7.508 -8.222 1084 H THR 46 H THR 46 -4.801 -9.656 -5.159 1085 HA THR 46 HA THR 46 -4.778 -8.122 -7.691 1086 HB THR 46 HB THR 46 -6.728 -9.465 -7.694 1087 HG1 THR 46 HG1 THR 46 -7.839 -7.074 -6.682 1088 HG21 THR 46 HG21 THR 46 -8.379 -9.491 -5.867 1089 HG22 THR 46 HG22 THR 46 -7.306 -8.480 -4.897 1090 HG23 THR 46 HG23 THR 46 -6.810 -10.110 -5.351 1091 H CYS 47 H CYS 47 -3.746 -6.269 -7.185 1092 HA CYS 47 HA CYS 47 -4.423 -4.776 -4.772 1093 HB2 CYS 47 HB2 CYS 47 -2.069 -4.965 -5.455 1094 HB3 CYS 47 HB3 CYS 47 -2.440 -4.160 -6.975 1095 HG CYS 47 HG CYS 47 -2.973 -2.616 -3.977 1096 H ASN 48 H ASN 48 -5.735 -3.035 -4.696 1097 HA ASN 48 HA ASN 48 -6.778 -1.927 -7.224 1098 HB2 ASN 48 HB2 ASN 48 -8.077 -1.987 -4.482 1099 HB3 ASN 48 HB3 ASN 48 -8.783 -1.272 -5.928 1100 HD21 ASN 48 HD21 ASN 48 -9.580 -2.617 -7.534 1101 HD22 ASN 48 HD22 ASN 48 -9.850 -4.303 -7.276 1102 H LEU 49 H LEU 49 -5.797 -0.053 -7.692 1103 HA LEU 49 HA LEU 49 -4.937 1.743 -5.535 1104 HB2 LEU 49 HB2 LEU 49 -3.215 1.224 -7.120 1105 HB3 LEU 49 HB3 LEU 49 -4.258 1.621 -8.472 1106 HG LEU 49 HG LEU 49 -4.222 3.998 -7.815 1107 HD11 LEU 49 HD11 LEU 49 -2.634 4.769 -6.093 1108 HD12 LEU 49 HD12 LEU 49 -2.331 3.089 -5.644 1109 HD13 LEU 49 HD13 LEU 49 -3.936 3.783 -5.426 1110 HD21 LEU 49 HD21 LEU 49 -1.903 4.467 -8.430 1111 HD22 LEU 49 HD22 LEU 49 -2.578 3.176 -9.422 1112 HD23 LEU 49 HD23 LEU 49 -1.469 2.787 -8.106 1113 H MET 50 H MET 50 -5.775 3.735 -5.208 1114 HA MET 50 HA MET 50 -7.639 4.851 -7.206 1115 HB2 MET 50 HB2 MET 50 -8.044 4.889 -4.208 1116 HB3 MET 50 HB3 MET 50 -9.089 5.657 -5.395 1117 HG2 MET 50 HG2 MET 50 -8.615 2.702 -5.056 1118 HG3 MET 50 HG3 MET 50 -10.071 3.597 -4.632 1119 HE1 MET 50 HE1 MET 50 -11.378 5.080 -6.592 1120 HE2 MET 50 HE2 MET 50 -11.101 4.815 -8.314 1121 HE3 MET 50 HE3 MET 50 -9.868 5.610 -7.336 1122 H ILE 51 H ILE 51 -6.745 6.665 -7.948 1123 HA ILE 51 HA ILE 51 -5.668 8.634 -6.051 1124 HB ILE 51 HB ILE 51 -3.814 9.138 -7.741 1125 HG12 ILE 51 HG12 ILE 51 -3.091 6.902 -8.925 1126 HG13 ILE 51 HG13 ILE 51 -4.799 6.498 -8.807 1127 HG21 ILE 51 HG21 ILE 51 -3.692 6.545 -6.202 1128 HG22 ILE 51 HG22 ILE 51 -3.359 8.158 -5.570 1129 HG23 ILE 51 HG23 ILE 51 -2.302 7.458 -6.793 1130 HD11 ILE 51 HD11 ILE 51 -4.296 7.431 -10.968 1131 HD12 ILE 51 HD12 ILE 51 -3.607 8.873 -10.227 1132 HD13 ILE 51 HD13 ILE 51 -5.334 8.541 -10.074 1133 H PHE 52 H PHE 52 -5.483 10.840 -6.995 1134 HA PHE 52 HA PHE 52 -7.695 11.327 -8.851 1135 HB2 PHE 52 HB2 PHE 52 -6.264 12.996 -6.827 1136 HB3 PHE 52 HB3 PHE 52 -7.016 13.818 -8.188 1137 HD1 PHE 52 HD2 PHE 52 -9.471 13.508 -8.589 1138 HD2 PHE 52 HD1 PHE 52 -7.563 12.234 -5.001 1139 HE1 PHE 52 HE2 PHE 52 -11.655 13.436 -7.463 1140 HE2 PHE 52 HE1 PHE 52 -9.745 12.164 -3.864 1141 HZ PHE 52 HZ PHE 52 -11.795 12.765 -5.095 1142 H VAL 53 H VAL 53 -7.503 12.193 -10.840 1143 HA VAL 53 HA VAL 53 -4.847 13.116 -11.760 1144 HB VAL 53 HB VAL 53 -5.137 12.026 -13.903 1145 HG11 VAL 53 HG11 VAL 53 -4.061 10.684 -12.186 1146 HG12 VAL 53 HG12 VAL 53 -5.016 9.664 -13.265 1147 HG13 VAL 53 HG13 VAL 53 -5.630 10.069 -11.662 1148 HG21 VAL 53 HG21 VAL 53 -7.012 10.530 -14.368 1149 HG22 VAL 53 HG22 VAL 53 -7.565 12.177 -14.073 1150 HG23 VAL 53 HG23 VAL 53 -7.740 10.950 -12.818 1151 H LYS 54 H LYS 54 -4.984 14.491 -13.739 1152 HA LYS 54 HA LYS 54 -7.354 16.208 -13.665 1153 HB2 LYS 54 HB2 LYS 54 -4.732 16.557 -15.137 1154 HB3 LYS 54 HB3 LYS 54 -6.025 17.746 -15.065 1155 HG2 LYS 54 HG2 LYS 54 -5.723 17.849 -12.599 1156 HG3 LYS 54 HG3 LYS 54 -4.339 16.766 -12.763 1157 HD2 LYS 54 HD2 LYS 54 -4.613 19.494 -14.046 1158 HD3 LYS 54 HD3 LYS 54 -3.639 19.117 -12.625 1159 HE2 LYS 54 HE2 LYS 54 -2.245 17.620 -13.962 1160 HE3 LYS 54 HE3 LYS 54 -3.239 17.945 -15.383 1161 HZ1 LYS 54 HZ1 LYS 54 -1.665 19.983 -13.907 1162 HZ2 LYS 54 HZ2 LYS 54 -2.554 20.243 -15.319 1163 HZ3 LYS 54 HZ3 LYS 54 -1.185 19.253 -15.353 1164 H ASN 55 H ASN 55 -6.114 13.663 -15.566 1165 HA ASN 55 HA ASN 55 -8.196 13.904 -17.528 1166 HB2 ASN 55 HB2 ASN 55 -6.663 14.029 -19.498 1167 HB3 ASN 55 HB3 ASN 55 -6.668 15.497 -18.522 1168 HD21 ASN 55 HD21 ASN 55 -4.829 16.070 -17.403 1169 HD22 ASN 55 HD22 ASN 55 -3.310 15.277 -17.622 1170 H THR 56 H THR 56 -7.831 12.192 -19.335 1171 HA THR 56 HA THR 56 -7.569 9.663 -18.006 1172 HB THR 56 HB THR 56 -8.138 8.694 -20.228 1173 HG1 THR 56 HG1 THR 56 -7.832 9.877 -21.952 1174 HG21 THR 56 HG21 THR 56 -9.878 11.022 -19.373 1175 HG22 THR 56 HG22 THR 56 -9.935 9.390 -18.708 1176 HG23 THR 56 HG23 THR 56 -10.395 9.673 -20.388 1177 H ASP 57 H ASP 57 -5.522 11.525 -20.153 1178 HA ASP 57 HA ASP 57 -3.767 9.473 -21.014 1179 HB2 ASP 57 HB2 ASP 57 -3.807 11.601 -22.168 1180 HB3 ASP 57 HB3 ASP 57 -3.393 12.467 -20.693 1181 H LYS 58 H LYS 58 -3.791 11.661 -18.287 1182 HA LYS 58 HA LYS 58 -1.375 10.992 -17.072 1183 HB2 LYS 58 HB2 LYS 58 -2.637 12.937 -16.413 1184 HB3 LYS 58 HB3 LYS 58 -4.013 11.950 -15.941 1185 HG2 LYS 58 HG2 LYS 58 -2.753 12.777 -14.012 1186 HG3 LYS 58 HG3 LYS 58 -2.771 11.012 -14.121 1187 HD2 LYS 58 HD2 LYS 58 -0.523 11.086 -15.163 1188 HD3 LYS 58 HD3 LYS 58 -0.513 12.839 -14.971 1189 HE2 LYS 58 HE2 LYS 58 -0.557 12.627 -12.572 1190 HE3 LYS 58 HE3 LYS 58 -0.754 10.876 -12.692 1191 HZ1 LYS 58 HZ1 LYS 58 1.614 12.434 -13.578 1192 HZ2 LYS 58 HZ2 LYS 58 1.418 10.768 -13.772 1193 HZ3 LYS 58 HZ3 LYS 58 1.529 11.427 -12.222 1194 H LEU 59 H LEU 59 -4.527 9.414 -16.958 1195 HA LEU 59 HA LEU 59 -3.832 7.601 -14.835 1196 HB2 LEU 59 HB2 LEU 59 -6.144 8.263 -15.180 1197 HB3 LEU 59 HB3 LEU 59 -6.125 7.601 -16.805 1198 HG LEU 59 HG LEU 59 -5.878 5.333 -15.893 1199 HD11 LEU 59 HD11 LEU 59 -6.067 6.669 -13.194 1200 HD12 LEU 59 HD12 LEU 59 -4.656 5.849 -13.859 1201 HD13 LEU 59 HD13 LEU 59 -6.113 4.930 -13.489 1202 HD21 LEU 59 HD21 LEU 59 -8.117 6.206 -16.317 1203 HD22 LEU 59 HD22 LEU 59 -8.183 6.862 -14.681 1204 HD23 LEU 59 HD23 LEU 59 -8.115 5.117 -14.930 1205 H THR 60 H THR 60 -4.176 7.279 -18.377 1206 HA THR 60 HA THR 60 -3.643 4.526 -18.562 1207 HB THR 60 HB THR 60 -3.040 4.936 -20.924 1208 HG1 THR 60 HG1 THR 60 -2.986 7.081 -21.690 1209 HG21 THR 60 HG21 THR 60 -5.169 5.926 -21.641 1210 HG22 THR 60 HG22 THR 60 -5.441 6.536 -20.009 1211 HG23 THR 60 HG23 THR 60 -5.412 4.799 -20.306 1212 H THR 61 H THR 61 -1.474 7.270 -18.318 1213 HA THR 61 HA THR 61 0.924 5.978 -19.048 1214 HB THR 61 HB THR 61 0.477 8.344 -17.213 1215 HG1 THR 61 HG1 THR 61 -0.143 8.613 -19.437 1216 HG21 THR 61 HG21 THR 61 2.861 8.885 -17.643 1217 HG22 THR 61 HG22 THR 61 3.049 7.316 -18.427 1218 HG23 THR 61 HG23 THR 61 2.656 7.403 -16.710 1219 H LEU 62 H LEU 62 -0.647 6.363 -15.876 1220 HA LEU 62 HA LEU 62 1.389 5.166 -14.335 1221 HB2 LEU 62 HB2 LEU 62 -1.589 5.214 -13.816 1222 HB3 LEU 62 HB3 LEU 62 -0.362 4.796 -12.632 1223 HG LEU 62 HG LEU 62 -0.804 7.499 -13.911 1224 HD11 LEU 62 HD11 LEU 62 -2.375 6.918 -12.133 1225 HD12 LEU 62 HD12 LEU 62 -1.289 8.215 -11.637 1226 HD13 LEU 62 HD13 LEU 62 -1.028 6.572 -11.049 1227 HD21 LEU 62 HD21 LEU 62 1.366 6.621 -12.004 1228 HD22 LEU 62 HD22 LEU 62 1.030 8.288 -12.477 1229 HD23 LEU 62 HD23 LEU 62 1.581 7.125 -13.682 1230 H MET 63 H MET 63 -1.362 3.766 -16.064 1231 HA MET 63 HA MET 63 -1.184 1.109 -15.235 1232 HB2 MET 63 HB2 MET 63 -1.777 2.080 -18.042 1233 HB3 MET 63 HB3 MET 63 -2.214 0.514 -17.373 1234 HG2 MET 63 HG2 MET 63 -3.744 1.561 -15.828 1235 HG3 MET 63 HG3 MET 63 -3.246 3.162 -16.382 1236 HE1 MET 63 HE1 MET 63 -6.324 2.298 -16.313 1237 HE2 MET 63 HE2 MET 63 -6.820 3.008 -17.851 1238 HE3 MET 63 HE3 MET 63 -5.678 3.866 -16.813 1239 H ASP 64 H ASP 64 0.463 2.704 -17.957 1240 HA ASP 64 HA ASP 64 1.930 0.487 -18.852 1241 HB2 ASP 64 HB2 ASP 64 1.540 2.646 -20.086 1242 HB3 ASP 64 HB3 ASP 64 2.753 3.394 -19.052 1243 H LYS 65 H LYS 65 2.797 3.049 -16.535 1244 HA LYS 65 HA LYS 65 5.416 2.272 -15.948 1245 HB2 LYS 65 HB2 LYS 65 3.319 3.533 -14.166 1246 HB3 LYS 65 HB3 LYS 65 5.005 3.357 -13.698 1247 HG2 LYS 65 HG2 LYS 65 5.626 4.730 -15.696 1248 HG3 LYS 65 HG3 LYS 65 3.905 5.004 -15.975 1249 HD2 LYS 65 HD2 LYS 65 4.850 6.891 -14.770 1250 HD3 LYS 65 HD3 LYS 65 3.731 6.019 -13.719 1251 HE2 LYS 65 HE2 LYS 65 5.618 4.890 -12.639 1252 HE3 LYS 65 HE3 LYS 65 6.741 5.737 -13.704 1253 HZ1 LYS 65 HZ1 LYS 65 6.005 7.833 -12.739 1254 HZ2 LYS 65 HZ2 LYS 65 6.613 6.803 -11.549 1255 HZ3 LYS 65 HZ3 LYS 65 4.946 7.013 -11.711 1256 H LEU 66 H LEU 66 2.368 1.097 -14.581 1257 HA LEU 66 HA LEU 66 3.578 -0.705 -12.710 1258 HB2 LEU 66 HB2 LEU 66 0.773 -0.593 -13.836 1259 HB3 LEU 66 HB3 LEU 66 1.270 -1.608 -12.491 1260 HG LEU 66 HG LEU 66 1.486 1.407 -12.447 1261 HD11 LEU 66 HD11 LEU 66 -0.857 0.792 -12.709 1262 HD12 LEU 66 HD12 LEU 66 -0.542 1.419 -11.093 1263 HD13 LEU 66 HD13 LEU 66 -0.731 -0.316 -11.341 1264 HD21 LEU 66 HD21 LEU 66 2.958 0.230 -10.891 1265 HD22 LEU 66 HD22 LEU 66 1.578 -0.660 -10.244 1266 HD23 LEU 66 HD23 LEU 66 1.681 1.088 -10.030 1267 H ARG 67 H ARG 67 2.414 -1.003 -16.024 1268 HA ARG 67 HA ARG 67 2.465 -3.839 -16.158 1269 HB2 ARG 67 HB2 ARG 67 2.500 -1.725 -18.317 1270 HB3 ARG 67 HB3 ARG 67 2.443 -3.451 -18.663 1271 HG2 ARG 67 HG2 ARG 67 0.335 -3.636 -17.428 1272 HG3 ARG 67 HG3 ARG 67 0.387 -1.908 -17.077 1273 HD2 ARG 67 HD2 ARG 67 0.243 -1.405 -19.461 1274 HD3 ARG 67 HD3 ARG 67 0.252 -3.129 -19.840 1275 HE ARG 67 HE ARG 67 -1.885 -2.388 -18.078 1276 HH11 ARG 67 HH11 ARG 67 -0.924 -2.473 -21.374 1277 HH12 ARG 67 HH12 ARG 67 -2.542 -2.613 -21.961 1278 HH21 ARG 67 HH21 ARG 67 -3.966 -2.529 -18.826 1279 HH22 ARG 67 HH22 ARG 67 -4.256 -2.621 -20.528 1280 H LYS 68 H LYS 68 5.055 -1.684 -15.972 1281 HA LYS 68 HA LYS 68 6.926 -3.071 -17.636 1282 HB2 LYS 68 HB2 LYS 68 7.556 -1.314 -15.251 1283 HB3 LYS 68 HB3 LYS 68 8.641 -1.732 -16.569 1284 HG2 LYS 68 HG2 LYS 68 6.209 0.043 -16.682 1285 HG3 LYS 68 HG3 LYS 68 7.896 0.506 -16.905 1286 HD2 LYS 68 HD2 LYS 68 7.992 -0.845 -18.955 1287 HD3 LYS 68 HD3 LYS 68 6.302 -1.302 -18.732 1288 HE2 LYS 68 HE2 LYS 68 5.774 1.183 -18.775 1289 HE3 LYS 68 HE3 LYS 68 7.429 1.426 -19.335 1290 HZ1 LYS 68 HZ1 LYS 68 5.341 -0.188 -20.697 1291 HZ2 LYS 68 HZ2 LYS 68 6.936 -0.016 -21.230 1292 HZ3 LYS 68 HZ3 LYS 68 5.908 1.326 -21.184 1293 H VAL 69 H VAL 69 5.526 -3.849 -14.650 1294 HA VAL 69 HA VAL 69 7.775 -5.393 -13.635 1295 HB VAL 69 HB VAL 69 4.935 -5.272 -12.583 1296 HG11 VAL 69 HG11 VAL 69 6.160 -7.230 -11.811 1297 HG12 VAL 69 HG12 VAL 69 5.943 -6.083 -10.487 1298 HG13 VAL 69 HG13 VAL 69 7.504 -6.211 -11.299 1299 HG21 VAL 69 HG21 VAL 69 5.945 -3.041 -12.595 1300 HG22 VAL 69 HG22 VAL 69 7.352 -3.664 -11.731 1301 HG23 VAL 69 HG23 VAL 69 5.772 -3.650 -10.948 1302 H GLN 70 H GLN 70 8.218 -7.182 -14.666 1303 HA GLN 70 HA GLN 70 6.727 -8.811 -16.267 1304 HB2 GLN 70 HB2 GLN 70 8.341 -10.631 -15.642 1305 HB3 GLN 70 HB3 GLN 70 9.085 -9.113 -16.120 1306 HG2 GLN 70 HG2 GLN 70 8.618 -9.748 -13.227 1307 HG3 GLN 70 HG3 GLN 70 10.028 -10.377 -14.076 1308 HE21 GLN 70 HE21 GLN 70 11.583 -8.887 -14.844 1309 HE22 GLN 70 HE22 GLN 70 11.705 -7.300 -14.174 1310 H GLY 71 H GLY 71 6.775 -8.869 -12.737 1311 HA2 GLY 71 HA2 GLY 71 5.497 -11.388 -12.405 1312 HA3 GLY 71 HA3 GLY 71 5.620 -10.127 -11.193 1313 H VAL 72 H VAL 72 4.203 -8.277 -13.223 1314 HA VAL 72 HA VAL 72 1.484 -9.114 -12.471 1315 HB VAL 72 HB VAL 72 2.491 -6.426 -13.433 1316 HG11 VAL 72 HG11 VAL 72 0.239 -5.598 -12.858 1317 HG12 VAL 72 HG12 VAL 72 -0.276 -7.250 -12.515 1318 HG13 VAL 72 HG13 VAL 72 0.186 -6.791 -14.156 1319 HG21 VAL 72 HG21 VAL 72 2.023 -5.698 -11.133 1320 HG22 VAL 72 HG22 VAL 72 3.233 -6.981 -11.175 1321 HG23 VAL 72 HG23 VAL 72 1.573 -7.348 -10.704 1322 H PHE 73 H PHE 73 -0.041 -9.628 -13.932 1323 HA PHE 73 HA PHE 73 0.677 -9.396 -16.785 1324 HB2 PHE 73 HB2 PHE 73 -1.028 -11.452 -16.890 1325 HB3 PHE 73 HB3 PHE 73 0.692 -11.652 -16.607 1326 HD1 PHE 73 HD2 PHE 73 1.546 -12.193 -14.385 1327 HD2 PHE 73 HD1 PHE 73 -2.639 -11.930 -15.150 1328 HE1 PHE 73 HE2 PHE 73 1.094 -13.399 -12.297 1329 HE2 PHE 73 HE1 PHE 73 -3.093 -13.142 -13.057 1330 HZ PHE 73 HZ PHE 73 -1.224 -13.880 -11.629 1331 H THR 74 H THR 74 -1.544 -8.332 -14.480 1332 HA THR 74 HA THR 74 -3.238 -7.327 -16.675 1333 HB THR 74 HB THR 74 -5.283 -7.677 -15.552 1334 HG1 THR 74 HG1 THR 74 -5.469 -8.009 -13.427 1335 HG21 THR 74 HG21 THR 74 -5.383 -10.087 -15.103 1336 HG22 THR 74 HG22 THR 74 -3.622 -10.149 -15.019 1337 HG23 THR 74 HG23 THR 74 -4.421 -9.750 -16.542 1338 H VAL 75 H VAL 75 -3.140 -5.184 -16.690 1339 HA VAL 75 HA VAL 75 -3.488 -3.738 -14.141 1340 HB VAL 75 HB VAL 75 -1.671 -2.788 -16.376 1341 HG11 VAL 75 HG11 VAL 75 -1.021 -1.027 -14.805 1342 HG12 VAL 75 HG12 VAL 75 -2.180 -1.644 -13.628 1343 HG13 VAL 75 HG13 VAL 75 -2.750 -0.971 -15.155 1344 HG21 VAL 75 HG21 VAL 75 -0.639 -4.681 -15.242 1345 HG22 VAL 75 HG22 VAL 75 -0.930 -3.927 -13.674 1346 HG23 VAL 75 HG23 VAL 75 0.196 -3.186 -14.813 1347 H GLU 76 H GLU 76 -5.511 -2.944 -14.330 1348 HA GLU 76 HA GLU 76 -6.385 -1.851 -16.940 1349 HB2 GLU 76 HB2 GLU 76 -8.059 -3.581 -15.098 1350 HB3 GLU 76 HB3 GLU 76 -8.566 -2.914 -16.643 1351 HG2 GLU 76 HG2 GLU 76 -6.939 -4.290 -17.806 1352 HG3 GLU 76 HG3 GLU 76 -6.340 -4.911 -16.269 1353 H ARG 77 H ARG 77 -8.472 -0.586 -16.743 1354 HA ARG 77 HA ARG 77 -8.161 1.363 -14.612 1355 HB2 ARG 77 HB2 ARG 77 -8.444 2.178 -16.884 1356 HB3 ARG 77 HB3 ARG 77 -9.967 1.316 -17.041 1357 HG2 ARG 77 HG2 ARG 77 -11.026 2.752 -15.445 1358 HG3 ARG 77 HG3 ARG 77 -9.491 3.515 -15.035 1359 HD2 ARG 77 HD2 ARG 77 -10.759 4.978 -16.476 1360 HD3 ARG 77 HD3 ARG 77 -9.341 4.387 -17.338 1361 HE ARG 77 HE ARG 77 -11.578 2.745 -17.894 1362 HH11 ARG 77 HH11 ARG 77 -10.297 5.864 -18.573 1363 HH12 ARG 77 HH12 ARG 77 -11.066 5.971 -20.116 1364 HH21 ARG 77 HH21 ARG 77 -12.598 2.912 -19.889 1365 HH22 ARG 77 HH22 ARG 77 -12.369 4.342 -20.837 1366 H LEU 78 H LEU 78 -9.554 1.769 -12.975 1367 HA LEU 78 HA LEU 78 -11.985 0.114 -12.744 1368 HB2 LEU 78 HB2 LEU 78 -10.413 1.563 -10.605 1369 HB3 LEU 78 HB3 LEU 78 -11.890 0.661 -10.324 1370 HG LEU 78 HG LEU 78 -9.290 -0.523 -11.315 1371 HD11 LEU 78 HD11 LEU 78 -10.590 -0.637 -8.590 1372 HD12 LEU 78 HD12 LEU 78 -9.100 0.209 -9.009 1373 HD13 LEU 78 HD13 LEU 78 -9.164 -1.550 -9.087 1374 HD21 LEU 78 HD21 LEU 78 -11.230 -1.742 -12.145 1375 HD22 LEU 78 HD22 LEU 78 -11.887 -1.844 -10.511 1376 HD23 LEU 78 HD23 LEU 78 -10.390 -2.684 -10.914 1377 H SER 79 H SER 79 -13.452 1.378 -13.880 1378 HA SER 79 HA SER 79 -13.890 4.142 -12.989 1379 HB2 SER 79 HB2 SER 79 -15.101 2.552 -15.264 1380 HB3 SER 79 HB3 SER 79 -15.583 4.196 -14.853 1381 HG SER 79 HG SER 79 -13.449 3.343 -16.274 1382 H ASN 80 H ASN 80 -15.204 0.977 -12.604 1383 HA ASN 80 HA ASN 80 -17.768 1.889 -11.581 1384 HB2 ASN 80 HB2 ASN 80 -16.571 -0.898 -11.538 1385 HB3 ASN 80 HB3 ASN 80 -18.258 -0.478 -11.257 1386 HD21 ASN 80 HD21 ASN 80 -18.908 -1.837 -12.931 1387 HD22 ASN 80 HD22 ASN 80 -18.693 -1.411 -14.592 1388 H LEU 81 H LEU 81 -17.042 3.202 -9.830 1389 HA LEU 81 HA LEU 81 -15.435 1.905 -7.748 1390 HB2 LEU 81 HB2 LEU 81 -16.220 4.806 -8.028 1391 HB3 LEU 81 HB3 LEU 81 -15.055 4.147 -6.895 1392 HG LEU 81 HG LEU 81 -14.766 4.225 -9.902 1393 HD11 LEU 81 HD11 LEU 81 -12.942 5.793 -9.441 1394 HD12 LEU 81 HD12 LEU 81 -13.300 5.712 -7.715 1395 HD13 LEU 81 HD13 LEU 81 -14.480 6.405 -8.831 1396 HD21 LEU 81 HD21 LEU 81 -12.859 3.178 -7.804 1397 HD22 LEU 81 HD22 LEU 81 -12.520 3.333 -9.528 1398 HD23 LEU 81 HD23 LEU 81 -13.753 2.203 -8.973 1399 H GLU 82 H GLU 82 -16.071 1.636 -5.664 1400 HA GLU 82 HA GLU 82 -18.897 1.954 -5.050 1401 HB2 GLU 82 HB2 GLU 82 -18.247 0.736 -2.913 1402 HB3 GLU 82 HB3 GLU 82 -18.099 -0.159 -4.415 1403 HG2 GLU 82 HG2 GLU 82 -16.209 -0.642 -3.074 1404 HG3 GLU 82 HG3 GLU 82 -15.672 0.340 -4.424 1405 H HIS 83 H HIS 83 -16.394 3.947 -4.999 1406 HA HIS 83 HA HIS 83 -16.390 5.146 -2.451 1407 HB2 HIS 83 HB2 HIS 83 -15.758 6.332 -5.167 1408 HB3 HIS 83 HB3 HIS 83 -15.424 7.120 -3.632 1409 HD1 HIS 83 HD1 HIS 83 -13.110 6.792 -2.819 1410 HD2 HIS 83 HD2 HIS 83 -14.361 3.638 -5.222 1411 HE1 HIS 83 HE1 HIS 83 -11.112 5.306 -3.076 1412 HE2 HIS 83 HE2 HIS 83 -11.986 3.285 -4.280 1413 H HIS 84 H HIS 84 -18.761 5.153 -4.898 1414 HA HIS 84 HA HIS 84 -20.110 7.539 -3.936 1415 HB2 HIS 84 HB2 HIS 84 -20.990 5.409 -5.904 1416 HB3 HIS 84 HB3 HIS 84 -21.905 6.866 -5.526 1417 HD1 HIS 84 HD1 HIS 84 -21.033 9.099 -6.498 1418 HD2 HIS 84 HD2 HIS 84 -18.759 5.789 -7.560 1419 HE1 HIS 84 HE1 HIS 84 -19.551 9.874 -8.366 1420 HE2 HIS 84 HE2 HIS 84 -18.336 7.806 -9.117 1421 H HIS 85 H HIS 85 -20.446 7.060 -1.756 1422 HA HIS 85 HA HIS 85 -21.618 4.608 -0.886 1423 HB2 HIS 85 HB2 HIS 85 -21.840 5.832 1.328 1424 HB3 HIS 85 HB3 HIS 85 -20.213 5.692 0.679 1425 HD1 HIS 85 HD1 HIS 85 -18.980 7.849 0.115 1426 HD2 HIS 85 HD2 HIS 85 -22.922 8.464 1.277 1427 HE1 HIS 85 HE1 HIS 85 -19.205 10.326 0.449 1428 HE2 HIS 85 HE2 HIS 85 -21.633 10.686 1.003 1429 H HIS 86 H HIS 86 -23.439 4.627 -2.378 1430 HA HIS 86 HA HIS 86 -25.578 6.519 -1.927 1431 HB2 HIS 86 HB2 HIS 86 -26.797 5.149 -3.637 1432 HB3 HIS 86 HB3 HIS 86 -25.245 5.767 -4.187 1433 HD1 HIS 86 HD1 HIS 86 -26.894 2.554 -3.086 1434 HD2 HIS 86 HD2 HIS 86 -23.428 3.845 -4.982 1435 HE1 HIS 86 HE1 HIS 86 -25.786 0.475 -3.950 1436 HE2 HIS 86 HE2 HIS 86 -23.780 1.294 -5.228 1437 H HIS 87 H HIS 87 -25.317 5.602 0.480 1438 HA HIS 87 HA HIS 87 -27.752 4.111 0.951 1439 HB2 HIS 87 HB2 HIS 87 -26.733 2.377 2.358 1440 HB3 HIS 87 HB3 HIS 87 -26.127 2.282 0.710 1441 HD1 HIS 87 HD1 HIS 87 -25.007 2.392 4.151 1442 HD2 HIS 87 HD2 HIS 87 -23.429 3.458 0.462 1443 HE1 HIS 87 HE1 HIS 87 -22.538 2.589 4.513 1444 HE2 HIS 87 HE2 HIS 87 -21.593 3.003 2.228 1445 H HIS 88 H HIS 88 -28.589 4.384 3.048 1446 HA HIS 88 HA HIS 88 -27.106 6.058 4.938 1447 HB2 HIS 88 HB2 HIS 88 -28.239 7.632 3.396 1448 HB3 HIS 88 HB3 HIS 88 -29.787 6.899 3.800 1449 HD1 HIS 88 HD1 HIS 88 -27.030 8.969 5.352 1450 HD2 HIS 88 HD2 HIS 88 -30.971 7.874 6.095 1451 HE1 HIS 88 HE1 HIS 88 -27.767 10.381 7.290 1452 HE2 HIS 88 HE2 HIS 88 -30.101 9.603 7.810 Start of MODEL 14 1 H1 MET 1 H1 MET 1 8.537 -20.150 9.580 2 H2 MET 1 H2 MET 1 8.936 -21.732 9.127 3 H3 MET 1 H3 MET 1 10.151 -20.664 9.621 4 HA MET 1 HA MET 1 7.965 -21.735 11.310 5 HB2 MET 1 HB2 MET 1 9.678 -23.404 10.841 6 HB3 MET 1 HB3 MET 1 10.947 -22.277 11.304 7 HG2 MET 1 HG2 MET 1 10.423 -23.990 13.024 8 HG3 MET 1 HG3 MET 1 10.258 -22.329 13.592 9 HE1 MET 1 HE1 MET 1 6.695 -25.081 12.545 10 HE2 MET 1 HE2 MET 1 8.384 -25.591 12.486 11 HE3 MET 1 HE3 MET 1 7.773 -24.421 11.318 12 H THR 2 H THR 2 7.863 -20.997 13.438 13 HA THR 2 HA THR 2 8.087 -19.597 15.217 14 HB THR 2 HB THR 2 10.613 -18.582 13.882 15 HG1 THR 2 HG1 THR 2 11.519 -19.898 15.702 16 HG21 THR 2 HG21 THR 2 11.190 -17.687 16.101 17 HG22 THR 2 HG22 THR 2 9.606 -18.171 16.707 18 HG23 THR 2 HG23 THR 2 9.732 -16.930 15.460 19 H ASP 3 H ASP 3 8.411 -18.203 12.004 20 HA ASP 3 HA ASP 3 7.576 -15.580 12.710 21 HB2 ASP 3 HB2 ASP 3 7.280 -15.283 10.256 22 HB3 ASP 3 HB3 ASP 3 8.857 -15.925 10.699 23 H PHE 4 H PHE 4 5.572 -14.566 11.796 24 HA PHE 4 HA PHE 4 3.249 -16.259 11.466 25 HB2 PHE 4 HB2 PHE 4 2.003 -15.275 13.361 26 HB3 PHE 4 HB3 PHE 4 3.399 -16.194 13.907 27 HD1 PHE 4 HD2 PHE 4 5.323 -15.066 14.903 28 HD2 PHE 4 HD1 PHE 4 1.905 -12.864 13.626 29 HE1 PHE 4 HE2 PHE 4 6.109 -13.115 16.173 30 HE2 PHE 4 HE1 PHE 4 2.694 -10.908 14.893 31 HZ PHE 4 HZ PHE 4 4.804 -11.023 16.155 32 H LEU 5 H LEU 5 1.284 -14.991 10.981 33 HA LEU 5 HA LEU 5 1.900 -12.672 9.370 34 HB2 LEU 5 HB2 LEU 5 0.294 -14.340 8.582 35 HB3 LEU 5 HB3 LEU 5 -0.726 -14.039 9.972 36 HG LEU 5 HG LEU 5 -1.206 -11.775 9.168 37 HD11 LEU 5 HD11 LEU 5 0.909 -11.289 8.060 38 HD12 LEU 5 HD12 LEU 5 -0.442 -11.037 6.958 39 HD13 LEU 5 HD13 LEU 5 0.552 -12.487 6.814 40 HD21 LEU 5 HD21 LEU 5 -2.502 -12.371 7.167 41 HD22 LEU 5 HD22 LEU 5 -2.664 -13.583 8.438 42 HD23 LEU 5 HD23 LEU 5 -1.618 -13.894 7.051 43 H ALA 6 H ALA 6 2.247 -10.827 10.408 44 HA ALA 6 HA ALA 6 0.647 -10.118 12.770 45 HB1 ALA 6 HB1 ALA 6 2.399 -8.493 13.240 46 HB2 ALA 6 HB2 ALA 6 3.210 -8.908 11.730 47 HB3 ALA 6 HB3 ALA 6 3.082 -10.104 13.020 48 H GLY 7 H GLY 7 -0.382 -8.096 12.948 49 HA2 GLY 7 HA2 GLY 7 -0.707 -6.591 10.418 50 HA3 GLY 7 HA3 GLY 7 -2.043 -6.914 11.511 51 H ILE 8 H ILE 8 -0.874 -4.367 10.510 52 HA ILE 8 HA ILE 8 -0.600 -3.050 13.140 53 HB ILE 8 HB ILE 8 0.946 -2.197 10.672 54 HG12 ILE 8 HG12 ILE 8 1.963 -3.658 13.132 55 HG13 ILE 8 HG13 ILE 8 1.821 -4.342 11.516 56 HG21 ILE 8 HG21 ILE 8 1.129 -1.278 13.548 57 HG22 ILE 8 HG22 ILE 8 0.403 -0.376 12.217 58 HG23 ILE 8 HG23 ILE 8 2.134 -0.709 12.212 59 HD11 ILE 8 HD11 ILE 8 4.116 -3.748 12.012 60 HD12 ILE 8 HD12 ILE 8 3.638 -2.080 12.326 61 HD13 ILE 8 HD13 ILE 8 3.489 -2.748 10.700 62 H ARG 9 H ARG 9 -1.790 -1.159 13.346 63 HA ARG 9 HA ARG 9 -3.223 -0.222 10.938 64 HB2 ARG 9 HB2 ARG 9 -4.784 -1.248 12.464 65 HB3 ARG 9 HB3 ARG 9 -4.177 -0.291 13.807 66 HG2 ARG 9 HG2 ARG 9 -5.170 1.683 13.000 67 HG3 ARG 9 HG3 ARG 9 -5.424 0.998 11.392 68 HD2 ARG 9 HD2 ARG 9 -6.789 -0.017 13.889 69 HD3 ARG 9 HD3 ARG 9 -7.496 1.175 12.795 70 HE ARG 9 HE ARG 9 -6.970 -0.771 11.088 71 HH11 ARG 9 HH11 ARG 9 -8.306 -1.034 14.255 72 HH12 ARG 9 HH12 ARG 9 -9.299 -2.386 13.841 73 HH21 ARG 9 HH21 ARG 9 -8.218 -2.547 10.590 74 HH22 ARG 9 HH22 ARG 9 -9.249 -3.232 11.795 75 H ILE 10 H ILE 10 -2.739 1.723 10.280 76 HA ILE 10 HA ILE 10 -1.399 3.620 12.109 77 HB ILE 10 HB ILE 10 -1.306 3.537 9.082 78 HG12 ILE 10 HG12 ILE 10 0.815 2.617 11.042 79 HG13 ILE 10 HG13 ILE 10 -0.239 1.540 10.132 80 HG21 ILE 10 HG21 ILE 10 -0.901 5.756 10.018 81 HG22 ILE 10 HG22 ILE 10 0.572 5.091 9.312 82 HG23 ILE 10 HG23 ILE 10 0.360 5.097 11.062 83 HD11 ILE 10 HD11 ILE 10 1.928 1.686 9.087 84 HD12 ILE 10 HD12 ILE 10 1.788 3.440 8.976 85 HD13 ILE 10 HD13 ILE 10 0.704 2.407 8.043 86 H VAL 11 H VAL 11 -2.703 5.297 12.744 87 HA VAL 11 HA VAL 11 -4.436 6.507 10.677 88 HB VAL 11 HB VAL 11 -5.046 6.249 13.631 89 HG11 VAL 11 HG11 VAL 11 -6.582 7.746 11.504 90 HG12 VAL 11 HG12 VAL 11 -5.710 8.464 12.857 91 HG13 VAL 11 HG13 VAL 11 -7.130 7.461 13.157 92 HG21 VAL 11 HG21 VAL 11 -6.495 5.198 11.195 93 HG22 VAL 11 HG22 VAL 11 -7.007 4.995 12.872 94 HG23 VAL 11 HG23 VAL 11 -5.517 4.237 12.307 95 H GLY 12 H GLY 12 -3.878 8.484 10.149 96 HA2 GLY 12 HA2 GLY 12 -2.801 10.338 12.147 97 HA3 GLY 12 HA3 GLY 12 -1.769 9.957 10.777 98 H GLU 13 H GLU 13 -2.437 12.558 11.163 99 HA GLU 13 HA GLU 13 -4.855 13.387 9.955 100 HB2 GLU 13 HB2 GLU 13 -3.837 15.630 9.898 101 HB3 GLU 13 HB3 GLU 13 -3.613 14.845 11.460 102 HG2 GLU 13 HG2 GLU 13 -1.310 14.249 10.801 103 HG3 GLU 13 HG3 GLU 13 -1.545 15.091 9.272 104 H ASP 14 H ASP 14 -5.435 13.696 7.887 105 HA ASP 14 HA ASP 14 -3.790 12.605 5.806 106 HB2 ASP 14 HB2 ASP 14 -6.190 12.223 5.830 107 HB3 ASP 14 HB3 ASP 14 -6.500 13.953 5.757 108 H LYS 15 H LYS 15 -2.072 13.786 5.151 109 HA LYS 15 HA LYS 15 -2.442 16.663 4.581 110 HB2 LYS 15 HB2 LYS 15 0.195 15.266 5.064 111 HB3 LYS 15 HB3 LYS 15 -0.087 16.996 4.940 112 HG2 LYS 15 HG2 LYS 15 -1.025 15.179 7.142 113 HG3 LYS 15 HG3 LYS 15 0.287 16.355 7.215 114 HD2 LYS 15 HD2 LYS 15 -2.468 17.258 6.479 115 HD3 LYS 15 HD3 LYS 15 -2.071 16.954 8.171 116 HE2 LYS 15 HE2 LYS 15 -0.455 18.775 6.389 117 HE3 LYS 15 HE3 LYS 15 -1.789 19.338 7.396 118 HZ1 LYS 15 HZ1 LYS 15 0.681 17.999 8.367 119 HZ2 LYS 15 HZ2 LYS 15 -0.612 18.487 9.342 120 HZ3 LYS 15 HZ3 LYS 15 0.309 19.642 8.521 121 H ASN 16 H ASN 16 -0.518 17.367 3.088 122 HA ASN 16 HA ASN 16 -1.133 16.780 0.493 123 HB2 ASN 16 HB2 ASN 16 1.340 17.876 1.798 124 HB3 ASN 16 HB3 ASN 16 1.206 17.763 0.038 125 HD21 ASN 16 HD21 ASN 16 0.015 19.321 2.912 126 HD22 ASN 16 HD22 ASN 16 -0.823 20.596 2.109 127 H GLY 17 H GLY 17 1.093 14.945 2.528 128 HA2 GLY 17 HA2 GLY 17 1.378 13.007 0.349 129 HA3 GLY 17 HA3 GLY 17 2.855 13.759 0.913 130 H MET 18 H MET 18 0.339 13.052 3.234 131 HA MET 18 HA MET 18 2.104 11.383 4.748 132 HB2 MET 18 HB2 MET 18 -0.819 12.100 4.995 133 HB3 MET 18 HB3 MET 18 -0.073 10.938 6.083 134 HG2 MET 18 HG2 MET 18 0.944 13.740 5.703 135 HG3 MET 18 HG3 MET 18 -0.222 13.278 6.944 136 HE1 MET 18 HE1 MET 18 0.815 10.346 7.644 137 HE2 MET 18 HE2 MET 18 0.291 11.515 8.857 138 HE3 MET 18 HE3 MET 18 1.840 10.691 9.035 139 H THR 19 H THR 19 -0.895 10.645 2.959 140 HA THR 19 HA THR 19 -1.005 7.906 3.494 141 HB THR 19 HB THR 19 -2.404 7.747 1.445 142 HG1 THR 19 HG1 THR 19 -2.505 9.405 0.036 143 HG21 THR 19 HG21 THR 19 -4.134 9.388 2.123 144 HG22 THR 19 HG22 THR 19 -2.954 10.175 3.172 145 HG23 THR 19 HG23 THR 19 -3.462 8.519 3.503 146 H ASN 20 H ASN 20 0.755 9.663 0.982 147 HA ASN 20 HA ASN 20 1.570 7.319 -0.440 148 HB2 ASN 20 HB2 ASN 20 1.275 9.657 -1.399 149 HB3 ASN 20 HB3 ASN 20 2.780 10.089 -0.594 150 HD21 ASN 20 HD21 ASN 20 2.072 9.983 -3.450 151 HD22 ASN 20 HD22 ASN 20 3.234 8.938 -4.163 152 H GLN 21 H GLN 21 3.168 9.585 1.820 153 HA GLN 21 HA GLN 21 5.694 8.342 1.717 154 HB2 GLN 21 HB2 GLN 21 6.346 9.728 3.499 155 HB3 GLN 21 HB3 GLN 21 5.193 10.668 2.578 156 HG2 GLN 21 HG2 GLN 21 3.481 10.261 4.222 157 HG3 GLN 21 HG3 GLN 21 4.538 9.161 5.105 158 HE21 GLN 21 HE21 GLN 21 3.914 12.481 4.291 159 HE22 GLN 21 HE22 GLN 21 4.914 13.175 5.515 160 H ILE 22 H ILE 22 2.887 7.779 3.760 161 HA ILE 22 HA ILE 22 4.119 6.119 5.680 162 HB ILE 22 HB ILE 22 1.278 6.530 4.803 163 HG12 ILE 22 HG12 ILE 22 2.369 8.206 6.242 164 HG13 ILE 22 HG13 ILE 22 1.040 7.411 7.079 165 HG21 ILE 22 HG21 ILE 22 0.510 5.030 6.609 166 HG22 ILE 22 HG22 ILE 22 2.172 4.481 6.835 167 HG23 ILE 22 HG23 ILE 22 1.337 4.169 5.312 168 HD11 ILE 22 HD11 ILE 22 3.963 6.772 7.423 169 HD12 ILE 22 HD12 ILE 22 2.623 6.008 8.279 170 HD13 ILE 22 HD13 ILE 22 2.968 7.719 8.532 171 H THR 23 H THR 23 2.170 5.190 2.808 172 HA THR 23 HA THR 23 2.723 2.418 3.122 173 HB THR 23 HB THR 23 1.864 3.796 0.557 174 HG1 THR 23 HG1 THR 23 0.155 4.242 1.767 175 HG21 THR 23 HG21 THR 23 2.634 1.484 0.259 176 HG22 THR 23 HG22 THR 23 0.895 1.618 -0.001 177 HG23 THR 23 HG23 THR 23 1.512 0.949 1.510 178 H GLY 24 H GLY 24 4.358 5.048 1.493 179 HA2 GLY 24 HA2 GLY 24 6.231 3.571 -0.016 180 HA3 GLY 24 HA3 GLY 24 6.469 5.200 0.597 181 H VAL 25 H VAL 25 6.535 4.931 3.292 182 HA VAL 25 HA VAL 25 9.027 3.836 3.930 183 HB VAL 25 HB VAL 25 6.666 4.405 5.746 184 HG11 VAL 25 HG11 VAL 25 8.115 2.774 6.829 185 HG12 VAL 25 HG12 VAL 25 8.274 4.344 7.614 186 HG13 VAL 25 HG13 VAL 25 9.526 3.782 6.506 187 HG21 VAL 25 HG21 VAL 25 7.552 6.379 4.622 188 HG22 VAL 25 HG22 VAL 25 9.183 5.979 5.159 189 HG23 VAL 25 HG23 VAL 25 7.950 6.427 6.339 190 H ILE 26 H ILE 26 5.793 2.432 4.182 191 HA ILE 26 HA ILE 26 6.507 -0.031 5.344 192 HB ILE 26 HB ILE 26 4.210 0.723 3.534 193 HG12 ILE 26 HG12 ILE 26 4.359 0.243 6.523 194 HG13 ILE 26 HG13 ILE 26 4.277 1.820 5.745 195 HG21 ILE 26 HG21 ILE 26 4.584 -1.660 3.286 196 HG22 ILE 26 HG22 ILE 26 3.126 -1.374 4.236 197 HG23 ILE 26 HG23 ILE 26 4.619 -1.863 5.038 198 HD11 ILE 26 HD11 ILE 26 2.061 1.236 4.856 199 HD12 ILE 26 HD12 ILE 26 2.122 1.200 6.617 200 HD13 ILE 26 HD13 ILE 26 2.148 -0.309 5.705 201 H SER 27 H SER 27 6.234 0.920 1.914 202 HA SER 27 HA SER 27 6.728 -1.670 0.875 203 HB2 SER 27 HB2 SER 27 7.025 -0.599 -1.291 204 HB3 SER 27 HB3 SER 27 5.653 0.117 -0.453 205 HG SER 27 HG SER 27 7.778 1.544 0.204 206 H LYS 28 H LYS 28 8.879 0.759 2.087 207 HA LYS 28 HA LYS 28 11.202 -0.621 0.936 208 HB2 LYS 28 HB2 LYS 28 12.534 1.270 1.739 209 HB3 LYS 28 HB3 LYS 28 11.183 1.822 0.759 210 HG2 LYS 28 HG2 LYS 28 9.956 2.285 2.913 211 HG3 LYS 28 HG3 LYS 28 11.475 1.968 3.752 212 HD2 LYS 28 HD2 LYS 28 11.203 4.359 3.415 213 HD3 LYS 28 HD3 LYS 28 12.549 3.771 2.436 214 HE2 LYS 28 HE2 LYS 28 11.148 3.769 0.452 215 HE3 LYS 28 HE3 LYS 28 9.740 4.222 1.410 216 HZ1 LYS 28 HZ1 LYS 28 10.598 6.144 0.306 217 HZ2 LYS 28 HZ2 LYS 28 12.151 5.878 0.918 218 HZ3 LYS 28 HZ3 LYS 28 10.899 6.309 1.964 219 H PHE 29 H PHE 29 9.416 -1.622 3.206 220 HA PHE 29 HA PHE 29 11.248 -1.956 5.410 221 HB2 PHE 29 HB2 PHE 29 8.619 -3.244 4.678 222 HB3 PHE 29 HB3 PHE 29 9.601 -3.891 5.985 223 HD1 PHE 29 HD2 PHE 29 10.456 -0.759 6.548 224 HD2 PHE 29 HD1 PHE 29 6.865 -3.053 6.439 225 HE1 PHE 29 HE2 PHE 29 9.402 0.820 8.109 226 HE2 PHE 29 HE1 PHE 29 5.810 -1.474 8.004 227 HZ PHE 29 HZ PHE 29 7.077 0.463 8.842 228 H ASP 30 H ASP 30 11.357 -4.492 6.071 229 HA ASP 30 HA ASP 30 13.047 -5.737 4.052 230 HB2 ASP 30 HB2 ASP 30 13.377 -7.380 6.095 231 HB3 ASP 30 HB3 ASP 30 14.154 -5.799 6.084 232 H THR 31 H THR 31 10.128 -6.442 5.895 233 HA THR 31 HA THR 31 9.759 -9.080 4.818 234 HB THR 31 HB THR 31 8.911 -8.630 7.018 235 HG1 THR 31 HG1 THR 31 7.149 -9.776 6.715 236 HG21 THR 31 HG21 THR 31 7.074 -7.064 7.441 237 HG22 THR 31 HG22 THR 31 7.144 -6.535 5.759 238 HG23 THR 31 HG23 THR 31 8.512 -6.242 6.840 239 H ASN 32 H ASN 32 7.417 -9.581 3.901 240 HA ASN 32 HA ASN 32 7.090 -7.799 1.568 241 HB2 ASN 32 HB2 ASN 32 7.925 -10.084 1.032 242 HB3 ASN 32 HB3 ASN 32 6.442 -10.756 1.711 243 HD21 ASN 32 HD21 ASN 32 5.604 -11.594 -0.162 244 HD22 ASN 32 HD22 ASN 32 5.124 -10.624 -1.506 245 H ILE 33 H ILE 33 5.067 -7.233 0.866 246 HA ILE 33 HA ILE 33 3.073 -6.990 2.910 247 HB ILE 33 HB ILE 33 2.977 -6.182 -0.002 248 HG12 ILE 33 HG12 ILE 33 3.684 -4.560 2.468 249 HG13 ILE 33 HG13 ILE 33 4.824 -5.104 1.242 250 HG21 ILE 33 HG21 ILE 33 1.234 -5.322 2.317 251 HG22 ILE 33 HG22 ILE 33 0.741 -6.343 0.966 252 HG23 ILE 33 HG23 ILE 33 1.170 -4.655 0.684 253 HD11 ILE 33 HD11 ILE 33 3.693 -3.708 -0.417 254 HD12 ILE 33 HD12 ILE 33 4.280 -2.765 0.952 255 HD13 ILE 33 HD13 ILE 33 2.564 -3.156 0.822 256 H ARG 34 H ARG 34 1.663 -8.586 3.379 257 HA ARG 34 HA ARG 34 0.704 -10.374 1.270 258 HB2 ARG 34 HB2 ARG 34 0.378 -10.381 4.278 259 HB3 ARG 34 HB3 ARG 34 -0.507 -11.487 3.231 260 HG2 ARG 34 HG2 ARG 34 2.502 -11.268 3.323 261 HG3 ARG 34 HG3 ARG 34 1.551 -12.474 4.196 262 HD2 ARG 34 HD2 ARG 34 0.913 -13.571 2.254 263 HD3 ARG 34 HD3 ARG 34 1.197 -12.158 1.240 264 HE ARG 34 HE ARG 34 3.491 -13.521 2.461 265 HH11 ARG 34 HH11 ARG 34 1.659 -12.675 -0.317 266 HH12 ARG 34 HH12 ARG 34 2.885 -13.162 -1.429 267 HH21 ARG 34 HH21 ARG 34 5.094 -14.123 1.026 268 HH22 ARG 34 HH22 ARG 34 4.828 -13.943 -0.671 269 H THR 35 H THR 35 -0.444 -7.809 3.358 270 HA THR 35 HA THR 35 -2.610 -7.252 1.512 271 HB THR 35 HB THR 35 -3.331 -7.641 4.426 272 HG1 THR 35 HG1 THR 35 -3.340 -9.491 2.314 273 HG21 THR 35 HG21 THR 35 -5.642 -7.528 3.602 274 HG22 THR 35 HG22 THR 35 -5.043 -7.284 1.961 275 HG23 THR 35 HG23 THR 35 -4.740 -6.067 3.200 276 H ILE 36 H ILE 36 -3.152 -5.054 1.563 277 HA ILE 36 HA ILE 36 -2.622 -3.541 3.973 278 HB ILE 36 HB ILE 36 -0.473 -3.435 2.666 279 HG12 ILE 36 HG12 ILE 36 -1.806 -0.738 2.988 280 HG13 ILE 36 HG13 ILE 36 -1.271 -1.719 4.350 281 HG21 ILE 36 HG21 ILE 36 -2.142 -1.823 0.729 282 HG22 ILE 36 HG22 ILE 36 -1.312 -3.345 0.399 283 HG23 ILE 36 HG23 ILE 36 -0.379 -1.883 0.733 284 HD11 ILE 36 HD11 ILE 36 0.481 -0.652 2.152 285 HD12 ILE 36 HD12 ILE 36 1.011 -1.635 3.519 286 HD13 ILE 36 HD13 ILE 36 0.360 -0.017 3.793 287 H VAL 37 H VAL 37 -4.080 -1.985 4.299 288 HA VAL 37 HA VAL 37 -5.832 -1.181 2.060 289 HB VAL 37 HB VAL 37 -6.771 -1.989 4.831 290 HG11 VAL 37 HG11 VAL 37 -8.092 -0.137 3.948 291 HG12 VAL 37 HG12 VAL 37 -9.041 -1.624 3.977 292 HG13 VAL 37 HG13 VAL 37 -8.376 -1.032 2.453 293 HG21 VAL 37 HG21 VAL 37 -7.940 -3.821 3.678 294 HG22 VAL 37 HG22 VAL 37 -6.192 -3.926 3.469 295 HG23 VAL 37 HG23 VAL 37 -7.203 -3.326 2.153 296 H LEU 38 H LEU 38 -5.359 0.935 1.841 297 HA LEU 38 HA LEU 38 -5.393 2.635 4.259 298 HB2 LEU 38 HB2 LEU 38 -3.176 2.526 3.185 299 HB3 LEU 38 HB3 LEU 38 -3.875 3.074 1.677 300 HG LEU 38 HG LEU 38 -4.041 4.808 4.140 301 HD11 LEU 38 HD11 LEU 38 -1.712 4.696 2.217 302 HD12 LEU 38 HD12 LEU 38 -1.681 4.220 3.915 303 HD13 LEU 38 HD13 LEU 38 -1.954 5.907 3.478 304 HD21 LEU 38 HD21 LEU 38 -5.377 5.475 2.197 305 HD22 LEU 38 HD22 LEU 38 -3.937 5.447 1.181 306 HD23 LEU 38 HD23 LEU 38 -4.075 6.627 2.486 307 H ASN 39 H ASN 39 -7.135 3.902 4.382 308 HA ASN 39 HA ASN 39 -7.961 5.370 1.994 309 HB2 ASN 39 HB2 ASN 39 -10.418 5.036 2.758 310 HB3 ASN 39 HB3 ASN 39 -9.632 3.760 1.843 311 HD21 ASN 39 HD21 ASN 39 -8.973 4.326 5.245 312 HD22 ASN 39 HD22 ASN 39 -9.728 2.882 5.800 313 H ALA 40 H ALA 40 -8.750 7.434 2.368 314 HA ALA 40 HA ALA 40 -8.332 8.436 5.123 315 HB1 ALA 40 HB1 ALA 40 -6.723 9.242 3.445 316 HB2 ALA 40 HB2 ALA 40 -7.690 10.555 4.117 317 HB3 ALA 40 HB3 ALA 40 -8.050 9.927 2.508 318 H LYS 41 H LYS 41 -9.935 9.376 6.173 319 HA LYS 41 HA LYS 41 -12.041 10.842 4.845 320 HB2 LYS 41 HB2 LYS 41 -13.904 9.563 5.527 321 HB3 LYS 41 HB3 LYS 41 -12.783 8.396 4.846 322 HG2 LYS 41 HG2 LYS 41 -13.237 8.920 7.781 323 HG3 LYS 41 HG3 LYS 41 -13.849 7.548 6.863 324 HD2 LYS 41 HD2 LYS 41 -11.522 6.836 6.422 325 HD3 LYS 41 HD3 LYS 41 -10.942 8.193 7.393 326 HE2 LYS 41 HE2 LYS 41 -12.641 5.889 8.356 327 HE3 LYS 41 HE3 LYS 41 -10.934 6.154 8.708 328 HZ1 LYS 41 HZ1 LYS 41 -11.477 8.086 9.974 329 HZ2 LYS 41 HZ2 LYS 41 -12.458 6.824 10.519 330 HZ3 LYS 41 HZ3 LYS 41 -13.102 8.020 9.511 331 H ASP 42 H ASP 42 -13.502 11.911 6.469 332 HA ASP 42 HA ASP 42 -13.784 13.289 8.262 333 HB2 ASP 42 HB2 ASP 42 -12.056 11.285 9.741 334 HB3 ASP 42 HB3 ASP 42 -13.074 12.513 10.483 335 H GLY 43 H GLY 43 -11.250 13.387 6.509 336 HA2 GLY 43 HA2 GLY 43 -9.505 14.923 6.355 337 HA3 GLY 43 HA3 GLY 43 -9.856 15.452 7.993 338 H ILE 44 H ILE 44 -9.661 12.146 7.982 339 HA ILE 44 HA ILE 44 -6.802 12.140 8.752 340 HB ILE 44 HB ILE 44 -8.774 10.135 9.836 341 HG12 ILE 44 HG12 ILE 44 -8.326 12.905 10.987 342 HG13 ILE 44 HG13 ILE 44 -9.814 12.311 10.258 343 HG21 ILE 44 HG21 ILE 44 -6.409 9.753 10.257 344 HG22 ILE 44 HG22 ILE 44 -7.240 10.132 11.764 345 HG23 ILE 44 HG23 ILE 44 -6.252 11.358 10.972 346 HD11 ILE 44 HD11 ILE 44 -10.016 10.650 12.045 347 HD12 ILE 44 HD12 ILE 44 -9.975 12.300 12.668 348 HD13 ILE 44 HD13 ILE 44 -8.541 11.280 12.780 349 H PHE 45 H PHE 45 -5.837 9.843 8.533 350 HA PHE 45 HA PHE 45 -7.254 8.241 6.501 351 HB2 PHE 45 HB2 PHE 45 -5.307 7.837 5.220 352 HB3 PHE 45 HB3 PHE 45 -5.280 9.567 5.534 353 HD1 PHE 45 HD2 PHE 45 -3.626 10.527 7.060 354 HD2 PHE 45 HD1 PHE 45 -3.667 6.359 6.189 355 HE1 PHE 45 HE2 PHE 45 -1.372 10.306 8.016 356 HE2 PHE 45 HE1 PHE 45 -1.411 6.134 7.145 357 HZ PHE 45 HZ PHE 45 -0.266 8.108 8.066 358 H THR 46 H THR 46 -6.937 5.987 6.614 359 HA THR 46 HA THR 46 -5.398 4.994 8.919 360 HB THR 46 HB THR 46 -7.644 4.921 9.719 361 HG1 THR 46 HG1 THR 46 -6.638 3.059 10.305 362 HG21 THR 46 HG21 THR 46 -9.463 3.763 8.547 363 HG22 THR 46 HG22 THR 46 -8.392 3.469 7.176 364 HG23 THR 46 HG23 THR 46 -8.850 5.119 7.601 365 H CYS 47 H CYS 47 -3.933 3.576 8.307 366 HA CYS 47 HA CYS 47 -4.424 1.906 5.913 367 HB2 CYS 47 HB2 CYS 47 -2.645 3.543 5.519 368 HB3 CYS 47 HB3 CYS 47 -1.784 2.980 6.947 369 HG CYS 47 HG CYS 47 -1.167 2.082 4.010 370 H ASN 48 H ASN 48 -4.676 -0.189 6.397 371 HA ASN 48 HA ASN 48 -3.428 -1.290 8.818 372 HB2 ASN 48 HB2 ASN 48 -5.476 -2.540 6.965 373 HB3 ASN 48 HB3 ASN 48 -4.883 -3.246 8.462 374 HD21 ASN 48 HD21 ASN 48 -7.559 -2.769 7.917 375 HD22 ASN 48 HD22 ASN 48 -8.146 -1.550 8.991 376 H LEU 49 H LEU 49 -1.488 -2.189 8.589 377 HA LEU 49 HA LEU 49 -0.663 -3.316 6.008 378 HB2 LEU 49 HB2 LEU 49 0.864 -1.701 6.925 379 HB3 LEU 49 HB3 LEU 49 0.887 -2.524 8.475 380 HG LEU 49 HG LEU 49 2.044 -4.444 7.441 381 HD11 LEU 49 HD11 LEU 49 1.171 -4.254 5.180 382 HD12 LEU 49 HD12 LEU 49 2.934 -4.272 5.170 383 HD13 LEU 49 HD13 LEU 49 2.065 -2.753 4.941 384 HD21 LEU 49 HD21 LEU 49 3.384 -2.718 8.480 385 HD22 LEU 49 HD22 LEU 49 3.378 -1.772 6.992 386 HD23 LEU 49 HD23 LEU 49 4.208 -3.327 7.045 387 H MET 50 H MET 50 -0.493 -5.447 5.696 388 HA MET 50 HA MET 50 -0.436 -7.248 8.043 389 HB2 MET 50 HB2 MET 50 -1.678 -7.814 5.341 390 HB3 MET 50 HB3 MET 50 -1.687 -8.885 6.737 391 HG2 MET 50 HG2 MET 50 -3.094 -6.237 6.465 392 HG3 MET 50 HG3 MET 50 -3.827 -7.837 6.542 393 HE1 MET 50 HE1 MET 50 -1.730 -9.012 8.849 394 HE2 MET 50 HE2 MET 50 -3.438 -9.441 8.709 395 HE3 MET 50 HE3 MET 50 -2.801 -8.848 10.242 396 H ILE 51 H ILE 51 1.521 -8.109 8.232 397 HA ILE 51 HA ILE 51 2.905 -9.175 5.879 398 HB ILE 51 HB ILE 51 5.080 -8.130 6.836 399 HG12 ILE 51 HG12 ILE 51 4.564 -5.782 7.790 400 HG13 ILE 51 HG13 ILE 51 2.966 -6.417 8.165 401 HG21 ILE 51 HG21 ILE 51 3.072 -6.371 5.429 402 HG22 ILE 51 HG22 ILE 51 4.135 -7.554 4.667 403 HG23 ILE 51 HG23 ILE 51 4.821 -6.138 5.459 404 HD11 ILE 51 HD11 ILE 51 5.571 -7.513 9.194 405 HD12 ILE 51 HD12 ILE 51 3.957 -8.094 9.610 406 HD13 ILE 51 HD13 ILE 51 4.462 -6.471 10.083 407 H PHE 52 H PHE 52 4.763 -10.591 6.458 408 HA PHE 52 HA PHE 52 4.219 -12.065 8.926 409 HB2 PHE 52 HB2 PHE 52 5.780 -12.667 6.430 410 HB3 PHE 52 HB3 PHE 52 6.097 -13.587 7.897 411 HD1 PHE 52 HD2 PHE 52 4.369 -15.014 8.874 412 HD2 PHE 52 HD1 PHE 52 3.746 -12.986 5.181 413 HE1 PHE 52 HE2 PHE 52 2.468 -16.493 8.392 414 HE2 PHE 52 HE1 PHE 52 1.840 -14.463 4.692 415 HZ PHE 52 HZ PHE 52 1.197 -16.219 6.296 416 H VAL 53 H VAL 53 5.564 -12.190 10.668 417 HA VAL 53 HA VAL 53 8.203 -10.862 10.490 418 HB VAL 53 HB VAL 53 7.949 -9.900 12.699 419 HG11 VAL 53 HG11 VAL 53 7.163 -8.526 10.857 420 HG12 VAL 53 HG12 VAL 53 6.166 -8.260 12.289 421 HG13 VAL 53 HG13 VAL 53 5.564 -9.264 10.970 422 HG21 VAL 53 HG21 VAL 53 5.834 -10.002 13.925 423 HG22 VAL 53 HG22 VAL 53 6.551 -11.600 13.725 424 HG23 VAL 53 HG23 VAL 53 5.188 -11.110 12.716 425 H LYS 54 H LYS 54 9.878 -11.804 11.614 426 HA LYS 54 HA LYS 54 9.673 -14.557 12.260 427 HB2 LYS 54 HB2 LYS 54 12.046 -14.310 12.999 428 HB3 LYS 54 HB3 LYS 54 11.726 -13.720 11.374 429 HG2 LYS 54 HG2 LYS 54 11.669 -11.423 12.212 430 HG3 LYS 54 HG3 LYS 54 11.984 -12.011 13.844 431 HD2 LYS 54 HD2 LYS 54 14.046 -11.206 12.867 432 HD3 LYS 54 HD3 LYS 54 14.127 -12.958 13.060 433 HE2 LYS 54 HE2 LYS 54 13.610 -13.262 10.694 434 HE3 LYS 54 HE3 LYS 54 13.456 -11.518 10.489 435 HZ1 LYS 54 HZ1 LYS 54 15.610 -12.369 9.747 436 HZ2 LYS 54 HZ2 LYS 54 15.943 -12.914 11.311 437 HZ3 LYS 54 HZ3 LYS 54 15.776 -11.258 11.010 438 H ASN 55 H ASN 55 9.225 -11.734 14.210 439 HA ASN 55 HA ASN 55 8.364 -13.299 16.430 440 HB2 ASN 55 HB2 ASN 55 9.997 -12.370 18.100 441 HB3 ASN 55 HB3 ASN 55 10.692 -13.525 16.965 442 HD21 ASN 55 HD21 ASN 55 12.311 -12.876 15.638 443 HD22 ASN 55 HD22 ASN 55 12.999 -11.296 15.664 444 H THR 56 H THR 56 7.799 -11.871 18.364 445 HA THR 56 HA THR 56 6.068 -9.811 17.500 446 HB THR 56 HB THR 56 5.709 -9.343 19.914 447 HG1 THR 56 HG1 THR 56 7.192 -9.921 21.305 448 HG21 THR 56 HG21 THR 56 4.470 -11.172 18.845 449 HG22 THR 56 HG22 THR 56 4.839 -11.558 20.527 450 HG23 THR 56 HG23 THR 56 5.781 -12.289 19.227 451 H ASP 57 H ASP 57 9.343 -9.723 18.765 452 HA ASP 57 HA ASP 57 9.466 -6.953 19.351 453 HB2 ASP 57 HB2 ASP 57 11.142 -8.427 20.267 454 HB3 ASP 57 HB3 ASP 57 11.621 -8.967 18.662 455 H LYS 58 H LYS 58 10.204 -8.866 16.493 456 HA LYS 58 HA LYS 58 11.107 -6.848 14.786 457 HB2 LYS 58 HB2 LYS 58 11.391 -9.163 14.221 458 HB3 LYS 58 HB3 LYS 58 9.658 -9.453 14.275 459 HG2 LYS 58 HG2 LYS 58 10.483 -9.384 11.990 460 HG3 LYS 58 HG3 LYS 58 9.341 -8.077 12.321 461 HD2 LYS 58 HD2 LYS 58 11.145 -6.478 12.516 462 HD3 LYS 58 HD3 LYS 58 12.351 -7.760 12.414 463 HE2 LYS 58 HE2 LYS 58 12.214 -6.590 10.299 464 HE3 LYS 58 HE3 LYS 58 11.611 -8.235 10.103 465 HZ1 LYS 58 HZ1 LYS 58 9.391 -7.444 10.104 466 HZ2 LYS 58 HZ2 LYS 58 10.261 -6.504 9.000 467 HZ3 LYS 58 HZ3 LYS 58 9.870 -5.877 10.523 468 H LEU 59 H LEU 59 7.860 -7.756 15.756 469 HA LEU 59 HA LEU 59 6.510 -6.210 13.746 470 HB2 LEU 59 HB2 LEU 59 5.413 -8.131 14.714 471 HB3 LEU 59 HB3 LEU 59 5.555 -7.457 16.327 472 HG LEU 59 HG LEU 59 3.975 -5.673 15.743 473 HD11 LEU 59 HD11 LEU 59 2.753 -5.728 13.622 474 HD12 LEU 59 HD12 LEU 59 3.781 -7.046 13.060 475 HD13 LEU 59 HD13 LEU 59 4.476 -5.455 13.369 476 HD21 LEU 59 HD21 LEU 59 2.955 -8.439 15.090 477 HD22 LEU 59 HD22 LEU 59 1.966 -7.052 15.550 478 HD23 LEU 59 HD23 LEU 59 3.112 -7.736 16.701 479 H THR 60 H THR 60 7.118 -5.717 17.247 480 HA THR 60 HA THR 60 5.841 -3.173 17.333 481 HB THR 60 HB THR 60 6.071 -4.377 19.385 482 HG1 THR 60 HG1 THR 60 7.266 -2.715 20.640 483 HG21 THR 60 HG21 THR 60 8.233 -4.778 20.452 484 HG22 THR 60 HG22 THR 60 9.050 -4.131 19.028 485 HG23 THR 60 HG23 THR 60 8.098 -5.609 18.903 486 H THR 61 H THR 61 9.120 -4.166 16.632 487 HA THR 61 HA THR 61 10.397 -1.672 16.606 488 HB THR 61 HB THR 61 10.850 -4.055 14.784 489 HG1 THR 61 HG1 THR 61 11.421 -4.615 16.831 490 HG21 THR 61 HG21 THR 61 13.048 -3.068 14.280 491 HG22 THR 61 HG22 THR 61 12.616 -1.627 15.200 492 HG23 THR 61 HG23 THR 61 11.740 -2.024 13.722 493 H LEU 62 H LEU 62 8.401 -3.232 14.103 494 HA LEU 62 HA LEU 62 8.716 -1.251 12.121 495 HB2 LEU 62 HB2 LEU 62 6.391 -3.111 12.633 496 HB3 LEU 62 HB3 LEU 62 6.583 -2.137 11.186 497 HG LEU 62 HG LEU 62 8.381 -4.400 12.080 498 HD11 LEU 62 HD11 LEU 62 7.596 -5.511 10.062 499 HD12 LEU 62 HD12 LEU 62 6.564 -4.130 9.687 500 HD13 LEU 62 HD13 LEU 62 6.243 -5.107 11.120 501 HD21 LEU 62 HD21 LEU 62 9.721 -2.643 11.037 502 HD22 LEU 62 HD22 LEU 62 8.620 -2.606 9.659 503 HD23 LEU 62 HD23 LEU 62 9.591 -4.044 9.972 504 H MET 63 H MET 63 6.487 -1.485 14.865 505 HA MET 63 HA MET 63 4.780 0.645 14.309 506 HB2 MET 63 HB2 MET 63 5.940 0.011 17.035 507 HB3 MET 63 HB3 MET 63 4.462 0.900 16.711 508 HG2 MET 63 HG2 MET 63 3.461 -1.131 15.765 509 HG3 MET 63 HG3 MET 63 4.942 -2.018 16.144 510 HE1 MET 63 HE1 MET 63 2.752 -3.524 18.937 511 HE2 MET 63 HE2 MET 63 4.035 -3.834 17.764 512 HE3 MET 63 HE3 MET 63 2.434 -3.313 17.214 513 H ASP 64 H ASP 64 7.889 0.733 16.051 514 HA ASP 64 HA ASP 64 8.132 3.448 16.508 515 HB2 ASP 64 HB2 ASP 64 9.683 1.806 17.417 516 HB3 ASP 64 HB3 ASP 64 10.294 1.448 15.809 517 H LYS 65 H LYS 65 9.315 1.640 13.687 518 HA LYS 65 HA LYS 65 10.407 3.716 12.214 519 HB2 LYS 65 HB2 LYS 65 8.942 1.282 11.185 520 HB3 LYS 65 HB3 LYS 65 10.029 2.282 10.230 521 HG2 LYS 65 HG2 LYS 65 11.837 1.683 11.900 522 HG3 LYS 65 HG3 LYS 65 10.711 0.500 12.564 523 HD2 LYS 65 HD2 LYS 65 12.128 -0.652 11.014 524 HD3 LYS 65 HD3 LYS 65 10.537 -0.503 10.266 525 HE2 LYS 65 HE2 LYS 65 11.315 1.392 8.946 526 HE3 LYS 65 HE3 LYS 65 12.892 1.316 9.728 527 HZ1 LYS 65 HZ1 LYS 65 12.993 0.265 7.592 528 HZ2 LYS 65 HZ2 LYS 65 11.697 -0.748 7.970 529 HZ3 LYS 65 HZ3 LYS 65 13.165 -0.922 8.787 530 H LEU 66 H LEU 66 7.034 2.697 12.425 531 HA LEU 66 HA LEU 66 6.119 4.576 10.423 532 HB2 LEU 66 HB2 LEU 66 4.568 2.898 12.408 533 HB3 LEU 66 HB3 LEU 66 3.880 3.761 11.041 534 HG LEU 66 HG LEU 66 5.915 1.537 10.762 535 HD11 LEU 66 HD11 LEU 66 3.894 0.647 11.777 536 HD12 LEU 66 HD12 LEU 66 4.048 0.101 10.108 537 HD13 LEU 66 HD13 LEU 66 2.912 1.389 10.513 538 HD21 LEU 66 HD21 LEU 66 5.835 3.092 8.878 539 HD22 LEU 66 HD22 LEU 66 4.093 2.851 8.742 540 HD23 LEU 66 HD23 LEU 66 5.198 1.512 8.428 541 H ARG 67 H ARG 67 6.469 4.536 13.896 542 HA ARG 67 HA ARG 67 4.731 6.761 14.429 543 HB2 ARG 67 HB2 ARG 67 6.824 5.353 16.100 544 HB3 ARG 67 HB3 ARG 67 5.869 6.707 16.701 545 HG2 ARG 67 HG2 ARG 67 3.819 5.447 16.369 546 HG3 ARG 67 HG3 ARG 67 4.732 4.109 15.678 547 HD2 ARG 67 HD2 ARG 67 5.887 3.804 17.832 548 HD3 ARG 67 HD3 ARG 67 4.930 5.119 18.519 549 HE ARG 67 HE ARG 67 3.003 3.519 17.664 550 HH11 ARG 67 HH11 ARG 67 5.854 2.778 19.450 551 HH12 ARG 67 HH12 ARG 67 5.160 1.373 20.175 552 HH21 ARG 67 HH21 ARG 67 2.131 1.707 18.579 553 HH22 ARG 67 HH22 ARG 67 3.071 0.770 19.685 554 H LYS 68 H LYS 68 7.758 6.571 13.023 555 HA LYS 68 HA LYS 68 8.976 8.928 14.087 556 HB2 LYS 68 HB2 LYS 68 9.500 7.565 11.432 557 HB3 LYS 68 HB3 LYS 68 10.555 8.722 12.231 558 HG2 LYS 68 HG2 LYS 68 9.822 5.996 13.283 559 HG3 LYS 68 HG3 LYS 68 11.339 6.421 12.497 560 HD2 LYS 68 HD2 LYS 68 10.398 7.840 14.983 561 HD3 LYS 68 HD3 LYS 68 11.283 6.320 15.070 562 HE2 LYS 68 HE2 LYS 68 12.839 8.123 15.335 563 HE3 LYS 68 HE3 LYS 68 13.121 7.366 13.771 564 HZ1 LYS 68 HZ1 LYS 68 11.859 9.180 12.741 565 HZ2 LYS 68 HZ2 LYS 68 13.210 9.747 13.578 566 HZ3 LYS 68 HZ3 LYS 68 11.673 9.911 14.252 567 H VAL 69 H VAL 69 6.303 8.554 12.091 568 HA VAL 69 HA VAL 69 6.731 11.031 10.600 569 HB VAL 69 HB VAL 69 4.333 9.183 10.548 570 HG11 VAL 69 HG11 VAL 69 3.777 11.440 9.817 571 HG12 VAL 69 HG12 VAL 69 3.797 10.351 8.432 572 HG13 VAL 69 HG13 VAL 69 5.150 11.447 8.710 573 HG21 VAL 69 HG21 VAL 69 6.340 8.021 9.781 574 HG22 VAL 69 HG22 VAL 69 6.694 9.338 8.662 575 HG23 VAL 69 HG23 VAL 69 5.256 8.344 8.429 576 H GLN 70 H GLN 70 6.245 12.893 11.507 577 HA GLN 70 HA GLN 70 4.974 13.295 13.944 578 HB2 GLN 70 HB2 GLN 70 4.879 15.705 13.242 579 HB3 GLN 70 HB3 GLN 70 6.460 14.949 13.071 580 HG2 GLN 70 HG2 GLN 70 6.009 14.623 10.658 581 HG3 GLN 70 HG3 GLN 70 4.479 15.475 10.858 582 HE21 GLN 70 HE21 GLN 70 5.121 17.061 9.385 583 HE22 GLN 70 HE22 GLN 70 6.279 18.273 9.799 584 H GLY 71 H GLY 71 3.509 12.895 10.825 585 HA2 GLY 71 HA2 GLY 71 1.031 14.211 11.506 586 HA3 GLY 71 HA3 GLY 71 1.357 13.283 10.054 587 H VAL 72 H VAL 72 2.274 11.043 12.086 588 HA VAL 72 HA VAL 72 -0.418 9.866 12.230 589 HB VAL 72 HB VAL 72 2.267 8.511 12.585 590 HG11 VAL 72 HG11 VAL 72 -0.521 7.347 12.364 591 HG12 VAL 72 HG12 VAL 72 0.501 7.346 13.802 592 HG13 VAL 72 HG13 VAL 72 0.977 6.414 12.383 593 HG21 VAL 72 HG21 VAL 72 1.844 7.553 10.362 594 HG22 VAL 72 HG22 VAL 72 1.956 9.312 10.301 595 HG23 VAL 72 HG23 VAL 72 0.379 8.525 10.223 596 H PHE 73 H PHE 73 -1.475 9.635 14.098 597 HA PHE 73 HA PHE 73 0.045 9.997 16.594 598 HB2 PHE 73 HB2 PHE 73 -2.485 10.398 17.430 599 HB3 PHE 73 HB3 PHE 73 -1.441 11.668 16.821 600 HD1 PHE 73 HD1 PHE 73 -4.291 9.472 15.979 601 HD2 PHE 73 HD2 PHE 73 -1.895 12.794 14.785 602 HE1 PHE 73 HE1 PHE 73 -5.948 10.052 14.256 603 HE2 PHE 73 HE2 PHE 73 -3.552 13.372 13.061 604 HZ PHE 73 HZ PHE 73 -5.575 12.001 12.795 605 H THR 74 H THR 74 -1.676 7.620 14.840 606 HA THR 74 HA THR 74 -1.537 5.889 17.237 607 HB THR 74 HB THR 74 -3.556 4.791 16.809 608 HG1 THR 74 HG1 THR 74 -3.752 4.366 14.721 609 HG21 THR 74 HG21 THR 74 -3.956 7.061 17.692 610 HG22 THR 74 HG22 THR 74 -5.289 6.510 16.677 611 HG23 THR 74 HG23 THR 74 -4.116 7.664 16.039 612 H VAL 75 H VAL 75 -0.005 4.438 16.897 613 HA VAL 75 HA VAL 75 -0.158 2.853 14.411 614 HB VAL 75 HB VAL 75 2.408 3.420 15.923 615 HG11 VAL 75 HG11 VAL 75 3.497 2.332 14.007 616 HG12 VAL 75 HG12 VAL 75 1.914 1.984 13.311 617 HG13 VAL 75 HG13 VAL 75 2.390 1.239 14.838 618 HG21 VAL 75 HG21 VAL 75 3.078 4.793 14.010 619 HG22 VAL 75 HG22 VAL 75 1.618 5.440 14.765 620 HG23 VAL 75 HG23 VAL 75 1.503 4.530 13.257 621 H GLU 76 H GLU 76 -1.061 0.988 15.024 622 HA GLU 76 HA GLU 76 -0.384 -0.141 17.670 623 HB2 GLU 76 HB2 GLU 76 -2.858 -0.695 17.864 624 HB3 GLU 76 HB3 GLU 76 -2.432 1.006 18.012 625 HG2 GLU 76 HG2 GLU 76 -3.008 1.294 15.602 626 HG3 GLU 76 HG3 GLU 76 -3.596 -0.366 15.598 627 H ARG 77 H ARG 77 -1.035 -2.387 17.971 628 HA ARG 77 HA ARG 77 -0.429 -3.975 15.599 629 HB2 ARG 77 HB2 ARG 77 0.873 -4.442 17.565 630 HB3 ARG 77 HB3 ARG 77 -0.571 -4.620 18.550 631 HG2 ARG 77 HG2 ARG 77 -1.171 -6.642 17.287 632 HG3 ARG 77 HG3 ARG 77 0.303 -6.470 16.330 633 HD2 ARG 77 HD2 ARG 77 0.564 -8.105 18.151 634 HD3 ARG 77 HD3 ARG 77 1.665 -6.738 18.323 635 HE ARG 77 HE ARG 77 -0.540 -6.076 19.811 636 HH11 ARG 77 HH11 ARG 77 1.709 -8.687 19.832 637 HH12 ARG 77 HH12 ARG 77 1.571 -8.926 21.536 638 HH21 ARG 77 HH21 ARG 77 -0.709 -6.402 21.979 639 HH22 ARG 77 HH22 ARG 77 0.211 -7.664 22.732 640 H LEU 78 H LEU 78 -1.879 -5.171 14.523 641 HA LEU 78 HA LEU 78 -4.605 -5.453 15.556 642 HB2 LEU 78 HB2 LEU 78 -3.443 -6.042 12.828 643 HB3 LEU 78 HB3 LEU 78 -5.133 -6.231 13.256 644 HG LEU 78 HG LEU 78 -3.619 -3.610 13.248 645 HD11 LEU 78 HD11 LEU 78 -3.960 -4.471 10.991 646 HD12 LEU 78 HD12 LEU 78 -4.983 -3.066 11.290 647 HD13 LEU 78 HD13 LEU 78 -5.682 -4.684 11.319 648 HD21 LEU 78 HD21 LEU 78 -5.390 -3.614 14.915 649 HD22 LEU 78 HD22 LEU 78 -6.545 -4.202 13.718 650 HD23 LEU 78 HD23 LEU 78 -5.840 -2.594 13.548 651 H SER 79 H SER 79 -4.827 -7.190 16.869 652 HA SER 79 HA SER 79 -3.495 -9.714 16.268 653 HB2 SER 79 HB2 SER 79 -3.639 -9.040 18.616 654 HB3 SER 79 HB3 SER 79 -5.399 -8.972 18.512 655 HG SER 79 HG SER 79 -3.893 -11.334 18.008 656 H ASN 80 H ASN 80 -6.854 -8.542 16.572 657 HA ASN 80 HA ASN 80 -7.997 -10.899 15.387 658 HB2 ASN 80 HB2 ASN 80 -10.084 -9.475 15.286 659 HB3 ASN 80 HB3 ASN 80 -9.384 -9.643 16.891 660 HD21 ASN 80 HD21 ASN 80 -9.958 -7.479 14.234 661 HD22 ASN 80 HD22 ASN 80 -9.579 -6.024 15.086 662 H LEU 81 H LEU 81 -8.238 -11.341 13.239 663 HA LEU 81 HA LEU 81 -7.684 -9.209 11.298 664 HB2 LEU 81 HB2 LEU 81 -6.535 -12.007 11.209 665 HB3 LEU 81 HB3 LEU 81 -6.256 -10.734 10.041 666 HG LEU 81 HG LEU 81 -5.308 -10.738 12.910 667 HD11 LEU 81 HD11 LEU 81 -3.795 -11.036 10.310 668 HD12 LEU 81 HD12 LEU 81 -4.073 -12.300 11.512 669 HD13 LEU 81 HD13 LEU 81 -3.072 -10.907 11.916 670 HD21 LEU 81 HD21 LEU 81 -5.841 -8.478 12.165 671 HD22 LEU 81 HD22 LEU 81 -4.864 -8.710 10.716 672 HD23 LEU 81 HD23 LEU 81 -4.096 -8.695 12.305 673 H GLU 82 H GLU 82 -8.553 -9.567 9.212 674 HA GLU 82 HA GLU 82 -11.059 -11.004 9.217 675 HB2 GLU 82 HB2 GLU 82 -11.393 -9.991 7.014 676 HB3 GLU 82 HB3 GLU 82 -10.899 -8.783 8.197 677 HG2 GLU 82 HG2 GLU 82 -8.808 -10.112 6.557 678 HG3 GLU 82 HG3 GLU 82 -9.824 -8.891 5.800 679 H HIS 83 H HIS 83 -8.029 -12.026 8.750 680 HA HIS 83 HA HIS 83 -8.207 -13.437 6.271 681 HB2 HIS 83 HB2 HIS 83 -6.270 -13.718 8.577 682 HB3 HIS 83 HB3 HIS 83 -6.044 -14.408 6.974 683 HD1 HIS 83 HD1 HIS 83 -4.623 -12.997 5.470 684 HD2 HIS 83 HD2 HIS 83 -6.573 -10.729 8.347 685 HE1 HIS 83 HE1 HIS 83 -3.773 -10.658 5.179 686 HE2 HIS 83 HE2 HIS 83 -5.145 -9.280 6.772 687 H HIS 84 H HIS 84 -8.454 -14.381 9.695 688 HA HIS 84 HA HIS 84 -9.697 -15.974 10.726 689 HB2 HIS 84 HB2 HIS 84 -11.509 -15.305 9.252 690 HB3 HIS 84 HB3 HIS 84 -10.908 -16.362 7.981 691 HD1 HIS 84 HD1 HIS 84 -12.362 -16.614 11.485 692 HD2 HIS 84 HD2 HIS 84 -11.973 -18.879 8.023 693 HE1 HIS 84 HE1 HIS 84 -13.700 -18.694 11.892 694 HE2 HIS 84 HE2 HIS 84 -13.356 -20.099 9.840 695 H HIS 85 H HIS 85 -7.610 -16.877 8.151 696 HA HIS 85 HA HIS 85 -8.025 -19.681 8.215 697 HB2 HIS 85 HB2 HIS 85 -6.936 -18.519 6.319 698 HB3 HIS 85 HB3 HIS 85 -5.535 -18.201 7.337 699 HD1 HIS 85 HD1 HIS 85 -7.519 -21.313 6.354 700 HD2 HIS 85 HD2 HIS 85 -3.599 -20.044 6.882 701 HE1 HIS 85 HE1 HIS 85 -6.096 -23.298 5.807 702 HE2 HIS 85 HE2 HIS 85 -3.739 -22.432 5.894 703 H HIS 86 H HIS 86 -7.913 -20.640 10.150 704 HA HIS 86 HA HIS 86 -5.821 -20.309 12.063 705 HB2 HIS 86 HB2 HIS 86 -8.118 -21.244 12.516 706 HB3 HIS 86 HB3 HIS 86 -7.658 -22.690 11.632 707 HD1 HIS 86 HD1 HIS 86 -6.863 -20.825 14.821 708 HD2 HIS 86 HD2 HIS 86 -6.289 -24.566 13.108 709 HE1 HIS 86 HE1 HIS 86 -5.935 -22.268 16.653 710 HE2 HIS 86 HE2 HIS 86 -5.752 -24.561 15.637 711 H HIS 87 H HIS 87 -4.456 -22.439 12.659 712 HA HIS 87 HA HIS 87 -2.614 -23.074 10.735 713 HB2 HIS 87 HB2 HIS 87 -2.379 -23.643 13.125 714 HB3 HIS 87 HB3 HIS 87 -3.575 -24.919 12.937 715 HD1 HIS 87 HD1 HIS 87 -2.706 -27.167 12.305 716 HD2 HIS 87 HD2 HIS 87 0.067 -24.158 11.575 717 HE1 HIS 87 HE1 HIS 87 -0.598 -28.347 11.620 718 HE2 HIS 87 HE2 HIS 87 1.019 -26.508 11.055 719 H HIS 88 H HIS 88 -5.841 -24.346 10.983 720 HA HIS 88 HA HIS 88 -5.496 -25.602 8.368 721 HB2 HIS 88 HB2 HIS 88 -5.219 -27.476 9.914 722 HB3 HIS 88 HB3 HIS 88 -6.719 -27.052 10.735 723 HD1 HIS 88 HD1 HIS 88 -8.931 -27.660 9.554 724 HD2 HIS 88 HD2 HIS 88 -5.540 -28.839 7.472 725 HE1 HIS 88 HE1 HIS 88 -9.749 -29.245 7.791 726 HE2 HIS 88 HE2 HIS 88 -7.708 -29.777 6.423 727 H1 MET 1 H1 MET 1 -11.312 19.809 -17.347 728 H2 MET 1 H2 MET 1 -9.668 19.876 -17.737 729 H3 MET 1 H3 MET 1 -10.793 20.733 -18.664 730 HA MET 1 HA MET 1 -9.587 22.219 -17.207 731 HB2 MET 1 HB2 MET 1 -11.915 22.744 -17.802 732 HB3 MET 1 HB3 MET 1 -12.489 21.818 -16.423 733 HG2 MET 1 HG2 MET 1 -11.367 23.397 -14.910 734 HG3 MET 1 HG3 MET 1 -10.831 24.335 -16.302 735 HE1 MET 1 HE1 MET 1 -12.488 25.656 -17.925 736 HE2 MET 1 HE2 MET 1 -14.243 25.630 -17.746 737 HE3 MET 1 HE3 MET 1 -13.382 24.164 -18.211 738 H THR 2 H THR 2 -11.792 20.295 -15.139 739 HA THR 2 HA THR 2 -9.906 20.610 -12.899 740 HB THR 2 HB THR 2 -12.774 19.616 -12.873 741 HG1 THR 2 HG1 THR 2 -12.926 21.755 -13.271 742 HG21 THR 2 HG21 THR 2 -11.479 18.748 -10.982 743 HG22 THR 2 HG22 THR 2 -12.648 19.953 -10.440 744 HG23 THR 2 HG23 THR 2 -10.943 20.383 -10.588 745 H ASP 3 H ASP 3 -9.260 18.815 -11.633 746 HA ASP 3 HA ASP 3 -8.711 16.414 -13.068 747 HB2 ASP 3 HB2 ASP 3 -7.710 15.682 -10.897 748 HB3 ASP 3 HB3 ASP 3 -7.136 17.257 -11.442 749 H PHE 4 H PHE 4 -9.043 14.237 -11.724 750 HA PHE 4 HA PHE 4 -11.570 14.047 -10.338 751 HB2 PHE 4 HB2 PHE 4 -12.575 12.391 -11.819 752 HB3 PHE 4 HB3 PHE 4 -12.306 13.898 -12.684 753 HD1 PHE 4 HD1 PHE 4 -11.272 10.388 -12.342 754 HD2 PHE 4 HD2 PHE 4 -10.713 14.019 -14.508 755 HE1 PHE 4 HE1 PHE 4 -10.058 9.155 -14.090 756 HE2 PHE 4 HE2 PHE 4 -9.501 12.784 -16.261 757 HZ PHE 4 HZ PHE 4 -9.161 10.348 -16.045 758 H LEU 5 H LEU 5 -11.980 11.784 -9.562 759 HA LEU 5 HA LEU 5 -9.466 10.692 -8.586 760 HB2 LEU 5 HB2 LEU 5 -11.301 11.082 -7.024 761 HB3 LEU 5 HB3 LEU 5 -12.332 9.998 -7.937 762 HG LEU 5 HG LEU 5 -10.900 8.089 -7.316 763 HD11 LEU 5 HD11 LEU 5 -9.106 8.352 -5.681 764 HD12 LEU 5 HD12 LEU 5 -9.336 10.102 -5.693 765 HD13 LEU 5 HD13 LEU 5 -8.764 9.278 -7.143 766 HD21 LEU 5 HD21 LEU 5 -11.744 9.747 -4.934 767 HD22 LEU 5 HD22 LEU 5 -11.468 8.004 -4.944 768 HD23 LEU 5 HD23 LEU 5 -12.795 8.692 -5.880 769 H ALA 6 H ALA 6 -8.440 9.282 -9.854 770 HA ALA 6 HA ALA 6 -9.950 7.439 -11.563 771 HB1 ALA 6 HB1 ALA 6 -7.841 7.079 -12.720 772 HB2 ALA 6 HB2 ALA 6 -6.998 8.065 -11.526 773 HB3 ALA 6 HB3 ALA 6 -8.191 8.803 -12.594 774 H GLY 7 H GLY 7 -9.672 5.195 -11.503 775 HA2 GLY 7 HA2 GLY 7 -8.220 4.126 -9.151 776 HA3 GLY 7 HA3 GLY 7 -9.798 3.529 -9.640 777 H ILE 8 H ILE 8 -7.061 2.264 -9.382 778 HA ILE 8 HA ILE 8 -7.066 0.895 -11.994 779 HB ILE 8 HB ILE 8 -4.548 1.498 -10.401 780 HG12 ILE 8 HG12 ILE 8 -5.507 2.809 -12.967 781 HG13 ILE 8 HG13 ILE 8 -5.488 3.571 -11.379 782 HG21 ILE 8 HG21 ILE 8 -4.407 -0.547 -11.709 783 HG22 ILE 8 HG22 ILE 8 -3.381 0.697 -12.422 784 HG23 ILE 8 HG23 ILE 8 -4.940 0.312 -13.154 785 HD11 ILE 8 HD11 ILE 8 -3.613 4.297 -12.749 786 HD12 ILE 8 HD12 ILE 8 -3.065 2.629 -12.908 787 HD13 ILE 8 HD13 ILE 8 -3.055 3.416 -11.329 788 H ARG 9 H ARG 9 -6.737 -1.370 -11.881 789 HA ARG 9 HA ARG 9 -6.175 -2.493 -9.202 790 HB2 ARG 9 HB2 ARG 9 -8.568 -2.823 -9.876 791 HB3 ARG 9 HB3 ARG 9 -8.003 -3.771 -11.249 792 HG2 ARG 9 HG2 ARG 9 -6.895 -5.329 -9.654 793 HG3 ARG 9 HG3 ARG 9 -7.604 -4.413 -8.324 794 HD2 ARG 9 HD2 ARG 9 -8.966 -6.343 -8.725 795 HD3 ARG 9 HD3 ARG 9 -9.858 -4.920 -9.265 796 HE ARG 9 HE ARG 9 -8.375 -6.158 -11.367 797 HH11 ARG 9 HH11 ARG 9 -11.279 -6.387 -9.549 798 HH12 ARG 9 HH12 ARG 9 -12.154 -7.156 -10.821 799 HH21 ARG 9 HH21 ARG 9 -9.523 -7.137 -13.025 800 HH22 ARG 9 HH22 ARG 9 -11.172 -7.592 -12.751 801 H ILE 10 H ILE 10 -4.544 -3.916 -9.098 802 HA ILE 10 HA ILE 10 -3.323 -4.847 -11.637 803 HB ILE 10 HB ILE 10 -1.898 -4.372 -9.005 804 HG12 ILE 10 HG12 ILE 10 -1.884 -2.515 -11.397 805 HG13 ILE 10 HG13 ILE 10 -2.916 -2.269 -9.992 806 HG21 ILE 10 HG21 ILE 10 -0.754 -5.916 -10.490 807 HG22 ILE 10 HG22 ILE 10 0.132 -4.395 -10.398 808 HG23 ILE 10 HG23 ILE 10 -0.854 -4.755 -11.815 809 HD11 ILE 10 HD11 ILE 10 -0.915 -2.118 -8.576 810 HD12 ILE 10 HD12 ILE 10 -0.949 -0.890 -9.840 811 HD13 ILE 10 HD13 ILE 10 0.095 -2.302 -10.011 812 H VAL 11 H VAL 11 -3.619 -7.038 -11.880 813 HA VAL 11 HA VAL 11 -3.309 -8.719 -9.462 814 HB VAL 11 HB VAL 11 -4.954 -9.311 -11.931 815 HG11 VAL 11 HG11 VAL 11 -4.432 -11.057 -9.517 816 HG12 VAL 11 HG12 VAL 11 -3.861 -11.354 -11.160 817 HG13 VAL 11 HG13 VAL 11 -5.587 -11.403 -10.805 818 HG21 VAL 11 HG21 VAL 11 -6.000 -7.757 -10.341 819 HG22 VAL 11 HG22 VAL 11 -5.760 -8.930 -9.044 820 HG23 VAL 11 HG23 VAL 11 -6.845 -9.306 -10.385 821 H GLY 12 H GLY 12 -1.410 -9.621 -9.398 822 HA2 GLY 12 HA2 GLY 12 -0.320 -10.910 -11.819 823 HA3 GLY 12 HA3 GLY 12 0.707 -9.871 -10.840 824 H GLU 13 H GLU 13 1.529 -12.406 -11.236 825 HA GLU 13 HA GLU 13 0.614 -14.279 -9.313 826 HB2 GLU 13 HB2 GLU 13 2.767 -15.472 -9.824 827 HB3 GLU 13 HB3 GLU 13 1.766 -15.103 -11.224 828 HG2 GLU 13 HG2 GLU 13 3.200 -13.184 -11.745 829 HG3 GLU 13 HG3 GLU 13 4.201 -13.550 -10.342 830 H ASP 14 H ASP 14 1.248 -14.733 -7.265 831 HA ASP 14 HA ASP 14 2.540 -12.666 -5.762 832 HB2 ASP 14 HB2 ASP 14 0.637 -14.144 -4.967 833 HB3 ASP 14 HB3 ASP 14 1.810 -15.446 -4.813 834 H LYS 15 H LYS 15 4.692 -12.504 -6.458 835 HA LYS 15 HA LYS 15 6.385 -14.882 -6.250 836 HB2 LYS 15 HB2 LYS 15 6.938 -12.120 -7.287 837 HB3 LYS 15 HB3 LYS 15 8.118 -13.411 -7.267 838 HG2 LYS 15 HG2 LYS 15 5.507 -13.446 -8.752 839 HG3 LYS 15 HG3 LYS 15 7.094 -13.128 -9.450 840 HD2 LYS 15 HD2 LYS 15 6.706 -15.673 -7.937 841 HD3 LYS 15 HD3 LYS 15 5.993 -15.539 -9.547 842 HE2 LYS 15 HE2 LYS 15 8.904 -15.122 -8.848 843 HE3 LYS 15 HE3 LYS 15 8.222 -16.533 -9.660 844 HZ1 LYS 15 HZ1 LYS 15 9.164 -15.087 -11.286 845 HZ2 LYS 15 HZ2 LYS 15 8.318 -13.752 -10.696 846 HZ3 LYS 15 HZ3 LYS 15 7.480 -15.014 -11.454 847 H ASN 16 H ASN 16 8.695 -14.267 -5.622 848 HA ASN 16 HA ASN 16 9.322 -14.173 -3.078 849 HB2 ASN 16 HB2 ASN 16 10.698 -12.487 -5.177 850 HB3 ASN 16 HB3 ASN 16 11.445 -13.134 -3.711 851 HD21 ASN 16 HD21 ASN 16 11.923 -13.536 -6.650 852 HD22 ASN 16 HD22 ASN 16 11.933 -15.254 -6.849 853 H GLY 17 H GLY 17 8.631 -11.200 -4.894 854 HA2 GLY 17 HA2 GLY 17 7.718 -9.859 -2.493 855 HA3 GLY 17 HA3 GLY 17 9.234 -9.225 -3.114 856 H MET 18 H MET 18 6.743 -10.455 -5.255 857 HA MET 18 HA MET 18 6.711 -8.116 -6.812 858 HB2 MET 18 HB2 MET 18 5.084 -10.609 -6.751 859 HB3 MET 18 HB3 MET 18 4.435 -9.243 -7.636 860 HG2 MET 18 HG2 MET 18 6.586 -9.125 -8.876 861 HG3 MET 18 HG3 MET 18 7.053 -10.627 -8.112 862 HE1 MET 18 HE1 MET 18 3.462 -9.559 -9.294 863 HE2 MET 18 HE2 MET 18 3.434 -10.200 -10.936 864 HE3 MET 18 HE3 MET 18 4.514 -8.866 -10.533 865 H THR 19 H THR 19 4.385 -9.240 -4.369 866 HA THR 19 HA THR 19 2.477 -7.226 -4.563 867 HB THR 19 HB THR 19 2.014 -7.694 -2.140 868 HG1 THR 19 HG1 THR 19 3.377 -8.942 -0.993 869 HG21 THR 19 HG21 THR 19 1.411 -10.045 -2.429 870 HG22 THR 19 HG22 THR 19 2.483 -10.163 -3.824 871 HG23 THR 19 HG23 THR 19 1.053 -9.132 -3.896 872 H ASN 20 H ASN 20 5.582 -7.215 -2.844 873 HA ASN 20 HA ASN 20 5.135 -4.714 -1.533 874 HB2 ASN 20 HB2 ASN 20 6.668 -6.623 -0.797 875 HB3 ASN 20 HB3 ASN 20 7.800 -6.054 -2.017 876 HD21 ASN 20 HD21 ASN 20 8.058 -6.192 0.883 877 HD22 ASN 20 HD22 ASN 20 8.404 -4.587 1.392 878 H GLN 21 H GLN 21 7.075 -5.739 -4.352 879 HA GLN 21 HA GLN 21 8.184 -3.199 -4.884 880 HB2 GLN 21 HB2 GLN 21 8.987 -4.095 -6.914 881 HB3 GLN 21 HB3 GLN 21 9.004 -5.427 -5.775 882 HG2 GLN 21 HG2 GLN 21 6.987 -6.337 -6.758 883 HG3 GLN 21 HG3 GLN 21 6.857 -4.949 -7.835 884 HE21 GLN 21 HE21 GLN 21 8.622 -7.866 -7.138 885 HE22 GLN 21 HE22 GLN 21 9.418 -7.976 -8.664 886 H ILE 22 H ILE 22 5.216 -4.753 -6.024 887 HA ILE 22 HA ILE 22 4.511 -2.983 -8.062 888 HB ILE 22 HB ILE 22 2.922 -4.775 -6.253 889 HG12 ILE 22 HG12 ILE 22 4.197 -5.774 -8.090 890 HG13 ILE 22 HG13 ILE 22 2.469 -5.956 -8.370 891 HG21 ILE 22 HG21 ILE 22 1.440 -2.886 -6.581 892 HG22 ILE 22 HG22 ILE 22 0.873 -4.273 -7.509 893 HG23 ILE 22 HG23 ILE 22 1.704 -2.948 -8.324 894 HD11 ILE 22 HD11 ILE 22 4.261 -3.907 -9.659 895 HD12 ILE 22 HD12 ILE 22 2.528 -4.079 -9.938 896 HD13 ILE 22 HD13 ILE 22 3.633 -5.370 -10.415 897 H THR 23 H THR 23 3.456 -2.869 -4.635 898 HA THR 23 HA THR 23 2.221 -0.308 -4.952 899 HB THR 23 HB THR 23 3.093 -1.521 -2.313 900 HG1 THR 23 HG1 THR 23 1.714 -3.064 -2.760 901 HG21 THR 23 HG21 THR 23 0.840 0.364 -3.046 902 HG22 THR 23 HG22 THR 23 2.315 0.793 -2.181 903 HG23 THR 23 HG23 THR 23 1.142 -0.292 -1.436 904 H GLY 24 H GLY 24 5.412 -1.418 -4.089 905 HA2 GLY 24 HA2 GLY 24 6.513 0.969 -3.079 906 HA3 GLY 24 HA3 GLY 24 7.410 -0.323 -3.858 907 H VAL 25 H VAL 25 6.131 -0.160 -6.430 908 HA VAL 25 HA VAL 25 7.464 2.119 -7.564 909 HB VAL 25 HB VAL 25 5.586 0.114 -8.847 910 HG11 VAL 25 HG11 VAL 25 7.347 2.197 -10.155 911 HG12 VAL 25 HG12 VAL 25 5.583 2.204 -10.116 912 HG13 VAL 25 HG13 VAL 25 6.439 0.940 -10.999 913 HG21 VAL 25 HG21 VAL 25 8.601 0.339 -8.853 914 HG22 VAL 25 HG22 VAL 25 7.668 -0.829 -9.790 915 HG23 VAL 25 HG23 VAL 25 7.648 -0.891 -8.027 916 H ILE 26 H ILE 26 4.100 1.298 -6.838 917 HA ILE 26 HA ILE 26 2.798 3.454 -8.018 918 HB ILE 26 HB ILE 26 2.166 2.016 -5.434 919 HG12 ILE 26 HG12 ILE 26 1.041 1.753 -8.241 920 HG13 ILE 26 HG13 ILE 26 2.114 0.606 -7.448 921 HG21 ILE 26 HG21 ILE 26 0.409 3.916 -6.991 922 HG22 ILE 26 HG22 ILE 26 1.123 4.225 -5.408 923 HG23 ILE 26 HG23 ILE 26 -0.088 2.956 -5.596 924 HD11 ILE 26 HD11 ILE 26 -0.702 1.275 -6.619 925 HD12 ILE 26 HD12 ILE 26 0.370 0.151 -5.783 926 HD13 ILE 26 HD13 ILE 26 -0.163 -0.195 -7.429 927 H SER 27 H SER 27 4.364 3.296 -4.818 928 HA SER 27 HA SER 27 3.756 5.915 -3.981 929 HB2 SER 27 HB2 SER 27 5.576 5.687 -2.374 930 HB3 SER 27 HB3 SER 27 4.684 4.170 -2.472 931 HG SER 27 HG SER 27 6.349 3.223 -3.463 932 H LYS 28 H LYS 28 5.955 4.797 -6.371 933 HA LYS 28 HA LYS 28 7.605 7.194 -6.380 934 HB2 LYS 28 HB2 LYS 28 7.580 4.837 -8.282 935 HB3 LYS 28 HB3 LYS 28 8.797 6.106 -8.235 936 HG2 LYS 28 HG2 LYS 28 9.448 5.397 -5.978 937 HG3 LYS 28 HG3 LYS 28 8.228 4.120 -6.035 938 HD2 LYS 28 HD2 LYS 28 9.364 3.059 -7.891 939 HD3 LYS 28 HD3 LYS 28 10.533 4.377 -7.973 940 HE2 LYS 28 HE2 LYS 28 11.486 2.427 -6.861 941 HE3 LYS 28 HE3 LYS 28 11.365 3.789 -5.747 942 HZ1 LYS 28 HZ1 LYS 28 10.663 1.718 -4.716 943 HZ2 LYS 28 HZ2 LYS 28 9.474 1.501 -5.893 944 HZ3 LYS 28 HZ3 LYS 28 9.364 2.798 -4.817 945 H PHE 29 H PHE 29 4.548 6.834 -7.336 946 HA PHE 29 HA PHE 29 4.680 7.884 -10.017 947 HB2 PHE 29 HB2 PHE 29 2.392 7.487 -8.091 948 HB3 PHE 29 HB3 PHE 29 2.173 8.286 -9.643 949 HD1 PHE 29 HD1 PHE 29 4.457 6.257 -10.801 950 HD2 PHE 29 HD2 PHE 29 0.662 5.896 -8.891 951 HE1 PHE 29 HE1 PHE 29 4.124 4.076 -11.883 952 HE2 PHE 29 HE2 PHE 29 0.331 3.706 -9.971 953 HZ PHE 29 HZ PHE 29 2.063 2.796 -11.467 954 H ASP 30 H ASP 30 3.210 9.872 -10.458 955 HA ASP 30 HA ASP 30 4.457 12.118 -9.051 956 HB2 ASP 30 HB2 ASP 30 2.705 12.617 -11.397 957 HB3 ASP 30 HB3 ASP 30 4.311 13.244 -11.039 958 H THR 31 H THR 31 1.973 10.466 -8.182 959 HA THR 31 HA THR 31 0.192 12.749 -7.648 960 HB THR 31 HB THR 31 -0.843 11.677 -9.520 961 HG1 THR 31 HG1 THR 31 -2.778 11.607 -8.622 962 HG21 THR 31 HG21 THR 31 0.278 9.527 -9.452 963 HG22 THR 31 HG22 THR 31 -1.467 9.298 -9.525 964 HG23 THR 31 HG23 THR 31 -0.614 9.079 -7.996 965 H ASN 32 H ASN 32 -1.581 12.072 -6.023 966 HA ASN 32 HA ASN 32 -0.143 10.888 -3.753 967 HB2 ASN 32 HB2 ASN 32 -2.611 12.641 -3.806 968 HB3 ASN 32 HB3 ASN 32 -1.814 12.057 -2.349 969 HD21 ASN 32 HD21 ASN 32 0.311 12.791 -1.917 970 HD22 ASN 32 HD22 ASN 32 0.844 14.309 -2.533 971 H ILE 33 H ILE 33 -0.586 8.899 -3.140 972 HA ILE 33 HA ILE 33 -2.734 7.317 -4.029 973 HB ILE 33 HB ILE 33 -1.020 6.936 -1.561 974 HG12 ILE 33 HG12 ILE 33 -0.623 5.908 -4.389 975 HG13 ILE 33 HG13 ILE 33 0.324 7.176 -3.619 976 HG21 ILE 33 HG21 ILE 33 -2.666 4.955 -3.146 977 HG22 ILE 33 HG22 ILE 33 -3.000 5.523 -1.509 978 HG23 ILE 33 HG23 ILE 33 -1.570 4.541 -1.828 979 HD11 ILE 33 HD11 ILE 33 1.127 5.557 -1.967 980 HD12 ILE 33 HD12 ILE 33 1.531 5.085 -3.618 981 HD13 ILE 33 HD13 ILE 33 0.201 4.291 -2.775 982 H ARG 34 H ARG 34 -4.766 8.220 -3.609 983 HA ARG 34 HA ARG 34 -5.480 9.166 -0.978 984 HB2 ARG 34 HB2 ARG 34 -7.184 8.637 -3.424 985 HB3 ARG 34 HB3 ARG 34 -7.774 9.376 -1.940 986 HG2 ARG 34 HG2 ARG 34 -5.658 10.494 -3.777 987 HG3 ARG 34 HG3 ARG 34 -7.315 11.074 -3.603 988 HD2 ARG 34 HD2 ARG 34 -5.164 11.115 -1.479 989 HD3 ARG 34 HD3 ARG 34 -5.779 12.506 -2.371 990 HE ARG 34 HE ARG 34 -8.003 11.531 -1.197 991 HH11 ARG 34 HH11 ARG 34 -4.890 12.329 0.055 992 HH12 ARG 34 HH12 ARG 34 -5.503 12.743 1.618 993 HH21 ARG 34 HH21 ARG 34 -8.770 12.079 0.822 994 HH22 ARG 34 HH22 ARG 34 -7.656 12.625 2.030 995 H THR 35 H THR 35 -5.780 6.185 -2.739 996 HA THR 35 HA THR 35 -6.406 4.778 -0.286 997 HB THR 35 HB THR 35 -8.293 4.521 -2.651 998 HG1 THR 35 HG1 THR 35 -8.408 5.976 -0.286 999 HG21 THR 35 HG21 THR 35 -9.565 2.985 -1.239 1000 HG22 THR 35 HG22 THR 35 -8.369 3.153 0.045 1001 HG23 THR 35 HG23 THR 35 -7.923 2.385 -1.480 1002 H ILE 36 H ILE 36 -5.332 2.870 -0.274 1003 HA ILE 36 HA ILE 36 -4.814 1.519 -2.835 1004 HB ILE 36 HB ILE 36 -2.735 2.728 -2.174 1005 HG12 ILE 36 HG12 ILE 36 -1.210 0.738 -2.339 1006 HG13 ILE 36 HG13 ILE 36 -2.615 -0.298 -2.120 1007 HG21 ILE 36 HG21 ILE 36 -2.759 0.899 0.226 1008 HG22 ILE 36 HG22 ILE 36 -2.928 2.655 0.243 1009 HG23 ILE 36 HG23 ILE 36 -1.408 1.920 -0.269 1010 HD11 ILE 36 HD11 ILE 36 -2.209 1.640 -4.385 1011 HD12 ILE 36 HD12 ILE 36 -3.578 0.546 -4.179 1012 HD13 ILE 36 HD13 ILE 36 -1.964 -0.104 -4.458 1013 H VAL 37 H VAL 37 -5.613 -0.486 -2.765 1014 HA VAL 37 HA VAL 37 -5.593 -1.926 -0.184 1015 HB VAL 37 HB VAL 37 -7.825 -1.995 -2.232 1016 HG11 VAL 37 HG11 VAL 37 -7.524 -4.175 -1.188 1017 HG12 VAL 37 HG12 VAL 37 -8.999 -3.419 -0.585 1018 HG13 VAL 37 HG13 VAL 37 -7.545 -3.436 0.413 1019 HG21 VAL 37 HG21 VAL 37 -7.845 0.073 -0.936 1020 HG22 VAL 37 HG22 VAL 37 -7.771 -0.847 0.566 1021 HG23 VAL 37 HG23 VAL 37 -9.196 -0.962 -0.469 1022 H LEU 38 H LEU 38 -3.976 -3.358 -0.515 1023 HA LEU 38 HA LEU 38 -4.076 -5.041 -2.942 1024 HB2 LEU 38 HB2 LEU 38 -1.976 -3.759 -2.615 1025 HB3 LEU 38 HB3 LEU 38 -1.743 -4.544 -1.066 1026 HG LEU 38 HG LEU 38 -1.867 -6.152 -3.628 1027 HD11 LEU 38 HD11 LEU 38 0.593 -4.890 -2.406 1028 HD12 LEU 38 HD12 LEU 38 -0.126 -4.485 -3.965 1029 HD13 LEU 38 HD13 LEU 38 0.591 -6.077 -3.713 1030 HD21 LEU 38 HD21 LEU 38 -2.050 -7.445 -1.578 1031 HD22 LEU 38 HD22 LEU 38 -0.611 -6.665 -0.922 1032 HD23 LEU 38 HD23 LEU 38 -0.477 -7.732 -2.320 1033 H ASN 39 H ASN 39 -4.975 -6.993 -2.609 1034 HA ASN 39 HA ASN 39 -4.289 -8.372 -0.088 1035 HB2 ASN 39 HB2 ASN 39 -6.412 -9.517 -0.078 1036 HB3 ASN 39 HB3 ASN 39 -6.712 -7.787 -0.191 1037 HD21 ASN 39 HD21 ASN 39 -7.701 -6.979 -1.992 1038 HD22 ASN 39 HD22 ASN 39 -8.364 -7.977 -3.233 1039 H ALA 40 H ALA 40 -3.206 -10.205 -0.295 1040 HA ALA 40 HA ALA 40 -2.949 -11.433 -2.966 1041 HB1 ALA 40 HB1 ALA 40 -1.176 -11.707 -0.528 1042 HB2 ALA 40 HB2 ALA 40 -0.872 -10.659 -1.912 1043 HB3 ALA 40 HB3 ALA 40 -0.875 -12.410 -2.119 1044 H LYS 41 H LYS 41 -4.058 -13.237 -3.318 1045 HA LYS 41 HA LYS 41 -4.554 -15.090 -1.094 1046 HB2 LYS 41 HB2 LYS 41 -6.859 -15.306 -1.544 1047 HB3 LYS 41 HB3 LYS 41 -6.557 -13.576 -1.539 1048 HG2 LYS 41 HG2 LYS 41 -6.739 -15.259 -4.035 1049 HG3 LYS 41 HG3 LYS 41 -8.091 -14.363 -3.336 1050 HD2 LYS 41 HD2 LYS 41 -6.774 -12.263 -3.605 1051 HD3 LYS 41 HD3 LYS 41 -5.511 -13.197 -4.411 1052 HE2 LYS 41 HE2 LYS 41 -7.165 -13.889 -6.122 1053 HE3 LYS 41 HE3 LYS 41 -8.369 -12.868 -5.338 1054 HZ1 LYS 41 HZ1 LYS 41 -5.822 -11.899 -6.511 1055 HZ2 LYS 41 HZ2 LYS 41 -7.036 -10.942 -5.829 1056 HZ3 LYS 41 HZ3 LYS 41 -7.337 -11.799 -7.256 1057 H ASP 42 H ASP 42 -4.392 -17.177 -1.569 1058 HA ASP 42 HA ASP 42 -3.514 -18.975 -2.644 1059 HB2 ASP 42 HB2 ASP 42 -6.075 -18.830 -3.062 1060 HB3 ASP 42 HB3 ASP 42 -5.609 -18.517 -4.734 1061 H GLY 43 H GLY 43 -1.558 -17.599 -3.263 1062 HA2 GLY 43 HA2 GLY 43 0.199 -17.624 -4.756 1063 HA3 GLY 43 HA3 GLY 43 -0.829 -18.478 -5.886 1064 H ILE 44 H ILE 44 -2.586 -15.783 -5.246 1065 HA ILE 44 HA ILE 44 -1.133 -14.105 -7.208 1066 HB ILE 44 HB ILE 44 -4.118 -13.967 -7.210 1067 HG12 ILE 44 HG12 ILE 44 -2.580 -16.233 -8.500 1068 HG13 ILE 44 HG13 ILE 44 -3.819 -16.359 -7.265 1069 HG21 ILE 44 HG21 ILE 44 -2.031 -13.823 -9.395 1070 HG22 ILE 44 HG22 ILE 44 -2.806 -12.454 -8.599 1071 HG23 ILE 44 HG23 ILE 44 -3.759 -13.542 -9.606 1072 HD11 ILE 44 HD11 ILE 44 -4.261 -15.364 -10.066 1073 HD12 ILE 44 HD12 ILE 44 -5.495 -15.559 -8.819 1074 HD13 ILE 44 HD13 ILE 44 -4.661 -16.973 -9.464 1075 H PHE 45 H PHE 45 -1.922 -11.782 -7.185 1076 HA PHE 45 HA PHE 45 -3.243 -10.987 -4.680 1077 HB2 PHE 45 HB2 PHE 45 -1.655 -9.232 -4.229 1078 HB3 PHE 45 HB3 PHE 45 -0.771 -10.743 -4.385 1079 HD1 PHE 45 HD2 PHE 45 -1.440 -7.469 -5.911 1080 HD2 PHE 45 HD1 PHE 45 0.752 -11.114 -6.234 1081 HE1 PHE 45 HE2 PHE 45 0.032 -6.432 -7.583 1082 HE2 PHE 45 HE1 PHE 45 2.226 -10.074 -7.905 1083 HZ PHE 45 HZ PHE 45 1.868 -7.737 -8.583 1084 H THR 46 H THR 46 -4.142 -8.797 -4.754 1085 HA THR 46 HA THR 46 -4.196 -7.545 -7.410 1086 HB THR 46 HB THR 46 -6.321 -8.624 -7.392 1087 HG1 THR 46 HG1 THR 46 -6.860 -5.952 -6.562 1088 HG21 THR 46 HG21 THR 46 -7.995 -8.280 -5.638 1089 HG22 THR 46 HG22 THR 46 -6.807 -7.394 -4.680 1090 HG23 THR 46 HG23 THR 46 -6.564 -9.108 -5.022 1091 H CYS 47 H CYS 47 -3.378 -5.600 -7.235 1092 HA CYS 47 HA CYS 47 -3.633 -4.098 -4.722 1093 HB2 CYS 47 HB2 CYS 47 -1.357 -4.428 -5.650 1094 HB3 CYS 47 HB3 CYS 47 -1.841 -3.571 -7.108 1095 HG CYS 47 HG CYS 47 -0.503 -2.336 -4.459 1096 H ASN 48 H ASN 48 -5.287 -2.727 -4.625 1097 HA ASN 48 HA ASN 48 -6.376 -1.524 -7.070 1098 HB2 ASN 48 HB2 ASN 48 -7.472 -1.709 -4.249 1099 HB3 ASN 48 HB3 ASN 48 -8.276 -0.846 -5.558 1100 HD21 ASN 48 HD21 ASN 48 -10.073 -2.191 -5.400 1101 HD22 ASN 48 HD22 ASN 48 -10.048 -3.814 -5.980 1102 H LEU 49 H LEU 49 -5.415 0.345 -7.609 1103 HA LEU 49 HA LEU 49 -4.494 2.188 -5.519 1104 HB2 LEU 49 HB2 LEU 49 -2.844 1.613 -7.185 1105 HB3 LEU 49 HB3 LEU 49 -3.935 2.061 -8.483 1106 HG LEU 49 HG LEU 49 -3.827 4.413 -7.785 1107 HD11 LEU 49 HD11 LEU 49 -1.899 3.420 -5.690 1108 HD12 LEU 49 HD12 LEU 49 -3.474 4.166 -5.421 1109 HD13 LEU 49 HD13 LEU 49 -2.157 5.115 -6.106 1110 HD21 LEU 49 HD21 LEU 49 -1.116 3.149 -8.200 1111 HD22 LEU 49 HD22 LEU 49 -1.508 4.850 -8.451 1112 HD23 LEU 49 HD23 LEU 49 -2.256 3.615 -9.463 1113 H MET 50 H MET 50 -5.450 4.098 -5.126 1114 HA MET 50 HA MET 50 -7.343 5.195 -7.112 1115 HB2 MET 50 HB2 MET 50 -7.591 5.328 -4.101 1116 HB3 MET 50 HB3 MET 50 -8.694 6.069 -5.254 1117 HG2 MET 50 HG2 MET 50 -8.212 3.116 -4.882 1118 HG3 MET 50 HG3 MET 50 -9.627 4.025 -4.361 1119 HE1 MET 50 HE1 MET 50 -11.080 5.490 -6.251 1120 HE2 MET 50 HE2 MET 50 -10.899 5.211 -7.983 1121 HE3 MET 50 HE3 MET 50 -9.607 6.000 -7.080 1122 H ILE 51 H ILE 51 -6.479 6.983 -7.956 1123 HA ILE 51 HA ILE 51 -5.226 8.967 -6.193 1124 HB ILE 51 HB ILE 51 -3.397 9.312 -7.930 1125 HG12 ILE 51 HG12 ILE 51 -2.877 6.945 -9.042 1126 HG13 ILE 51 HG13 ILE 51 -4.627 6.779 -8.964 1127 HG21 ILE 51 HG21 ILE 51 -2.958 8.326 -5.754 1128 HG22 ILE 51 HG22 ILE 51 -1.963 7.568 -6.996 1129 HG23 ILE 51 HG23 ILE 51 -3.384 6.730 -6.370 1130 HD11 ILE 51 HD11 ILE 51 -3.090 8.953 -10.376 1131 HD12 ILE 51 HD12 ILE 51 -4.851 8.852 -10.268 1132 HD13 ILE 51 HD13 ILE 51 -3.945 7.603 -11.121 1133 H PHE 52 H PHE 52 -4.997 11.112 -7.197 1134 HA PHE 52 HA PHE 52 -7.253 11.648 -8.977 1135 HB2 PHE 52 HB2 PHE 52 -5.555 13.360 -7.188 1136 HB3 PHE 52 HB3 PHE 52 -6.490 14.110 -8.479 1137 HD1 PHE 52 HD2 PHE 52 -8.988 13.700 -8.544 1138 HD2 PHE 52 HD1 PHE 52 -6.591 12.781 -5.147 1139 HE1 PHE 52 HE2 PHE 52 -11.004 13.683 -7.140 1140 HE2 PHE 52 HE1 PHE 52 -8.605 12.761 -3.732 1141 HZ PHE 52 HZ PHE 52 -10.814 13.217 -4.728 1142 H VAL 53 H VAL 53 -7.123 12.413 -11.016 1143 HA VAL 53 HA VAL 53 -4.462 13.052 -12.139 1144 HB VAL 53 HB VAL 53 -4.935 11.855 -14.170 1145 HG11 VAL 53 HG11 VAL 53 -5.065 9.538 -13.397 1146 HG12 VAL 53 HG12 VAL 53 -5.600 10.096 -11.811 1147 HG13 VAL 53 HG13 VAL 53 -3.981 10.501 -12.390 1148 HG21 VAL 53 HG21 VAL 53 -7.625 11.187 -12.975 1149 HG22 VAL 53 HG22 VAL 53 -6.986 10.540 -14.487 1150 HG23 VAL 53 HG23 VAL 53 -7.319 12.265 -14.337 1151 H LYS 54 H LYS 54 -4.451 14.625 -13.787 1152 HA LYS 54 HA LYS 54 -6.708 16.430 -13.823 1153 HB2 LYS 54 HB2 LYS 54 -4.421 16.769 -15.725 1154 HB3 LYS 54 HB3 LYS 54 -5.331 17.986 -14.847 1155 HG2 LYS 54 HG2 LYS 54 -3.417 18.130 -13.661 1156 HG3 LYS 54 HG3 LYS 54 -4.123 16.774 -12.778 1157 HD2 LYS 54 HD2 LYS 54 -2.890 15.224 -14.302 1158 HD3 LYS 54 HD3 LYS 54 -2.107 16.627 -15.027 1159 HE2 LYS 54 HE2 LYS 54 -1.920 15.752 -12.149 1160 HE3 LYS 54 HE3 LYS 54 -0.659 15.601 -13.371 1161 HZ1 LYS 54 HZ1 LYS 54 -1.763 18.133 -12.279 1162 HZ2 LYS 54 HZ2 LYS 54 -0.626 18.038 -13.528 1163 HZ3 LYS 54 HZ3 LYS 54 -0.227 17.489 -11.980 1164 H ASN 55 H ASN 55 -5.570 13.827 -15.717 1165 HA ASN 55 HA ASN 55 -7.640 14.144 -17.718 1166 HB2 ASN 55 HB2 ASN 55 -5.981 14.012 -19.601 1167 HB3 ASN 55 HB3 ASN 55 -5.928 15.527 -18.703 1168 HD21 ASN 55 HD21 ASN 55 -4.146 15.953 -17.368 1169 HD22 ASN 55 HD22 ASN 55 -2.672 15.064 -17.509 1170 H THR 56 H THR 56 -7.669 12.266 -19.245 1171 HA THR 56 HA THR 56 -7.386 9.817 -17.790 1172 HB THR 56 HB THR 56 -8.204 8.717 -19.862 1173 HG1 THR 56 HG1 THR 56 -8.714 10.027 -21.658 1174 HG21 THR 56 HG21 THR 56 -9.760 11.183 -19.054 1175 HG22 THR 56 HG22 THR 56 -9.822 9.608 -18.259 1176 HG23 THR 56 HG23 THR 56 -10.417 9.786 -19.910 1177 H ASP 57 H ASP 57 -5.445 11.450 -20.196 1178 HA ASP 57 HA ASP 57 -3.918 9.323 -21.183 1179 HB2 ASP 57 HB2 ASP 57 -3.849 11.557 -22.172 1180 HB3 ASP 57 HB3 ASP 57 -3.114 12.207 -20.708 1181 H LYS 58 H LYS 58 -3.409 11.357 -18.324 1182 HA LYS 58 HA LYS 58 -1.053 10.245 -17.341 1183 HB2 LYS 58 HB2 LYS 58 -1.751 12.129 -16.175 1184 HB3 LYS 58 HB3 LYS 58 -3.426 11.604 -16.113 1185 HG2 LYS 58 HG2 LYS 58 -2.516 11.577 -13.899 1186 HG3 LYS 58 HG3 LYS 58 -2.803 9.917 -14.417 1187 HD2 LYS 58 HD2 LYS 58 -0.688 9.884 -13.359 1188 HD3 LYS 58 HD3 LYS 58 -0.339 9.866 -15.089 1189 HE2 LYS 58 HE2 LYS 58 -0.042 12.353 -14.962 1190 HE3 LYS 58 HE3 LYS 58 -0.189 12.218 -13.209 1191 HZ1 LYS 58 HZ1 LYS 58 1.739 10.781 -13.185 1192 HZ2 LYS 58 HZ2 LYS 58 2.117 12.254 -13.924 1193 HZ3 LYS 58 HZ3 LYS 58 1.868 10.876 -14.867 1194 H LEU 59 H LEU 59 -4.409 9.265 -16.674 1195 HA LEU 59 HA LEU 59 -3.860 7.118 -14.971 1196 HB2 LEU 59 HB2 LEU 59 -6.073 8.124 -15.220 1197 HB3 LEU 59 HB3 LEU 59 -6.180 7.522 -16.864 1198 HG LEU 59 HG LEU 59 -6.231 5.214 -16.037 1199 HD11 LEU 59 HD11 LEU 59 -6.101 6.473 -13.295 1200 HD12 LEU 59 HD12 LEU 59 -4.872 5.452 -14.046 1201 HD13 LEU 59 HD13 LEU 59 -6.444 4.774 -13.625 1202 HD21 LEU 59 HD21 LEU 59 -8.243 7.006 -14.664 1203 HD22 LEU 59 HD22 LEU 59 -8.442 5.282 -14.990 1204 HD23 LEU 59 HD23 LEU 59 -8.337 6.425 -16.327 1205 H THR 60 H THR 60 -4.333 7.124 -18.515 1206 HA THR 60 HA THR 60 -4.028 4.321 -18.839 1207 HB THR 60 HB THR 60 -3.780 4.720 -21.219 1208 HG1 THR 60 HG1 THR 60 -2.915 7.201 -20.394 1209 HG21 THR 60 HG21 THR 60 -5.812 6.586 -19.983 1210 HG22 THR 60 HG22 THR 60 -6.036 4.866 -20.307 1211 HG23 THR 60 HG23 THR 60 -5.840 5.997 -21.646 1212 H THR 61 H THR 61 -1.689 6.920 -18.614 1213 HA THR 61 HA THR 61 0.520 5.424 -19.653 1214 HB THR 61 HB THR 61 0.555 7.860 -17.840 1215 HG1 THR 61 HG1 THR 61 0.739 9.031 -19.730 1216 HG21 THR 61 HG21 THR 61 2.858 8.182 -18.647 1217 HG22 THR 61 HG22 THR 61 2.758 6.666 -19.544 1218 HG23 THR 61 HG23 THR 61 2.695 6.654 -17.781 1219 H LEU 62 H LEU 62 -0.717 6.090 -16.380 1220 HA LEU 62 HA LEU 62 1.280 4.791 -14.906 1221 HB2 LEU 62 HB2 LEU 62 -1.674 5.006 -14.316 1222 HB3 LEU 62 HB3 LEU 62 -0.462 4.499 -13.153 1223 HG LEU 62 HG LEU 62 -0.672 7.226 -14.443 1224 HD11 LEU 62 HD11 LEU 62 -2.361 6.809 -12.735 1225 HD12 LEU 62 HD12 LEU 62 -1.177 7.994 -12.185 1226 HD13 LEU 62 HD13 LEU 62 -1.103 6.332 -11.594 1227 HD21 LEU 62 HD21 LEU 62 1.327 6.189 -12.429 1228 HD22 LEU 62 HD22 LEU 62 1.171 7.867 -12.952 1229 HD23 LEU 62 HD23 LEU 62 1.669 6.629 -14.105 1230 H MET 63 H MET 63 -1.575 3.483 -16.519 1231 HA MET 63 HA MET 63 -1.559 0.853 -15.655 1232 HB2 MET 63 HB2 MET 63 -2.066 1.848 -18.471 1233 HB3 MET 63 HB3 MET 63 -2.529 0.269 -17.856 1234 HG2 MET 63 HG2 MET 63 -4.045 1.306 -16.269 1235 HG3 MET 63 HG3 MET 63 -3.551 2.906 -16.821 1236 HE1 MET 63 HE1 MET 63 -6.593 1.958 -16.666 1237 HE2 MET 63 HE2 MET 63 -7.201 2.620 -18.186 1238 HE3 MET 63 HE3 MET 63 -6.075 3.556 -17.203 1239 H ASP 64 H ASP 64 0.204 2.166 -18.469 1240 HA ASP 64 HA ASP 64 1.647 -0.103 -19.171 1241 HB2 ASP 64 HB2 ASP 64 1.584 1.928 -20.553 1242 HB3 ASP 64 HB3 ASP 64 2.531 2.790 -19.350 1243 H LYS 65 H LYS 65 2.633 2.542 -16.990 1244 HA LYS 65 HA LYS 65 5.165 1.660 -16.300 1245 HB2 LYS 65 HB2 LYS 65 3.139 3.091 -14.571 1246 HB3 LYS 65 HB3 LYS 65 4.851 2.951 -14.186 1247 HG2 LYS 65 HG2 LYS 65 5.343 4.138 -16.340 1248 HG3 LYS 65 HG3 LYS 65 3.608 4.406 -16.518 1249 HD2 LYS 65 HD2 LYS 65 4.618 6.382 -15.560 1250 HD3 LYS 65 HD3 LYS 65 3.609 5.603 -14.342 1251 HE2 LYS 65 HE2 LYS 65 5.530 4.679 -13.242 1252 HE3 LYS 65 HE3 LYS 65 6.593 5.193 -14.553 1253 HZ1 LYS 65 HZ1 LYS 65 6.250 7.464 -13.967 1254 HZ2 LYS 65 HZ2 LYS 65 6.675 6.633 -12.561 1255 HZ3 LYS 65 HZ3 LYS 65 5.067 7.067 -12.833 1256 H LEU 66 H LEU 66 2.063 0.603 -15.021 1257 HA LEU 66 HA LEU 66 3.229 -1.175 -13.052 1258 HB2 LEU 66 HB2 LEU 66 0.392 -0.960 -14.080 1259 HB3 LEU 66 HB3 LEU 66 0.902 -1.851 -12.656 1260 HG LEU 66 HG LEU 66 1.233 1.139 -12.950 1261 HD11 LEU 66 HD11 LEU 66 -0.988 -0.387 -11.596 1262 HD12 LEU 66 HD12 LEU 66 -1.130 0.641 -13.021 1263 HD13 LEU 66 HD13 LEU 66 -0.711 1.350 -11.464 1264 HD21 LEU 66 HD21 LEU 66 1.536 1.070 -10.512 1265 HD22 LEU 66 HD22 LEU 66 2.757 0.115 -11.353 1266 HD23 LEU 66 HD23 LEU 66 1.407 -0.690 -10.552 1267 H ARG 67 H ARG 67 2.076 -1.403 -16.338 1268 HA ARG 67 HA ARG 67 1.929 -4.271 -16.429 1269 HB2 ARG 67 HB2 ARG 67 1.880 -2.167 -18.597 1270 HB3 ARG 67 HB3 ARG 67 1.731 -3.890 -18.923 1271 HG2 ARG 67 HG2 ARG 67 -0.290 -3.999 -17.582 1272 HG3 ARG 67 HG3 ARG 67 -0.128 -2.293 -17.166 1273 HD2 ARG 67 HD2 ARG 67 -0.407 -1.686 -19.520 1274 HD3 ARG 67 HD3 ARG 67 -0.534 -3.392 -19.953 1275 HE ARG 67 HE ARG 67 -2.502 -3.112 -18.150 1276 HH11 ARG 67 HH11 ARG 67 -1.708 -1.381 -21.011 1277 HH12 ARG 67 HH12 ARG 67 -3.337 -0.849 -21.266 1278 HH21 ARG 67 HH21 ARG 67 -4.586 -2.424 -18.485 1279 HH22 ARG 67 HH22 ARG 67 -4.941 -1.428 -19.853 1280 H LYS 68 H LYS 68 4.564 -2.192 -16.385 1281 HA LYS 68 HA LYS 68 6.264 -3.486 -18.278 1282 HB2 LYS 68 HB2 LYS 68 7.229 -1.995 -15.837 1283 HB3 LYS 68 HB3 LYS 68 8.060 -2.210 -17.370 1284 HG2 LYS 68 HG2 LYS 68 5.613 -0.528 -16.870 1285 HG3 LYS 68 HG3 LYS 68 7.250 0.055 -17.159 1286 HD2 LYS 68 HD2 LYS 68 5.705 -1.590 -19.167 1287 HD3 LYS 68 HD3 LYS 68 5.656 0.169 -19.124 1288 HE2 LYS 68 HE2 LYS 68 8.161 0.143 -19.354 1289 HE3 LYS 68 HE3 LYS 68 8.044 -1.592 -19.649 1290 HZ1 LYS 68 HZ1 LYS 68 6.696 -1.177 -21.575 1291 HZ2 LYS 68 HZ2 LYS 68 8.112 -0.257 -21.707 1292 HZ3 LYS 68 HZ3 LYS 68 6.659 0.481 -21.258 1293 H VAL 69 H VAL 69 5.233 -4.314 -15.100 1294 HA VAL 69 HA VAL 69 7.410 -6.143 -14.563 1295 HB VAL 69 HB VAL 69 4.722 -5.902 -13.173 1296 HG11 VAL 69 HG11 VAL 69 5.769 -8.071 -12.802 1297 HG12 VAL 69 HG12 VAL 69 5.839 -7.102 -11.325 1298 HG13 VAL 69 HG13 VAL 69 7.277 -7.286 -12.329 1299 HG21 VAL 69 HG21 VAL 69 5.935 -4.621 -11.454 1300 HG22 VAL 69 HG22 VAL 69 5.968 -3.810 -13.020 1301 HG23 VAL 69 HG23 VAL 69 7.393 -4.678 -12.446 1302 H GLN 70 H GLN 70 7.553 -7.923 -15.788 1303 HA GLN 70 HA GLN 70 5.465 -8.929 -17.390 1304 HB2 GLN 70 HB2 GLN 70 7.042 -10.817 -17.838 1305 HB3 GLN 70 HB3 GLN 70 7.726 -9.217 -18.084 1306 HG2 GLN 70 HG2 GLN 70 8.751 -9.394 -15.807 1307 HG3 GLN 70 HG3 GLN 70 8.213 -11.074 -15.764 1308 HE21 GLN 70 HE21 GLN 70 10.340 -11.813 -15.642 1309 HE22 GLN 70 HE22 GLN 70 11.396 -11.800 -17.008 1310 H GLY 71 H GLY 71 6.108 -9.477 -14.088 1311 HA2 GLY 71 HA2 GLY 71 4.878 -12.065 -13.871 1312 HA3 GLY 71 HA3 GLY 71 5.239 -10.966 -12.550 1313 H VAL 72 H VAL 72 3.642 -8.800 -14.008 1314 HA VAL 72 HA VAL 72 1.052 -9.559 -12.901 1315 HB VAL 72 HB VAL 72 1.908 -6.960 -14.206 1316 HG11 VAL 72 HG11 VAL 72 -0.504 -7.277 -14.369 1317 HG12 VAL 72 HG12 VAL 72 -0.137 -6.025 -13.183 1318 HG13 VAL 72 HG13 VAL 72 -0.596 -7.641 -12.646 1319 HG21 VAL 72 HG21 VAL 72 3.142 -7.377 -12.151 1320 HG22 VAL 72 HG22 VAL 72 1.639 -7.698 -11.286 1321 HG23 VAL 72 HG23 VAL 72 1.971 -6.079 -11.904 1322 H PHE 73 H PHE 73 -0.793 -9.970 -14.062 1323 HA PHE 73 HA PHE 73 -0.486 -9.995 -16.993 1324 HB2 PHE 73 HB2 PHE 73 -2.519 -11.755 -16.621 1325 HB3 PHE 73 HB3 PHE 73 -0.828 -12.195 -16.746 1326 HD1 PHE 73 HD2 PHE 73 0.451 -12.851 -14.794 1327 HD2 PHE 73 HD1 PHE 73 -3.698 -11.927 -14.496 1328 HE1 PHE 73 HE2 PHE 73 0.364 -13.954 -12.597 1329 HE2 PHE 73 HE1 PHE 73 -3.783 -13.035 -12.294 1330 HZ PHE 73 HZ PHE 73 -1.750 -14.044 -11.350 1331 H THR 74 H THR 74 -2.415 -8.756 -14.404 1332 HA THR 74 HA THR 74 -4.182 -7.557 -16.448 1333 HB THR 74 HB THR 74 -6.124 -7.820 -15.223 1334 HG1 THR 74 HG1 THR 74 -6.154 -8.281 -12.989 1335 HG21 THR 74 HG21 THR 74 -6.292 -10.160 -14.510 1336 HG22 THR 74 HG22 THR 74 -4.532 -10.282 -14.482 1337 HG23 THR 74 HG23 THR 74 -5.376 -10.022 -16.010 1338 H VAL 75 H VAL 75 -4.009 -5.431 -16.496 1339 HA VAL 75 HA VAL 75 -3.942 -3.946 -13.946 1340 HB VAL 75 HB VAL 75 -2.383 -3.136 -16.420 1341 HG11 VAL 75 HG11 VAL 75 -3.183 -1.215 -15.161 1342 HG12 VAL 75 HG12 VAL 75 -1.435 -1.376 -14.985 1343 HG13 VAL 75 HG13 VAL 75 -2.505 -1.882 -13.674 1344 HG21 VAL 75 HG21 VAL 75 -1.327 -5.062 -15.352 1345 HG22 VAL 75 HG22 VAL 75 -1.356 -4.229 -13.795 1346 HG23 VAL 75 HG23 VAL 75 -0.357 -3.606 -15.109 1347 H GLU 76 H GLU 76 -5.939 -3.049 -13.879 1348 HA GLU 76 HA GLU 76 -7.169 -2.140 -16.420 1349 HB2 GLU 76 HB2 GLU 76 -8.542 -3.520 -14.098 1350 HB3 GLU 76 HB3 GLU 76 -9.320 -2.974 -15.577 1351 HG2 GLU 76 HG2 GLU 76 -8.061 -4.589 -16.876 1352 HG3 GLU 76 HG3 GLU 76 -7.175 -5.093 -15.436 1353 H ARG 77 H ARG 77 -8.964 -0.619 -16.189 1354 HA ARG 77 HA ARG 77 -8.541 1.329 -14.044 1355 HB2 ARG 77 HB2 ARG 77 -8.590 2.332 -16.197 1356 HB3 ARG 77 HB3 ARG 77 -10.016 1.421 -16.678 1357 HG2 ARG 77 HG2 ARG 77 -11.415 2.714 -15.215 1358 HG3 ARG 77 HG3 ARG 77 -10.013 3.524 -14.514 1359 HD2 ARG 77 HD2 ARG 77 -11.224 4.924 -16.152 1360 HD3 ARG 77 HD3 ARG 77 -9.547 4.630 -16.602 1361 HE ARG 77 HE ARG 77 -10.937 2.692 -17.916 1362 HH11 ARG 77 HH11 ARG 77 -11.262 6.119 -17.755 1363 HH12 ARG 77 HH12 ARG 77 -11.776 6.261 -19.398 1364 HH21 ARG 77 HH21 ARG 77 -11.584 2.884 -20.023 1365 HH22 ARG 77 HH22 ARG 77 -11.938 4.449 -20.675 1366 H LEU 78 H LEU 78 -9.856 1.477 -12.339 1367 HA LEU 78 HA LEU 78 -12.255 -0.145 -12.169 1368 HB2 LEU 78 HB2 LEU 78 -10.934 1.701 -10.167 1369 HB3 LEU 78 HB3 LEU 78 -12.335 0.701 -9.824 1370 HG LEU 78 HG LEU 78 -9.586 -0.322 -10.571 1371 HD11 LEU 78 HD11 LEU 78 -9.657 0.648 -8.327 1372 HD12 LEU 78 HD12 LEU 78 -9.477 -1.104 -8.260 1373 HD13 LEU 78 HD13 LEU 78 -11.044 -0.365 -7.925 1374 HD21 LEU 78 HD21 LEU 78 -11.349 -1.800 -11.380 1375 HD22 LEU 78 HD22 LEU 78 -12.090 -1.818 -9.779 1376 HD23 LEU 78 HD23 LEU 78 -10.496 -2.532 -10.021 1377 H SER 79 H SER 79 -14.162 0.575 -12.880 1378 HA SER 79 HA SER 79 -14.646 3.419 -13.282 1379 HB2 SER 79 HB2 SER 79 -15.324 1.835 -15.039 1380 HB3 SER 79 HB3 SER 79 -16.403 1.023 -13.906 1381 HG SER 79 HG SER 79 -16.806 3.285 -15.366 1382 H ASN 80 H ASN 80 -16.595 0.815 -11.782 1383 HA ASN 80 HA ASN 80 -18.124 2.656 -10.201 1384 HB2 ASN 80 HB2 ASN 80 -19.081 0.517 -10.941 1385 HB3 ASN 80 HB3 ASN 80 -17.884 -0.363 -9.994 1386 HD21 ASN 80 HD21 ASN 80 -18.077 -0.395 -7.739 1387 HD22 ASN 80 HD22 ASN 80 -19.545 0.048 -6.946 1388 H LEU 81 H LEU 81 -17.143 3.768 -8.616 1389 HA LEU 81 HA LEU 81 -14.976 2.510 -7.094 1390 HB2 LEU 81 HB2 LEU 81 -15.931 5.378 -7.108 1391 HB3 LEU 81 HB3 LEU 81 -14.533 4.774 -6.235 1392 HG LEU 81 HG LEU 81 -14.880 4.988 -9.226 1393 HD11 LEU 81 HD11 LEU 81 -14.287 7.062 -8.114 1394 HD12 LEU 81 HD12 LEU 81 -12.925 6.461 -9.059 1395 HD13 LEU 81 HD13 LEU 81 -12.933 6.269 -7.302 1396 HD21 LEU 81 HD21 LEU 81 -12.607 4.048 -9.412 1397 HD22 LEU 81 HD22 LEU 81 -13.761 2.884 -8.766 1398 HD23 LEU 81 HD23 LEU 81 -12.625 3.692 -7.684 1399 H GLU 82 H GLU 82 -15.024 2.126 -4.938 1400 HA GLU 82 HA GLU 82 -17.600 2.133 -3.598 1401 HB2 GLU 82 HB2 GLU 82 -16.326 0.957 -1.782 1402 HB3 GLU 82 HB3 GLU 82 -16.268 0.158 -3.347 1403 HG2 GLU 82 HG2 GLU 82 -14.026 1.205 -3.718 1404 HG3 GLU 82 HG3 GLU 82 -14.090 1.797 -2.057 1405 H HIS 83 H HIS 83 -16.214 4.649 -4.217 1406 HA HIS 83 HA HIS 83 -15.532 5.737 -1.579 1407 HB2 HIS 83 HB2 HIS 83 -15.173 6.891 -4.360 1408 HB3 HIS 83 HB3 HIS 83 -14.665 7.667 -2.870 1409 HD1 HIS 83 HD1 HIS 83 -12.277 7.360 -2.366 1410 HD2 HIS 83 HD2 HIS 83 -13.799 4.202 -4.591 1411 HE1 HIS 83 HE1 HIS 83 -10.321 5.869 -2.844 1412 HE2 HIS 83 HE2 HIS 83 -11.297 3.881 -4.033 1413 H HIS 84 H HIS 84 -18.081 5.626 -3.838 1414 HA HIS 84 HA HIS 84 -19.647 7.561 -2.363 1415 HB2 HIS 84 HB2 HIS 84 -20.202 8.953 -4.315 1416 HB3 HIS 84 HB3 HIS 84 -18.481 9.021 -3.965 1417 HD1 HIS 84 HD1 HIS 84 -20.926 7.869 -6.543 1418 HD2 HIS 84 HD2 HIS 84 -16.816 7.833 -5.923 1419 HE1 HIS 84 HE1 HIS 84 -19.922 7.234 -8.747 1420 HE2 HIS 84 HE2 HIS 84 -17.456 7.049 -8.307 1421 H HIS 85 H HIS 85 -21.739 6.956 -2.316 1422 HA HIS 85 HA HIS 85 -22.656 4.782 -4.027 1423 HB2 HIS 85 HB2 HIS 85 -23.186 4.794 -1.595 1424 HB3 HIS 85 HB3 HIS 85 -24.120 6.270 -1.820 1425 HD1 HIS 85 HD1 HIS 85 -26.550 5.856 -2.024 1426 HD2 HIS 85 HD2 HIS 85 -24.327 2.617 -3.385 1427 HE1 HIS 85 HE1 HIS 85 -28.228 4.101 -2.648 1428 HE2 HIS 85 HE2 HIS 85 -26.872 2.236 -3.645 1429 H HIS 86 H HIS 86 -23.238 8.207 -3.511 1430 HA HIS 86 HA HIS 86 -24.353 8.525 -6.151 1431 HB2 HIS 86 HB2 HIS 86 -26.397 7.873 -5.095 1432 HB3 HIS 86 HB3 HIS 86 -26.077 8.882 -3.691 1433 HD1 HIS 86 HD1 HIS 86 -26.710 9.377 -7.424 1434 HD2 HIS 86 HD2 HIS 86 -27.385 11.238 -3.771 1435 HE1 HIS 86 HE1 HIS 86 -28.036 11.439 -7.953 1436 HE2 HIS 86 HE2 HIS 86 -28.277 12.632 -5.753 1437 H HIS 87 H HIS 87 -24.331 10.705 -6.864 1438 HA HIS 87 HA HIS 87 -22.448 12.451 -5.783 1439 HB2 HIS 87 HB2 HIS 87 -24.763 12.915 -7.657 1440 HB3 HIS 87 HB3 HIS 87 -23.719 14.238 -7.159 1441 HD1 HIS 87 HD1 HIS 87 -23.803 13.617 -10.081 1442 HD2 HIS 87 HD2 HIS 87 -21.111 11.797 -7.486 1443 HE1 HIS 87 HE1 HIS 87 -21.882 12.876 -11.514 1444 HE2 HIS 87 HE2 HIS 87 -20.207 11.913 -9.905 1445 H HIS 88 H HIS 88 -22.544 14.310 -4.508 1446 HA HIS 88 HA HIS 88 -24.430 14.392 -2.422 1447 HB2 HIS 88 HB2 HIS 88 -23.390 16.615 -1.868 1448 HB3 HIS 88 HB3 HIS 88 -22.257 15.281 -2.016 1449 HD1 HIS 88 HD1 HIS 88 -20.515 15.412 -3.895 1450 HD2 HIS 88 HD2 HIS 88 -23.160 18.615 -3.853 1451 HE1 HIS 88 HE1 HIS 88 -19.541 17.105 -5.464 1452 HE2 HIS 88 HE2 HIS 88 -21.236 18.956 -5.547 Start of MODEL 15 1 H1 MET 1 H1 MET 1 12.007 -23.504 13.795 2 H2 MET 1 H2 MET 1 10.738 -23.863 12.738 3 H3 MET 1 H3 MET 1 10.411 -23.474 14.350 4 HA MET 1 HA MET 1 11.244 -21.241 14.026 5 HB2 MET 1 HB2 MET 1 11.559 -22.127 11.141 6 HB3 MET 1 HB3 MET 1 11.752 -20.476 11.718 7 HG2 MET 1 HG2 MET 1 13.661 -21.123 13.053 8 HG3 MET 1 HG3 MET 1 13.434 -22.815 12.605 9 HE1 MET 1 HE1 MET 1 16.025 -22.875 11.911 10 HE2 MET 1 HE2 MET 1 16.194 -21.165 12.304 11 HE3 MET 1 HE3 MET 1 16.743 -21.770 10.740 12 H THR 2 H THR 2 9.277 -20.448 14.547 13 HA THR 2 HA THR 2 7.037 -20.879 12.659 14 HB THR 2 HB THR 2 6.579 -21.817 14.870 15 HG1 THR 2 HG1 THR 2 4.944 -19.561 14.955 16 HG21 THR 2 HG21 THR 2 8.018 -20.376 16.228 17 HG22 THR 2 HG22 THR 2 6.364 -20.361 16.840 18 HG23 THR 2 HG23 THR 2 6.966 -18.997 15.897 19 H ASP 3 H ASP 3 5.445 -19.153 12.504 20 HA ASP 3 HA ASP 3 6.407 -16.451 13.122 21 HB2 ASP 3 HB2 ASP 3 5.660 -15.722 10.815 22 HB3 ASP 3 HB3 ASP 3 7.113 -16.718 10.849 23 H PHE 4 H PHE 4 4.532 -14.834 12.408 24 HA PHE 4 HA PHE 4 1.888 -15.995 12.486 25 HB2 PHE 4 HB2 PHE 4 1.074 -14.687 14.369 26 HB3 PHE 4 HB3 PHE 4 2.371 -15.752 14.881 27 HD1 PHE 4 HD1 PHE 4 1.355 -12.275 14.357 28 HD2 PHE 4 HD2 PHE 4 4.509 -14.850 15.621 29 HE1 PHE 4 HE1 PHE 4 2.511 -10.357 15.370 30 HE2 PHE 4 HE2 PHE 4 5.670 -12.930 16.640 31 HZ PHE 4 HZ PHE 4 4.668 -10.681 16.511 32 H LEU 5 H LEU 5 0.212 -14.492 11.932 33 HA LEU 5 HA LEU 5 1.146 -12.542 10.023 34 HB2 LEU 5 HB2 LEU 5 -0.751 -14.030 9.534 35 HB3 LEU 5 HB3 LEU 5 -1.661 -13.290 10.836 36 HG LEU 5 HG LEU 5 -1.692 -11.152 9.638 37 HD11 LEU 5 HD11 LEU 5 0.442 -11.311 8.474 38 HD12 LEU 5 HD12 LEU 5 -0.865 -10.996 7.334 39 HD13 LEU 5 HD13 LEU 5 -0.183 -12.618 7.467 40 HD21 LEU 5 HD21 LEU 5 -2.579 -13.475 7.926 41 HD22 LEU 5 HD22 LEU 5 -3.149 -11.810 7.790 42 HD23 LEU 5 HD23 LEU 5 -3.495 -12.744 9.245 43 H ALA 6 H ALA 6 1.854 -10.686 10.790 44 HA ALA 6 HA ALA 6 0.641 -9.450 13.138 45 HB1 ALA 6 HB1 ALA 6 3.126 -8.721 11.591 46 HB2 ALA 6 HB2 ALA 6 3.064 -9.682 13.069 47 HB3 ALA 6 HB3 ALA 6 2.594 -7.984 13.101 48 H GLY 7 H GLY 7 -0.689 -7.737 13.039 49 HA2 GLY 7 HA2 GLY 7 -0.936 -6.279 10.477 50 HA3 GLY 7 HA3 GLY 7 -2.231 -6.466 11.649 51 H ILE 8 H ILE 8 -1.074 -4.019 10.461 52 HA ILE 8 HA ILE 8 -0.459 -2.617 12.987 53 HB ILE 8 HB ILE 8 0.907 -1.965 10.357 54 HG12 ILE 8 HG12 ILE 8 2.046 -3.394 12.785 55 HG13 ILE 8 HG13 ILE 8 1.717 -4.135 11.223 56 HG21 ILE 8 HG21 ILE 8 0.623 -0.053 11.843 57 HG22 ILE 8 HG22 ILE 8 2.322 -0.513 11.754 58 HG23 ILE 8 HG23 ILE 8 1.364 -0.951 13.171 59 HD11 ILE 8 HD11 ILE 8 3.745 -1.974 11.772 60 HD12 ILE 8 HD12 ILE 8 3.402 -2.679 10.192 61 HD13 ILE 8 HD13 ILE 8 4.079 -3.679 11.477 62 H ARG 9 H ARG 9 -1.516 -0.700 13.263 63 HA ARG 9 HA ARG 9 -3.131 0.336 11.007 64 HB2 ARG 9 HB2 ARG 9 -4.519 -0.487 12.853 65 HB3 ARG 9 HB3 ARG 9 -3.658 0.547 13.985 66 HG2 ARG 9 HG2 ARG 9 -4.471 2.523 12.659 67 HG3 ARG 9 HG3 ARG 9 -5.480 1.403 11.742 68 HD2 ARG 9 HD2 ARG 9 -6.631 0.741 13.798 69 HD3 ARG 9 HD3 ARG 9 -5.603 1.827 14.734 70 HE ARG 9 HE ARG 9 -7.415 2.826 12.635 71 HH11 ARG 9 HH11 ARG 9 -6.209 2.944 15.878 72 HH12 ARG 9 HH12 ARG 9 -7.120 4.363 16.261 73 HH21 ARG 9 HH21 ARG 9 -8.566 4.650 13.173 74 HH22 ARG 9 HH22 ARG 9 -8.427 5.307 14.771 75 H ILE 10 H ILE 10 -2.504 2.250 10.221 76 HA ILE 10 HA ILE 10 -0.996 4.115 11.973 77 HB ILE 10 HB ILE 10 -0.871 4.000 8.952 78 HG12 ILE 10 HG12 ILE 10 1.183 2.849 10.857 79 HG13 ILE 10 HG13 ILE 10 -0.037 1.877 10.037 80 HG21 ILE 10 HG21 ILE 10 1.185 5.320 9.247 81 HG22 ILE 10 HG22 ILE 10 0.911 5.345 10.989 82 HG23 ILE 10 HG23 ILE 10 -0.230 6.140 9.903 83 HD11 ILE 10 HD11 ILE 10 2.137 3.500 8.734 84 HD12 ILE 10 HD12 ILE 10 0.875 2.619 7.874 85 HD13 ILE 10 HD13 ILE 10 2.049 1.743 8.854 86 H VAL 11 H VAL 11 -2.284 5.859 12.529 87 HA VAL 11 HA VAL 11 -4.030 6.957 10.404 88 HB VAL 11 HB VAL 11 -4.486 7.093 13.393 89 HG11 VAL 11 HG11 VAL 11 -5.251 9.133 12.264 90 HG12 VAL 11 HG12 VAL 11 -6.609 8.174 12.854 91 HG13 VAL 11 HG13 VAL 11 -6.197 8.157 11.139 92 HG21 VAL 11 HG21 VAL 11 -6.439 5.689 12.939 93 HG22 VAL 11 HG22 VAL 11 -4.951 4.883 12.446 94 HG23 VAL 11 HG23 VAL 11 -6.000 5.617 11.231 95 H GLY 12 H GLY 12 -3.372 8.792 9.605 96 HA2 GLY 12 HA2 GLY 12 -2.189 10.839 11.362 97 HA3 GLY 12 HA3 GLY 12 -1.323 10.364 9.907 98 H GLU 13 H GLU 13 -2.043 12.998 10.232 99 HA GLU 13 HA GLU 13 -4.613 13.589 9.131 100 HB2 GLU 13 HB2 GLU 13 -3.731 15.935 8.991 101 HB3 GLU 13 HB3 GLU 13 -3.642 15.202 10.587 102 HG2 GLU 13 HG2 GLU 13 -1.272 14.795 10.319 103 HG3 GLU 13 HG3 GLU 13 -1.326 15.391 8.661 104 H ASP 14 H ASP 14 -5.242 14.113 7.094 105 HA ASP 14 HA ASP 14 -3.790 13.124 4.881 106 HB2 ASP 14 HB2 ASP 14 -6.408 14.206 5.385 107 HB3 ASP 14 HB3 ASP 14 -5.752 14.970 3.946 108 H LYS 15 H LYS 15 -1.718 14.207 4.837 109 HA LYS 15 HA LYS 15 -1.794 17.061 4.144 110 HB2 LYS 15 HB2 LYS 15 0.657 15.326 4.450 111 HB3 LYS 15 HB3 LYS 15 0.610 17.075 4.339 112 HG2 LYS 15 HG2 LYS 15 -0.428 15.384 6.596 113 HG3 LYS 15 HG3 LYS 15 0.998 16.421 6.602 114 HD2 LYS 15 HD2 LYS 15 -1.701 17.587 6.005 115 HD3 LYS 15 HD3 LYS 15 -1.228 17.267 7.671 116 HE2 LYS 15 HE2 LYS 15 0.459 18.898 5.779 117 HE3 LYS 15 HE3 LYS 15 -0.782 19.609 6.810 118 HZ1 LYS 15 HZ1 LYS 15 1.356 19.761 7.871 119 HZ2 LYS 15 HZ2 LYS 15 1.602 18.093 7.730 120 HZ3 LYS 15 HZ3 LYS 15 0.384 18.683 8.740 121 H ASN 16 H ASN 16 0.095 17.568 2.530 122 HA ASN 16 HA ASN 16 -0.682 17.253 -0.023 123 HB2 ASN 16 HB2 ASN 16 2.074 17.580 1.136 124 HB3 ASN 16 HB3 ASN 16 1.769 17.694 -0.602 125 HD21 ASN 16 HD21 ASN 16 1.387 19.209 2.478 126 HD22 ASN 16 HD22 ASN 16 0.775 20.714 1.894 127 H GLY 17 H GLY 17 1.186 14.812 1.730 128 HA2 GLY 17 HA2 GLY 17 0.473 12.818 -0.189 129 HA3 GLY 17 HA3 GLY 17 2.146 13.299 -0.400 130 H MET 18 H MET 18 0.316 12.891 2.642 131 HA MET 18 HA MET 18 2.457 11.440 3.832 132 HB2 MET 18 HB2 MET 18 -0.354 12.049 4.695 133 HB3 MET 18 HB3 MET 18 0.629 10.919 5.616 134 HG2 MET 18 HG2 MET 18 2.366 12.734 5.770 135 HG3 MET 18 HG3 MET 18 1.168 13.825 5.101 136 HE1 MET 18 HE1 MET 18 0.332 10.820 7.433 137 HE2 MET 18 HE2 MET 18 0.465 11.543 9.035 138 HE3 MET 18 HE3 MET 18 1.910 11.316 8.053 139 H THR 19 H THR 19 -0.565 10.390 2.315 140 HA THR 19 HA THR 19 -0.503 7.711 3.170 141 HB THR 19 HB THR 19 -1.940 7.214 1.234 142 HG1 THR 19 HG1 THR 19 -2.396 8.935 -0.234 143 HG21 THR 19 HG21 THR 19 -3.768 8.774 1.761 144 HG22 THR 19 HG22 THR 19 -2.626 9.835 2.587 145 HG23 THR 19 HG23 THR 19 -2.955 8.224 3.226 146 H ASN 20 H ASN 20 1.117 9.339 0.480 147 HA ASN 20 HA ASN 20 2.064 6.977 -0.803 148 HB2 ASN 20 HB2 ASN 20 3.111 9.816 -0.910 149 HB3 ASN 20 HB3 ASN 20 3.672 8.512 -1.949 150 HD21 ASN 20 HD21 ASN 20 3.013 9.454 -3.831 151 HD22 ASN 20 HD22 ASN 20 1.352 9.646 -4.255 152 H GLN 21 H GLN 21 3.582 9.283 1.440 153 HA GLN 21 HA GLN 21 6.066 7.946 1.562 154 HB2 GLN 21 HB2 GLN 21 6.615 9.387 3.369 155 HB3 GLN 21 HB3 GLN 21 5.660 10.325 2.240 156 HG2 GLN 21 HG2 GLN 21 3.717 10.130 3.658 157 HG3 GLN 21 HG3 GLN 21 4.582 9.055 4.752 158 HE21 GLN 21 HE21 GLN 21 4.326 12.333 3.594 159 HE22 GLN 21 HE22 GLN 21 5.180 13.059 4.908 160 H ILE 22 H ILE 22 3.104 7.606 3.444 161 HA ILE 22 HA ILE 22 4.169 6.093 5.561 162 HB ILE 22 HB ILE 22 1.390 6.419 4.463 163 HG12 ILE 22 HG12 ILE 22 2.330 8.243 5.793 164 HG13 ILE 22 HG13 ILE 22 1.016 7.468 6.670 165 HG21 ILE 22 HG21 ILE 22 2.139 4.610 6.765 166 HG22 ILE 22 HG22 ILE 22 1.469 4.105 5.214 167 HG23 ILE 22 HG23 ILE 22 0.500 5.080 6.316 168 HD11 ILE 22 HD11 ILE 22 2.619 6.253 8.031 169 HD12 ILE 22 HD12 ILE 22 2.889 7.993 8.130 170 HD13 ILE 22 HD13 ILE 22 3.948 6.992 7.138 171 H THR 23 H THR 23 2.406 4.947 2.639 172 HA THR 23 HA THR 23 3.046 2.219 3.192 173 HB THR 23 HB THR 23 2.295 3.282 0.453 174 HG1 THR 23 HG1 THR 23 0.767 2.998 2.780 175 HG21 THR 23 HG21 THR 23 1.286 1.044 0.214 176 HG22 THR 23 HG22 THR 23 1.904 0.612 1.809 177 HG23 THR 23 HG23 THR 23 3.026 0.964 0.494 178 H GLY 24 H GLY 24 4.628 4.810 1.465 179 HA2 GLY 24 HA2 GLY 24 6.639 3.398 0.117 180 HA3 GLY 24 HA3 GLY 24 6.796 5.030 0.748 181 H VAL 25 H VAL 25 6.619 4.625 3.480 182 HA VAL 25 HA VAL 25 9.139 3.591 4.212 183 HB VAL 25 HB VAL 25 6.702 4.111 5.940 184 HG11 VAL 25 HG11 VAL 25 8.255 4.116 7.845 185 HG12 VAL 25 HG12 VAL 25 9.572 3.637 6.773 186 HG13 VAL 25 HG13 VAL 25 8.215 2.543 7.049 187 HG21 VAL 25 HG21 VAL 25 7.869 6.193 6.541 188 HG22 VAL 25 HG22 VAL 25 7.540 6.112 4.810 189 HG23 VAL 25 HG23 VAL 25 9.165 5.788 5.413 190 H ILE 26 H ILE 26 5.924 2.159 4.142 191 HA ILE 26 HA ILE 26 6.568 -0.302 5.377 192 HB ILE 26 HB ILE 26 4.414 0.355 3.353 193 HG12 ILE 26 HG12 ILE 26 4.331 0.116 6.379 194 HG13 ILE 26 HG13 ILE 26 4.281 1.623 5.472 195 HG21 ILE 26 HG21 ILE 26 4.856 -2.040 3.351 196 HG22 ILE 26 HG22 ILE 26 3.303 -1.700 4.111 197 HG23 ILE 26 HG23 ILE 26 4.705 -2.090 5.109 198 HD11 ILE 26 HD11 ILE 26 2.197 -0.550 5.410 199 HD12 ILE 26 HD12 ILE 26 2.146 0.955 4.491 200 HD13 ILE 26 HD13 ILE 26 2.078 0.996 6.253 201 H SER 27 H SER 27 6.709 0.737 1.968 202 HA SER 27 HA SER 27 7.535 -1.800 0.953 203 HB2 SER 27 HB2 SER 27 8.128 -0.638 -1.106 204 HB3 SER 27 HB3 SER 27 6.586 -0.028 -0.512 205 HG SER 27 HG SER 27 8.594 1.445 0.501 206 H LYS 28 H LYS 28 9.171 0.719 2.624 207 HA LYS 28 HA LYS 28 11.849 -0.020 1.931 208 HB2 LYS 28 HB2 LYS 28 10.725 1.545 4.264 209 HB3 LYS 28 HB3 LYS 28 12.446 1.298 4.000 210 HG2 LYS 28 HG2 LYS 28 12.311 2.470 1.873 211 HG3 LYS 28 HG3 LYS 28 10.572 2.683 2.087 212 HD2 LYS 28 HD2 LYS 28 10.891 4.133 3.952 213 HD3 LYS 28 HD3 LYS 28 12.610 3.739 4.049 214 HE2 LYS 28 HE2 LYS 28 11.278 5.182 1.750 215 HE3 LYS 28 HE3 LYS 28 12.202 5.955 3.038 216 HZ1 LYS 28 HZ1 LYS 28 13.281 3.945 1.135 217 HZ2 LYS 28 HZ2 LYS 28 14.154 4.736 2.350 218 HZ3 LYS 28 HZ3 LYS 28 13.533 5.613 1.047 219 H PHE 29 H PHE 29 9.489 -1.451 3.956 220 HA PHE 29 HA PHE 29 11.143 -2.530 5.989 221 HB2 PHE 29 HB2 PHE 29 8.462 -3.433 4.925 222 HB3 PHE 29 HB3 PHE 29 9.250 -4.175 6.311 223 HD1 PHE 29 HD2 PHE 29 10.296 -1.057 6.862 224 HD2 PHE 29 HD1 PHE 29 6.591 -3.161 6.649 225 HE1 PHE 29 HE2 PHE 29 9.264 0.605 8.349 226 HE2 PHE 29 HE1 PHE 29 5.564 -1.496 8.139 227 HZ PHE 29 HZ PHE 29 6.900 0.384 8.993 228 H ASP 30 H ASP 30 12.033 -4.551 6.267 229 HA ASP 30 HA ASP 30 13.046 -5.887 3.959 230 HB2 ASP 30 HB2 ASP 30 14.067 -7.424 5.626 231 HB3 ASP 30 HB3 ASP 30 14.373 -5.727 5.985 232 H THR 31 H THR 31 10.264 -6.340 5.986 233 HA THR 31 HA THR 31 9.686 -9.023 5.032 234 HB THR 31 HB THR 31 8.932 -8.366 7.283 235 HG1 THR 31 HG1 THR 31 7.215 -9.598 7.052 236 HG21 THR 31 HG21 THR 31 7.068 -6.789 7.573 237 HG22 THR 31 HG22 THR 31 7.115 -6.418 5.849 238 HG23 THR 31 HG23 THR 31 8.481 -5.994 6.881 239 H ASN 32 H ASN 32 7.596 -9.487 3.887 240 HA ASN 32 HA ASN 32 7.177 -7.439 1.806 241 HB2 ASN 32 HB2 ASN 32 6.925 -10.440 1.679 242 HB3 ASN 32 HB3 ASN 32 6.300 -9.376 0.420 243 HD21 ASN 32 HD21 ASN 32 7.620 -9.732 -1.208 244 HD22 ASN 32 HD22 ASN 32 9.341 -9.583 -1.167 245 H ILE 33 H ILE 33 5.239 -6.695 1.287 246 HA ILE 33 HA ILE 33 3.131 -6.781 3.132 247 HB ILE 33 HB ILE 33 3.241 -5.827 0.264 248 HG12 ILE 33 HG12 ILE 33 3.009 -3.561 1.482 249 HG13 ILE 33 HG13 ILE 33 3.374 -4.443 2.957 250 HG21 ILE 33 HG21 ILE 33 1.083 -4.682 0.683 251 HG22 ILE 33 HG22 ILE 33 0.957 -5.524 2.229 252 HG23 ILE 33 HG23 ILE 33 0.935 -6.439 0.722 253 HD11 ILE 33 HD11 ILE 33 5.323 -3.325 2.037 254 HD12 ILE 33 HD12 ILE 33 5.167 -4.270 0.556 255 HD13 ILE 33 HD13 ILE 33 5.530 -5.073 2.085 256 H ARG 34 H ARG 34 2.005 -8.588 3.558 257 HA ARG 34 HA ARG 34 1.277 -10.490 1.490 258 HB2 ARG 34 HB2 ARG 34 0.340 -10.363 4.370 259 HB3 ARG 34 HB3 ARG 34 0.235 -11.748 3.289 260 HG2 ARG 34 HG2 ARG 34 2.792 -10.510 4.306 261 HG3 ARG 34 HG3 ARG 34 2.042 -11.981 4.925 262 HD2 ARG 34 HD2 ARG 34 2.337 -13.058 2.750 263 HD3 ARG 34 HD3 ARG 34 3.052 -11.580 2.105 264 HE ARG 34 HE ARG 34 4.841 -11.916 3.813 265 HH11 ARG 34 HH11 ARG 34 3.017 -14.593 2.645 266 HH12 ARG 34 HH12 ARG 34 4.270 -15.735 2.972 267 HH21 ARG 34 HH21 ARG 34 6.448 -13.404 4.227 268 HH22 ARG 34 HH22 ARG 34 6.169 -15.076 3.873 269 H THR 35 H THR 35 -0.262 -8.021 3.454 270 HA THR 35 HA THR 35 -2.302 -7.592 1.431 271 HB THR 35 HB THR 35 -3.187 -8.059 4.289 272 HG1 THR 35 HG1 THR 35 -2.887 -9.873 2.179 273 HG21 THR 35 HG21 THR 35 -4.628 -6.582 2.959 274 HG22 THR 35 HG22 THR 35 -5.441 -8.104 3.325 275 HG23 THR 35 HG23 THR 35 -4.765 -7.828 1.719 276 H ILE 36 H ILE 36 -3.045 -5.426 1.491 277 HA ILE 36 HA ILE 36 -2.640 -3.883 3.906 278 HB ILE 36 HB ILE 36 -0.437 -3.723 2.700 279 HG12 ILE 36 HG12 ILE 36 -1.873 -1.069 2.948 280 HG13 ILE 36 HG13 ILE 36 -1.339 -2.017 4.333 281 HG21 ILE 36 HG21 ILE 36 -1.187 -3.665 0.395 282 HG22 ILE 36 HG22 ILE 36 -0.296 -2.185 0.761 283 HG23 ILE 36 HG23 ILE 36 -2.059 -2.158 0.685 284 HD11 ILE 36 HD11 ILE 36 0.961 -1.855 3.556 285 HD12 ILE 36 HD12 ILE 36 0.239 -0.266 3.817 286 HD13 ILE 36 HD13 ILE 36 0.424 -0.892 2.179 287 H VAL 37 H VAL 37 -4.133 -2.364 4.178 288 HA VAL 37 HA VAL 37 -5.641 -1.383 1.843 289 HB VAL 37 HB VAL 37 -6.891 -2.200 4.481 290 HG11 VAL 37 HG11 VAL 37 -8.012 -0.277 3.474 291 HG12 VAL 37 HG12 VAL 37 -9.031 -1.714 3.390 292 HG13 VAL 37 HG13 VAL 37 -8.175 -1.154 1.952 293 HG21 VAL 37 HG21 VAL 37 -8.021 -3.963 3.186 294 HG22 VAL 37 HG22 VAL 37 -6.270 -4.160 3.174 295 HG23 VAL 37 HG23 VAL 37 -7.092 -3.502 1.758 296 H LEU 38 H LEU 38 -4.935 0.678 1.792 297 HA LEU 38 HA LEU 38 -5.106 2.287 4.261 298 HB2 LEU 38 HB2 LEU 38 -2.949 2.283 2.961 299 HB3 LEU 38 HB3 LEU 38 -3.801 3.032 1.628 300 HG LEU 38 HG LEU 38 -3.569 4.313 4.364 301 HD11 LEU 38 HD11 LEU 38 -1.335 3.993 3.472 302 HD12 LEU 38 HD12 LEU 38 -1.782 5.698 3.405 303 HD13 LEU 38 HD13 LEU 38 -1.818 4.717 1.939 304 HD21 LEU 38 HD21 LEU 38 -4.305 5.443 1.654 305 HD22 LEU 38 HD22 LEU 38 -4.072 6.392 3.123 306 HD23 LEU 38 HD23 LEU 38 -5.387 5.222 3.031 307 H ASN 39 H ASN 39 -6.980 3.333 4.494 308 HA ASN 39 HA ASN 39 -8.180 4.591 2.119 309 HB2 ASN 39 HB2 ASN 39 -10.465 4.091 3.304 310 HB3 ASN 39 HB3 ASN 39 -9.695 2.861 2.313 311 HD21 ASN 39 HD21 ASN 39 -8.616 3.702 5.550 312 HD22 ASN 39 HD22 ASN 39 -9.077 2.207 6.272 313 H ALA 40 H ALA 40 -8.536 6.668 2.316 314 HA ALA 40 HA ALA 40 -8.302 7.931 4.961 315 HB1 ALA 40 HB1 ALA 40 -8.048 9.113 2.191 316 HB2 ALA 40 HB2 ALA 40 -6.718 8.661 3.259 317 HB3 ALA 40 HB3 ALA 40 -7.800 9.978 3.709 318 H LYS 41 H LYS 41 -9.861 9.132 5.839 319 HA LYS 41 HA LYS 41 -12.425 9.370 4.413 320 HB2 LYS 41 HB2 LYS 41 -13.501 9.290 6.659 321 HB3 LYS 41 HB3 LYS 41 -12.661 7.813 6.224 322 HG2 LYS 41 HG2 LYS 41 -11.372 9.909 7.953 323 HG3 LYS 41 HG3 LYS 41 -12.431 8.668 8.623 324 HD2 LYS 41 HD2 LYS 41 -10.947 6.929 7.660 325 HD3 LYS 41 HD3 LYS 41 -9.871 8.202 7.077 326 HE2 LYS 41 HE2 LYS 41 -9.022 7.259 9.152 327 HE3 LYS 41 HE3 LYS 41 -9.506 8.936 9.394 328 HZ1 LYS 41 HZ1 LYS 41 -11.535 8.203 10.419 329 HZ2 LYS 41 HZ2 LYS 41 -10.230 7.462 11.196 330 HZ3 LYS 41 HZ3 LYS 41 -11.171 6.584 10.101 331 H ASP 42 H ASP 42 -13.180 11.004 6.987 332 HA ASP 42 HA ASP 42 -12.965 13.553 5.834 333 HB2 ASP 42 HB2 ASP 42 -13.461 12.887 8.743 334 HB3 ASP 42 HB3 ASP 42 -13.907 14.378 7.916 335 H GLY 43 H GLY 43 -10.701 13.852 5.354 336 HA2 GLY 43 HA2 GLY 43 -8.822 15.129 5.722 337 HA3 GLY 43 HA3 GLY 43 -9.467 15.538 7.299 338 H ILE 44 H ILE 44 -9.314 12.203 7.123 339 HA ILE 44 HA ILE 44 -6.511 12.060 8.019 340 HB ILE 44 HB ILE 44 -8.436 10.330 9.496 341 HG12 ILE 44 HG12 ILE 44 -8.138 13.277 10.122 342 HG13 ILE 44 HG13 ILE 44 -9.605 12.455 9.611 343 HG21 ILE 44 HG21 ILE 44 -6.861 10.710 11.333 344 HG22 ILE 44 HG22 ILE 44 -5.970 11.858 10.332 345 HG23 ILE 44 HG23 ILE 44 -6.042 10.156 9.873 346 HD11 ILE 44 HD11 ILE 44 -9.619 12.886 11.999 347 HD12 ILE 44 HD12 ILE 44 -8.126 11.965 12.182 348 HD13 ILE 44 HD13 ILE 44 -9.605 11.153 11.666 349 H PHE 45 H PHE 45 -5.655 9.838 7.993 350 HA PHE 45 HA PHE 45 -7.254 7.957 6.375 351 HB2 PHE 45 HB2 PHE 45 -5.370 7.337 5.021 352 HB3 PHE 45 HB3 PHE 45 -5.518 9.088 4.951 353 HD1 PHE 45 HD2 PHE 45 -3.879 10.521 6.075 354 HD2 PHE 45 HD1 PHE 45 -3.464 6.276 6.048 355 HE1 PHE 45 HE2 PHE 45 -1.533 10.745 6.772 356 HE2 PHE 45 HE1 PHE 45 -1.119 6.502 6.747 357 HZ PHE 45 HZ PHE 45 -0.154 8.734 7.111 358 H THR 46 H THR 46 -6.921 5.752 6.779 359 HA THR 46 HA THR 46 -5.034 5.090 8.955 360 HB THR 46 HB THR 46 -7.190 4.798 9.935 361 HG1 THR 46 HG1 THR 46 -6.543 2.153 9.124 362 HG21 THR 46 HG21 THR 46 -8.538 4.735 7.882 363 HG22 THR 46 HG22 THR 46 -8.954 3.417 8.979 364 HG23 THR 46 HG23 THR 46 -7.957 3.100 7.560 365 H CYS 47 H CYS 47 -3.396 4.000 8.138 366 HA CYS 47 HA CYS 47 -3.735 2.327 5.761 367 HB2 CYS 47 HB2 CYS 47 -1.848 3.900 5.820 368 HB3 CYS 47 HB3 CYS 47 -1.231 3.123 7.273 369 HG CYS 47 HG CYS 47 -0.774 0.660 5.948 370 H ASN 48 H ASN 48 -4.513 0.340 6.231 371 HA ASN 48 HA ASN 48 -3.658 -1.084 8.629 372 HB2 ASN 48 HB2 ASN 48 -5.581 -1.907 6.431 373 HB3 ASN 48 HB3 ASN 48 -5.317 -2.777 7.940 374 HD21 ASN 48 HD21 ASN 48 -7.481 -2.568 8.512 375 HD22 ASN 48 HD22 ASN 48 -8.161 -1.067 9.032 376 H LEU 49 H LEU 49 -1.662 -1.975 8.469 377 HA LEU 49 HA LEU 49 -0.822 -3.249 5.958 378 HB2 LEU 49 HB2 LEU 49 0.752 -1.663 6.845 379 HB3 LEU 49 HB3 LEU 49 0.717 -2.431 8.421 380 HG LEU 49 HG LEU 49 1.799 -4.439 7.459 381 HD11 LEU 49 HD11 LEU 49 0.991 -4.252 5.168 382 HD12 LEU 49 HD12 LEU 49 2.751 -4.357 5.207 383 HD13 LEU 49 HD13 LEU 49 1.968 -2.801 4.929 384 HD21 LEU 49 HD21 LEU 49 3.296 -1.868 6.944 385 HD22 LEU 49 HD22 LEU 49 4.018 -3.463 7.154 386 HD23 LEU 49 HD23 LEU 49 3.164 -2.699 8.495 387 H MET 50 H MET 50 -0.543 -5.407 5.741 388 HA MET 50 HA MET 50 -0.644 -7.097 8.165 389 HB2 MET 50 HB2 MET 50 -1.905 -7.736 5.490 390 HB3 MET 50 HB3 MET 50 -1.927 -8.764 6.916 391 HG2 MET 50 HG2 MET 50 -3.282 -6.095 6.583 392 HG3 MET 50 HG3 MET 50 -4.050 -7.678 6.680 393 HE1 MET 50 HE1 MET 50 -1.938 -8.828 9.024 394 HE2 MET 50 HE2 MET 50 -3.642 -9.269 8.896 395 HE3 MET 50 HE3 MET 50 -3.003 -8.639 10.415 396 H ILE 51 H ILE 51 1.268 -8.062 8.398 397 HA ILE 51 HA ILE 51 2.544 -9.357 6.095 398 HB ILE 51 HB ILE 51 4.810 -8.504 6.968 399 HG12 ILE 51 HG12 ILE 51 4.530 -6.083 7.905 400 HG13 ILE 51 HG13 ILE 51 2.927 -6.625 8.392 401 HG21 ILE 51 HG21 ILE 51 3.867 -7.835 4.827 402 HG22 ILE 51 HG22 ILE 51 4.710 -6.489 5.594 403 HG23 ILE 51 HG23 ILE 51 2.946 -6.554 5.617 404 HD11 ILE 51 HD11 ILE 51 3.895 -8.333 9.788 405 HD12 ILE 51 HD12 ILE 51 4.593 -6.762 10.185 406 HD13 ILE 51 HD13 ILE 51 5.514 -7.918 9.220 407 H PHE 52 H PHE 52 4.263 -10.924 6.754 408 HA PHE 52 HA PHE 52 3.511 -12.225 9.271 409 HB2 PHE 52 HB2 PHE 52 4.754 -13.176 6.726 410 HB3 PHE 52 HB3 PHE 52 5.132 -14.054 8.203 411 HD1 PHE 52 HD2 PHE 52 3.230 -14.972 9.583 412 HD2 PHE 52 HD1 PHE 52 2.703 -13.538 5.607 413 HE1 PHE 52 HE2 PHE 52 1.117 -16.215 9.424 414 HE2 PHE 52 HE1 PHE 52 0.587 -14.782 5.437 415 HZ PHE 52 HZ PHE 52 -0.209 -16.124 7.343 416 H VAL 53 H VAL 53 4.801 -12.408 10.995 417 HA VAL 53 HA VAL 53 7.665 -11.739 10.725 418 HB VAL 53 HB VAL 53 7.670 -10.501 12.792 419 HG11 VAL 53 HG11 VAL 53 6.200 -8.601 12.274 420 HG12 VAL 53 HG12 VAL 53 5.381 -9.586 11.061 421 HG13 VAL 53 HG13 VAL 53 7.086 -9.171 10.856 422 HG21 VAL 53 HG21 VAL 53 5.626 -10.062 14.075 423 HG22 VAL 53 HG22 VAL 53 6.015 -11.782 14.026 424 HG23 VAL 53 HG23 VAL 53 4.730 -11.138 13.004 425 H LYS 54 H LYS 54 9.060 -13.006 11.914 426 HA LYS 54 HA LYS 54 7.960 -15.300 13.279 427 HB2 LYS 54 HB2 LYS 54 10.094 -16.275 13.287 428 HB3 LYS 54 HB3 LYS 54 9.969 -15.442 11.746 429 HG2 LYS 54 HG2 LYS 54 11.372 -14.317 14.165 430 HG3 LYS 54 HG3 LYS 54 12.174 -15.225 12.882 431 HD2 LYS 54 HD2 LYS 54 11.601 -13.541 11.259 432 HD3 LYS 54 HD3 LYS 54 10.605 -12.685 12.438 433 HE2 LYS 54 HE2 LYS 54 12.723 -11.571 12.191 434 HE3 LYS 54 HE3 LYS 54 12.569 -12.270 13.800 435 HZ1 LYS 54 HZ1 LYS 54 14.774 -12.642 12.860 436 HZ2 LYS 54 HZ2 LYS 54 14.101 -13.464 11.547 437 HZ3 LYS 54 HZ3 LYS 54 13.969 -14.108 13.104 438 H ASN 55 H ASN 55 8.855 -12.195 14.233 439 HA ASN 55 HA ASN 55 8.903 -13.040 17.062 440 HB2 ASN 55 HB2 ASN 55 10.651 -10.850 15.899 441 HB3 ASN 55 HB3 ASN 55 10.567 -11.307 17.592 442 HD21 ASN 55 HD21 ASN 55 10.440 -14.150 16.916 443 HD22 ASN 55 HD22 ASN 55 12.048 -14.585 16.485 444 H THR 56 H THR 56 7.676 -11.827 18.441 445 HA THR 56 HA THR 56 5.865 -9.849 17.536 446 HB THR 56 HB THR 56 5.457 -9.371 19.934 447 HG1 THR 56 HG1 THR 56 6.715 -10.618 21.471 448 HG21 THR 56 HG21 THR 56 4.753 -11.625 20.620 449 HG22 THR 56 HG22 THR 56 5.744 -12.327 19.341 450 HG23 THR 56 HG23 THR 56 4.355 -11.320 18.928 451 H ASP 57 H ASP 57 9.007 -9.662 19.117 452 HA ASP 57 HA ASP 57 9.268 -6.887 19.384 453 HB2 ASP 57 HB2 ASP 57 10.760 -8.700 20.343 454 HB3 ASP 57 HB3 ASP 57 11.487 -8.851 18.746 455 H LYS 58 H LYS 58 10.070 -9.053 16.720 456 HA LYS 58 HA LYS 58 11.154 -7.253 14.896 457 HB2 LYS 58 HB2 LYS 58 11.384 -9.515 14.367 458 HB3 LYS 58 HB3 LYS 58 9.697 -9.867 14.690 459 HG2 LYS 58 HG2 LYS 58 10.220 -10.071 12.331 460 HG3 LYS 58 HG3 LYS 58 9.048 -8.794 12.629 461 HD2 LYS 58 HD2 LYS 58 10.913 -7.135 12.502 462 HD3 LYS 58 HD3 LYS 58 12.000 -8.456 12.071 463 HE2 LYS 58 HE2 LYS 58 10.653 -8.907 10.073 464 HE3 LYS 58 HE3 LYS 58 9.564 -7.588 10.509 465 HZ1 LYS 58 HZ1 LYS 58 11.468 -6.071 10.364 466 HZ2 LYS 58 HZ2 LYS 58 11.150 -6.835 8.891 467 HZ3 LYS 58 HZ3 LYS 58 12.441 -7.350 9.841 468 H LEU 59 H LEU 59 7.774 -7.907 15.685 469 HA LEU 59 HA LEU 59 6.673 -6.307 13.591 470 HB2 LEU 59 HB2 LEU 59 5.302 -7.995 14.584 471 HB3 LEU 59 HB3 LEU 59 5.534 -7.324 16.188 472 HG LEU 59 HG LEU 59 4.214 -5.351 15.584 473 HD11 LEU 59 HD11 LEU 59 2.973 -5.298 13.448 474 HD12 LEU 59 HD12 LEU 59 3.904 -6.691 12.896 475 HD13 LEU 59 HD13 LEU 59 4.717 -5.164 13.232 476 HD21 LEU 59 HD21 LEU 59 2.030 -6.449 15.379 477 HD22 LEU 59 HD22 LEU 59 3.070 -7.259 16.550 478 HD23 LEU 59 HD23 LEU 59 2.835 -7.959 14.948 479 H THR 60 H THR 60 7.280 -5.684 17.067 480 HA THR 60 HA THR 60 6.228 -3.081 17.149 481 HB THR 60 HB THR 60 7.562 -2.703 19.165 482 HG1 THR 60 HG1 THR 60 9.087 -4.307 19.815 483 HG21 THR 60 HG21 THR 60 5.549 -4.107 19.352 484 HG22 THR 60 HG22 THR 60 6.788 -4.597 20.509 485 HG23 THR 60 HG23 THR 60 6.526 -5.544 19.044 486 H THR 61 H THR 61 9.391 -4.253 16.145 487 HA THR 61 HA THR 61 10.788 -1.862 15.872 488 HB THR 61 HB THR 61 10.898 -4.256 14.012 489 HG1 THR 61 HG1 THR 61 12.593 -4.923 15.397 490 HG21 THR 61 HG21 THR 61 12.938 -2.077 14.512 491 HG22 THR 61 HG22 THR 61 11.988 -2.281 13.039 492 HG23 THR 61 HG23 THR 61 13.178 -3.499 13.498 493 H LEU 62 H LEU 62 8.560 -3.416 13.565 494 HA LEU 62 HA LEU 62 8.845 -1.524 11.490 495 HB2 LEU 62 HB2 LEU 62 6.483 -3.288 12.151 496 HB3 LEU 62 HB3 LEU 62 6.688 -2.404 10.650 497 HG LEU 62 HG LEU 62 8.338 -4.731 11.640 498 HD11 LEU 62 HD11 LEU 62 6.199 -5.294 10.606 499 HD12 LEU 62 HD12 LEU 62 7.551 -5.791 9.588 500 HD13 LEU 62 HD13 LEU 62 6.628 -4.340 9.187 501 HD21 LEU 62 HD21 LEU 62 8.805 -2.963 9.239 502 HD22 LEU 62 HD22 LEU 62 9.635 -4.486 9.559 503 HD23 LEU 62 HD23 LEU 62 9.853 -3.118 10.650 504 H MET 63 H MET 63 6.381 -1.767 14.070 505 HA MET 63 HA MET 63 4.908 0.497 13.335 506 HB2 MET 63 HB2 MET 63 5.313 -0.787 16.042 507 HB3 MET 63 HB3 MET 63 4.208 0.558 15.777 508 HG2 MET 63 HG2 MET 63 3.101 -0.861 14.007 509 HG3 MET 63 HG3 MET 63 4.065 -2.208 14.608 510 HE1 MET 63 HE1 MET 63 2.642 -2.853 18.133 511 HE2 MET 63 HE2 MET 63 4.133 -2.026 17.682 512 HE3 MET 63 HE3 MET 63 3.628 -3.476 16.811 513 H ASP 64 H ASP 64 7.778 0.237 15.407 514 HA ASP 64 HA ASP 64 7.995 2.926 16.153 515 HB2 ASP 64 HB2 ASP 64 9.382 1.110 17.090 516 HB3 ASP 64 HB3 ASP 64 10.227 0.969 15.554 517 H LYS 65 H LYS 65 9.271 1.248 13.290 518 HA LYS 65 HA LYS 65 10.581 3.378 12.044 519 HB2 LYS 65 HB2 LYS 65 9.135 1.018 10.819 520 HB3 LYS 65 HB3 LYS 65 10.241 2.061 9.936 521 HG2 LYS 65 HG2 LYS 65 12.056 1.394 11.473 522 HG3 LYS 65 HG3 LYS 65 10.932 0.319 12.301 523 HD2 LYS 65 HD2 LYS 65 12.151 -1.058 10.818 524 HD3 LYS 65 HD3 LYS 65 10.578 -0.820 10.053 525 HE2 LYS 65 HE2 LYS 65 12.348 -0.607 8.407 526 HE3 LYS 65 HE3 LYS 65 11.558 0.952 8.641 527 HZ1 LYS 65 HZ1 LYS 65 13.373 1.653 10.036 528 HZ2 LYS 65 HZ2 LYS 65 13.991 1.118 8.557 529 HZ3 LYS 65 HZ3 LYS 65 14.108 0.135 9.925 530 H LEU 66 H LEU 66 7.179 2.461 11.974 531 HA LEU 66 HA LEU 66 6.390 4.445 10.046 532 HB2 LEU 66 HB2 LEU 66 4.758 2.811 11.998 533 HB3 LEU 66 HB3 LEU 66 4.103 3.740 10.659 534 HG LEU 66 HG LEU 66 6.067 1.477 10.270 535 HD11 LEU 66 HD11 LEU 66 4.095 0.568 11.351 536 HD12 LEU 66 HD12 LEU 66 4.157 0.074 9.660 537 HD13 LEU 66 HD13 LEU 66 3.056 1.355 10.164 538 HD21 LEU 66 HD21 LEU 66 5.209 1.517 7.966 539 HD22 LEU 66 HD22 LEU 66 5.947 3.051 8.423 540 HD23 LEU 66 HD23 LEU 66 4.190 2.898 8.375 541 H ARG 67 H ARG 67 6.695 4.356 13.520 542 HA ARG 67 HA ARG 67 5.067 6.631 14.084 543 HB2 ARG 67 HB2 ARG 67 7.182 5.180 15.685 544 HB3 ARG 67 HB3 ARG 67 6.295 6.564 16.319 545 HG2 ARG 67 HG2 ARG 67 4.209 5.393 16.133 546 HG3 ARG 67 HG3 ARG 67 4.982 4.053 15.293 547 HD2 ARG 67 HD2 ARG 67 6.269 3.530 17.312 548 HD3 ARG 67 HD3 ARG 67 5.504 4.882 18.149 549 HE ARG 67 HE ARG 67 3.406 3.385 17.302 550 HH11 ARG 67 HH11 ARG 67 6.232 2.652 19.136 551 HH12 ARG 67 HH12 ARG 67 5.444 1.403 20.038 552 HH21 ARG 67 HH21 ARG 67 2.423 1.762 18.440 553 HH22 ARG 67 HH22 ARG 67 3.316 0.911 19.654 554 H LYS 68 H LYS 68 8.038 6.445 12.548 555 HA LYS 68 HA LYS 68 9.310 8.770 13.619 556 HB2 LYS 68 HB2 LYS 68 9.760 7.553 10.886 557 HB3 LYS 68 HB3 LYS 68 10.867 8.578 11.788 558 HG2 LYS 68 HG2 LYS 68 10.053 5.753 12.450 559 HG3 LYS 68 HG3 LYS 68 11.630 6.306 11.887 560 HD2 LYS 68 HD2 LYS 68 11.915 7.590 13.970 561 HD3 LYS 68 HD3 LYS 68 10.332 7.030 14.526 562 HE2 LYS 68 HE2 LYS 68 11.208 4.674 14.305 563 HE3 LYS 68 HE3 LYS 68 12.802 5.367 14.017 564 HZ1 LYS 68 HZ1 LYS 68 11.177 5.858 16.445 565 HZ2 LYS 68 HZ2 LYS 68 12.771 6.353 16.187 566 HZ3 LYS 68 HZ3 LYS 68 12.407 4.704 16.341 567 H VAL 69 H VAL 69 6.572 8.462 11.671 568 HA VAL 69 HA VAL 69 7.048 10.811 10.030 569 HB VAL 69 HB VAL 69 4.586 9.067 10.289 570 HG11 VAL 69 HG11 VAL 69 3.823 10.185 8.214 571 HG12 VAL 69 HG12 VAL 69 5.196 11.287 8.318 572 HG13 VAL 69 HG13 VAL 69 3.949 11.310 9.566 573 HG21 VAL 69 HG21 VAL 69 6.487 7.880 9.333 574 HG22 VAL 69 HG22 VAL 69 6.735 9.175 8.162 575 HG23 VAL 69 HG23 VAL 69 5.273 8.190 8.092 576 H GLN 70 H GLN 70 6.821 12.756 10.841 577 HA GLN 70 HA GLN 70 5.714 13.483 13.273 578 HB2 GLN 70 HB2 GLN 70 5.796 15.820 12.372 579 HB3 GLN 70 HB3 GLN 70 7.287 14.908 12.165 580 HG2 GLN 70 HG2 GLN 70 6.614 14.427 9.825 581 HG3 GLN 70 HG3 GLN 70 5.207 15.463 10.054 582 HE21 GLN 70 HE21 GLN 70 8.673 15.365 9.748 583 HE22 GLN 70 HE22 GLN 70 8.887 17.054 9.459 584 H GLY 71 H GLY 71 4.080 13.171 10.183 585 HA2 GLY 71 HA2 GLY 71 1.761 14.695 10.940 586 HA3 GLY 71 HA3 GLY 71 1.929 13.699 9.508 587 H VAL 72 H VAL 72 2.714 11.432 11.538 588 HA VAL 72 HA VAL 72 -0.024 10.457 11.783 589 HB VAL 72 HB VAL 72 2.598 9.074 12.416 590 HG11 VAL 72 HG11 VAL 72 1.269 6.998 12.449 591 HG12 VAL 72 HG12 VAL 72 -0.208 7.948 12.279 592 HG13 VAL 72 HG13 VAL 72 0.786 8.112 13.728 593 HG21 VAL 72 HG21 VAL 72 2.200 7.841 10.329 594 HG22 VAL 72 HG22 VAL 72 2.348 9.574 10.037 595 HG23 VAL 72 HG23 VAL 72 0.757 8.811 10.031 596 H PHE 73 H PHE 73 -1.042 9.875 13.707 597 HA PHE 73 HA PHE 73 0.341 10.650 16.188 598 HB2 PHE 73 HB2 PHE 73 -2.178 11.157 16.944 599 HB3 PHE 73 HB3 PHE 73 -1.130 12.363 16.219 600 HD1 PHE 73 HD2 PHE 73 -1.504 13.167 13.980 601 HD2 PHE 73 HD1 PHE 73 -4.070 10.228 15.690 602 HE1 PHE 73 HE2 PHE 73 -3.162 13.594 12.217 603 HE2 PHE 73 HE1 PHE 73 -5.737 10.661 13.921 604 HZ PHE 73 HZ PHE 73 -5.278 12.344 12.186 605 H THR 74 H THR 74 -1.441 8.197 14.572 606 HA THR 74 HA THR 74 -1.298 6.599 17.058 607 HB THR 74 HB THR 74 -3.338 5.533 16.738 608 HG1 THR 74 HG1 THR 74 -4.351 5.320 14.814 609 HG21 THR 74 HG21 THR 74 -5.038 7.257 16.442 610 HG22 THR 74 HG22 THR 74 -3.848 8.317 15.688 611 HG23 THR 74 HG23 THR 74 -3.688 7.883 17.391 612 H VAL 75 H VAL 75 0.064 4.973 16.844 613 HA VAL 75 HA VAL 75 -0.025 3.350 14.391 614 HB VAL 75 HB VAL 75 2.559 3.987 15.846 615 HG11 VAL 75 HG11 VAL 75 2.031 2.457 13.291 616 HG12 VAL 75 HG12 VAL 75 2.541 1.773 14.835 617 HG13 VAL 75 HG13 VAL 75 3.625 2.842 13.943 618 HG21 VAL 75 HG21 VAL 75 1.783 5.968 14.640 619 HG22 VAL 75 HG22 VAL 75 1.594 5.014 13.168 620 HG23 VAL 75 HG23 VAL 75 3.201 5.271 13.851 621 H GLU 76 H GLU 76 -0.924 1.521 15.109 622 HA GLU 76 HA GLU 76 -0.026 0.346 17.666 623 HB2 GLU 76 HB2 GLU 76 -2.447 -0.170 18.154 624 HB3 GLU 76 HB3 GLU 76 -2.029 1.540 18.226 625 HG2 GLU 76 HG2 GLU 76 -2.962 1.890 16.009 626 HG3 GLU 76 HG3 GLU 76 -3.337 0.172 15.874 627 H ARG 77 H ARG 77 -0.687 -1.950 17.928 628 HA ARG 77 HA ARG 77 -0.407 -3.393 15.429 629 HB2 ARG 77 HB2 ARG 77 0.873 -4.167 17.337 630 HB3 ARG 77 HB3 ARG 77 -0.598 -4.379 18.282 631 HG2 ARG 77 HG2 ARG 77 -1.348 -6.095 16.668 632 HG3 ARG 77 HG3 ARG 77 0.181 -5.921 15.809 633 HD2 ARG 77 HD2 ARG 77 1.388 -6.648 17.802 634 HD3 ARG 77 HD3 ARG 77 -0.136 -6.798 18.680 635 HE ARG 77 HE ARG 77 -0.270 -8.342 16.337 636 HH11 ARG 77 HH11 ARG 77 1.319 -8.347 19.397 637 HH12 ARG 77 HH12 ARG 77 1.478 -10.068 19.425 638 HH21 ARG 77 HH21 ARG 77 -0.057 -10.522 16.377 639 HH22 ARG 77 HH22 ARG 77 0.715 -11.294 17.720 640 H LEU 78 H LEU 78 -1.880 -4.750 14.487 641 HA LEU 78 HA LEU 78 -4.635 -4.762 15.504 642 HB2 LEU 78 HB2 LEU 78 -3.529 -5.640 12.828 643 HB3 LEU 78 HB3 LEU 78 -5.225 -5.655 13.273 644 HG LEU 78 HG LEU 78 -3.501 -3.178 13.032 645 HD11 LEU 78 HD11 LEU 78 -5.678 -4.235 11.224 646 HD12 LEU 78 HD12 LEU 78 -3.953 -4.178 10.859 647 HD13 LEU 78 HD13 LEU 78 -4.862 -2.680 11.055 648 HD21 LEU 78 HD21 LEU 78 -5.235 -2.915 14.727 649 HD22 LEU 78 HD22 LEU 78 -6.458 -3.464 13.583 650 HD23 LEU 78 HD23 LEU 78 -5.606 -1.945 13.301 651 H SER 79 H SER 79 -5.100 -6.403 16.825 652 HA SER 79 HA SER 79 -3.645 -8.938 16.640 653 HB2 SER 79 HB2 SER 79 -4.724 -9.456 18.807 654 HB3 SER 79 HB3 SER 79 -3.868 -7.916 18.854 655 HG SER 79 HG SER 79 -5.699 -6.895 19.145 656 H ASN 80 H ASN 80 -7.061 -7.979 17.010 657 HA ASN 80 HA ASN 80 -8.072 -10.544 16.308 658 HB2 ASN 80 HB2 ASN 80 -10.283 -9.247 16.132 659 HB3 ASN 80 HB3 ASN 80 -9.474 -9.272 17.695 660 HD21 ASN 80 HD21 ASN 80 -8.416 -7.389 18.410 661 HD22 ASN 80 HD22 ASN 80 -8.799 -5.839 17.750 662 H LEU 81 H LEU 81 -7.562 -11.309 14.334 663 HA LEU 81 HA LEU 81 -8.139 -9.633 11.966 664 HB2 LEU 81 HB2 LEU 81 -6.310 -12.031 12.171 665 HB3 LEU 81 HB3 LEU 81 -6.524 -11.007 10.763 666 HG LEU 81 HG LEU 81 -5.291 -10.152 13.391 667 HD11 LEU 81 HD11 LEU 81 -3.199 -10.038 12.118 668 HD12 LEU 81 HD12 LEU 81 -4.024 -10.701 10.706 669 HD13 LEU 81 HD13 LEU 81 -3.851 -11.677 12.165 670 HD21 LEU 81 HD21 LEU 81 -5.595 -8.630 10.796 671 HD22 LEU 81 HD22 LEU 81 -4.713 -8.077 12.220 672 HD23 LEU 81 HD23 LEU 81 -6.459 -8.303 12.300 673 H GLU 82 H GLU 82 -9.010 -10.717 10.074 674 HA GLU 82 HA GLU 82 -10.689 -13.048 10.746 675 HB2 GLU 82 HB2 GLU 82 -11.977 -12.196 8.626 676 HB3 GLU 82 HB3 GLU 82 -12.238 -11.463 10.198 677 HG2 GLU 82 HG2 GLU 82 -12.048 -9.841 8.366 678 HG3 GLU 82 HG3 GLU 82 -10.869 -9.588 9.638 679 H HIS 83 H HIS 83 -7.841 -12.763 9.496 680 HA HIS 83 HA HIS 83 -8.088 -13.683 6.798 681 HB2 HIS 83 HB2 HIS 83 -5.696 -13.712 8.654 682 HB3 HIS 83 HB3 HIS 83 -5.638 -14.064 6.932 683 HD1 HIS 83 HD1 HIS 83 -4.756 -12.134 5.672 684 HD2 HIS 83 HD2 HIS 83 -7.018 -10.920 8.936 685 HE1 HIS 83 HE1 HIS 83 -4.585 -9.634 5.714 686 HE2 HIS 83 HE2 HIS 83 -6.177 -8.932 7.524 687 H HIS 84 H HIS 84 -8.282 -15.714 6.040 688 HA HIS 84 HA HIS 84 -7.987 -17.970 7.916 689 HB2 HIS 84 HB2 HIS 84 -9.351 -19.242 6.202 690 HB3 HIS 84 HB3 HIS 84 -10.196 -17.931 7.015 691 HD1 HIS 84 HD1 HIS 84 -11.150 -16.103 5.583 692 HD2 HIS 84 HD2 HIS 84 -8.662 -18.661 3.450 693 HE1 HIS 84 HE1 HIS 84 -11.438 -15.466 3.175 694 HE2 HIS 84 HE2 HIS 84 -9.722 -16.834 1.953 695 H HIS 85 H HIS 85 -6.672 -19.707 7.468 696 HA HIS 85 HA HIS 85 -4.738 -19.383 5.278 697 HB2 HIS 85 HB2 HIS 85 -4.827 -21.275 7.643 698 HB3 HIS 85 HB3 HIS 85 -3.576 -21.317 6.406 699 HD1 HIS 85 HD1 HIS 85 -1.580 -19.927 6.846 700 HD2 HIS 85 HD2 HIS 85 -4.851 -18.678 9.082 701 HE1 HIS 85 HE1 HIS 85 -0.703 -18.148 8.377 702 HE2 HIS 85 HE2 HIS 85 -2.640 -17.597 9.882 703 H HIS 86 H HIS 86 -7.667 -20.834 5.709 704 HA HIS 86 HA HIS 86 -7.402 -23.426 4.728 705 HB2 HIS 86 HB2 HIS 86 -9.420 -22.576 5.853 706 HB3 HIS 86 HB3 HIS 86 -9.773 -21.561 4.460 707 HD1 HIS 86 HD1 HIS 86 -9.781 -25.153 5.574 708 HD2 HIS 86 HD2 HIS 86 -10.978 -22.861 2.317 709 HE1 HIS 86 HE1 HIS 86 -11.199 -26.673 4.161 710 HE2 HIS 86 HE2 HIS 86 -12.026 -25.222 2.276 711 H HIS 87 H HIS 87 -6.452 -23.952 2.881 712 HA HIS 87 HA HIS 87 -7.176 -22.557 0.391 713 HB2 HIS 87 HB2 HIS 87 -4.763 -22.949 0.828 714 HB3 HIS 87 HB3 HIS 87 -5.064 -24.680 0.907 715 HD1 HIS 87 HD1 HIS 87 -5.545 -25.910 -1.350 716 HD2 HIS 87 HD2 HIS 87 -4.598 -21.876 -1.746 717 HE1 HIS 87 HE1 HIS 87 -5.093 -25.558 -3.791 718 HE2 HIS 87 HE2 HIS 87 -4.348 -23.168 -3.976 719 H HIS 88 H HIS 88 -7.733 -23.963 -1.513 720 HA HIS 88 HA HIS 88 -9.761 -25.812 -1.060 721 HB2 HIS 88 HB2 HIS 88 -9.420 -24.746 -3.244 722 HB3 HIS 88 HB3 HIS 88 -7.922 -25.644 -3.466 723 HD1 HIS 88 HD1 HIS 88 -8.123 -28.179 -4.018 724 HD2 HIS 88 HD2 HIS 88 -11.767 -26.202 -3.735 725 HE1 HIS 88 HE1 HIS 88 -9.817 -29.751 -4.992 726 HE2 HIS 88 HE2 HIS 88 -12.030 -28.613 -4.631 727 H1 MET 1 H1 MET 1 -8.725 20.814 -18.139 728 H2 MET 1 H2 MET 1 -10.337 21.149 -17.747 729 H3 MET 1 H3 MET 1 -9.959 20.463 -19.243 730 HA MET 1 HA MET 1 -10.869 18.791 -17.812 731 HB2 MET 1 HB2 MET 1 -7.877 18.470 -18.182 732 HB3 MET 1 HB3 MET 1 -9.012 17.159 -17.889 733 HG2 MET 1 HG2 MET 1 -8.952 18.963 -20.301 734 HG3 MET 1 HG3 MET 1 -8.436 17.279 -20.236 735 HE1 MET 1 HE1 MET 1 -10.073 15.226 -19.977 736 HE2 MET 1 HE2 MET 1 -11.806 15.385 -19.686 737 HE3 MET 1 HE3 MET 1 -10.654 15.903 -18.455 738 H THR 2 H THR 2 -11.403 18.404 -15.766 739 HA THR 2 HA THR 2 -9.757 19.499 -13.601 740 HB THR 2 HB THR 2 -12.124 20.064 -13.545 741 HG1 THR 2 HG1 THR 2 -12.502 18.677 -11.403 742 HG21 THR 2 HG21 THR 2 -13.846 18.353 -13.180 743 HG22 THR 2 HG22 THR 2 -12.629 17.087 -13.344 744 HG23 THR 2 HG23 THR 2 -13.025 18.113 -14.724 745 H ASP 3 H ASP 3 -9.237 18.252 -11.705 746 HA ASP 3 HA ASP 3 -8.396 15.590 -12.291 747 HB2 ASP 3 HB2 ASP 3 -7.720 15.591 -9.830 748 HB3 ASP 3 HB3 ASP 3 -6.959 16.790 -10.867 749 H PHE 4 H PHE 4 -9.252 13.654 -11.750 750 HA PHE 4 HA PHE 4 -11.670 13.581 -10.080 751 HB2 PHE 4 HB2 PHE 4 -12.706 11.974 -11.624 752 HB3 PHE 4 HB3 PHE 4 -12.390 13.505 -12.430 753 HD1 PHE 4 HD1 PHE 4 -11.388 9.976 -12.166 754 HD2 PHE 4 HD2 PHE 4 -10.813 13.642 -14.260 755 HE1 PHE 4 HE1 PHE 4 -10.169 8.777 -13.930 756 HE2 PHE 4 HE2 PHE 4 -9.599 12.444 -16.028 757 HZ PHE 4 HZ PHE 4 -9.261 10.006 -15.856 758 H LEU 5 H LEU 5 -12.126 11.456 -9.178 759 HA LEU 5 HA LEU 5 -9.728 10.150 -8.274 760 HB2 LEU 5 HB2 LEU 5 -11.576 10.531 -6.748 761 HB3 LEU 5 HB3 LEU 5 -12.646 9.586 -7.762 762 HG LEU 5 HG LEU 5 -11.403 7.539 -7.213 763 HD11 LEU 5 HD11 LEU 5 -9.642 7.589 -5.482 764 HD12 LEU 5 HD12 LEU 5 -9.681 9.354 -5.514 765 HD13 LEU 5 HD13 LEU 5 -9.174 8.454 -6.945 766 HD21 LEU 5 HD21 LEU 5 -12.146 9.128 -4.757 767 HD22 LEU 5 HD22 LEU 5 -12.019 7.372 -4.861 768 HD23 LEU 5 HD23 LEU 5 -13.264 8.222 -5.776 769 H ALA 6 H ALA 6 -8.713 8.844 -9.662 770 HA ALA 6 HA ALA 6 -10.263 7.060 -11.408 771 HB1 ALA 6 HB1 ALA 6 -8.213 6.843 -12.709 772 HB2 ALA 6 HB2 ALA 6 -7.349 7.835 -11.534 773 HB3 ALA 6 HB3 ALA 6 -8.648 8.540 -12.496 774 H GLY 7 H GLY 7 -10.242 4.891 -11.152 775 HA2 GLY 7 HA2 GLY 7 -8.484 3.752 -9.077 776 HA3 GLY 7 HA3 GLY 7 -9.985 3.042 -9.647 777 H ILE 8 H ILE 8 -7.137 2.042 -9.448 778 HA ILE 8 HA ILE 8 -6.989 0.962 -12.197 779 HB ILE 8 HB ILE 8 -4.596 1.376 -10.378 780 HG12 ILE 8 HG12 ILE 8 -5.467 3.019 -12.779 781 HG13 ILE 8 HG13 ILE 8 -5.510 3.555 -11.102 782 HG21 ILE 8 HG21 ILE 8 -4.800 0.599 -13.294 783 HG22 ILE 8 HG22 ILE 8 -4.355 -0.468 -11.961 784 HG23 ILE 8 HG23 ILE 8 -3.298 0.871 -12.408 785 HD11 ILE 8 HD11 ILE 8 -3.070 3.386 -10.996 786 HD12 ILE 8 HD12 ILE 8 -3.601 4.486 -12.268 787 HD13 ILE 8 HD13 ILE 8 -3.038 2.867 -12.681 788 H ARG 9 H ARG 9 -6.631 -1.253 -12.375 789 HA ARG 9 HA ARG 9 -6.742 -2.793 -9.854 790 HB2 ARG 9 HB2 ARG 9 -8.835 -2.609 -11.421 791 HB3 ARG 9 HB3 ARG 9 -7.972 -3.755 -12.428 792 HG2 ARG 9 HG2 ARG 9 -8.454 -4.336 -9.526 793 HG3 ARG 9 HG3 ARG 9 -9.712 -4.612 -10.728 794 HD2 ARG 9 HD2 ARG 9 -8.067 -6.033 -11.986 795 HD3 ARG 9 HD3 ARG 9 -6.981 -5.882 -10.603 796 HE ARG 9 HE ARG 9 -8.460 -7.180 -9.317 797 HH11 ARG 9 HH11 ARG 9 -9.515 -6.827 -12.586 798 HH12 ARG 9 HH12 ARG 9 -10.699 -8.076 -12.462 799 HH21 ARG 9 HH21 ARG 9 -10.014 -8.769 -9.159 800 HH22 ARG 9 HH22 ARG 9 -10.992 -9.157 -10.533 801 H ILE 10 H ILE 10 -4.995 -4.019 -9.571 802 HA ILE 10 HA ILE 10 -3.403 -4.851 -11.928 803 HB ILE 10 HB ILE 10 -2.413 -4.448 -9.093 804 HG12 ILE 10 HG12 ILE 10 -2.017 -2.568 -11.437 805 HG13 ILE 10 HG13 ILE 10 -3.220 -2.320 -10.173 806 HG21 ILE 10 HG21 ILE 10 -0.179 -4.490 -10.129 807 HG22 ILE 10 HG22 ILE 10 -0.921 -4.823 -11.694 808 HG23 ILE 10 HG23 ILE 10 -1.058 -5.998 -10.386 809 HD11 ILE 10 HD11 ILE 10 -1.235 -0.990 -9.767 810 HD12 ILE 10 HD12 ILE 10 -0.237 -2.443 -9.774 811 HD13 ILE 10 HD13 ILE 10 -1.438 -2.205 -8.504 812 H VAL 11 H VAL 11 -3.614 -7.035 -12.305 813 HA VAL 11 HA VAL 11 -3.519 -8.797 -9.933 814 HB VAL 11 HB VAL 11 -4.890 -9.293 -12.586 815 HG11 VAL 11 HG11 VAL 11 -4.365 -11.281 -10.370 816 HG12 VAL 11 HG12 VAL 11 -3.659 -11.318 -11.986 817 HG13 VAL 11 HG13 VAL 11 -5.393 -11.557 -11.776 818 HG21 VAL 11 HG21 VAL 11 -5.925 -9.415 -9.743 819 HG22 VAL 11 HG22 VAL 11 -6.870 -9.629 -11.218 820 HG23 VAL 11 HG23 VAL 11 -6.159 -8.058 -10.849 821 H GLY 12 H GLY 12 -1.549 -9.522 -9.665 822 HA2 GLY 12 HA2 GLY 12 -0.038 -10.518 -12.008 823 HA3 GLY 12 HA3 GLY 12 0.738 -9.504 -10.797 824 H GLU 13 H GLU 13 1.691 -12.044 -11.435 825 HA GLU 13 HA GLU 13 0.674 -14.072 -9.715 826 HB2 GLU 13 HB2 GLU 13 2.708 -15.318 -10.319 827 HB3 GLU 13 HB3 GLU 13 1.907 -14.639 -11.728 828 HG2 GLU 13 HG2 GLU 13 3.534 -12.840 -11.820 829 HG3 GLU 13 HG3 GLU 13 4.317 -13.450 -10.363 830 H ASP 14 H ASP 14 1.353 -14.803 -7.743 831 HA ASP 14 HA ASP 14 2.659 -13.019 -5.967 832 HB2 ASP 14 HB2 ASP 14 0.974 -14.541 -5.140 833 HB3 ASP 14 HB3 ASP 14 1.891 -15.935 -5.695 834 H LYS 15 H LYS 15 4.731 -12.605 -6.911 835 HA LYS 15 HA LYS 15 6.706 -14.739 -6.821 836 HB2 LYS 15 HB2 LYS 15 6.811 -11.832 -7.539 837 HB3 LYS 15 HB3 LYS 15 8.295 -12.696 -7.188 838 HG2 LYS 15 HG2 LYS 15 6.347 -13.210 -9.420 839 HG3 LYS 15 HG3 LYS 15 8.034 -12.689 -9.522 840 HD2 LYS 15 HD2 LYS 15 8.457 -14.941 -8.222 841 HD3 LYS 15 HD3 LYS 15 6.907 -15.383 -8.940 842 HE2 LYS 15 HE2 LYS 15 9.227 -14.331 -10.535 843 HE3 LYS 15 HE3 LYS 15 8.964 -16.046 -10.243 844 HZ1 LYS 15 HZ1 LYS 15 7.067 -14.224 -11.607 845 HZ2 LYS 15 HZ2 LYS 15 6.826 -15.876 -11.343 846 HZ3 LYS 15 HZ3 LYS 15 8.064 -15.352 -12.367 847 H ASN 16 H ASN 16 8.881 -13.906 -5.797 848 HA ASN 16 HA ASN 16 8.573 -13.948 -2.991 849 HB2 ASN 16 HB2 ASN 16 10.943 -13.395 -4.778 850 HB3 ASN 16 HB3 ASN 16 11.069 -13.570 -3.025 851 HD21 ASN 16 HD21 ASN 16 10.546 -15.190 -6.038 852 HD22 ASN 16 HD22 ASN 16 10.645 -16.802 -5.426 853 H GLY 17 H GLY 17 8.712 -11.298 -5.239 854 HA2 GLY 17 HA2 GLY 17 8.449 -9.426 -3.005 855 HA3 GLY 17 HA3 GLY 17 9.822 -9.184 -4.068 856 H MET 18 H MET 18 6.766 -10.302 -5.383 857 HA MET 18 HA MET 18 6.618 -7.997 -7.098 858 HB2 MET 18 HB2 MET 18 5.068 -10.524 -6.766 859 HB3 MET 18 HB3 MET 18 4.243 -9.185 -7.548 860 HG2 MET 18 HG2 MET 18 6.904 -10.279 -8.430 861 HG3 MET 18 HG3 MET 18 5.350 -10.757 -9.114 862 HE1 MET 18 HE1 MET 18 3.799 -7.977 -8.963 863 HE2 MET 18 HE2 MET 18 3.717 -9.038 -10.370 864 HE3 MET 18 HE3 MET 18 4.101 -7.331 -10.574 865 H THR 19 H THR 19 4.512 -9.179 -4.456 866 HA THR 19 HA THR 19 2.595 -7.164 -4.525 867 HB THR 19 HB THR 19 2.135 -7.683 -2.164 868 HG1 THR 19 HG1 THR 19 3.535 -8.906 -0.965 869 HG21 THR 19 HG21 THR 19 1.708 -10.079 -2.385 870 HG22 THR 19 HG22 THR 19 2.830 -10.172 -3.742 871 HG23 THR 19 HG23 THR 19 1.334 -9.249 -3.897 872 H ASN 20 H ASN 20 5.766 -7.175 -2.943 873 HA ASN 20 HA ASN 20 5.326 -4.716 -1.544 874 HB2 ASN 20 HB2 ASN 20 6.931 -6.707 -0.974 875 HB3 ASN 20 HB3 ASN 20 8.057 -5.880 -2.046 876 HD21 ASN 20 HD21 ASN 20 7.911 -6.362 0.934 877 HD22 ASN 20 HD22 ASN 20 8.111 -4.801 1.637 878 H GLN 21 H GLN 21 7.162 -5.661 -4.455 879 HA GLN 21 HA GLN 21 8.226 -3.097 -4.962 880 HB2 GLN 21 HB2 GLN 21 8.982 -3.921 -7.022 881 HB3 GLN 21 HB3 GLN 21 9.020 -5.300 -5.944 882 HG2 GLN 21 HG2 GLN 21 6.969 -6.152 -6.916 883 HG3 GLN 21 HG3 GLN 21 6.840 -4.728 -7.948 884 HE21 GLN 21 HE21 GLN 21 8.591 -7.663 -7.342 885 HE22 GLN 21 HE22 GLN 21 9.374 -7.738 -8.876 886 H ILE 22 H ILE 22 5.184 -4.600 -5.879 887 HA ILE 22 HA ILE 22 4.426 -2.763 -7.888 888 HB ILE 22 HB ILE 22 2.921 -4.731 -6.195 889 HG12 ILE 22 HG12 ILE 22 4.212 -5.564 -8.093 890 HG13 ILE 22 HG13 ILE 22 2.490 -5.776 -8.386 891 HG21 ILE 22 HG21 ILE 22 1.622 -2.815 -8.136 892 HG22 ILE 22 HG22 ILE 22 1.362 -2.882 -6.391 893 HG23 ILE 22 HG23 ILE 22 0.845 -4.224 -7.411 894 HD11 ILE 22 HD11 ILE 22 2.499 -3.792 -9.821 895 HD12 ILE 22 HD12 ILE 22 3.623 -5.027 -10.388 896 HD13 ILE 22 HD13 ILE 22 4.230 -3.605 -9.540 897 H THR 23 H THR 23 3.404 -2.918 -4.444 898 HA THR 23 HA THR 23 2.040 -0.413 -4.617 899 HB THR 23 HB THR 23 3.004 -1.689 -2.045 900 HG1 THR 23 HG1 THR 23 0.952 -2.418 -3.813 901 HG21 THR 23 HG21 THR 23 0.662 0.118 -2.681 902 HG22 THR 23 HG22 THR 23 2.131 0.588 -1.823 903 HG23 THR 23 HG23 THR 23 1.021 -0.577 -1.101 904 H GLY 24 H GLY 24 5.314 -1.373 -3.838 905 HA2 GLY 24 HA2 GLY 24 6.344 1.041 -2.855 906 HA3 GLY 24 HA3 GLY 24 7.251 -0.137 -3.797 907 H VAL 25 H VAL 25 6.260 -0.067 -6.274 908 HA VAL 25 HA VAL 25 7.108 2.304 -7.481 909 HB VAL 25 HB VAL 25 5.227 0.155 -8.489 910 HG11 VAL 25 HG11 VAL 25 5.563 1.079 -10.752 911 HG12 VAL 25 HG12 VAL 25 6.408 2.459 -10.052 912 HG13 VAL 25 HG13 VAL 25 4.699 2.199 -9.700 913 HG21 VAL 25 HG21 VAL 25 8.126 0.767 -9.093 914 HG22 VAL 25 HG22 VAL 25 7.181 -0.529 -9.828 915 HG23 VAL 25 HG23 VAL 25 7.530 -0.565 -8.099 916 H ILE 26 H ILE 26 3.863 1.297 -6.499 917 HA ILE 26 HA ILE 26 2.393 3.446 -7.513 918 HB ILE 26 HB ILE 26 1.927 1.676 -5.118 919 HG12 ILE 26 HG12 ILE 26 0.652 1.754 -7.869 920 HG13 ILE 26 HG13 ILE 26 1.877 0.604 -7.346 921 HG21 ILE 26 HG21 ILE 26 0.029 3.706 -6.297 922 HG22 ILE 26 HG22 ILE 26 0.757 3.756 -4.691 923 HG23 ILE 26 HG23 ILE 26 -0.397 2.487 -5.095 924 HD11 ILE 26 HD11 ILE 26 -0.313 -0.407 -7.302 925 HD12 ILE 26 HD12 ILE 26 -0.910 0.866 -6.237 926 HD13 ILE 26 HD13 ILE 26 0.318 -0.263 -5.662 927 H SER 27 H SER 27 3.944 3.117 -4.297 928 HA SER 27 HA SER 27 3.070 5.604 -3.277 929 HB2 SER 27 HB2 SER 27 4.786 5.363 -1.561 930 HB3 SER 27 HB3 SER 27 4.008 3.806 -1.842 931 HG SER 27 HG SER 27 5.825 3.280 -3.190 932 H LYS 28 H LYS 28 5.546 4.843 -5.553 933 HA LYS 28 HA LYS 28 7.142 7.192 -5.215 934 HB2 LYS 28 HB2 LYS 28 6.901 5.341 -7.599 935 HB3 LYS 28 HB3 LYS 28 8.152 6.554 -7.373 936 HG2 LYS 28 HG2 LYS 28 8.933 5.348 -5.372 937 HG3 LYS 28 HG3 LYS 28 7.704 4.115 -5.660 938 HD2 LYS 28 HD2 LYS 28 9.795 3.310 -6.522 939 HD3 LYS 28 HD3 LYS 28 8.741 3.675 -7.885 940 HE2 LYS 28 HE2 LYS 28 10.885 5.536 -6.848 941 HE3 LYS 28 HE3 LYS 28 11.120 4.405 -8.176 942 HZ1 LYS 28 HZ1 LYS 28 9.181 5.574 -9.268 943 HZ2 LYS 28 HZ2 LYS 28 10.624 6.447 -9.160 944 HZ3 LYS 28 HZ3 LYS 28 9.361 6.780 -8.093 945 H PHE 29 H PHE 29 4.063 6.736 -6.598 946 HA PHE 29 HA PHE 29 4.257 8.444 -8.851 947 HB2 PHE 29 HB2 PHE 29 1.846 7.595 -7.240 948 HB3 PHE 29 HB3 PHE 29 1.751 8.514 -8.738 949 HD1 PHE 29 HD1 PHE 29 4.340 6.756 -9.712 950 HD2 PHE 29 HD2 PHE 29 0.357 5.975 -8.421 951 HE1 PHE 29 HE1 PHE 29 4.334 4.670 -11.016 952 HE2 PHE 29 HE2 PHE 29 0.349 3.877 -9.715 953 HZ PHE 29 HZ PHE 29 2.337 3.226 -11.018 954 H ASP 30 H ASP 30 3.396 10.503 -9.208 955 HA ASP 30 HA ASP 30 3.912 12.487 -7.253 956 HB2 ASP 30 HB2 ASP 30 2.807 14.002 -8.977 957 HB3 ASP 30 HB3 ASP 30 4.169 13.049 -9.564 958 H THR 31 H THR 31 0.972 10.895 -8.331 959 HA THR 31 HA THR 31 -0.834 12.743 -7.074 960 HB THR 31 HB THR 31 -1.614 11.556 -9.017 961 HG1 THR 31 HG1 THR 31 -3.346 11.925 -7.751 962 HG21 THR 31 HG21 THR 31 -0.265 9.530 -8.830 963 HG22 THR 31 HG22 THR 31 -1.970 9.119 -9.019 964 HG23 THR 31 HG23 THR 31 -1.207 9.013 -7.432 965 H ASN 32 H ASN 32 -2.263 12.295 -5.305 966 HA ASN 32 HA ASN 32 -0.845 10.983 -3.134 967 HB2 ASN 32 HB2 ASN 32 -1.948 13.242 -2.918 968 HB3 ASN 32 HB3 ASN 32 -3.506 12.428 -3.020 969 HD21 ASN 32 HD21 ASN 32 -4.180 12.942 -0.977 970 HD22 ASN 32 HD22 ASN 32 -3.442 12.333 0.458 971 H ILE 33 H ILE 33 -1.231 8.958 -2.460 972 HA ILE 33 HA ILE 33 -3.193 7.293 -3.651 973 HB ILE 33 HB ILE 33 -1.599 6.799 -1.124 974 HG12 ILE 33 HG12 ILE 33 -1.014 5.968 -3.984 975 HG13 ILE 33 HG13 ILE 33 -0.195 7.267 -3.124 976 HG21 ILE 33 HG21 ILE 33 -2.029 4.422 -1.553 977 HG22 ILE 33 HG22 ILE 33 -3.034 4.848 -2.939 978 HG23 ILE 33 HG23 ILE 33 -3.535 5.310 -1.312 979 HD11 ILE 33 HD11 ILE 33 1.133 5.233 -3.170 980 HD12 ILE 33 HD12 ILE 33 -0.161 4.359 -2.351 981 HD13 ILE 33 HD13 ILE 33 0.684 5.669 -1.521 982 H ARG 34 H ARG 34 -5.269 8.036 -3.329 983 HA ARG 34 HA ARG 34 -6.233 8.862 -0.767 984 HB2 ARG 34 HB2 ARG 34 -7.137 9.621 -3.012 985 HB3 ARG 34 HB3 ARG 34 -7.910 8.048 -3.152 986 HG2 ARG 34 HG2 ARG 34 -9.464 9.763 -2.363 987 HG3 ARG 34 HG3 ARG 34 -9.237 8.487 -1.161 988 HD2 ARG 34 HD2 ARG 34 -7.576 9.954 -0.012 989 HD3 ARG 34 HD3 ARG 34 -7.971 11.235 -1.157 990 HE ARG 34 HE ARG 34 -10.372 10.581 -0.089 991 HH11 ARG 34 HH11 ARG 34 -7.331 11.448 1.257 992 HH12 ARG 34 HH12 ARG 34 -8.016 12.105 2.697 993 HH21 ARG 34 HH21 ARG 34 -11.260 11.450 1.779 994 HH22 ARG 34 HH22 ARG 34 -10.216 12.131 2.974 995 H THR 35 H THR 35 -6.237 5.852 -2.561 996 HA THR 35 HA THR 35 -6.720 4.358 -0.137 997 HB THR 35 HB THR 35 -8.701 4.028 -2.414 998 HG1 THR 35 HG1 THR 35 -8.812 5.443 -0.011 999 HG21 THR 35 HG21 THR 35 -8.201 1.908 -1.303 1000 HG22 THR 35 HG22 THR 35 -9.836 2.443 -0.916 1001 HG23 THR 35 HG23 THR 35 -8.543 2.638 0.267 1002 H ILE 36 H ILE 36 -5.725 2.364 -0.233 1003 HA ILE 36 HA ILE 36 -5.190 1.181 -2.877 1004 HB ILE 36 HB ILE 36 -3.109 2.361 -2.137 1005 HG12 ILE 36 HG12 ILE 36 -1.570 0.405 -2.432 1006 HG13 ILE 36 HG13 ILE 36 -2.960 -0.665 -2.274 1007 HG21 ILE 36 HG21 ILE 36 -3.343 2.105 0.272 1008 HG22 ILE 36 HG22 ILE 36 -1.799 1.449 -0.275 1009 HG23 ILE 36 HG23 ILE 36 -3.130 0.359 0.122 1010 HD11 ILE 36 HD11 ILE 36 -3.941 0.338 -4.278 1011 HD12 ILE 36 HD12 ILE 36 -2.352 -0.354 -4.593 1012 HD13 ILE 36 HD13 ILE 36 -2.535 1.392 -4.432 1013 H VAL 37 H VAL 37 -5.630 -0.958 -2.957 1014 HA VAL 37 HA VAL 37 -5.805 -2.483 -0.427 1015 HB VAL 37 HB VAL 37 -7.805 -2.625 -2.703 1016 HG11 VAL 37 HG11 VAL 37 -7.664 -4.193 -0.119 1017 HG12 VAL 37 HG12 VAL 37 -7.473 -4.830 -1.753 1018 HG13 VAL 37 HG13 VAL 37 -9.035 -4.201 -1.229 1019 HG21 VAL 37 HG21 VAL 37 -8.134 -0.630 -1.349 1020 HG22 VAL 37 HG22 VAL 37 -8.125 -1.599 0.125 1021 HG23 VAL 37 HG23 VAL 37 -9.429 -1.787 -1.047 1022 H LEU 38 H LEU 38 -4.165 -3.907 -0.581 1023 HA LEU 38 HA LEU 38 -3.900 -5.456 -3.087 1024 HB2 LEU 38 HB2 LEU 38 -1.927 -4.054 -2.411 1025 HB3 LEU 38 HB3 LEU 38 -1.783 -5.029 -0.964 1026 HG LEU 38 HG LEU 38 -1.615 -6.258 -3.721 1027 HD11 LEU 38 HD11 LEU 38 0.656 -5.133 -2.078 1028 HD12 LEU 38 HD12 LEU 38 0.081 -4.523 -3.630 1029 HD13 LEU 38 HD13 LEU 38 0.830 -6.117 -3.534 1030 HD21 LEU 38 HD21 LEU 38 -1.966 -7.813 -1.864 1031 HD22 LEU 38 HD22 LEU 38 -0.562 -7.150 -1.029 1032 HD23 LEU 38 HD23 LEU 38 -0.358 -8.009 -2.556 1033 H ASN 39 H ASN 39 -4.779 -7.403 -2.928 1034 HA ASN 39 HA ASN 39 -4.336 -8.991 -0.490 1035 HB2 ASN 39 HB2 ASN 39 -6.689 -9.940 -0.860 1036 HB3 ASN 39 HB3 ASN 39 -6.579 -8.315 -0.194 1037 HD21 ASN 39 HD21 ASN 39 -8.767 -9.579 -1.640 1038 HD22 ASN 39 HD22 ASN 39 -9.077 -8.564 -3.003 1039 H ALA 40 H ALA 40 -3.566 -10.975 -0.858 1040 HA ALA 40 HA ALA 40 -3.466 -11.971 -3.645 1041 HB1 ALA 40 HB1 ALA 40 -1.294 -11.429 -2.640 1042 HB2 ALA 40 HB2 ALA 40 -1.435 -13.153 -2.987 1043 HB3 ALA 40 HB3 ALA 40 -1.612 -12.566 -1.332 1044 H LYS 41 H LYS 41 -4.297 -13.896 -4.153 1045 HA LYS 41 HA LYS 41 -4.647 -15.977 -2.160 1046 HB2 LYS 41 HB2 LYS 41 -6.980 -16.300 -2.436 1047 HB3 LYS 41 HB3 LYS 41 -6.769 -14.583 -2.139 1048 HG2 LYS 41 HG2 LYS 41 -7.101 -15.777 -4.887 1049 HG3 LYS 41 HG3 LYS 41 -8.435 -15.169 -3.912 1050 HD2 LYS 41 HD2 LYS 41 -7.455 -12.934 -3.924 1051 HD3 LYS 41 HD3 LYS 41 -6.065 -13.531 -4.836 1052 HE2 LYS 41 HE2 LYS 41 -7.461 -14.043 -6.736 1053 HE3 LYS 41 HE3 LYS 41 -8.919 -13.664 -5.822 1054 HZ1 LYS 41 HZ1 LYS 41 -6.804 -11.738 -6.596 1055 HZ2 LYS 41 HZ2 LYS 41 -8.192 -11.366 -5.703 1056 HZ3 LYS 41 HZ3 LYS 41 -8.331 -11.882 -7.306 1057 H ASP 42 H ASP 42 -4.946 -18.077 -3.084 1058 HA ASP 42 HA ASP 42 -4.589 -19.739 -4.591 1059 HB2 ASP 42 HB2 ASP 42 -5.892 -17.716 -6.425 1060 HB3 ASP 42 HB3 ASP 42 -5.565 -19.383 -6.889 1061 H GLY 43 H GLY 43 -2.460 -17.543 -4.311 1062 HA2 GLY 43 HA2 GLY 43 -0.241 -17.621 -5.073 1063 HA3 GLY 43 HA3 GLY 43 -0.762 -18.566 -6.456 1064 H ILE 44 H ILE 44 -2.692 -15.825 -6.012 1065 HA ILE 44 HA ILE 44 -1.030 -14.118 -7.764 1066 HB ILE 44 HB ILE 44 -4.018 -14.243 -8.146 1067 HG12 ILE 44 HG12 ILE 44 -1.990 -16.020 -9.531 1068 HG13 ILE 44 HG13 ILE 44 -3.269 -16.541 -8.438 1069 HG21 ILE 44 HG21 ILE 44 -1.747 -13.495 -9.996 1070 HG22 ILE 44 HG22 ILE 44 -2.795 -12.370 -9.131 1071 HG23 ILE 44 HG23 ILE 44 -3.467 -13.411 -10.385 1072 HD11 ILE 44 HD11 ILE 44 -3.886 -16.973 -10.731 1073 HD12 ILE 44 HD12 ILE 44 -3.640 -15.274 -11.141 1074 HD13 ILE 44 HD13 ILE 44 -4.940 -15.738 -10.043 1075 H PHE 45 H PHE 45 -1.652 -11.803 -7.644 1076 HA PHE 45 HA PHE 45 -3.253 -11.157 -5.244 1077 HB2 PHE 45 HB2 PHE 45 -1.719 -9.456 -4.535 1078 HB3 PHE 45 HB3 PHE 45 -0.795 -10.933 -4.773 1079 HD1 PHE 45 HD2 PHE 45 -1.427 -7.542 -5.992 1080 HD2 PHE 45 HD1 PHE 45 0.831 -11.109 -6.576 1081 HE1 PHE 45 HE2 PHE 45 0.111 -6.324 -7.474 1082 HE2 PHE 45 HE1 PHE 45 2.373 -9.889 -8.054 1083 HZ PHE 45 HZ PHE 45 2.008 -7.495 -8.506 1084 H THR 46 H THR 46 -4.572 -9.374 -5.352 1085 HA THR 46 HA THR 46 -4.609 -7.913 -7.925 1086 HB THR 46 HB THR 46 -6.594 -9.223 -7.886 1087 HG1 THR 46 HG1 THR 46 -7.469 -6.681 -6.947 1088 HG21 THR 46 HG21 THR 46 -6.653 -9.788 -5.505 1089 HG22 THR 46 HG22 THR 46 -8.219 -9.194 -6.056 1090 HG23 THR 46 HG23 THR 46 -7.158 -8.141 -5.120 1091 H CYS 47 H CYS 47 -3.543 -6.070 -7.447 1092 HA CYS 47 HA CYS 47 -4.166 -4.612 -4.979 1093 HB2 CYS 47 HB2 CYS 47 -1.797 -4.935 -5.588 1094 HB3 CYS 47 HB3 CYS 47 -2.066 -4.062 -7.092 1095 HG CYS 47 HG CYS 47 -2.605 -2.582 -4.062 1096 H ASN 48 H ASN 48 -5.684 -3.067 -4.996 1097 HA ASN 48 HA ASN 48 -6.399 -1.784 -7.548 1098 HB2 ASN 48 HB2 ASN 48 -7.967 -1.810 -4.955 1099 HB3 ASN 48 HB3 ASN 48 -8.512 -1.161 -6.499 1100 HD21 ASN 48 HD21 ASN 48 -9.810 -3.122 -4.946 1101 HD22 ASN 48 HD22 ASN 48 -9.871 -4.577 -5.875 1102 H LEU 49 H LEU 49 -5.566 0.165 -7.895 1103 HA LEU 49 HA LEU 49 -4.705 1.810 -5.621 1104 HB2 LEU 49 HB2 LEU 49 -2.994 1.405 -7.264 1105 HB3 LEU 49 HB3 LEU 49 -4.045 1.936 -8.563 1106 HG LEU 49 HG LEU 49 -3.982 4.232 -7.720 1107 HD11 LEU 49 HD11 LEU 49 -3.773 3.823 -5.348 1108 HD12 LEU 49 HD12 LEU 49 -2.449 4.849 -5.895 1109 HD13 LEU 49 HD13 LEU 49 -2.164 3.137 -5.576 1110 HD21 LEU 49 HD21 LEU 49 -1.631 4.730 -8.198 1111 HD22 LEU 49 HD22 LEU 49 -2.291 3.554 -9.335 1112 HD23 LEU 49 HD23 LEU 49 -1.234 3.019 -8.027 1113 H MET 50 H MET 50 -5.829 3.531 -5.001 1114 HA MET 50 HA MET 50 -7.728 4.760 -6.900 1115 HB2 MET 50 HB2 MET 50 -7.929 4.743 -3.885 1116 HB3 MET 50 HB3 MET 50 -9.123 5.365 -5.017 1117 HG2 MET 50 HG2 MET 50 -8.325 2.491 -4.607 1118 HG3 MET 50 HG3 MET 50 -9.858 3.251 -4.191 1119 HE1 MET 50 HE1 MET 50 -9.923 5.154 -6.934 1120 HE2 MET 50 HE2 MET 50 -11.357 4.482 -6.155 1121 HE3 MET 50 HE3 MET 50 -11.073 4.205 -7.874 1122 H ILE 51 H ILE 51 -6.856 6.575 -7.652 1123 HA ILE 51 HA ILE 51 -5.734 8.531 -5.766 1124 HB ILE 51 HB ILE 51 -3.892 9.011 -7.482 1125 HG12 ILE 51 HG12 ILE 51 -3.193 6.760 -8.641 1126 HG13 ILE 51 HG13 ILE 51 -4.901 6.358 -8.486 1127 HG21 ILE 51 HG21 ILE 51 -3.416 8.074 -5.307 1128 HG22 ILE 51 HG22 ILE 51 -2.391 7.321 -6.528 1129 HG23 ILE 51 HG23 ILE 51 -3.789 6.452 -5.893 1130 HD11 ILE 51 HD11 ILE 51 -5.489 8.313 -9.800 1131 HD12 ILE 51 HD12 ILE 51 -4.362 7.276 -10.675 1132 HD13 ILE 51 HD13 ILE 51 -3.786 8.761 -9.917 1133 H PHE 52 H PHE 52 -5.127 10.630 -7.140 1134 HA PHE 52 HA PHE 52 -7.537 11.221 -8.743 1135 HB2 PHE 52 HB2 PHE 52 -5.941 12.866 -6.809 1136 HB3 PHE 52 HB3 PHE 52 -6.811 13.678 -8.106 1137 HD1 PHE 52 HD2 PHE 52 -9.238 13.571 -8.244 1138 HD2 PHE 52 HD1 PHE 52 -7.145 11.852 -4.949 1139 HE1 PHE 52 HE2 PHE 52 -11.334 13.499 -6.954 1140 HE2 PHE 52 HE1 PHE 52 -9.240 11.780 -3.659 1141 HZ PHE 52 HZ PHE 52 -11.335 12.603 -4.659 1142 H VAL 53 H VAL 53 -7.356 11.860 -10.806 1143 HA VAL 53 HA VAL 53 -4.684 12.635 -11.833 1144 HB VAL 53 HB VAL 53 -5.087 11.473 -13.908 1145 HG11 VAL 53 HG11 VAL 53 -4.083 10.107 -12.184 1146 HG12 VAL 53 HG12 VAL 53 -5.177 9.125 -13.162 1147 HG13 VAL 53 HG13 VAL 53 -5.676 9.674 -11.561 1148 HG21 VAL 53 HG21 VAL 53 -7.474 11.776 -14.117 1149 HG22 VAL 53 HG22 VAL 53 -7.762 10.694 -12.755 1150 HG23 VAL 53 HG23 VAL 53 -7.075 10.063 -14.253 1151 H LYS 54 H LYS 54 -4.609 14.321 -13.311 1152 HA LYS 54 HA LYS 54 -6.818 16.111 -13.425 1153 HB2 LYS 54 HB2 LYS 54 -5.397 17.437 -14.967 1154 HB3 LYS 54 HB3 LYS 54 -4.583 16.993 -13.472 1155 HG2 LYS 54 HG2 LYS 54 -3.348 15.256 -14.600 1156 HG3 LYS 54 HG3 LYS 54 -4.249 15.536 -16.092 1157 HD2 LYS 54 HD2 LYS 54 -2.038 16.575 -16.192 1158 HD3 LYS 54 HD3 LYS 54 -3.315 17.791 -16.240 1159 HE2 LYS 54 HE2 LYS 54 -2.972 18.284 -13.881 1160 HE3 LYS 54 HE3 LYS 54 -1.754 17.013 -13.773 1161 HZ1 LYS 54 HZ1 LYS 54 -0.829 19.276 -14.004 1162 HZ2 LYS 54 HZ2 LYS 54 -1.527 19.381 -15.538 1163 HZ3 LYS 54 HZ3 LYS 54 -0.334 18.224 -15.233 1164 H ASN 55 H ASN 55 -5.692 13.607 -15.604 1165 HA ASN 55 HA ASN 55 -8.155 13.783 -17.096 1166 HB2 ASN 55 HB2 ASN 55 -7.116 14.016 -19.310 1167 HB3 ASN 55 HB3 ASN 55 -6.794 15.427 -18.308 1168 HD21 ASN 55 HD21 ASN 55 -4.717 15.951 -17.845 1169 HD22 ASN 55 HD22 ASN 55 -3.350 15.079 -18.434 1170 H THR 56 H THR 56 -7.980 12.108 -19.053 1171 HA THR 56 HA THR 56 -7.620 9.579 -17.764 1172 HB THR 56 HB THR 56 -8.401 8.582 -19.869 1173 HG1 THR 56 HG1 THR 56 -8.710 9.822 -21.684 1174 HG21 THR 56 HG21 THR 56 -10.603 9.674 -19.970 1175 HG22 THR 56 HG22 THR 56 -9.961 11.052 -19.074 1176 HG23 THR 56 HG23 THR 56 -10.065 9.469 -18.302 1177 H ASP 57 H ASP 57 -5.737 11.374 -20.154 1178 HA ASP 57 HA ASP 57 -4.051 9.233 -20.961 1179 HB2 ASP 57 HB2 ASP 57 -4.305 11.425 -22.172 1180 HB3 ASP 57 HB3 ASP 57 -3.367 12.190 -20.894 1181 H LYS 58 H LYS 58 -3.858 11.635 -18.400 1182 HA LYS 58 HA LYS 58 -1.408 10.978 -17.247 1183 HB2 LYS 58 HB2 LYS 58 -2.513 12.915 -16.467 1184 HB3 LYS 58 HB3 LYS 58 -4.002 12.042 -16.142 1185 HG2 LYS 58 HG2 LYS 58 -2.893 12.674 -14.081 1186 HG3 LYS 58 HG3 LYS 58 -2.948 10.919 -14.256 1187 HD2 LYS 58 HD2 LYS 58 -0.602 10.958 -15.061 1188 HD3 LYS 58 HD3 LYS 58 -0.564 12.705 -14.821 1189 HE2 LYS 58 HE2 LYS 58 -0.953 12.394 -12.431 1190 HE3 LYS 58 HE3 LYS 58 -1.032 10.647 -12.661 1191 HZ1 LYS 58 HZ1 LYS 58 1.140 11.510 -11.861 1192 HZ2 LYS 58 HZ2 LYS 58 1.343 12.274 -13.355 1193 HZ3 LYS 58 HZ3 LYS 58 1.239 10.591 -13.276 1194 H LEU 59 H LEU 59 -4.612 9.545 -16.725 1195 HA LEU 59 HA LEU 59 -3.836 7.673 -14.747 1196 HB2 LEU 59 HB2 LEU 59 -6.155 8.285 -15.070 1197 HB3 LEU 59 HB3 LEU 59 -6.134 7.653 -16.706 1198 HG LEU 59 HG LEU 59 -5.816 5.369 -15.808 1199 HD11 LEU 59 HD11 LEU 59 -6.116 6.704 -13.120 1200 HD12 LEU 59 HD12 LEU 59 -4.697 5.850 -13.730 1201 HD13 LEU 59 HD13 LEU 59 -6.187 4.964 -13.404 1202 HD21 LEU 59 HD21 LEU 59 -8.080 5.081 -14.953 1203 HD22 LEU 59 HD22 LEU 59 -8.057 6.191 -16.322 1204 HD23 LEU 59 HD23 LEU 59 -8.211 6.820 -14.681 1205 H THR 60 H THR 60 -4.192 7.330 -18.283 1206 HA THR 60 HA THR 60 -3.587 4.581 -18.411 1207 HB THR 60 HB THR 60 -3.093 4.929 -20.806 1208 HG1 THR 60 HG1 THR 60 -3.796 7.510 -21.030 1209 HG21 THR 60 HG21 THR 60 -5.534 6.423 -19.827 1210 HG22 THR 60 HG22 THR 60 -5.417 4.682 -20.094 1211 HG23 THR 60 HG23 THR 60 -5.297 5.795 -21.458 1212 H THR 61 H THR 61 -1.499 7.387 -18.192 1213 HA THR 61 HA THR 61 0.937 6.208 -18.934 1214 HB THR 61 HB THR 61 0.443 8.337 -16.834 1215 HG1 THR 61 HG1 THR 61 -0.110 8.762 -19.144 1216 HG21 THR 61 HG21 THR 61 3.034 7.520 -18.167 1217 HG22 THR 61 HG22 THR 61 2.619 7.284 -16.468 1218 HG23 THR 61 HG23 THR 61 2.823 8.915 -17.110 1219 H LEU 62 H LEU 62 -0.603 6.413 -15.723 1220 HA LEU 62 HA LEU 62 1.348 5.023 -14.272 1221 HB2 LEU 62 HB2 LEU 62 -1.636 5.053 -13.783 1222 HB3 LEU 62 HB3 LEU 62 -0.409 4.599 -12.615 1223 HG LEU 62 HG LEU 62 -0.866 7.353 -13.774 1224 HD11 LEU 62 HD11 LEU 62 -1.386 7.953 -11.462 1225 HD12 LEU 62 HD12 LEU 62 -1.161 6.272 -10.974 1226 HD13 LEU 62 HD13 LEU 62 -2.475 6.706 -12.069 1227 HD21 LEU 62 HD21 LEU 62 0.929 8.097 -12.268 1228 HD22 LEU 62 HD22 LEU 62 1.523 6.989 -13.503 1229 HD23 LEU 62 HD23 LEU 62 1.270 6.416 -11.854 1230 H MET 63 H MET 63 -1.411 3.836 -16.135 1231 HA MET 63 HA MET 63 -1.361 1.136 -15.477 1232 HB2 MET 63 HB2 MET 63 -1.855 2.329 -18.216 1233 HB3 MET 63 HB3 MET 63 -2.313 0.710 -17.708 1234 HG2 MET 63 HG2 MET 63 -3.855 1.634 -16.077 1235 HG3 MET 63 HG3 MET 63 -3.368 3.271 -16.528 1236 HE1 MET 63 HE1 MET 63 -6.417 2.501 -16.514 1237 HE2 MET 63 HE2 MET 63 -6.921 3.217 -18.045 1238 HE3 MET 63 HE3 MET 63 -5.765 4.065 -17.014 1239 H ASP 64 H ASP 64 0.488 2.802 -18.048 1240 HA ASP 64 HA ASP 64 1.885 0.580 -19.005 1241 HB2 ASP 64 HB2 ASP 64 1.812 2.863 -20.068 1242 HB3 ASP 64 HB3 ASP 64 2.982 3.399 -18.865 1243 H LYS 65 H LYS 65 2.821 2.900 -16.459 1244 HA LYS 65 HA LYS 65 5.306 1.878 -15.778 1245 HB2 LYS 65 HB2 LYS 65 3.188 3.212 -14.106 1246 HB3 LYS 65 HB3 LYS 65 4.746 2.755 -13.434 1247 HG2 LYS 65 HG2 LYS 65 5.771 4.091 -15.354 1248 HG3 LYS 65 HG3 LYS 65 4.154 4.763 -15.578 1249 HD2 LYS 65 HD2 LYS 65 4.151 5.664 -13.356 1250 HD3 LYS 65 HD3 LYS 65 5.651 4.820 -12.958 1251 HE2 LYS 65 HE2 LYS 65 5.323 7.012 -14.999 1252 HE3 LYS 65 HE3 LYS 65 6.081 7.165 -13.413 1253 HZ1 LYS 65 HZ1 LYS 65 7.720 6.919 -15.177 1254 HZ2 LYS 65 HZ2 LYS 65 7.054 5.434 -15.624 1255 HZ3 LYS 65 HZ3 LYS 65 7.785 5.614 -14.110 1256 H LEU 66 H LEU 66 2.121 0.824 -14.654 1257 HA LEU 66 HA LEU 66 3.146 -1.224 -12.921 1258 HB2 LEU 66 HB2 LEU 66 0.366 -0.877 -14.057 1259 HB3 LEU 66 HB3 LEU 66 0.807 -1.874 -12.680 1260 HG LEU 66 HG LEU 66 1.146 1.132 -12.750 1261 HD11 LEU 66 HD11 LEU 66 -0.833 1.225 -11.295 1262 HD12 LEU 66 HD12 LEU 66 -1.088 -0.502 -11.553 1263 HD13 LEU 66 HD13 LEU 66 -1.210 0.622 -12.907 1264 HD21 LEU 66 HD21 LEU 66 2.639 0.002 -11.186 1265 HD22 LEU 66 HD22 LEU 66 1.270 -0.846 -10.466 1266 HD23 LEU 66 HD23 LEU 66 1.398 0.908 -10.321 1267 H ARG 67 H ARG 67 2.274 -1.053 -16.287 1268 HA ARG 67 HA ARG 67 2.131 -3.901 -16.712 1269 HB2 ARG 67 HB2 ARG 67 2.271 -1.569 -18.637 1270 HB3 ARG 67 HB3 ARG 67 2.109 -3.247 -19.147 1271 HG2 ARG 67 HG2 ARG 67 -0.016 -3.444 -18.059 1272 HG3 ARG 67 HG3 ARG 67 0.159 -1.854 -17.319 1273 HD2 ARG 67 HD2 ARG 67 0.105 -0.825 -19.557 1274 HD3 ARG 67 HD3 ARG 67 -0.106 -2.424 -20.276 1275 HE ARG 67 HE ARG 67 -2.132 -2.178 -18.442 1276 HH11 ARG 67 HH11 ARG 67 -1.158 -0.414 -21.252 1277 HH12 ARG 67 HH12 ARG 67 -2.773 0.104 -21.593 1278 HH21 ARG 67 HH21 ARG 67 -4.175 -1.500 -18.909 1279 HH22 ARG 67 HH22 ARG 67 -4.449 -0.499 -20.295 1280 H LYS 68 H LYS 68 4.711 -1.806 -16.222 1281 HA LYS 68 HA LYS 68 6.622 -2.912 -18.041 1282 HB2 LYS 68 HB2 LYS 68 7.149 -1.507 -15.417 1283 HB3 LYS 68 HB3 LYS 68 8.302 -1.754 -16.717 1284 HG2 LYS 68 HG2 LYS 68 5.814 -0.060 -16.897 1285 HG3 LYS 68 HG3 LYS 68 7.440 0.545 -16.609 1286 HD2 LYS 68 HD2 LYS 68 7.182 0.893 -18.881 1287 HD3 LYS 68 HD3 LYS 68 8.023 -0.650 -18.845 1288 HE2 LYS 68 HE2 LYS 68 6.085 -1.838 -19.429 1289 HE3 LYS 68 HE3 LYS 68 5.024 -0.506 -18.978 1290 HZ1 LYS 68 HZ1 LYS 68 5.318 -0.832 -21.415 1291 HZ2 LYS 68 HZ2 LYS 68 6.930 -0.367 -21.240 1292 HZ3 LYS 68 HZ3 LYS 68 5.689 0.724 -20.866 1293 H VAL 69 H VAL 69 5.373 -3.919 -14.968 1294 HA VAL 69 HA VAL 69 7.674 -5.446 -14.163 1295 HB VAL 69 HB VAL 69 4.882 -5.496 -12.999 1296 HG11 VAL 69 HG11 VAL 69 7.528 -6.473 -11.906 1297 HG12 VAL 69 HG12 VAL 69 6.125 -7.453 -12.328 1298 HG13 VAL 69 HG13 VAL 69 6.044 -6.344 -10.965 1299 HG21 VAL 69 HG21 VAL 69 7.287 -3.859 -12.172 1300 HG22 VAL 69 HG22 VAL 69 5.746 -3.932 -11.316 1301 HG23 VAL 69 HG23 VAL 69 5.822 -3.239 -12.936 1302 H GLN 70 H GLN 70 8.154 -7.430 -14.696 1303 HA GLN 70 HA GLN 70 6.848 -8.991 -16.586 1304 HB2 GLN 70 HB2 GLN 70 8.408 -10.784 -15.852 1305 HB3 GLN 70 HB3 GLN 70 9.199 -9.230 -16.096 1306 HG2 GLN 70 HG2 GLN 70 8.997 -8.855 -13.610 1307 HG3 GLN 70 HG3 GLN 70 8.485 -10.535 -13.478 1308 HE21 GLN 70 HE21 GLN 70 10.844 -9.167 -12.394 1309 HE22 GLN 70 HE22 GLN 70 12.207 -10.050 -12.982 1310 H GLY 71 H GLY 71 6.447 -8.975 -13.101 1311 HA2 GLY 71 HA2 GLY 71 5.125 -11.493 -12.888 1312 HA3 GLY 71 HA3 GLY 71 5.183 -10.246 -11.661 1313 H VAL 72 H VAL 72 3.928 -8.302 -13.702 1314 HA VAL 72 HA VAL 72 1.185 -9.034 -12.990 1315 HB VAL 72 HB VAL 72 2.147 -6.462 -14.268 1316 HG11 VAL 72 HG11 VAL 72 -0.474 -7.184 -12.936 1317 HG12 VAL 72 HG12 VAL 72 -0.221 -6.859 -14.651 1318 HG13 VAL 72 HG13 VAL 72 -0.020 -5.564 -13.471 1319 HG21 VAL 72 HG21 VAL 72 1.632 -7.097 -11.358 1320 HG22 VAL 72 HG22 VAL 72 1.944 -5.487 -12.008 1321 HG23 VAL 72 HG23 VAL 72 3.193 -6.729 -12.095 1322 H PHE 73 H PHE 73 -0.431 -9.485 -14.421 1323 HA PHE 73 HA PHE 73 0.249 -9.382 -17.288 1324 HB2 PHE 73 HB2 PHE 73 -1.589 -11.337 -17.315 1325 HB3 PHE 73 HB3 PHE 73 0.129 -11.630 -17.120 1326 HD1 PHE 73 HD2 PHE 73 1.062 -12.300 -14.995 1327 HD2 PHE 73 HD1 PHE 73 -3.126 -11.660 -15.448 1328 HE1 PHE 73 HE2 PHE 73 0.657 -13.501 -12.890 1329 HE2 PHE 73 HE1 PHE 73 -3.534 -12.866 -13.340 1330 HZ PHE 73 HZ PHE 73 -1.639 -13.786 -12.061 1331 H THR 74 H THR 74 -2.040 -8.429 -14.881 1332 HA THR 74 HA THR 74 -3.666 -7.234 -17.045 1333 HB THR 74 HB THR 74 -5.705 -7.584 -15.968 1334 HG1 THR 74 HG1 THR 74 -5.097 -6.977 -13.846 1335 HG21 THR 74 HG21 THR 74 -4.840 -9.687 -16.891 1336 HG22 THR 74 HG22 THR 74 -5.850 -9.980 -15.474 1337 HG23 THR 74 HG23 THR 74 -4.094 -10.060 -15.336 1338 H VAL 75 H VAL 75 -3.482 -5.105 -17.031 1339 HA VAL 75 HA VAL 75 -3.702 -3.678 -14.458 1340 HB VAL 75 HB VAL 75 -1.957 -2.757 -16.761 1341 HG11 VAL 75 HG11 VAL 75 -2.950 -0.908 -15.526 1342 HG12 VAL 75 HG12 VAL 75 -1.219 -1.006 -15.203 1343 HG13 VAL 75 HG13 VAL 75 -2.373 -1.589 -14.003 1344 HG21 VAL 75 HG21 VAL 75 -0.941 -4.672 -15.634 1345 HG22 VAL 75 HG22 VAL 75 -1.138 -3.876 -14.072 1346 HG23 VAL 75 HG23 VAL 75 -0.046 -3.194 -15.278 1347 H GLU 76 H GLU 76 -5.676 -2.810 -14.523 1348 HA GLU 76 HA GLU 76 -6.687 -1.612 -17.029 1349 HB2 GLU 76 HB2 GLU 76 -8.919 -2.718 -16.431 1350 HB3 GLU 76 HB3 GLU 76 -7.650 -3.777 -17.040 1351 HG2 GLU 76 HG2 GLU 76 -7.086 -4.358 -14.682 1352 HG3 GLU 76 HG3 GLU 76 -8.481 -3.412 -14.165 1353 H ARG 77 H ARG 77 -8.686 -0.280 -16.677 1354 HA ARG 77 HA ARG 77 -8.386 1.353 -14.274 1355 HB2 ARG 77 HB2 ARG 77 -8.496 2.652 -16.236 1356 HB3 ARG 77 HB3 ARG 77 -9.829 1.712 -16.895 1357 HG2 ARG 77 HG2 ARG 77 -11.335 2.663 -15.208 1358 HG3 ARG 77 HG3 ARG 77 -9.998 3.600 -14.539 1359 HD2 ARG 77 HD2 ARG 77 -9.858 4.969 -16.440 1360 HD3 ARG 77 HD3 ARG 77 -10.778 3.843 -17.433 1361 HE ARG 77 HE ARG 77 -12.769 4.580 -16.374 1362 HH11 ARG 77 HH11 ARG 77 -10.011 6.396 -15.393 1363 HH12 ARG 77 HH12 ARG 77 -10.954 7.749 -14.887 1364 HH21 ARG 77 HH21 ARG 77 -13.953 6.312 -15.714 1365 HH22 ARG 77 HH22 ARG 77 -13.156 7.712 -15.083 1366 H LEU 78 H LEU 78 -9.720 1.305 -12.574 1367 HA LEU 78 HA LEU 78 -12.222 -0.201 -12.666 1368 HB2 LEU 78 HB2 LEU 78 -10.772 1.176 -10.396 1369 HB3 LEU 78 HB3 LEU 78 -12.292 0.321 -10.211 1370 HG LEU 78 HG LEU 78 -9.709 -0.960 -11.137 1371 HD11 LEU 78 HD11 LEU 78 -11.045 -1.077 -8.430 1372 HD12 LEU 78 HD12 LEU 78 -9.535 -0.247 -8.806 1373 HD13 LEU 78 HD13 LEU 78 -9.628 -2.005 -8.928 1374 HD21 LEU 78 HD21 LEU 78 -11.715 -2.077 -11.985 1375 HD22 LEU 78 HD22 LEU 78 -12.356 -2.185 -10.344 1376 HD23 LEU 78 HD23 LEU 78 -10.891 -3.066 -10.780 1377 H SER 79 H SER 79 -13.873 0.898 -13.563 1378 HA SER 79 HA SER 79 -14.156 3.781 -13.163 1379 HB2 SER 79 HB2 SER 79 -14.558 2.879 -15.412 1380 HB3 SER 79 HB3 SER 79 -15.840 1.844 -14.781 1381 HG SER 79 HG SER 79 -16.912 3.835 -14.129 1382 H ASN 80 H ASN 80 -15.803 0.791 -12.286 1383 HA ASN 80 HA ASN 80 -17.909 2.223 -10.863 1384 HB2 ASN 80 HB2 ASN 80 -17.441 -0.767 -10.988 1385 HB3 ASN 80 HB3 ASN 80 -18.922 0.063 -10.514 1386 HD21 ASN 80 HD21 ASN 80 -20.146 1.118 -12.133 1387 HD22 ASN 80 HD22 ASN 80 -19.985 0.685 -13.793 1388 H LEU 81 H LEU 81 -17.115 3.154 -9.037 1389 HA LEU 81 HA LEU 81 -15.145 1.703 -7.430 1390 HB2 LEU 81 HB2 LEU 81 -16.083 4.562 -7.174 1391 HB3 LEU 81 HB3 LEU 81 -14.742 3.830 -6.313 1392 HG LEU 81 HG LEU 81 -14.900 4.479 -9.256 1393 HD11 LEU 81 HD11 LEU 81 -12.929 5.853 -8.747 1394 HD12 LEU 81 HD12 LEU 81 -13.064 5.408 -7.042 1395 HD13 LEU 81 HD13 LEU 81 -14.343 6.349 -7.817 1396 HD21 LEU 81 HD21 LEU 81 -13.848 2.307 -9.070 1397 HD22 LEU 81 HD22 LEU 81 -12.783 2.895 -7.792 1398 HD23 LEU 81 HD23 LEU 81 -12.626 3.526 -9.431 1399 H GLU 82 H GLU 82 -15.293 1.509 -5.169 1400 HA GLU 82 HA GLU 82 -17.988 1.372 -4.050 1401 HB2 GLU 82 HB2 GLU 82 -16.920 0.234 -2.170 1402 HB3 GLU 82 HB3 GLU 82 -16.379 -0.482 -3.683 1403 HG2 GLU 82 HG2 GLU 82 -14.315 0.920 -3.525 1404 HG3 GLU 82 HG3 GLU 82 -14.850 1.435 -1.928 1405 H HIS 83 H HIS 83 -16.567 3.942 -4.671 1406 HA HIS 83 HA HIS 83 -16.171 5.092 -1.993 1407 HB2 HIS 83 HB2 HIS 83 -15.283 6.118 -4.693 1408 HB3 HIS 83 HB3 HIS 83 -14.970 6.914 -3.154 1409 HD1 HIS 83 HD1 HIS 83 -12.748 6.400 -2.194 1410 HD2 HIS 83 HD2 HIS 83 -14.089 3.370 -4.688 1411 HE1 HIS 83 HE1 HIS 83 -10.847 4.775 -2.360 1412 HE2 HIS 83 HE2 HIS 83 -11.782 2.832 -3.653 1413 H HIS 84 H HIS 84 -18.614 5.112 -1.880 1414 HA HIS 84 HA HIS 84 -19.491 7.785 -2.232 1415 HB2 HIS 84 HB2 HIS 84 -19.882 6.187 -4.505 1416 HB3 HIS 84 HB3 HIS 84 -21.458 6.231 -3.721 1417 HD1 HIS 84 HD1 HIS 84 -18.876 8.496 -5.253 1418 HD2 HIS 84 HD2 HIS 84 -22.806 8.641 -3.921 1419 HE1 HIS 84 HE1 HIS 84 -19.752 10.724 -5.998 1420 HE2 HIS 84 HE2 HIS 84 -22.067 10.862 -5.027 1421 H HIS 85 H HIS 85 -20.990 8.247 -0.739 1422 HA HIS 85 HA HIS 85 -22.630 6.048 0.345 1423 HB2 HIS 85 HB2 HIS 85 -21.308 8.284 1.904 1424 HB3 HIS 85 HB3 HIS 85 -22.487 7.162 2.578 1425 HD1 HIS 85 HD1 HIS 85 -21.730 4.558 2.513 1426 HD2 HIS 85 HD2 HIS 85 -18.723 7.380 1.974 1427 HE1 HIS 85 HE1 HIS 85 -19.573 3.339 2.919 1428 HE2 HIS 85 HE2 HIS 85 -17.782 5.087 2.715 1429 H HIS 86 H HIS 86 -24.760 6.490 0.742 1430 HA HIS 86 HA HIS 86 -25.914 8.514 -0.861 1431 HB2 HIS 86 HB2 HIS 86 -26.981 6.321 -0.389 1432 HB3 HIS 86 HB3 HIS 86 -27.249 6.832 1.274 1433 HD1 HIS 86 HD1 HIS 86 -28.616 7.126 -2.142 1434 HD2 HIS 86 HD2 HIS 86 -29.226 8.888 1.569 1435 HE1 HIS 86 HE1 HIS 86 -30.804 8.335 -2.321 1436 HE2 HIS 86 HE2 HIS 86 -31.002 9.602 -0.165 1437 H HIS 87 H HIS 87 -25.269 10.552 -0.189 1438 HA HIS 87 HA HIS 87 -26.108 11.423 2.487 1439 HB2 HIS 87 HB2 HIS 87 -24.864 13.542 1.927 1440 HB3 HIS 87 HB3 HIS 87 -23.871 12.095 2.006 1441 HD1 HIS 87 HD1 HIS 87 -25.167 14.656 -0.402 1442 HD2 HIS 87 HD2 HIS 87 -22.657 11.348 -0.402 1443 HE1 HIS 87 HE1 HIS 87 -23.946 14.741 -2.590 1444 HE2 HIS 87 HE2 HIS 87 -22.297 12.849 -2.473 1445 H HIS 88 H HIS 88 -28.334 11.365 2.101 1446 HA HIS 88 HA HIS 88 -30.390 12.160 1.590 1447 HB2 HIS 88 HB2 HIS 88 -28.946 14.772 1.061 1448 HB3 HIS 88 HB3 HIS 88 -30.661 14.578 1.417 1449 HD1 HIS 88 HD1 HIS 88 -31.276 13.898 3.886 1450 HD2 HIS 88 HD2 HIS 88 -27.267 14.794 3.265 1451 HE1 HIS 88 HE1 HIS 88 -30.291 14.190 6.171 1452 HE2 HIS 88 HE2 HIS 88 -27.910 14.884 5.768 Start of MODEL 16 1 H1 MET 1 H1 MET 1 11.465 -17.125 16.568 2 H2 MET 1 H2 MET 1 9.939 -17.824 16.754 3 H3 MET 1 H3 MET 1 10.106 -16.387 15.888 4 HA MET 1 HA MET 1 11.417 -17.515 14.198 5 HB2 MET 1 HB2 MET 1 10.707 -20.027 15.735 6 HB3 MET 1 HB3 MET 1 11.577 -19.960 14.211 7 HG2 MET 1 HG2 MET 1 13.417 -18.774 15.328 8 HG3 MET 1 HG3 MET 1 12.545 -18.889 16.857 9 HE1 MET 1 HE1 MET 1 12.355 -22.863 17.193 10 HE2 MET 1 HE2 MET 1 11.238 -21.905 16.222 11 HE3 MET 1 HE3 MET 1 11.732 -21.337 17.819 12 H THR 2 H THR 2 8.564 -18.950 15.799 13 HA THR 2 HA THR 2 7.206 -19.912 13.581 14 HB THR 2 HB THR 2 5.116 -19.644 14.913 15 HG1 THR 2 HG1 THR 2 5.709 -17.660 15.962 16 HG21 THR 2 HG21 THR 2 7.478 -20.711 16.472 17 HG22 THR 2 HG22 THR 2 6.548 -21.599 15.265 18 HG23 THR 2 HG23 THR 2 5.784 -21.097 16.773 19 H ASP 3 H ASP 3 6.641 -18.856 11.775 20 HA ASP 3 HA ASP 3 6.254 -16.031 11.675 21 HB2 ASP 3 HB2 ASP 3 5.629 -16.410 9.315 22 HB3 ASP 3 HB3 ASP 3 7.132 -17.221 9.739 23 H PHE 4 H PHE 4 4.493 -14.964 12.299 24 HA PHE 4 HA PHE 4 1.859 -16.187 11.820 25 HB2 PHE 4 HB2 PHE 4 0.978 -15.101 13.818 26 HB3 PHE 4 HB3 PHE 4 2.310 -16.164 14.241 27 HD1 PHE 4 HD1 PHE 4 1.180 -12.683 14.020 28 HD2 PHE 4 HD2 PHE 4 4.401 -15.262 15.099 29 HE1 PHE 4 HE1 PHE 4 2.258 -10.830 15.224 30 HE2 PHE 4 HE2 PHE 4 5.479 -13.408 16.304 31 HZ PHE 4 HZ PHE 4 4.415 -11.186 16.361 32 H LEU 5 H LEU 5 0.146 -14.679 11.379 33 HA LEU 5 HA LEU 5 1.070 -12.574 9.642 34 HB2 LEU 5 HB2 LEU 5 -0.783 -14.059 9.019 35 HB3 LEU 5 HB3 LEU 5 -1.713 -13.458 10.373 36 HG LEU 5 HG LEU 5 -1.829 -11.237 9.351 37 HD11 LEU 5 HD11 LEU 5 0.319 -11.208 8.212 38 HD12 LEU 5 HD12 LEU 5 -0.981 -10.869 7.070 39 HD13 LEU 5 HD13 LEU 5 -0.226 -12.465 7.101 40 HD21 LEU 5 HD21 LEU 5 -3.563 -12.864 8.794 41 HD22 LEU 5 HD22 LEU 5 -2.599 -13.441 7.434 42 HD23 LEU 5 HD23 LEU 5 -3.238 -11.796 7.429 43 H ALA 6 H ALA 6 1.782 -10.807 10.622 44 HA ALA 6 HA ALA 6 0.441 -9.730 12.980 45 HB1 ALA 6 HB1 ALA 6 2.397 -8.273 13.153 46 HB2 ALA 6 HB2 ALA 6 3.016 -8.921 11.633 47 HB3 ALA 6 HB3 ALA 6 2.860 -9.970 13.044 48 H GLY 7 H GLY 7 -0.791 -7.929 12.964 49 HA2 GLY 7 HA2 GLY 7 -1.014 -6.420 10.430 50 HA3 GLY 7 HA3 GLY 7 -2.314 -6.618 11.595 51 H ILE 8 H ILE 8 -0.992 -4.191 10.425 52 HA ILE 8 HA ILE 8 -0.540 -2.804 12.989 53 HB ILE 8 HB ILE 8 0.965 -2.191 10.426 54 HG12 ILE 8 HG12 ILE 8 1.987 -3.460 12.985 55 HG13 ILE 8 HG13 ILE 8 1.753 -4.295 11.452 56 HG21 ILE 8 HG21 ILE 8 2.263 -0.638 11.826 57 HG22 ILE 8 HG22 ILE 8 1.228 -1.020 13.201 58 HG23 ILE 8 HG23 ILE 8 0.553 -0.209 11.786 59 HD11 ILE 8 HD11 ILE 8 3.463 -2.897 10.422 60 HD12 ILE 8 HD12 ILE 8 4.094 -3.754 11.827 61 HD13 ILE 8 HD13 ILE 8 3.690 -2.042 11.947 62 H ARG 9 H ARG 9 -1.796 -1.008 13.244 63 HA ARG 9 HA ARG 9 -3.111 0.096 10.843 64 HB2 ARG 9 HB2 ARG 9 -4.636 -0.762 12.625 65 HB3 ARG 9 HB3 ARG 9 -3.971 0.440 13.726 66 HG2 ARG 9 HG2 ARG 9 -4.741 2.228 12.208 67 HG3 ARG 9 HG3 ARG 9 -5.459 1.006 11.160 68 HD2 ARG 9 HD2 ARG 9 -6.889 0.283 13.054 69 HD3 ARG 9 HD3 ARG 9 -6.210 1.591 14.025 70 HE ARG 9 HE ARG 9 -7.484 2.321 11.505 71 HH11 ARG 9 HH11 ARG 9 -7.659 2.157 14.944 72 HH12 ARG 9 HH12 ARG 9 -8.983 3.265 15.040 73 HH21 ARG 9 HH21 ARG 9 -9.233 3.701 11.643 74 HH22 ARG 9 HH22 ARG 9 -9.879 4.106 13.192 75 H ILE 10 H ILE 10 -2.483 2.008 10.154 76 HA ILE 10 HA ILE 10 -0.983 3.816 11.960 77 HB ILE 10 HB ILE 10 -0.943 3.768 8.929 78 HG12 ILE 10 HG12 ILE 10 1.170 2.630 10.776 79 HG13 ILE 10 HG13 ILE 10 -0.040 1.652 9.954 80 HG21 ILE 10 HG21 ILE 10 1.083 5.135 9.176 81 HG22 ILE 10 HG22 ILE 10 0.878 5.117 10.927 82 HG23 ILE 10 HG23 ILE 10 -0.323 5.911 9.908 83 HD11 ILE 10 HD11 ILE 10 0.825 2.395 7.794 84 HD12 ILE 10 HD12 ILE 10 2.067 1.606 8.764 85 HD13 ILE 10 HD13 ILE 10 2.045 3.363 8.622 86 H VAL 11 H VAL 11 -2.262 5.527 12.618 87 HA VAL 11 HA VAL 11 -4.005 6.726 10.553 88 HB VAL 11 HB VAL 11 -4.479 6.591 13.537 89 HG11 VAL 11 HG11 VAL 11 -5.989 8.191 11.467 90 HG12 VAL 11 HG12 VAL 11 -5.031 8.840 12.798 91 HG13 VAL 11 HG13 VAL 11 -6.507 7.936 13.134 92 HG21 VAL 11 HG21 VAL 11 -6.112 5.633 11.171 93 HG22 VAL 11 HG22 VAL 11 -6.562 5.473 12.871 94 HG23 VAL 11 HG23 VAL 11 -5.153 4.613 12.248 95 H GLY 12 H GLY 12 -3.086 8.434 9.756 96 HA2 GLY 12 HA2 GLY 12 -1.907 10.449 11.572 97 HA3 GLY 12 HA3 GLY 12 -1.080 9.976 10.092 98 H GLU 13 H GLU 13 -1.731 12.626 10.511 99 HA GLU 13 HA GLU 13 -4.314 13.277 9.484 100 HB2 GLU 13 HB2 GLU 13 -3.500 15.604 9.450 101 HB3 GLU 13 HB3 GLU 13 -3.232 14.806 10.994 102 HG2 GLU 13 HG2 GLU 13 -0.890 14.550 10.524 103 HG3 GLU 13 HG3 GLU 13 -1.111 15.136 8.874 104 H ASP 14 H ASP 14 -4.974 13.897 7.501 105 HA ASP 14 HA ASP 14 -3.463 13.142 5.203 106 HB2 ASP 14 HB2 ASP 14 -5.884 12.936 5.249 107 HB3 ASP 14 HB3 ASP 14 -6.063 14.664 5.519 108 H LYS 15 H LYS 15 -1.671 14.306 4.726 109 HA LYS 15 HA LYS 15 -1.914 17.041 3.860 110 HB2 LYS 15 HB2 LYS 15 -0.483 18.114 5.435 111 HB3 LYS 15 HB3 LYS 15 -1.646 17.207 6.397 112 HG2 LYS 15 HG2 LYS 15 -0.028 15.455 6.788 113 HG3 LYS 15 HG3 LYS 15 1.137 16.246 5.728 114 HD2 LYS 15 HD2 LYS 15 0.264 16.988 8.495 115 HD3 LYS 15 HD3 LYS 15 1.888 16.814 7.843 116 HE2 LYS 15 HE2 LYS 15 1.729 19.099 8.078 117 HE3 LYS 15 HE3 LYS 15 1.232 18.890 6.398 118 HZ1 LYS 15 HZ1 LYS 15 -0.680 19.049 8.662 119 HZ2 LYS 15 HZ2 LYS 15 -1.032 19.137 7.007 120 HZ3 LYS 15 HZ3 LYS 15 -0.197 20.394 7.757 121 H ASN 16 H ASN 16 -0.252 17.627 2.474 122 HA ASN 16 HA ASN 16 1.647 17.541 1.222 123 HB2 ASN 16 HB2 ASN 16 2.890 16.260 3.663 124 HB3 ASN 16 HB3 ASN 16 3.710 17.190 2.414 125 HD21 ASN 16 HD21 ASN 16 1.472 19.163 2.352 126 HD22 ASN 16 HD22 ASN 16 1.709 20.138 3.751 127 H GLY 17 H GLY 17 -0.058 14.961 1.331 128 HA2 GLY 17 HA2 GLY 17 0.051 13.011 0.072 129 HA3 GLY 17 HA3 GLY 17 1.736 13.360 -0.277 130 H MET 18 H MET 18 0.356 13.137 2.960 131 HA MET 18 HA MET 18 2.286 11.427 4.023 132 HB2 MET 18 HB2 MET 18 -0.522 12.142 4.833 133 HB3 MET 18 HB3 MET 18 0.366 10.930 5.744 134 HG2 MET 18 HG2 MET 18 1.452 13.690 5.246 135 HG3 MET 18 HG3 MET 18 0.422 13.301 6.625 136 HE1 MET 18 HE1 MET 18 1.382 10.283 7.168 137 HE2 MET 18 HE2 MET 18 1.045 11.462 8.436 138 HE3 MET 18 HE3 MET 18 2.565 10.567 8.445 139 H THR 19 H THR 19 -0.966 10.583 2.846 140 HA THR 19 HA THR 19 -1.017 7.866 3.336 141 HB THR 19 HB THR 19 -2.527 7.665 1.378 142 HG1 THR 19 HG1 THR 19 -2.912 9.776 0.267 143 HG21 THR 19 HG21 THR 19 -4.223 9.292 2.099 144 HG22 THR 19 HG22 THR 19 -2.994 10.177 3.003 145 HG23 THR 19 HG23 THR 19 -3.435 8.539 3.487 146 H ASN 20 H ASN 20 0.612 9.579 0.722 147 HA ASN 20 HA ASN 20 1.249 7.238 -0.785 148 HB2 ASN 20 HB2 ASN 20 0.952 9.470 -1.815 149 HB3 ASN 20 HB3 ASN 20 2.378 10.047 -0.957 150 HD21 ASN 20 HD21 ASN 20 1.204 8.043 -3.528 151 HD22 ASN 20 HD22 ASN 20 2.724 7.813 -4.295 152 H GLN 21 H GLN 21 3.081 9.418 1.358 153 HA GLN 21 HA GLN 21 5.558 8.088 1.037 154 HB2 GLN 21 HB2 GLN 21 6.377 9.423 2.825 155 HB3 GLN 21 HB3 GLN 21 5.275 10.426 1.908 156 HG2 GLN 21 HG2 GLN 21 3.582 10.214 3.583 157 HG3 GLN 21 HG3 GLN 21 4.515 8.997 4.448 158 HE21 GLN 21 HE21 GLN 21 4.277 12.390 3.668 159 HE22 GLN 21 HE22 GLN 21 5.339 12.939 4.912 160 H ILE 22 H ILE 22 2.905 7.669 3.304 161 HA ILE 22 HA ILE 22 4.233 6.063 5.196 162 HB ILE 22 HB ILE 22 1.340 6.503 4.519 163 HG12 ILE 22 HG12 ILE 22 2.528 8.281 5.700 164 HG13 ILE 22 HG13 ILE 22 1.331 7.546 6.760 165 HG21 ILE 22 HG21 ILE 22 0.681 5.174 6.474 166 HG22 ILE 22 HG22 ILE 22 2.352 4.643 6.676 167 HG23 ILE 22 HG23 ILE 22 1.445 4.180 5.236 168 HD11 ILE 22 HD11 ILE 22 3.406 7.984 7.936 169 HD12 ILE 22 HD12 ILE 22 4.284 6.981 6.782 170 HD13 ILE 22 HD13 ILE 22 3.083 6.252 7.848 171 H THR 23 H THR 23 2.015 5.061 2.547 172 HA THR 23 HA THR 23 2.490 2.290 2.995 173 HB THR 23 HB THR 23 1.549 3.446 0.358 174 HG1 THR 23 HG1 THR 23 0.205 3.233 2.838 175 HG21 THR 23 HG21 THR 23 2.003 1.026 0.423 176 HG22 THR 23 HG22 THR 23 0.284 1.358 0.222 177 HG23 THR 23 HG23 THR 23 0.904 0.864 1.797 178 H GLY 24 H GLY 24 4.067 4.758 1.090 179 HA2 GLY 24 HA2 GLY 24 5.746 3.158 -0.506 180 HA3 GLY 24 HA3 GLY 24 6.112 4.786 0.044 181 H VAL 25 H VAL 25 6.322 4.488 2.768 182 HA VAL 25 HA VAL 25 8.866 3.309 3.125 183 HB VAL 25 HB VAL 25 6.828 4.131 5.212 184 HG11 VAL 25 HG11 VAL 25 9.780 3.576 5.559 185 HG12 VAL 25 HG12 VAL 25 8.470 2.542 6.129 186 HG13 VAL 25 HG13 VAL 25 8.674 4.158 6.805 187 HG21 VAL 25 HG21 VAL 25 8.229 6.159 5.392 188 HG22 VAL 25 HG22 VAL 25 7.512 5.978 3.792 189 HG23 VAL 25 HG23 VAL 25 9.211 5.576 4.046 190 H ILE 26 H ILE 26 5.605 2.136 3.820 191 HA ILE 26 HA ILE 26 6.169 -0.187 5.236 192 HB ILE 26 HB ILE 26 3.978 0.391 3.242 193 HG12 ILE 26 HG12 ILE 26 3.998 0.300 6.275 194 HG13 ILE 26 HG13 ILE 26 3.985 1.761 5.291 195 HG21 ILE 26 HG21 ILE 26 4.227 -1.995 5.074 196 HG22 ILE 26 HG22 ILE 26 4.258 -2.012 3.310 197 HG23 ILE 26 HG23 ILE 26 2.781 -1.560 4.159 198 HD11 ILE 26 HD11 ILE 26 1.785 1.293 6.166 199 HD12 ILE 26 HD12 ILE 26 1.803 -0.309 5.432 200 HD13 ILE 26 HD13 ILE 26 1.788 1.128 4.410 201 H SER 27 H SER 27 6.084 0.250 1.692 202 HA SER 27 HA SER 27 6.570 -2.441 1.007 203 HB2 SER 27 HB2 SER 27 7.157 -1.649 -1.207 204 HB3 SER 27 HB3 SER 27 5.796 -0.703 -0.610 205 HG SER 27 HG SER 27 7.142 1.010 -0.253 206 H LYS 28 H LYS 28 8.678 -0.051 2.286 207 HA LYS 28 HA LYS 28 11.137 -1.246 1.306 208 HB2 LYS 28 HB2 LYS 28 10.799 0.926 3.390 209 HB3 LYS 28 HB3 LYS 28 12.252 0.554 2.470 210 HG2 LYS 28 HG2 LYS 28 11.131 1.266 0.409 211 HG3 LYS 28 HG3 LYS 28 9.669 1.626 1.333 212 HD2 LYS 28 HD2 LYS 28 10.923 3.312 2.625 213 HD3 LYS 28 HD3 LYS 28 12.360 2.971 1.656 214 HE2 LYS 28 HE2 LYS 28 11.218 3.719 -0.354 215 HE3 LYS 28 HE3 LYS 28 9.724 3.964 0.553 216 HZ1 LYS 28 HZ1 LYS 28 12.264 5.435 0.991 217 HZ2 LYS 28 HZ2 LYS 28 10.824 5.677 1.841 218 HZ3 LYS 28 HZ3 LYS 28 10.902 6.036 0.194 219 H PHE 29 H PHE 29 9.112 -2.468 3.442 220 HA PHE 29 HA PHE 29 10.868 -2.910 5.699 221 HB2 PHE 29 HB2 PHE 29 8.144 -4.004 4.988 222 HB3 PHE 29 HB3 PHE 29 9.019 -4.492 6.431 223 HD1 PHE 29 HD2 PHE 29 10.065 -1.328 6.357 224 HD2 PHE 29 HD1 PHE 29 6.385 -3.439 6.737 225 HE1 PHE 29 HE2 PHE 29 9.103 0.574 7.578 226 HE2 PHE 29 HE1 PHE 29 5.420 -1.535 7.962 227 HZ PHE 29 HZ PHE 29 6.779 0.471 8.385 228 H ASP 30 H ASP 30 11.410 -5.072 6.479 229 HA ASP 30 HA ASP 30 12.419 -6.782 4.351 230 HB2 ASP 30 HB2 ASP 30 12.729 -6.938 7.361 231 HB3 ASP 30 HB3 ASP 30 13.554 -7.977 6.203 232 H THR 31 H THR 31 9.500 -6.674 4.873 233 HA THR 31 HA THR 31 9.097 -9.573 5.131 234 HB THR 31 HB THR 31 8.433 -8.751 7.293 235 HG1 THR 31 HG1 THR 31 6.733 -9.993 7.178 236 HG21 THR 31 HG21 THR 31 8.094 -6.382 6.690 237 HG22 THR 31 HG22 THR 31 6.729 -7.031 7.598 238 HG23 THR 31 HG23 THR 31 6.602 -6.819 5.852 239 H ASN 32 H ASN 32 7.279 -10.396 4.006 240 HA ASN 32 HA ASN 32 6.793 -8.937 1.560 241 HB2 ASN 32 HB2 ASN 32 7.316 -11.356 1.550 242 HB3 ASN 32 HB3 ASN 32 5.818 -11.672 2.418 243 HD21 ASN 32 HD21 ASN 32 6.273 -9.348 -0.198 244 HD22 ASN 32 HD22 ASN 32 5.216 -10.145 -1.306 245 H ILE 33 H ILE 33 5.071 -7.686 1.170 246 HA ILE 33 HA ILE 33 2.988 -7.325 3.075 247 HB ILE 33 HB ILE 33 3.133 -6.359 0.210 248 HG12 ILE 33 HG12 ILE 33 3.850 -4.931 2.790 249 HG13 ILE 33 HG13 ILE 33 5.013 -5.597 1.650 250 HG21 ILE 33 HG21 ILE 33 0.845 -6.296 1.021 251 HG22 ILE 33 HG22 ILE 33 1.486 -4.657 0.926 252 HG23 ILE 33 HG23 ILE 33 1.357 -5.463 2.490 253 HD11 ILE 33 HD11 ILE 33 3.059 -3.379 1.071 254 HD12 ILE 33 HD12 ILE 33 4.245 -4.038 -0.059 255 HD13 ILE 33 HD13 ILE 33 4.783 -3.194 1.393 256 H ARG 34 H ARG 34 1.588 -8.980 3.431 257 HA ARG 34 HA ARG 34 0.540 -10.529 1.206 258 HB2 ARG 34 HB2 ARG 34 0.989 -11.079 3.914 259 HB3 ARG 34 HB3 ARG 34 -0.763 -11.027 3.774 260 HG2 ARG 34 HG2 ARG 34 1.050 -12.711 2.040 261 HG3 ARG 34 HG3 ARG 34 0.188 -13.293 3.465 262 HD2 ARG 34 HD2 ARG 34 -1.933 -12.919 2.426 263 HD3 ARG 34 HD3 ARG 34 -1.190 -12.045 1.088 264 HE ARG 34 HE ARG 34 -0.318 -14.117 0.274 265 HH11 ARG 34 HH11 ARG 34 -2.522 -14.487 2.895 266 HH12 ARG 34 HH12 ARG 34 -2.929 -16.107 2.463 267 HH21 ARG 34 HH21 ARG 34 -0.862 -16.184 -0.273 268 HH22 ARG 34 HH22 ARG 34 -1.998 -17.059 0.689 269 H THR 35 H THR 35 -0.544 -7.985 3.375 270 HA THR 35 HA THR 35 -2.655 -7.330 1.510 271 HB THR 35 HB THR 35 -3.438 -7.902 4.383 272 HG1 THR 35 HG1 THR 35 -3.604 -9.428 2.035 273 HG21 THR 35 HG21 THR 35 -5.738 -7.522 3.566 274 HG22 THR 35 HG22 THR 35 -5.088 -7.058 1.993 275 HG23 THR 35 HG23 THR 35 -4.732 -6.083 3.419 276 H ILE 36 H ILE 36 -2.879 -5.152 1.367 277 HA ILE 36 HA ILE 36 -2.393 -3.513 3.770 278 HB ILE 36 HB ILE 36 -0.381 -3.327 2.326 279 HG12 ILE 36 HG12 ILE 36 -0.375 -0.818 2.128 280 HG13 ILE 36 HG13 ILE 36 -2.091 -0.832 2.523 281 HG21 ILE 36 HG21 ILE 36 -2.281 -2.195 0.277 282 HG22 ILE 36 HG22 ILE 36 -1.374 -3.703 0.150 283 HG23 ILE 36 HG23 ILE 36 -0.521 -2.159 0.168 284 HD11 ILE 36 HD11 ILE 36 -1.583 -1.812 4.693 285 HD12 ILE 36 HD12 ILE 36 -0.727 -0.289 4.455 286 HD13 ILE 36 HD13 ILE 36 0.135 -1.818 4.293 287 H VAL 37 H VAL 37 -4.016 -2.098 4.163 288 HA VAL 37 HA VAL 37 -5.756 -1.250 1.936 289 HB VAL 37 HB VAL 37 -6.793 -2.210 4.623 290 HG11 VAL 37 HG11 VAL 37 -8.276 -1.179 2.195 291 HG12 VAL 37 HG12 VAL 37 -8.129 -0.370 3.756 292 HG13 VAL 37 HG13 VAL 37 -9.029 -1.881 3.626 293 HG21 VAL 37 HG21 VAL 37 -6.099 -4.087 3.235 294 HG22 VAL 37 HG22 VAL 37 -7.042 -3.463 1.881 295 HG23 VAL 37 HG23 VAL 37 -7.859 -4.025 3.341 296 H LEU 38 H LEU 38 -5.272 0.876 1.866 297 HA LEU 38 HA LEU 38 -5.418 2.427 4.382 298 HB2 LEU 38 HB2 LEU 38 -3.214 2.481 3.266 299 HB3 LEU 38 HB3 LEU 38 -3.960 3.102 1.811 300 HG LEU 38 HG LEU 38 -4.125 4.649 4.398 301 HD11 LEU 38 HD11 LEU 38 -2.117 5.884 3.730 302 HD12 LEU 38 HD12 LEU 38 -1.884 4.780 2.373 303 HD13 LEU 38 HD13 LEU 38 -1.752 4.184 4.028 304 HD21 LEU 38 HD21 LEU 38 -4.271 6.575 2.851 305 HD22 LEU 38 HD22 LEU 38 -5.574 5.415 2.603 306 HD23 LEU 38 HD23 LEU 38 -4.212 5.460 1.483 307 H ASN 39 H ASN 39 -7.001 3.927 4.577 308 HA ASN 39 HA ASN 39 -8.117 5.139 2.155 309 HB2 ASN 39 HB2 ASN 39 -10.426 4.858 2.894 310 HB3 ASN 39 HB3 ASN 39 -9.648 3.287 2.715 311 HD21 ASN 39 HD21 ASN 39 -9.129 2.108 4.592 312 HD22 ASN 39 HD22 ASN 39 -9.905 2.440 6.097 313 H ALA 40 H ALA 40 -8.638 7.271 2.365 314 HA ALA 40 HA ALA 40 -8.035 8.534 4.963 315 HB1 ALA 40 HB1 ALA 40 -6.717 9.273 3.019 316 HB2 ALA 40 HB2 ALA 40 -7.679 10.584 3.700 317 HB3 ALA 40 HB3 ALA 40 -8.201 9.789 2.214 318 H LYS 41 H LYS 41 -9.672 9.150 6.186 319 HA LYS 41 HA LYS 41 -12.003 10.441 5.028 320 HB2 LYS 41 HB2 LYS 41 -13.646 9.013 5.938 321 HB3 LYS 41 HB3 LYS 41 -12.477 7.931 5.195 322 HG2 LYS 41 HG2 LYS 41 -12.683 8.557 8.138 323 HG3 LYS 41 HG3 LYS 41 -13.264 7.093 7.347 324 HD2 LYS 41 HD2 LYS 41 -10.954 6.541 6.698 325 HD3 LYS 41 HD3 LYS 41 -10.383 8.006 7.504 326 HE2 LYS 41 HE2 LYS 41 -11.742 5.638 8.796 327 HE3 LYS 41 HE3 LYS 41 -10.047 6.098 8.954 328 HZ1 LYS 41 HZ1 LYS 41 -10.729 8.125 10.066 329 HZ2 LYS 41 HZ2 LYS 41 -11.351 6.779 10.871 330 HZ3 LYS 41 HZ3 LYS 41 -12.360 7.714 9.885 331 H ASP 42 H ASP 42 -13.327 11.544 6.664 332 HA ASP 42 HA ASP 42 -13.581 12.987 8.404 333 HB2 ASP 42 HB2 ASP 42 -11.608 11.303 9.961 334 HB3 ASP 42 HB3 ASP 42 -12.886 12.333 10.598 335 H GLY 43 H GLY 43 -11.094 13.091 6.522 336 HA2 GLY 43 HA2 GLY 43 -9.468 14.747 6.211 337 HA3 GLY 43 HA3 GLY 43 -9.768 15.319 7.846 338 H ILE 44 H ILE 44 -9.319 11.986 7.721 339 HA ILE 44 HA ILE 44 -6.429 12.143 8.322 340 HB ILE 44 HB ILE 44 -8.219 10.236 9.824 341 HG12 ILE 44 HG12 ILE 44 -7.700 13.107 10.656 342 HG13 ILE 44 HG13 ILE 44 -9.251 12.436 10.160 343 HG21 ILE 44 HG21 ILE 44 -5.602 11.581 10.512 344 HG22 ILE 44 HG22 ILE 44 -5.826 9.904 10.011 345 HG23 ILE 44 HG23 ILE 44 -6.472 10.456 11.554 346 HD11 ILE 44 HD11 ILE 44 -9.217 10.951 12.106 347 HD12 ILE 44 HD12 ILE 44 -9.131 12.651 12.567 348 HD13 ILE 44 HD13 ILE 44 -7.678 11.652 12.607 349 H PHE 45 H PHE 45 -5.482 9.774 8.264 350 HA PHE 45 HA PHE 45 -7.080 8.045 6.481 351 HB2 PHE 45 HB2 PHE 45 -5.164 7.430 5.169 352 HB3 PHE 45 HB3 PHE 45 -5.257 9.183 5.192 353 HD1 PHE 45 HD1 PHE 45 -3.387 6.249 6.385 354 HD2 PHE 45 HD2 PHE 45 -3.543 10.508 6.245 355 HE1 PHE 45 HE1 PHE 45 -1.056 6.360 7.152 356 HE2 PHE 45 HE2 PHE 45 -1.210 10.617 7.014 357 HZ PHE 45 HZ PHE 45 0.031 8.542 7.471 358 H THR 46 H THR 46 -6.933 5.835 6.811 359 HA THR 46 HA THR 46 -5.262 4.947 9.086 360 HB THR 46 HB THR 46 -7.517 4.798 9.852 361 HG1 THR 46 HG1 THR 46 -6.787 2.173 8.974 362 HG21 THR 46 HG21 THR 46 -8.184 3.257 7.339 363 HG22 THR 46 HG22 THR 46 -8.672 4.915 7.691 364 HG23 THR 46 HG23 THR 46 -9.282 3.587 8.678 365 H CYS 47 H CYS 47 -3.566 3.987 8.159 366 HA CYS 47 HA CYS 47 -3.879 2.262 5.826 367 HB2 CYS 47 HB2 CYS 47 -1.983 3.841 5.929 368 HB3 CYS 47 HB3 CYS 47 -1.392 3.032 7.375 369 HG CYS 47 HG CYS 47 -0.685 0.691 6.139 370 H ASN 48 H ASN 48 -4.416 0.189 6.119 371 HA ASN 48 HA ASN 48 -3.696 -1.172 8.623 372 HB2 ASN 48 HB2 ASN 48 -5.714 -1.866 6.474 373 HB3 ASN 48 HB3 ASN 48 -5.357 -2.898 7.856 374 HD21 ASN 48 HD21 ASN 48 -7.464 -2.759 8.592 375 HD22 ASN 48 HD22 ASN 48 -8.088 -1.333 9.332 376 H LEU 49 H LEU 49 -1.740 -2.109 8.469 377 HA LEU 49 HA LEU 49 -0.910 -3.396 5.967 378 HB2 LEU 49 HB2 LEU 49 0.680 -1.837 6.878 379 HB3 LEU 49 HB3 LEU 49 0.617 -2.612 8.450 380 HG LEU 49 HG LEU 49 1.693 -4.622 7.502 381 HD11 LEU 49 HD11 LEU 49 0.908 -4.473 5.209 382 HD12 LEU 49 HD12 LEU 49 2.668 -4.548 5.252 383 HD13 LEU 49 HD13 LEU 49 1.860 -3.009 4.956 384 HD21 LEU 49 HD21 LEU 49 3.203 -2.060 6.984 385 HD22 LEU 49 HD22 LEU 49 3.923 -3.659 7.181 386 HD23 LEU 49 HD23 LEU 49 3.076 -2.900 8.529 387 H MET 50 H MET 50 -0.634 -5.545 5.751 388 HA MET 50 HA MET 50 -0.735 -7.254 8.156 389 HB2 MET 50 HB2 MET 50 -2.065 -7.848 5.508 390 HB3 MET 50 HB3 MET 50 -2.056 -8.897 6.914 391 HG2 MET 50 HG2 MET 50 -3.389 -6.208 6.698 392 HG3 MET 50 HG3 MET 50 -4.179 -7.781 6.710 393 HE1 MET 50 HE1 MET 50 -1.975 -9.013 8.967 394 HE2 MET 50 HE2 MET 50 -3.663 -9.517 8.883 395 HE3 MET 50 HE3 MET 50 -2.994 -8.918 10.401 396 H ILE 51 H ILE 51 1.194 -8.179 8.324 397 HA ILE 51 HA ILE 51 2.409 -9.452 5.981 398 HB ILE 51 HB ILE 51 4.680 -8.542 6.779 399 HG12 ILE 51 HG12 ILE 51 4.388 -6.136 7.711 400 HG13 ILE 51 HG13 ILE 51 2.798 -6.678 8.231 401 HG21 ILE 51 HG21 ILE 51 2.695 -6.704 5.448 402 HG22 ILE 51 HG22 ILE 51 3.711 -7.915 4.664 403 HG23 ILE 51 HG23 ILE 51 4.448 -6.502 5.419 404 HD11 ILE 51 HD11 ILE 51 4.445 -6.800 10.016 405 HD12 ILE 51 HD12 ILE 51 5.423 -7.901 9.045 406 HD13 ILE 51 HD13 ILE 51 3.823 -8.398 9.604 407 H PHE 52 H PHE 52 4.133 -10.994 6.539 408 HA PHE 52 HA PHE 52 3.504 -12.337 9.061 409 HB2 PHE 52 HB2 PHE 52 4.821 -13.225 6.511 410 HB3 PHE 52 HB3 PHE 52 5.070 -14.144 7.991 411 HD1 PHE 52 HD2 PHE 52 3.147 -15.177 9.144 412 HD2 PHE 52 HD1 PHE 52 2.743 -13.346 5.321 413 HE1 PHE 52 HE2 PHE 52 1.016 -16.358 8.814 414 HE2 PHE 52 HE1 PHE 52 0.608 -14.523 4.983 415 HZ PHE 52 HZ PHE 52 -0.258 -16.034 6.726 416 H VAL 53 H VAL 53 4.851 -12.475 10.755 417 HA VAL 53 HA VAL 53 7.594 -11.399 10.441 418 HB VAL 53 HB VAL 53 7.483 -10.493 12.695 419 HG11 VAL 53 HG11 VAL 53 5.092 -9.641 11.065 420 HG12 VAL 53 HG12 VAL 53 6.740 -9.032 10.893 421 HG13 VAL 53 HG13 VAL 53 5.832 -8.717 12.373 422 HG21 VAL 53 HG21 VAL 53 4.657 -11.550 12.745 423 HG22 VAL 53 HG22 VAL 53 5.378 -10.499 13.965 424 HG23 VAL 53 HG23 VAL 53 6.013 -12.124 13.715 425 H LYS 54 H LYS 54 9.186 -12.213 11.939 426 HA LYS 54 HA LYS 54 8.829 -15.042 12.499 427 HB2 LYS 54 HB2 LYS 54 11.265 -15.000 12.965 428 HB3 LYS 54 HB3 LYS 54 10.856 -14.355 11.380 429 HG2 LYS 54 HG2 LYS 54 10.937 -12.047 12.517 430 HG3 LYS 54 HG3 LYS 54 11.782 -12.879 13.822 431 HD2 LYS 54 HD2 LYS 54 12.628 -12.757 10.923 432 HD3 LYS 54 HD3 LYS 54 13.378 -11.897 12.267 433 HE2 LYS 54 HE2 LYS 54 14.026 -14.031 13.271 434 HE3 LYS 54 HE3 LYS 54 13.254 -14.900 11.945 435 HZ1 LYS 54 HZ1 LYS 54 15.554 -13.042 11.698 436 HZ2 LYS 54 HZ2 LYS 54 14.806 -13.846 10.416 437 HZ3 LYS 54 HZ3 LYS 54 15.626 -14.726 11.601 438 H ASN 55 H ASN 55 8.390 -12.205 14.243 439 HA ASN 55 HA ASN 55 7.609 -13.512 16.583 440 HB2 ASN 55 HB2 ASN 55 9.324 -12.697 18.193 441 HB3 ASN 55 HB3 ASN 55 9.955 -13.893 17.068 442 HD21 ASN 55 HD21 ASN 55 11.549 -13.313 15.657 443 HD22 ASN 55 HD22 ASN 55 12.336 -11.776 15.696 444 H THR 56 H THR 56 7.371 -11.810 18.488 445 HA THR 56 HA THR 56 5.696 -9.771 17.400 446 HB THR 56 HB THR 56 5.251 -9.096 19.713 447 HG1 THR 56 HG1 THR 56 6.561 -9.620 21.311 448 HG21 THR 56 HG21 THR 56 4.386 -11.240 20.557 449 HG22 THR 56 HG22 THR 56 5.374 -12.101 19.376 450 HG23 THR 56 HG23 THR 56 4.066 -11.050 18.833 451 H ASP 57 H ASP 57 8.891 -9.666 18.953 452 HA ASP 57 HA ASP 57 9.095 -6.844 19.108 453 HB2 ASP 57 HB2 ASP 57 10.575 -8.405 20.349 454 HB3 ASP 57 HB3 ASP 57 11.333 -8.876 18.831 455 H LYS 58 H LYS 58 9.892 -9.179 16.622 456 HA LYS 58 HA LYS 58 11.051 -7.539 14.692 457 HB2 LYS 58 HB2 LYS 58 11.063 -9.896 14.355 458 HB3 LYS 58 HB3 LYS 58 9.315 -10.004 14.513 459 HG2 LYS 58 HG2 LYS 58 9.909 -10.293 12.217 460 HG3 LYS 58 HG3 LYS 58 9.078 -8.749 12.415 461 HD2 LYS 58 HD2 LYS 58 11.434 -7.721 12.591 462 HD3 LYS 58 HD3 LYS 58 12.013 -9.262 11.953 463 HE2 LYS 58 HE2 LYS 58 11.768 -7.768 10.111 464 HE3 LYS 58 HE3 LYS 58 10.452 -8.938 10.013 465 HZ1 LYS 58 HZ1 LYS 58 9.003 -7.298 11.078 466 HZ2 LYS 58 HZ2 LYS 58 9.631 -6.724 9.616 467 HZ3 LYS 58 HZ3 LYS 58 10.268 -6.175 11.083 468 H LEU 59 H LEU 59 7.680 -7.975 15.593 469 HA LEU 59 HA LEU 59 6.602 -6.384 13.452 470 HB2 LEU 59 HB2 LEU 59 5.227 -8.089 14.450 471 HB3 LEU 59 HB3 LEU 59 5.441 -7.397 16.048 472 HG LEU 59 HG LEU 59 4.160 -5.400 15.333 473 HD11 LEU 59 HD11 LEU 59 4.595 -5.425 12.963 474 HD12 LEU 59 HD12 LEU 59 2.856 -5.515 13.244 475 HD13 LEU 59 HD13 LEU 59 3.751 -6.964 12.788 476 HD21 LEU 59 HD21 LEU 59 1.963 -6.488 15.300 477 HD22 LEU 59 HD22 LEU 59 3.034 -7.216 16.497 478 HD23 LEU 59 HD23 LEU 59 2.737 -8.037 14.964 479 H THR 60 H THR 60 7.200 -5.831 16.930 480 HA THR 60 HA THR 60 6.153 -3.224 17.070 481 HB THR 60 HB THR 60 7.423 -2.950 19.147 482 HG1 THR 60 HG1 THR 60 8.798 -4.788 19.763 483 HG21 THR 60 HG21 THR 60 5.372 -4.277 19.229 484 HG22 THR 60 HG22 THR 60 6.562 -4.911 20.364 485 HG23 THR 60 HG23 THR 60 6.280 -5.736 18.831 486 H THR 61 H THR 61 9.292 -4.373 16.018 487 HA THR 61 HA THR 61 10.669 -1.924 15.968 488 HB THR 61 HB THR 61 10.963 -4.271 14.070 489 HG1 THR 61 HG1 THR 61 11.566 -5.038 16.021 490 HG21 THR 61 HG21 THR 61 13.228 -3.384 13.635 491 HG22 THR 61 HG22 THR 61 12.845 -1.961 14.606 492 HG23 THR 61 HG23 THR 61 11.970 -2.266 13.104 493 H LEU 62 H LEU 62 8.523 -3.423 13.568 494 HA LEU 62 HA LEU 62 8.806 -1.477 11.548 495 HB2 LEU 62 HB2 LEU 62 6.431 -3.228 12.200 496 HB3 LEU 62 HB3 LEU 62 6.634 -2.327 10.709 497 HG LEU 62 HG LEU 62 8.353 -4.627 11.662 498 HD11 LEU 62 HD11 LEU 62 6.167 -5.316 10.835 499 HD12 LEU 62 HD12 LEU 62 7.444 -5.791 9.716 500 HD13 LEU 62 HD13 LEU 62 6.427 -4.396 9.352 501 HD21 LEU 62 HD21 LEU 62 8.569 -2.970 9.146 502 HD22 LEU 62 HD22 LEU 62 9.488 -4.436 9.492 503 HD23 LEU 62 HD23 LEU 62 9.722 -2.996 10.482 504 H MET 63 H MET 63 6.683 -1.656 14.367 505 HA MET 63 HA MET 63 5.036 0.549 13.887 506 HB2 MET 63 HB2 MET 63 6.162 -0.333 16.558 507 HB3 MET 63 HB3 MET 63 4.746 0.684 16.319 508 HG2 MET 63 HG2 MET 63 3.583 -1.167 15.248 509 HG3 MET 63 HG3 MET 63 5.012 -2.186 15.442 510 HE1 MET 63 HE1 MET 63 2.679 -3.820 18.059 511 HE2 MET 63 HE2 MET 63 3.759 -4.070 16.686 512 HE3 MET 63 HE3 MET 63 2.234 -3.206 16.467 513 H ASP 64 H ASP 64 8.187 0.409 15.528 514 HA ASP 64 HA ASP 64 8.480 3.129 16.105 515 HB2 ASP 64 HB2 ASP 64 9.909 1.396 17.075 516 HB3 ASP 64 HB3 ASP 64 10.607 1.058 15.496 517 H LYS 65 H LYS 65 9.529 1.287 13.256 518 HA LYS 65 HA LYS 65 10.795 3.307 11.823 519 HB2 LYS 65 HB2 LYS 65 9.186 0.938 10.858 520 HB3 LYS 65 HB3 LYS 65 10.174 1.935 9.797 521 HG2 LYS 65 HG2 LYS 65 12.160 1.330 11.143 522 HG3 LYS 65 HG3 LYS 65 11.143 0.274 12.125 523 HD2 LYS 65 HD2 LYS 65 12.295 -1.045 10.457 524 HD3 LYS 65 HD3 LYS 65 10.570 -1.014 10.087 525 HE2 LYS 65 HE2 LYS 65 11.798 -0.721 8.042 526 HE3 LYS 65 HE3 LYS 65 11.014 0.806 8.444 527 HZ1 LYS 65 HZ1 LYS 65 13.148 1.562 9.377 528 HZ2 LYS 65 HZ2 LYS 65 13.249 1.209 7.730 529 HZ3 LYS 65 HZ3 LYS 65 13.872 0.123 8.865 530 H LEU 66 H LEU 66 7.361 2.382 11.764 531 HA LEU 66 HA LEU 66 6.559 4.423 9.928 532 HB2 LEU 66 HB2 LEU 66 4.949 2.791 11.903 533 HB3 LEU 66 HB3 LEU 66 4.270 3.761 10.607 534 HG LEU 66 HG LEU 66 6.177 1.479 10.084 535 HD11 LEU 66 HD11 LEU 66 4.259 0.569 11.260 536 HD12 LEU 66 HD12 LEU 66 4.212 0.109 9.560 537 HD13 LEU 66 HD13 LEU 66 3.161 1.395 10.155 538 HD21 LEU 66 HD21 LEU 66 4.181 2.914 8.325 539 HD22 LEU 66 HD22 LEU 66 5.221 1.576 7.836 540 HD23 LEU 66 HD23 LEU 66 5.932 3.124 8.288 541 H ARG 67 H ARG 67 6.954 4.268 13.373 542 HA ARG 67 HA ARG 67 5.329 6.526 14.039 543 HB2 ARG 67 HB2 ARG 67 5.831 4.634 15.578 544 HB3 ARG 67 HB3 ARG 67 7.499 5.179 15.664 545 HG2 ARG 67 HG2 ARG 67 6.868 7.185 16.795 546 HG3 ARG 67 HG3 ARG 67 5.152 6.875 16.502 547 HD2 ARG 67 HD2 ARG 67 6.955 5.104 18.160 548 HD3 ARG 67 HD3 ARG 67 5.888 6.343 18.826 549 HE ARG 67 HE ARG 67 4.059 4.997 17.656 550 HH11 ARG 67 HH11 ARG 67 6.904 3.564 18.980 551 HH12 ARG 67 HH12 ARG 67 6.124 2.055 19.308 552 HH21 ARG 67 HH21 ARG 67 3.069 3.067 18.085 553 HH22 ARG 67 HH22 ARG 67 3.973 1.777 18.806 554 H LYS 68 H LYS 68 8.342 6.330 12.552 555 HA LYS 68 HA LYS 68 9.644 8.573 13.754 556 HB2 LYS 68 HB2 LYS 68 10.078 7.415 10.992 557 HB3 LYS 68 HB3 LYS 68 11.162 8.511 11.834 558 HG2 LYS 68 HG2 LYS 68 10.513 5.663 12.561 559 HG3 LYS 68 HG3 LYS 68 12.050 6.299 11.975 560 HD2 LYS 68 HD2 LYS 68 12.186 7.691 14.052 561 HD3 LYS 68 HD3 LYS 68 10.732 6.876 14.635 562 HE2 LYS 68 HE2 LYS 68 11.981 4.696 14.315 563 HE3 LYS 68 HE3 LYS 68 13.432 5.665 14.070 564 HZ1 LYS 68 HZ1 LYS 68 13.318 4.978 16.342 565 HZ2 LYS 68 HZ2 LYS 68 11.745 5.565 16.507 566 HZ3 LYS 68 HZ3 LYS 68 13.027 6.644 16.290 567 H VAL 69 H VAL 69 7.042 8.353 11.544 568 HA VAL 69 HA VAL 69 7.527 10.900 10.235 569 HB VAL 69 HB VAL 69 5.085 9.106 10.128 570 HG11 VAL 69 HG11 VAL 69 5.873 11.464 8.407 571 HG12 VAL 69 HG12 VAL 69 4.522 11.397 9.540 572 HG13 VAL 69 HG13 VAL 69 4.513 10.386 8.095 573 HG21 VAL 69 HG21 VAL 69 5.952 8.377 7.950 574 HG22 VAL 69 HG22 VAL 69 7.084 7.993 9.248 575 HG23 VAL 69 HG23 VAL 69 7.392 9.369 8.186 576 H GLN 70 H GLN 70 7.004 12.804 11.099 577 HA GLN 70 HA GLN 70 5.757 13.176 13.568 578 HB2 GLN 70 HB2 GLN 70 5.686 15.558 13.010 579 HB3 GLN 70 HB3 GLN 70 7.223 14.851 12.525 580 HG2 GLN 70 HG2 GLN 70 6.527 14.787 10.220 581 HG3 GLN 70 HG3 GLN 70 4.910 15.339 10.652 582 HE21 GLN 70 HE21 GLN 70 6.897 16.512 8.854 583 HE22 GLN 70 HE22 GLN 70 7.147 18.122 9.424 584 H GLY 71 H GLY 71 4.336 13.012 10.359 585 HA2 GLY 71 HA2 GLY 71 1.839 14.220 11.010 586 HA3 GLY 71 HA3 GLY 71 2.183 13.256 9.586 587 H VAL 72 H VAL 72 3.048 11.037 11.604 588 HA VAL 72 HA VAL 72 0.354 9.898 11.828 589 HB VAL 72 HB VAL 72 3.037 8.559 12.266 590 HG11 VAL 72 HG11 VAL 72 0.255 7.380 12.069 591 HG12 VAL 72 HG12 VAL 72 1.245 7.473 13.526 592 HG13 VAL 72 HG13 VAL 72 1.754 6.456 12.177 593 HG21 VAL 72 HG21 VAL 72 1.166 8.472 9.889 594 HG22 VAL 72 HG22 VAL 72 2.613 7.482 10.086 595 HG23 VAL 72 HG23 VAL 72 2.757 9.233 9.941 596 H PHE 73 H PHE 73 -0.718 9.966 13.709 597 HA PHE 73 HA PHE 73 0.836 10.335 16.180 598 HB2 PHE 73 HB2 PHE 73 -1.557 11.009 17.064 599 HB3 PHE 73 HB3 PHE 73 -0.550 12.142 16.181 600 HD1 PHE 73 HD1 PHE 73 -3.568 10.048 16.026 601 HD2 PHE 73 HD2 PHE 73 -1.133 12.873 13.965 602 HE1 PHE 73 HE1 PHE 73 -5.382 10.432 14.407 603 HE2 PHE 73 HE2 PHE 73 -2.946 13.259 12.348 604 HZ PHE 73 HZ PHE 73 -5.071 12.043 12.567 605 H THR 74 H THR 74 -0.848 7.920 14.550 606 HA THR 74 HA THR 74 -0.827 6.355 17.049 607 HB THR 74 HB THR 74 -2.876 5.265 16.666 608 HG1 THR 74 HG1 THR 74 -3.973 5.313 14.751 609 HG21 THR 74 HG21 THR 74 -3.214 7.524 17.549 610 HG22 THR 74 HG22 THR 74 -4.561 7.042 16.518 611 HG23 THR 74 HG23 THR 74 -3.337 8.153 15.904 612 H VAL 75 H VAL 75 0.569 4.746 16.806 613 HA VAL 75 HA VAL 75 0.430 3.142 14.327 614 HB VAL 75 HB VAL 75 2.928 3.429 16.020 615 HG11 VAL 75 HG11 VAL 75 2.783 1.361 14.736 616 HG12 VAL 75 HG12 VAL 75 4.034 2.411 14.070 617 HG13 VAL 75 HG13 VAL 75 2.472 2.278 13.262 618 HG21 VAL 75 HG21 VAL 75 2.400 5.609 15.014 619 HG22 VAL 75 HG22 VAL 75 2.298 4.850 13.423 620 HG23 VAL 75 HG23 VAL 75 3.837 4.893 14.282 621 H GLU 76 H GLU 76 -0.728 1.390 14.933 622 HA GLU 76 HA GLU 76 -0.123 0.111 17.533 623 HB2 GLU 76 HB2 GLU 76 -2.881 0.576 16.366 624 HB3 GLU 76 HB3 GLU 76 -2.530 -0.275 17.863 625 HG2 GLU 76 HG2 GLU 76 -1.675 1.768 18.859 626 HG3 GLU 76 HG3 GLU 76 -1.931 2.637 17.347 627 H ARG 77 H ARG 77 -1.018 -2.134 17.699 628 HA ARG 77 HA ARG 77 -0.649 -3.565 15.171 629 HB2 ARG 77 HB2 ARG 77 0.638 -4.417 17.046 630 HB3 ARG 77 HB3 ARG 77 -0.821 -4.578 18.021 631 HG2 ARG 77 HG2 ARG 77 -1.668 -6.252 16.391 632 HG3 ARG 77 HG3 ARG 77 -0.134 -6.141 15.532 633 HD2 ARG 77 HD2 ARG 77 1.048 -6.928 17.513 634 HD3 ARG 77 HD3 ARG 77 -0.474 -7.001 18.404 635 HE ARG 77 HE ARG 77 -0.585 -8.561 16.026 636 HH11 ARG 77 HH11 ARG 77 0.574 -8.586 19.271 637 HH12 ARG 77 HH12 ARG 77 0.621 -10.311 19.349 638 HH21 ARG 77 HH21 ARG 77 -0.549 -10.772 16.156 639 HH22 ARG 77 HH22 ARG 77 -0.025 -11.534 17.622 640 H LEU 78 H LEU 78 -2.209 -4.697 14.156 641 HA LEU 78 HA LEU 78 -4.939 -4.633 15.163 642 HB2 LEU 78 HB2 LEU 78 -3.760 -5.716 12.601 643 HB3 LEU 78 HB3 LEU 78 -5.474 -5.709 12.976 644 HG LEU 78 HG LEU 78 -3.770 -3.217 12.736 645 HD11 LEU 78 HD11 LEU 78 -4.905 -2.849 10.600 646 HD12 LEU 78 HD12 LEU 78 -5.703 -4.417 10.749 647 HD13 LEU 78 HD13 LEU 78 -3.948 -4.330 10.576 648 HD21 LEU 78 HD21 LEU 78 -5.693 -2.941 14.210 649 HD22 LEU 78 HD22 LEU 78 -6.761 -3.579 12.960 650 HD23 LEU 78 HD23 LEU 78 -5.924 -2.047 12.708 651 H SER 79 H SER 79 -5.241 -6.075 16.776 652 HA SER 79 HA SER 79 -3.935 -8.640 16.859 653 HB2 SER 79 HB2 SER 79 -5.301 -8.962 18.930 654 HB3 SER 79 HB3 SER 79 -4.373 -7.460 18.935 655 HG SER 79 HG SER 79 -6.617 -7.258 19.601 656 H ASN 80 H ASN 80 -7.412 -7.791 16.916 657 HA ASN 80 HA ASN 80 -8.178 -10.428 16.070 658 HB2 ASN 80 HB2 ASN 80 -9.780 -7.884 16.403 659 HB3 ASN 80 HB3 ASN 80 -10.485 -9.436 15.959 660 HD21 ASN 80 HD21 ASN 80 -10.395 -11.146 17.464 661 HD22 ASN 80 HD22 ASN 80 -10.241 -10.826 19.156 662 H LEU 81 H LEU 81 -7.631 -11.028 14.065 663 HA LEU 81 HA LEU 81 -7.774 -9.119 11.859 664 HB2 LEU 81 HB2 LEU 81 -6.765 -11.968 11.886 665 HB3 LEU 81 HB3 LEU 81 -6.594 -10.824 10.567 666 HG LEU 81 HG LEU 81 -5.286 -10.653 13.285 667 HD11 LEU 81 HD11 LEU 81 -4.133 -11.073 10.526 668 HD12 LEU 81 HD12 LEU 81 -4.262 -12.284 11.804 669 HD13 LEU 81 HD13 LEU 81 -3.205 -10.890 12.016 670 HD21 LEU 81 HD21 LEU 81 -5.180 -8.710 10.974 671 HD22 LEU 81 HD22 LEU 81 -4.154 -8.644 12.406 672 HD23 LEU 81 HD23 LEU 81 -5.896 -8.420 12.560 673 H GLU 82 H GLU 82 -8.905 -9.505 9.937 674 HA GLU 82 HA GLU 82 -11.242 -11.286 10.207 675 HB2 GLU 82 HB2 GLU 82 -12.327 -9.714 8.587 676 HB3 GLU 82 HB3 GLU 82 -11.890 -8.974 10.122 677 HG2 GLU 82 HG2 GLU 82 -9.850 -8.056 9.058 678 HG3 GLU 82 HG3 GLU 82 -10.392 -8.715 7.516 679 H HIS 83 H HIS 83 -8.719 -12.265 9.228 680 HA HIS 83 HA HIS 83 -8.919 -12.325 6.314 681 HB2 HIS 83 HB2 HIS 83 -6.863 -13.455 8.221 682 HB3 HIS 83 HB3 HIS 83 -6.789 -13.670 6.477 683 HD1 HIS 83 HD1 HIS 83 -5.369 -12.006 5.335 684 HD2 HIS 83 HD2 HIS 83 -6.975 -10.501 8.862 685 HE1 HIS 83 HE1 HIS 83 -4.407 -9.700 5.588 686 HE2 HIS 83 HE2 HIS 83 -5.524 -8.753 7.632 687 H HIS 84 H HIS 84 -10.947 -13.481 6.252 688 HA HIS 84 HA HIS 84 -10.550 -16.397 6.416 689 HB2 HIS 84 HB2 HIS 84 -13.056 -14.938 7.310 690 HB3 HIS 84 HB3 HIS 84 -12.853 -16.686 7.250 691 HD1 HIS 84 HD1 HIS 84 -11.232 -17.741 9.042 692 HD2 HIS 84 HD2 HIS 84 -12.021 -13.696 9.564 693 HE1 HIS 84 HE1 HIS 84 -10.490 -17.209 11.374 694 HE2 HIS 84 HE2 HIS 84 -11.148 -14.810 11.729 695 H HIS 85 H HIS 85 -10.959 -17.355 4.522 696 HA HIS 85 HA HIS 85 -11.792 -16.031 2.209 697 HB2 HIS 85 HB2 HIS 85 -11.672 -18.959 2.919 698 HB3 HIS 85 HB3 HIS 85 -12.243 -18.427 1.343 699 HD1 HIS 85 HD1 HIS 85 -10.513 -17.527 -0.309 700 HD2 HIS 85 HD2 HIS 85 -8.899 -18.647 3.351 701 HE1 HIS 85 HE1 HIS 85 -8.029 -17.565 -0.655 702 HE2 HIS 85 HE2 HIS 85 -7.106 -18.472 1.497 703 H HIS 86 H HIS 86 -13.730 -15.133 1.828 704 HA HIS 86 HA HIS 86 -16.142 -15.952 3.093 705 HB2 HIS 86 HB2 HIS 86 -15.752 -13.632 2.319 706 HB3 HIS 86 HB3 HIS 86 -15.768 -14.189 0.650 707 HD1 HIS 86 HD1 HIS 86 -18.026 -13.476 3.550 708 HD2 HIS 86 HD2 HIS 86 -18.328 -14.720 -0.404 709 HE1 HIS 86 HE1 HIS 86 -20.458 -13.295 2.970 710 HE2 HIS 86 HE2 HIS 86 -20.639 -14.304 0.680 711 H HIS 87 H HIS 87 -16.060 -18.236 2.575 712 HA HIS 87 HA HIS 87 -16.683 -19.010 -0.164 713 HB2 HIS 87 HB2 HIS 87 -16.785 -21.355 0.949 714 HB3 HIS 87 HB3 HIS 87 -15.228 -20.553 0.796 715 HD1 HIS 87 HD1 HIS 87 -13.897 -21.037 2.804 716 HD2 HIS 87 HD2 HIS 87 -17.894 -20.409 3.756 717 HE1 HIS 87 HE1 HIS 87 -14.025 -21.198 5.307 718 HE2 HIS 87 HE2 HIS 87 -16.442 -20.788 5.861 719 H HIS 88 H HIS 88 -18.504 -17.712 2.167 720 HA HIS 88 HA HIS 88 -20.956 -18.808 1.036 721 HB2 HIS 88 HB2 HIS 88 -20.051 -19.394 3.766 722 HB3 HIS 88 HB3 HIS 88 -21.654 -18.672 3.730 723 HD1 HIS 88 HD1 HIS 88 -19.954 -21.419 1.684 724 HD2 HIS 88 HD2 HIS 88 -23.487 -20.643 3.720 725 HE1 HIS 88 HE1 HIS 88 -21.356 -23.470 1.390 726 HE2 HIS 88 HE2 HIS 88 -23.553 -22.903 2.467 727 H1 MET 1 H1 MET 1 -10.705 16.930 -17.718 728 H2 MET 1 H2 MET 1 -9.038 16.750 -17.504 729 H3 MET 1 H3 MET 1 -9.639 17.342 -18.967 730 HA MET 1 HA MET 1 -8.718 19.127 -17.670 731 HB2 MET 1 HB2 MET 1 -10.660 19.574 -19.121 732 HB3 MET 1 HB3 MET 1 -11.745 19.208 -17.789 733 HG2 MET 1 HG2 MET 1 -11.517 21.611 -18.115 734 HG3 MET 1 HG3 MET 1 -10.896 21.116 -16.541 735 HE1 MET 1 HE1 MET 1 -8.247 22.270 -20.148 736 HE2 MET 1 HE2 MET 1 -10.009 22.368 -20.148 737 HE3 MET 1 HE3 MET 1 -9.212 20.795 -20.113 738 H THR 2 H THR 2 -11.727 18.125 -15.989 739 HA THR 2 HA THR 2 -10.780 19.220 -13.483 740 HB THR 2 HB THR 2 -13.263 17.567 -14.046 741 HG1 THR 2 HG1 THR 2 -14.307 19.596 -14.131 742 HG21 THR 2 HG21 THR 2 -14.111 18.526 -11.942 743 HG22 THR 2 HG22 THR 2 -12.557 19.316 -11.676 744 HG23 THR 2 HG23 THR 2 -12.664 17.554 -11.668 745 H ASP 3 H ASP 3 -9.964 18.119 -11.740 746 HA ASP 3 HA ASP 3 -8.921 15.504 -12.081 747 HB2 ASP 3 HB2 ASP 3 -9.242 17.160 -9.568 748 HB3 ASP 3 HB3 ASP 3 -8.346 15.649 -9.650 749 H PHE 4 H PHE 4 -9.957 13.639 -11.958 750 HA PHE 4 HA PHE 4 -12.327 13.386 -10.225 751 HB2 PHE 4 HB2 PHE 4 -13.142 11.658 -11.778 752 HB3 PHE 4 HB3 PHE 4 -12.905 13.189 -12.610 753 HD1 PHE 4 HD1 PHE 4 -11.670 9.752 -12.223 754 HD2 PHE 4 HD2 PHE 4 -11.191 13.447 -14.293 755 HE1 PHE 4 HE1 PHE 4 -10.218 8.640 -13.868 756 HE2 PHE 4 HE2 PHE 4 -9.744 12.333 -15.943 757 HZ PHE 4 HZ PHE 4 -9.244 9.932 -15.723 758 H LEU 5 H LEU 5 -12.608 11.296 -9.222 759 HA LEU 5 HA LEU 5 -10.147 10.189 -8.253 760 HB2 LEU 5 HB2 LEU 5 -12.120 10.428 -6.820 761 HB3 LEU 5 HB3 LEU 5 -13.010 9.339 -7.861 762 HG LEU 5 HG LEU 5 -11.582 7.476 -7.195 763 HD11 LEU 5 HD11 LEU 5 -10.128 9.496 -5.478 764 HD12 LEU 5 HD12 LEU 5 -9.478 8.669 -6.894 765 HD13 LEU 5 HD13 LEU 5 -9.880 7.749 -5.444 766 HD21 LEU 5 HD21 LEU 5 -12.237 7.321 -4.849 767 HD22 LEU 5 HD22 LEU 5 -13.544 7.982 -5.831 768 HD23 LEU 5 HD23 LEU 5 -12.570 9.053 -4.821 769 H ALA 6 H ALA 6 -8.996 9.030 -9.716 770 HA ALA 6 HA ALA 6 -10.332 7.058 -11.419 771 HB1 ALA 6 HB1 ALA 6 -8.208 6.885 -12.590 772 HB2 ALA 6 HB2 ALA 6 -7.438 7.922 -11.387 773 HB3 ALA 6 HB3 ALA 6 -8.691 8.576 -12.443 774 H GLY 7 H GLY 7 -9.471 4.870 -11.576 775 HA2 GLY 7 HA2 GLY 7 -8.040 3.932 -9.174 776 HA3 GLY 7 HA3 GLY 7 -9.560 3.178 -9.633 777 H ILE 8 H ILE 8 -6.942 1.947 -9.394 778 HA ILE 8 HA ILE 8 -6.790 0.772 -12.092 779 HB ILE 8 HB ILE 8 -4.348 1.431 -10.414 780 HG12 ILE 8 HG12 ILE 8 -5.283 2.698 -13.008 781 HG13 ILE 8 HG13 ILE 8 -5.355 3.460 -11.424 782 HG21 ILE 8 HG21 ILE 8 -4.569 0.249 -13.190 783 HG22 ILE 8 HG22 ILE 8 -4.081 -0.609 -11.726 784 HG23 ILE 8 HG23 ILE 8 -3.066 0.680 -12.372 785 HD11 ILE 8 HD11 ILE 8 -2.907 3.373 -11.291 786 HD12 ILE 8 HD12 ILE 8 -3.476 4.294 -12.683 787 HD13 ILE 8 HD13 ILE 8 -2.859 2.658 -12.903 788 H ARG 9 H ARG 9 -6.544 -1.467 -12.094 789 HA ARG 9 HA ARG 9 -6.101 -2.757 -9.472 790 HB2 ARG 9 HB2 ARG 9 -8.399 -3.098 -10.405 791 HB3 ARG 9 HB3 ARG 9 -7.678 -3.915 -11.785 792 HG2 ARG 9 HG2 ARG 9 -6.778 -5.642 -10.335 793 HG3 ARG 9 HG3 ARG 9 -7.396 -4.799 -8.914 794 HD2 ARG 9 HD2 ARG 9 -9.700 -5.070 -9.845 795 HD3 ARG 9 HD3 ARG 9 -9.007 -6.067 -11.126 796 HE ARG 9 HE ARG 9 -8.126 -7.226 -8.818 797 HH11 ARG 9 HH11 ARG 9 -11.227 -6.435 -10.110 798 HH12 ARG 9 HH12 ARG 9 -12.028 -7.702 -9.246 799 HH21 ARG 9 HH21 ARG 9 -9.172 -8.868 -7.735 800 HH22 ARG 9 HH22 ARG 9 -10.884 -9.056 -7.913 801 H ILE 10 H ILE 10 -4.308 -3.901 -9.306 802 HA ILE 10 HA ILE 10 -2.896 -4.786 -11.755 803 HB ILE 10 HB ILE 10 -1.728 -4.262 -9.006 804 HG12 ILE 10 HG12 ILE 10 -1.556 -2.480 -11.452 805 HG13 ILE 10 HG13 ILE 10 -2.638 -2.194 -10.093 806 HG21 ILE 10 HG21 ILE 10 -0.400 -4.716 -11.679 807 HG22 ILE 10 HG22 ILE 10 -0.421 -5.833 -10.313 808 HG23 ILE 10 HG23 ILE 10 0.432 -4.296 -10.182 809 HD11 ILE 10 HD11 ILE 10 -0.676 -0.812 -9.907 810 HD12 ILE 10 HD12 ILE 10 0.371 -2.226 -10.003 811 HD13 ILE 10 HD13 ILE 10 -0.687 -2.005 -8.609 812 H VAL 11 H VAL 11 -3.107 -6.988 -12.047 813 HA VAL 11 HA VAL 11 -2.992 -8.681 -9.624 814 HB VAL 11 HB VAL 11 -4.281 -9.307 -12.289 815 HG11 VAL 11 HG11 VAL 11 -4.995 -11.421 -11.253 816 HG12 VAL 11 HG12 VAL 11 -4.011 -11.048 -9.837 817 HG13 VAL 11 HG13 VAL 11 -3.241 -11.316 -11.402 818 HG21 VAL 11 HG21 VAL 11 -5.611 -7.805 -10.916 819 HG22 VAL 11 HG22 VAL 11 -5.454 -8.890 -9.533 820 HG23 VAL 11 HG23 VAL 11 -6.360 -9.403 -10.958 821 H GLY 12 H GLY 12 -1.144 -9.659 -9.320 822 HA2 GLY 12 HA2 GLY 12 0.373 -10.690 -11.622 823 HA3 GLY 12 HA3 GLY 12 1.178 -9.615 -10.489 824 H GLU 13 H GLU 13 2.227 -12.058 -10.922 825 HA GLU 13 HA GLU 13 1.323 -14.161 -9.298 826 HB2 GLU 13 HB2 GLU 13 3.686 -15.009 -9.550 827 HB3 GLU 13 HB3 GLU 13 2.868 -14.602 -11.057 828 HG2 GLU 13 HG2 GLU 13 4.037 -12.407 -11.038 829 HG3 GLU 13 HG3 GLU 13 4.933 -12.942 -9.618 830 H ASP 14 H ASP 14 1.255 -14.384 -7.163 831 HA ASP 14 HA ASP 14 2.316 -12.451 -5.370 832 HB2 ASP 14 HB2 ASP 14 0.302 -13.475 -4.702 833 HB3 ASP 14 HB3 ASP 14 0.918 -15.093 -5.009 834 H LYS 15 H LYS 15 4.570 -12.417 -5.689 835 HA LYS 15 HA LYS 15 6.000 -14.656 -4.448 836 HB2 LYS 15 HB2 LYS 15 6.770 -12.624 -6.493 837 HB3 LYS 15 HB3 LYS 15 8.024 -13.311 -5.468 838 HG2 LYS 15 HG2 LYS 15 7.448 -15.536 -6.172 839 HG3 LYS 15 HG3 LYS 15 6.096 -14.917 -7.128 840 HD2 LYS 15 HD2 LYS 15 7.617 -13.755 -8.606 841 HD3 LYS 15 HD3 LYS 15 8.997 -14.211 -7.598 842 HE2 LYS 15 HE2 LYS 15 8.903 -15.673 -9.503 843 HE3 LYS 15 HE3 LYS 15 8.485 -16.582 -8.052 844 HZ1 LYS 15 HZ1 LYS 15 6.612 -15.557 -10.106 845 HZ2 LYS 15 HZ2 LYS 15 6.125 -16.265 -8.651 846 HZ3 LYS 15 HZ3 LYS 15 6.981 -17.175 -9.787 847 H ASN 16 H ASN 16 8.020 -14.016 -3.334 848 HA ASN 16 HA ASN 16 7.297 -12.522 -1.008 849 HB2 ASN 16 HB2 ASN 16 9.529 -13.318 -0.209 850 HB3 ASN 16 HB3 ASN 16 8.490 -14.599 -0.832 851 HD21 ASN 16 HD21 ASN 16 8.999 -15.586 -2.792 852 HD22 ASN 16 HD22 ASN 16 10.567 -15.440 -3.501 853 H GLY 17 H GLY 17 7.403 -10.746 -3.133 854 HA2 GLY 17 HA2 GLY 17 8.964 -8.622 -2.203 855 HA3 GLY 17 HA3 GLY 17 9.846 -9.387 -3.519 856 H MET 18 H MET 18 7.336 -10.155 -4.881 857 HA MET 18 HA MET 18 6.987 -8.013 -6.630 858 HB2 MET 18 HB2 MET 18 5.343 -10.455 -5.999 859 HB3 MET 18 HB3 MET 18 4.745 -9.270 -7.147 860 HG2 MET 18 HG2 MET 18 7.399 -10.673 -7.389 861 HG3 MET 18 HG3 MET 18 5.910 -11.196 -8.181 862 HE1 MET 18 HE1 MET 18 5.154 -7.984 -10.394 863 HE2 MET 18 HE2 MET 18 4.730 -8.117 -8.690 864 HE3 MET 18 HE3 MET 18 4.495 -9.495 -9.767 865 H THR 19 H THR 19 4.813 -8.998 -3.959 866 HA THR 19 HA THR 19 2.918 -6.949 -4.295 867 HB THR 19 HB THR 19 2.264 -7.377 -1.948 868 HG1 THR 19 HG1 THR 19 3.475 -8.843 -0.716 869 HG21 THR 19 HG21 THR 19 1.461 -8.901 -3.693 870 HG22 THR 19 HG22 THR 19 1.726 -9.761 -2.176 871 HG23 THR 19 HG23 THR 19 2.898 -9.904 -3.487 872 H ASN 20 H ASN 20 6.023 -6.968 -2.665 873 HA ASN 20 HA ASN 20 5.670 -4.483 -1.281 874 HB2 ASN 20 HB2 ASN 20 8.164 -6.066 -1.968 875 HB3 ASN 20 HB3 ASN 20 8.141 -4.651 -0.919 876 HD21 ASN 20 HD21 ASN 20 7.415 -4.847 1.147 877 HD22 ASN 20 HD22 ASN 20 7.020 -6.359 1.877 878 H GLN 21 H GLN 21 7.387 -5.466 -4.237 879 HA GLN 21 HA GLN 21 8.420 -2.916 -4.840 880 HB2 GLN 21 HB2 GLN 21 9.072 -3.806 -6.947 881 HB3 GLN 21 HB3 GLN 21 9.286 -5.074 -5.759 882 HG2 GLN 21 HG2 GLN 21 7.229 -6.139 -6.499 883 HG3 GLN 21 HG3 GLN 21 6.955 -4.837 -7.653 884 HE21 GLN 21 HE21 GLN 21 8.924 -7.604 -6.893 885 HE22 GLN 21 HE22 GLN 21 9.617 -7.780 -8.459 886 H ILE 22 H ILE 22 5.385 -4.483 -5.675 887 HA ILE 22 HA ILE 22 4.627 -2.790 -7.787 888 HB ILE 22 HB ILE 22 3.095 -4.601 -5.944 889 HG12 ILE 22 HG12 ILE 22 4.418 -5.629 -7.714 890 HG13 ILE 22 HG13 ILE 22 2.704 -5.828 -8.064 891 HG21 ILE 22 HG21 ILE 22 1.857 -2.882 -8.095 892 HG22 ILE 22 HG22 ILE 22 1.559 -2.769 -6.360 893 HG23 ILE 22 HG23 ILE 22 1.053 -4.206 -7.248 894 HD11 ILE 22 HD11 ILE 22 4.544 -3.797 -9.310 895 HD12 ILE 22 HD12 ILE 22 2.823 -3.971 -9.653 896 HD13 ILE 22 HD13 ILE 22 3.941 -5.269 -10.067 897 H THR 23 H THR 23 3.568 -2.650 -4.343 898 HA THR 23 HA THR 23 2.241 -0.156 -4.747 899 HB THR 23 HB THR 23 3.195 -1.097 -2.035 900 HG1 THR 23 HG1 THR 23 1.165 -2.166 -3.689 901 HG21 THR 23 HG21 THR 23 2.134 1.110 -2.161 902 HG22 THR 23 HG22 THR 23 1.122 -0.034 -1.282 903 HG23 THR 23 HG23 THR 23 0.726 0.391 -2.946 904 H GLY 24 H GLY 24 5.500 -1.085 -3.889 905 HA2 GLY 24 HA2 GLY 24 6.549 1.375 -3.048 906 HA3 GLY 24 HA3 GLY 24 7.450 0.127 -3.895 907 H VAL 25 H VAL 25 6.347 0.071 -6.376 908 HA VAL 25 HA VAL 25 7.357 2.323 -7.702 909 HB VAL 25 HB VAL 25 5.315 0.313 -8.697 910 HG11 VAL 25 HG11 VAL 25 5.992 1.014 -10.961 911 HG12 VAL 25 HG12 VAL 25 7.002 2.280 -10.263 912 HG13 VAL 25 HG13 VAL 25 5.250 2.337 -10.061 913 HG21 VAL 25 HG21 VAL 25 7.250 -0.757 -9.788 914 HG22 VAL 25 HG22 VAL 25 7.417 -0.730 -8.033 915 HG23 VAL 25 HG23 VAL 25 8.321 0.418 -9.021 916 H ILE 26 H ILE 26 4.073 1.559 -6.642 917 HA ILE 26 HA ILE 26 2.704 3.691 -7.838 918 HB ILE 26 HB ILE 26 2.123 2.243 -5.249 919 HG12 ILE 26 HG12 ILE 26 0.976 1.935 -8.039 920 HG13 ILE 26 HG13 ILE 26 2.115 0.832 -7.275 921 HG21 ILE 26 HG21 ILE 26 -0.159 3.125 -5.423 922 HG22 ILE 26 HG22 ILE 26 0.320 4.092 -6.815 923 HG23 ILE 26 HG23 ILE 26 1.019 4.423 -5.229 924 HD11 ILE 26 HD11 ILE 26 -0.173 -0.017 -7.243 925 HD12 ILE 26 HD12 ILE 26 -0.684 1.389 -6.309 926 HD13 ILE 26 HD13 ILE 26 0.455 0.234 -5.615 927 H SER 27 H SER 27 4.393 3.561 -4.702 928 HA SER 27 HA SER 27 3.648 6.161 -3.840 929 HB2 SER 27 HB2 SER 27 5.293 5.957 -2.133 930 HB3 SER 27 HB3 SER 27 4.669 4.331 -2.394 931 HG SER 27 HG SER 27 6.518 3.857 -3.596 932 H LYS 28 H LYS 28 5.933 5.094 -6.182 933 HA LYS 28 HA LYS 28 7.613 7.422 -6.115 934 HB2 LYS 28 HB2 LYS 28 7.318 5.350 -8.302 935 HB3 LYS 28 HB3 LYS 28 8.630 6.509 -8.134 936 HG2 LYS 28 HG2 LYS 28 9.229 5.439 -5.967 937 HG3 LYS 28 HG3 LYS 28 7.991 4.220 -6.277 938 HD2 LYS 28 HD2 LYS 28 10.145 3.345 -6.931 939 HD3 LYS 28 HD3 LYS 28 9.172 3.615 -8.378 940 HE2 LYS 28 HE2 LYS 28 11.466 4.368 -8.722 941 HE3 LYS 28 HE3 LYS 28 10.348 5.731 -8.770 942 HZ1 LYS 28 HZ1 LYS 28 10.961 6.285 -6.513 943 HZ2 LYS 28 HZ2 LYS 28 12.344 6.223 -7.483 944 HZ3 LYS 28 HZ3 LYS 28 11.997 4.950 -6.426 945 H PHE 29 H PHE 29 4.484 6.942 -7.269 946 HA PHE 29 HA PHE 29 4.542 8.538 -9.622 947 HB2 PHE 29 HB2 PHE 29 2.244 7.863 -7.770 948 HB3 PHE 29 HB3 PHE 29 2.060 8.687 -9.312 949 HD1 PHE 29 HD1 PHE 29 4.399 6.813 -10.513 950 HD2 PHE 29 HD2 PHE 29 0.661 6.160 -8.571 951 HE1 PHE 29 HE1 PHE 29 4.187 4.644 -11.645 952 HE2 PHE 29 HE2 PHE 29 0.452 3.987 -9.703 953 HZ PHE 29 HZ PHE 29 2.216 3.228 -11.244 954 H ASP 30 H ASP 30 2.864 10.502 -9.621 955 HA ASP 30 HA ASP 30 3.977 12.482 -7.739 956 HB2 ASP 30 HB2 ASP 30 3.491 14.137 -9.515 957 HB3 ASP 30 HB3 ASP 30 4.554 12.855 -10.090 958 H THR 31 H THR 31 1.277 10.727 -7.890 959 HA THR 31 HA THR 31 -0.611 12.965 -7.508 960 HB THR 31 HB THR 31 -1.301 11.509 -9.304 961 HG1 THR 31 HG1 THR 31 -3.315 11.580 -8.637 962 HG21 THR 31 HG21 THR 31 -1.235 9.255 -7.286 963 HG22 THR 31 HG22 THR 31 -0.101 9.476 -8.620 964 HG23 THR 31 HG23 THR 31 -1.799 9.138 -8.952 965 H ASN 32 H ASN 32 -2.474 12.461 -5.997 966 HA ASN 32 HA ASN 32 -1.312 11.647 -3.434 967 HB2 ASN 32 HB2 ASN 32 -3.794 13.240 -4.104 968 HB3 ASN 32 HB3 ASN 32 -3.319 12.804 -2.464 969 HD21 ASN 32 HD21 ASN 32 -1.502 13.760 -1.559 970 HD22 ASN 32 HD22 ASN 32 -0.808 15.200 -2.213 971 H ILE 33 H ILE 33 -1.777 9.760 -2.544 972 HA ILE 33 HA ILE 33 -3.751 7.992 -3.645 973 HB ILE 33 HB ILE 33 -1.970 7.729 -1.214 974 HG12 ILE 33 HG12 ILE 33 -1.774 6.564 -4.011 975 HG13 ILE 33 HG13 ILE 33 -0.738 7.814 -3.329 976 HG21 ILE 33 HG21 ILE 33 -3.946 6.334 -0.921 977 HG22 ILE 33 HG22 ILE 33 -2.538 5.326 -1.253 978 HG23 ILE 33 HG23 ILE 33 -3.720 5.636 -2.525 979 HD11 ILE 33 HD11 ILE 33 0.099 6.198 -1.684 980 HD12 ILE 33 HD12 ILE 33 0.398 5.687 -3.345 981 HD13 ILE 33 HD13 ILE 33 -0.907 4.948 -2.418 982 H ARG 34 H ARG 34 -5.832 7.825 -3.072 983 HA ARG 34 HA ARG 34 -6.676 8.872 -0.448 984 HB2 ARG 34 HB2 ARG 34 -8.216 8.371 -2.998 985 HB3 ARG 34 HB3 ARG 34 -9.012 8.702 -1.463 986 HG2 ARG 34 HG2 ARG 34 -7.077 10.530 -2.891 987 HG3 ARG 34 HG3 ARG 34 -8.830 10.729 -2.795 988 HD2 ARG 34 HD2 ARG 34 -8.677 10.959 -0.362 989 HD3 ARG 34 HD3 ARG 34 -6.931 10.725 -0.442 990 HE ARG 34 HE ARG 34 -7.808 12.926 -2.046 991 HH11 ARG 34 HH11 ARG 34 -6.974 11.957 1.153 992 HH12 ARG 34 HH12 ARG 34 -6.582 13.561 1.659 993 HH21 ARG 34 HH21 ARG 34 -7.305 14.983 -1.377 994 HH22 ARG 34 HH22 ARG 34 -6.770 15.248 0.246 995 H THR 35 H THR 35 -6.550 5.998 -2.413 996 HA THR 35 HA THR 35 -6.950 4.359 -0.065 997 HB THR 35 HB THR 35 -8.860 4.074 -2.404 998 HG1 THR 35 HG1 THR 35 -9.044 5.269 0.074 999 HG21 THR 35 HG21 THR 35 -8.549 2.361 0.071 1000 HG22 THR 35 HG22 THR 35 -8.206 1.873 -1.589 1001 HG23 THR 35 HG23 THR 35 -9.862 2.228 -1.098 1002 H ILE 36 H ILE 36 -5.648 2.611 -0.164 1003 HA ILE 36 HA ILE 36 -5.042 1.460 -2.809 1004 HB ILE 36 HB ILE 36 -3.045 2.737 -2.023 1005 HG12 ILE 36 HG12 ILE 36 -1.402 0.883 -2.315 1006 HG13 ILE 36 HG13 ILE 36 -2.710 -0.279 -2.124 1007 HG21 ILE 36 HG21 ILE 36 -1.724 1.865 -0.141 1008 HG22 ILE 36 HG22 ILE 36 -3.026 0.732 0.232 1009 HG23 ILE 36 HG23 ILE 36 -3.300 2.470 0.380 1010 HD11 ILE 36 HD11 ILE 36 -2.460 1.757 -4.326 1011 HD12 ILE 36 HD12 ILE 36 -3.770 0.589 -4.142 1012 HD13 ILE 36 HD13 ILE 36 -2.126 0.031 -4.454 1013 H VAL 37 H VAL 37 -5.324 -0.679 -2.935 1014 HA VAL 37 HA VAL 37 -5.548 -2.256 -0.443 1015 HB VAL 37 HB VAL 37 -7.255 -2.573 -2.934 1016 HG11 VAL 37 HG11 VAL 37 -7.304 -4.133 -0.345 1017 HG12 VAL 37 HG12 VAL 37 -6.768 -4.737 -1.913 1018 HG13 VAL 37 HG13 VAL 37 -8.459 -4.303 -1.668 1019 HG21 VAL 37 HG21 VAL 37 -7.930 -0.640 -1.599 1020 HG22 VAL 37 HG22 VAL 37 -8.013 -1.650 -0.155 1021 HG23 VAL 37 HG23 VAL 37 -9.134 -1.924 -1.489 1022 H LEU 38 H LEU 38 -4.495 -4.194 -0.430 1023 HA LEU 38 HA LEU 38 -3.806 -5.464 -2.972 1024 HB2 LEU 38 HB2 LEU 38 -1.843 -4.078 -2.244 1025 HB3 LEU 38 HB3 LEU 38 -1.743 -5.053 -0.794 1026 HG LEU 38 HG LEU 38 -1.522 -6.304 -3.533 1027 HD11 LEU 38 HD11 LEU 38 0.734 -5.160 -1.881 1028 HD12 LEU 38 HD12 LEU 38 0.154 -4.533 -3.425 1029 HD13 LEU 38 HD13 LEU 38 0.909 -6.125 -3.351 1030 HD21 LEU 38 HD21 LEU 38 -0.247 -8.015 -2.308 1031 HD22 LEU 38 HD22 LEU 38 -1.881 -7.837 -1.672 1032 HD23 LEU 38 HD23 LEU 38 -0.517 -7.133 -0.804 1033 H ASN 39 H ASN 39 -4.695 -7.421 -2.839 1034 HA ASN 39 HA ASN 39 -4.307 -8.975 -0.372 1035 HB2 ASN 39 HB2 ASN 39 -6.668 -9.926 -0.782 1036 HB3 ASN 39 HB3 ASN 39 -6.540 -8.319 -0.078 1037 HD21 ASN 39 HD21 ASN 39 -8.731 -9.541 -1.576 1038 HD22 ASN 39 HD22 ASN 39 -9.026 -8.487 -2.911 1039 H ALA 40 H ALA 40 -3.514 -10.940 -0.694 1040 HA ALA 40 HA ALA 40 -3.329 -11.951 -3.458 1041 HB1 ALA 40 HB1 ALA 40 -1.419 -13.248 -2.687 1042 HB2 ALA 40 HB2 ALA 40 -1.687 -12.701 -1.031 1043 HB3 ALA 40 HB3 ALA 40 -1.213 -11.545 -2.275 1044 H LYS 41 H LYS 41 -4.219 -13.805 -4.066 1045 HA LYS 41 HA LYS 41 -4.856 -15.918 -2.188 1046 HB2 LYS 41 HB2 LYS 41 -7.190 -16.120 -2.817 1047 HB3 LYS 41 HB3 LYS 41 -6.898 -14.519 -2.162 1048 HG2 LYS 41 HG2 LYS 41 -7.012 -15.112 -5.116 1049 HG3 LYS 41 HG3 LYS 41 -8.409 -14.611 -4.161 1050 HD2 LYS 41 HD2 LYS 41 -7.236 -12.526 -3.563 1051 HD3 LYS 41 HD3 LYS 41 -5.856 -13.029 -4.542 1052 HE2 LYS 41 HE2 LYS 41 -7.228 -11.452 -5.777 1053 HE3 LYS 41 HE3 LYS 41 -7.302 -13.040 -6.538 1054 HZ1 LYS 41 HZ1 LYS 41 -9.366 -11.896 -4.729 1055 HZ2 LYS 41 HZ2 LYS 41 -9.441 -13.407 -5.485 1056 HZ3 LYS 41 HZ3 LYS 41 -9.477 -11.998 -6.412 1057 H ASP 42 H ASP 42 -5.014 -17.948 -3.162 1058 HA ASP 42 HA ASP 42 -4.709 -19.588 -4.699 1059 HB2 ASP 42 HB2 ASP 42 -6.660 -18.425 -5.777 1060 HB3 ASP 42 HB3 ASP 42 -5.517 -17.534 -6.774 1061 H GLY 43 H GLY 43 -2.537 -17.545 -4.088 1062 HA2 GLY 43 HA2 GLY 43 -0.257 -17.608 -4.609 1063 HA3 GLY 43 HA3 GLY 43 -0.629 -18.535 -6.053 1064 H ILE 44 H ILE 44 -2.628 -15.865 -5.912 1065 HA ILE 44 HA ILE 44 -0.768 -14.168 -7.470 1066 HB ILE 44 HB ILE 44 -3.737 -14.142 -7.978 1067 HG12 ILE 44 HG12 ILE 44 -1.763 -16.028 -9.292 1068 HG13 ILE 44 HG13 ILE 44 -3.085 -16.490 -8.221 1069 HG21 ILE 44 HG21 ILE 44 -2.359 -12.352 -8.916 1070 HG22 ILE 44 HG22 ILE 44 -3.049 -13.355 -10.190 1071 HG23 ILE 44 HG23 ILE 44 -1.354 -13.544 -9.741 1072 HD11 ILE 44 HD11 ILE 44 -4.692 -15.651 -9.851 1073 HD12 ILE 44 HD12 ILE 44 -3.650 -16.893 -10.545 1074 HD13 ILE 44 HD13 ILE 44 -3.368 -15.192 -10.923 1075 H PHE 45 H PHE 45 -1.373 -11.810 -7.377 1076 HA PHE 45 HA PHE 45 -3.028 -11.146 -5.026 1077 HB2 PHE 45 HB2 PHE 45 -1.464 -9.530 -4.205 1078 HB3 PHE 45 HB3 PHE 45 -0.575 -11.025 -4.457 1079 HD1 PHE 45 HD1 PHE 45 1.103 -11.199 -6.206 1080 HD2 PHE 45 HD2 PHE 45 -1.057 -7.576 -5.595 1081 HE1 PHE 45 HE1 PHE 45 2.735 -9.990 -7.591 1082 HE2 PHE 45 HE2 PHE 45 0.573 -6.367 -6.984 1083 HZ PHE 45 HZ PHE 45 2.467 -7.578 -7.982 1084 H THR 46 H THR 46 -4.221 -9.257 -5.137 1085 HA THR 46 HA THR 46 -4.094 -7.772 -7.693 1086 HB THR 46 HB THR 46 -6.155 -8.971 -7.727 1087 HG1 THR 46 HG1 THR 46 -6.784 -6.329 -6.836 1088 HG21 THR 46 HG21 THR 46 -6.764 -7.857 -4.986 1089 HG22 THR 46 HG22 THR 46 -6.308 -9.524 -5.338 1090 HG23 THR 46 HG23 THR 46 -7.827 -8.877 -5.957 1091 H CYS 47 H CYS 47 -3.094 -5.896 -7.267 1092 HA CYS 47 HA CYS 47 -3.695 -4.433 -4.798 1093 HB2 CYS 47 HB2 CYS 47 -1.325 -4.704 -5.484 1094 HB3 CYS 47 HB3 CYS 47 -1.660 -3.796 -6.953 1095 HG CYS 47 HG CYS 47 -2.480 -2.226 -4.098 1096 H ASN 48 H ASN 48 -5.288 -2.965 -4.807 1097 HA ASN 48 HA ASN 48 -6.113 -1.754 -7.358 1098 HB2 ASN 48 HB2 ASN 48 -7.642 -2.116 -4.767 1099 HB3 ASN 48 HB3 ASN 48 -8.266 -1.266 -6.176 1100 HD21 ASN 48 HD21 ASN 48 -9.959 -2.675 -6.472 1101 HD22 ASN 48 HD22 ASN 48 -9.749 -4.293 -7.029 1102 H LEU 49 H LEU 49 -5.354 0.223 -7.688 1103 HA LEU 49 HA LEU 49 -4.693 1.977 -5.433 1104 HB2 LEU 49 HB2 LEU 49 -2.922 1.641 -7.030 1105 HB3 LEU 49 HB3 LEU 49 -3.981 2.054 -8.366 1106 HG LEU 49 HG LEU 49 -4.106 4.383 -7.527 1107 HD11 LEU 49 HD11 LEU 49 -3.706 3.984 -5.165 1108 HD12 LEU 49 HD12 LEU 49 -2.533 5.135 -5.806 1109 HD13 LEU 49 HD13 LEU 49 -2.056 3.462 -5.512 1110 HD21 LEU 49 HD21 LEU 49 -2.478 3.767 -9.241 1111 HD22 LEU 49 HD22 LEU 49 -1.299 3.374 -7.989 1112 HD23 LEU 49 HD23 LEU 49 -1.851 5.037 -8.190 1113 H MET 50 H MET 50 -5.792 3.815 -4.984 1114 HA MET 50 HA MET 50 -7.717 4.847 -6.980 1115 HB2 MET 50 HB2 MET 50 -8.028 4.814 -3.970 1116 HB3 MET 50 HB3 MET 50 -9.141 5.581 -5.092 1117 HG2 MET 50 HG2 MET 50 -8.543 2.637 -4.884 1118 HG3 MET 50 HG3 MET 50 -10.014 3.454 -4.368 1119 HE1 MET 50 HE1 MET 50 -9.972 5.582 -6.984 1120 HE2 MET 50 HE2 MET 50 -11.457 4.967 -6.255 1121 HE3 MET 50 HE3 MET 50 -11.186 4.791 -7.989 1122 H ILE 51 H ILE 51 -6.965 6.702 -7.759 1123 HA ILE 51 HA ILE 51 -5.941 8.755 -5.939 1124 HB ILE 51 HB ILE 51 -4.071 9.232 -7.650 1125 HG12 ILE 51 HG12 ILE 51 -3.224 6.943 -8.607 1126 HG13 ILE 51 HG13 ILE 51 -4.907 6.457 -8.477 1127 HG21 ILE 51 HG21 ILE 51 -3.616 8.486 -5.404 1128 HG22 ILE 51 HG22 ILE 51 -2.526 7.680 -6.531 1129 HG23 ILE 51 HG23 ILE 51 -3.908 6.808 -5.862 1130 HD11 ILE 51 HD11 ILE 51 -4.382 7.205 -10.712 1131 HD12 ILE 51 HD12 ILE 51 -3.834 8.761 -10.088 1132 HD13 ILE 51 HD13 ILE 51 -5.535 8.304 -9.955 1133 H PHE 52 H PHE 52 -5.805 10.910 -6.927 1134 HA PHE 52 HA PHE 52 -8.019 11.307 -8.803 1135 HB2 PHE 52 HB2 PHE 52 -6.587 13.076 -6.849 1136 HB3 PHE 52 HB3 PHE 52 -7.464 13.814 -8.185 1137 HD1 PHE 52 HD2 PHE 52 -9.882 13.626 -8.347 1138 HD2 PHE 52 HD1 PHE 52 -7.768 11.986 -5.029 1139 HE1 PHE 52 HE2 PHE 52 -11.992 13.450 -7.094 1140 HE2 PHE 52 HE1 PHE 52 -9.875 11.811 -3.772 1141 HZ PHE 52 HZ PHE 52 -11.990 12.544 -4.801 1142 H VAL 53 H VAL 53 -7.820 12.127 -10.846 1143 HA VAL 53 HA VAL 53 -5.196 13.149 -11.730 1144 HB VAL 53 HB VAL 53 -5.095 11.834 -13.694 1145 HG11 VAL 53 HG11 VAL 53 -4.365 10.624 -11.703 1146 HG12 VAL 53 HG12 VAL 53 -5.039 9.529 -12.914 1147 HG13 VAL 53 HG13 VAL 53 -5.994 9.974 -11.498 1148 HG21 VAL 53 HG21 VAL 53 -7.418 11.910 -14.366 1149 HG22 VAL 53 HG22 VAL 53 -7.862 10.809 -13.061 1150 HG23 VAL 53 HG23 VAL 53 -6.841 10.244 -14.386 1151 H LYS 54 H LYS 54 -5.270 14.673 -13.400 1152 HA LYS 54 HA LYS 54 -7.691 16.167 -13.645 1153 HB2 LYS 54 HB2 LYS 54 -6.363 17.604 -15.183 1154 HB3 LYS 54 HB3 LYS 54 -5.592 17.334 -13.625 1155 HG2 LYS 54 HG2 LYS 54 -4.112 15.680 -14.607 1156 HG3 LYS 54 HG3 LYS 54 -4.913 15.860 -16.168 1157 HD2 LYS 54 HD2 LYS 54 -3.479 18.089 -14.718 1158 HD3 LYS 54 HD3 LYS 54 -2.752 17.097 -15.981 1159 HE2 LYS 54 HE2 LYS 54 -4.473 17.864 -17.563 1160 HE3 LYS 54 HE3 LYS 54 -5.185 18.863 -16.296 1161 HZ1 LYS 54 HZ1 LYS 54 -3.629 19.999 -17.908 1162 HZ2 LYS 54 HZ2 LYS 54 -2.368 19.179 -17.135 1163 HZ3 LYS 54 HZ3 LYS 54 -3.329 20.261 -16.265 1164 H ASN 55 H ASN 55 -6.421 13.547 -15.465 1165 HA ASN 55 HA ASN 55 -8.643 13.489 -17.230 1166 HB2 ASN 55 HB2 ASN 55 -7.208 13.680 -19.364 1167 HB3 ASN 55 HB3 ASN 55 -7.672 15.162 -18.542 1168 HD21 ASN 55 HD21 ASN 55 -5.119 13.034 -17.387 1169 HD22 ASN 55 HD22 ASN 55 -3.828 14.122 -17.722 1170 H THR 56 H THR 56 -8.692 11.644 -18.635 1171 HA THR 56 HA THR 56 -7.755 9.284 -17.459 1172 HB THR 56 HB THR 56 -8.460 8.144 -19.575 1173 HG1 THR 56 HG1 THR 56 -9.012 9.305 -21.322 1174 HG21 THR 56 HG21 THR 56 -10.097 8.578 -17.806 1175 HG22 THR 56 HG22 THR 56 -10.843 8.746 -19.396 1176 HG23 THR 56 HG23 THR 56 -10.409 10.183 -18.470 1177 H ASP 57 H ASP 57 -6.185 11.330 -19.793 1178 HA ASP 57 HA ASP 57 -4.427 9.506 -21.003 1179 HB2 ASP 57 HB2 ASP 57 -3.954 12.433 -20.360 1180 HB3 ASP 57 HB3 ASP 57 -3.076 11.482 -21.558 1181 H LYS 58 H LYS 58 -4.126 11.438 -18.080 1182 HA LYS 58 HA LYS 58 -1.592 10.598 -17.228 1183 HB2 LYS 58 HB2 LYS 58 -2.571 12.486 -16.174 1184 HB3 LYS 58 HB3 LYS 58 -4.045 11.610 -15.789 1185 HG2 LYS 58 HG2 LYS 58 -2.722 11.987 -13.797 1186 HG3 LYS 58 HG3 LYS 58 -2.838 10.265 -14.169 1187 HD2 LYS 58 HD2 LYS 58 -0.583 10.378 -15.213 1188 HD3 LYS 58 HD3 LYS 58 -0.476 12.077 -14.744 1189 HE2 LYS 58 HE2 LYS 58 -0.601 11.464 -12.399 1190 HE3 LYS 58 HE3 LYS 58 -0.807 9.764 -12.830 1191 HZ1 LYS 58 HZ1 LYS 58 1.573 11.399 -13.513 1192 HZ2 LYS 58 HZ2 LYS 58 1.384 9.739 -13.773 1193 HZ3 LYS 58 HZ3 LYS 58 1.484 10.343 -12.199 1194 H LEU 59 H LEU 59 -4.786 9.166 -16.818 1195 HA LEU 59 HA LEU 59 -4.061 7.169 -14.928 1196 HB2 LEU 59 HB2 LEU 59 -6.352 7.959 -15.211 1197 HB3 LEU 59 HB3 LEU 59 -6.386 7.350 -16.853 1198 HG LEU 59 HG LEU 59 -6.241 5.040 -16.006 1199 HD11 LEU 59 HD11 LEU 59 -6.521 4.593 -13.607 1200 HD12 LEU 59 HD12 LEU 59 -6.363 6.319 -13.275 1201 HD13 LEU 59 HD13 LEU 59 -5.004 5.424 -13.952 1202 HD21 LEU 59 HD21 LEU 59 -8.488 4.914 -15.077 1203 HD22 LEU 59 HD22 LEU 59 -8.429 6.079 -16.399 1204 HD23 LEU 59 HD23 LEU 59 -8.460 6.642 -14.727 1205 H THR 60 H THR 60 -4.453 7.091 -18.483 1206 HA THR 60 HA THR 60 -3.876 4.334 -18.820 1207 HB THR 60 HB THR 60 -3.443 4.895 -21.203 1208 HG1 THR 60 HG1 THR 60 -2.664 6.866 -21.463 1209 HG21 THR 60 HG21 THR 60 -5.686 5.767 -21.714 1210 HG22 THR 60 HG22 THR 60 -5.880 6.254 -20.030 1211 HG23 THR 60 HG23 THR 60 -5.750 4.545 -20.442 1212 H THR 61 H THR 61 -1.819 7.193 -18.706 1213 HA THR 61 HA THR 61 0.605 6.008 -19.515 1214 HB THR 61 HB THR 61 0.195 8.296 -17.565 1215 HG1 THR 61 HG1 THR 61 0.062 9.556 -19.308 1216 HG21 THR 61 HG21 THR 61 2.484 8.963 -18.168 1217 HG22 THR 61 HG22 THR 61 2.652 7.513 -19.155 1218 HG23 THR 61 HG23 THR 61 2.464 7.371 -17.406 1219 H LEU 62 H LEU 62 -0.908 6.238 -16.304 1220 HA LEU 62 HA LEU 62 1.204 5.096 -14.821 1221 HB2 LEU 62 HB2 LEU 62 -1.768 5.069 -14.284 1222 HB3 LEU 62 HB3 LEU 62 -0.549 4.574 -13.123 1223 HG LEU 62 HG LEU 62 -0.914 7.355 -14.258 1224 HD11 LEU 62 HD11 LEU 62 -1.516 7.943 -11.969 1225 HD12 LEU 62 HD12 LEU 62 -1.351 6.255 -11.485 1226 HD13 LEU 62 HD13 LEU 62 -2.609 6.726 -12.629 1227 HD21 LEU 62 HD21 LEU 62 0.841 8.030 -12.688 1228 HD22 LEU 62 HD22 LEU 62 1.455 6.887 -13.881 1229 HD23 LEU 62 HD23 LEU 62 1.097 6.343 -12.241 1230 H MET 63 H MET 63 -1.539 3.600 -16.505 1231 HA MET 63 HA MET 63 -1.331 0.976 -15.653 1232 HB2 MET 63 HB2 MET 63 -1.834 1.870 -18.503 1233 HB3 MET 63 HB3 MET 63 -2.263 0.310 -17.821 1234 HG2 MET 63 HG2 MET 63 -3.866 1.364 -16.344 1235 HG3 MET 63 HG3 MET 63 -3.393 2.957 -16.937 1236 HE1 MET 63 HE1 MET 63 -6.928 2.627 -18.490 1237 HE2 MET 63 HE2 MET 63 -5.782 3.750 -17.758 1238 HE3 MET 63 HE3 MET 63 -6.309 2.323 -16.866 1239 H ASP 64 H ASP 64 0.359 2.460 -18.410 1240 HA ASP 64 HA ASP 64 1.943 0.322 -19.188 1241 HB2 ASP 64 HB2 ASP 64 1.687 2.459 -20.428 1242 HB3 ASP 64 HB3 ASP 64 2.702 3.253 -19.230 1243 H LYS 65 H LYS 65 2.819 2.951 -16.935 1244 HA LYS 65 HA LYS 65 5.352 2.157 -16.188 1245 HB2 LYS 65 HB2 LYS 65 3.210 3.390 -14.438 1246 HB3 LYS 65 HB3 LYS 65 4.922 3.351 -14.047 1247 HG2 LYS 65 HG2 LYS 65 5.385 4.708 -16.066 1248 HG3 LYS 65 HG3 LYS 65 3.648 4.792 -16.372 1249 HD2 LYS 65 HD2 LYS 65 4.293 6.812 -15.258 1250 HD3 LYS 65 HD3 LYS 65 3.369 5.838 -14.114 1251 HE2 LYS 65 HE2 LYS 65 5.280 6.778 -12.983 1252 HE3 LYS 65 HE3 LYS 65 5.513 5.038 -13.144 1253 HZ1 LYS 65 HZ1 LYS 65 7.525 6.287 -13.664 1254 HZ2 LYS 65 HZ2 LYS 65 6.723 7.094 -14.913 1255 HZ3 LYS 65 HZ3 LYS 65 6.977 5.429 -15.011 1256 H LEU 66 H LEU 66 2.259 0.967 -14.961 1257 HA LEU 66 HA LEU 66 3.452 -0.738 -12.960 1258 HB2 LEU 66 HB2 LEU 66 0.628 -0.632 -14.036 1259 HB3 LEU 66 HB3 LEU 66 1.140 -1.509 -12.604 1260 HG LEU 66 HG LEU 66 1.373 1.494 -12.903 1261 HD11 LEU 66 HD11 LEU 66 -0.974 0.860 -12.947 1262 HD12 LEU 66 HD12 LEU 66 -0.567 1.652 -11.426 1263 HD13 LEU 66 HD13 LEU 66 -0.761 -0.100 -11.484 1264 HD21 LEU 66 HD21 LEU 66 1.642 -0.313 -10.496 1265 HD22 LEU 66 HD22 LEU 66 1.701 1.450 -10.470 1266 HD23 LEU 66 HD23 LEU 66 2.951 0.539 -11.315 1267 H ARG 67 H ARG 67 2.476 -1.080 -16.285 1268 HA ARG 67 HA ARG 67 2.440 -3.952 -16.326 1269 HB2 ARG 67 HB2 ARG 67 2.566 -1.896 -18.543 1270 HB3 ARG 67 HB3 ARG 67 2.450 -3.630 -18.828 1271 HG2 ARG 67 HG2 ARG 67 0.309 -3.719 -17.722 1272 HG3 ARG 67 HG3 ARG 67 0.434 -2.021 -17.265 1273 HD2 ARG 67 HD2 ARG 67 0.406 -1.397 -19.654 1274 HD3 ARG 67 HD3 ARG 67 0.231 -3.101 -20.081 1275 HE ARG 67 HE ARG 67 -1.818 -2.512 -18.318 1276 HH11 ARG 67 HH11 ARG 67 -0.842 -1.493 -21.469 1277 HH12 ARG 67 HH12 ARG 67 -2.463 -1.147 -21.965 1278 HH21 ARG 67 HH21 ARG 67 -3.870 -2.003 -18.962 1279 HH22 ARG 67 HH22 ARG 67 -4.144 -1.412 -20.564 1280 H LYS 68 H LYS 68 4.948 -1.704 -16.176 1281 HA LYS 68 HA LYS 68 6.884 -3.059 -17.803 1282 HB2 LYS 68 HB2 LYS 68 7.474 -1.093 -15.583 1283 HB3 LYS 68 HB3 LYS 68 8.468 -1.461 -16.987 1284 HG2 LYS 68 HG2 LYS 68 5.796 -0.059 -17.020 1285 HG3 LYS 68 HG3 LYS 68 7.368 0.703 -17.222 1286 HD2 LYS 68 HD2 LYS 68 6.322 -1.441 -19.075 1287 HD3 LYS 68 HD3 LYS 68 6.066 0.283 -19.348 1288 HE2 LYS 68 HE2 LYS 68 8.769 -1.030 -19.064 1289 HE3 LYS 68 HE3 LYS 68 7.994 -0.643 -20.600 1290 HZ1 LYS 68 HZ1 LYS 68 9.636 1.029 -19.803 1291 HZ2 LYS 68 HZ2 LYS 68 8.592 1.388 -18.524 1292 HZ3 LYS 68 HZ3 LYS 68 8.100 1.657 -20.119 1293 H VAL 69 H VAL 69 5.494 -4.099 -15.046 1294 HA VAL 69 HA VAL 69 7.920 -5.196 -13.819 1295 HB VAL 69 HB VAL 69 5.049 -5.390 -12.873 1296 HG11 VAL 69 HG11 VAL 69 6.443 -7.194 -12.014 1297 HG12 VAL 69 HG12 VAL 69 6.040 -6.060 -10.726 1298 HG13 VAL 69 HG13 VAL 69 7.644 -6.026 -11.459 1299 HG21 VAL 69 HG21 VAL 69 7.248 -3.509 -11.985 1300 HG22 VAL 69 HG22 VAL 69 5.660 -3.663 -11.231 1301 HG23 VAL 69 HG23 VAL 69 5.797 -3.065 -12.885 1302 H GLN 70 H GLN 70 8.565 -7.233 -14.158 1303 HA GLN 70 HA GLN 70 7.524 -8.851 -16.179 1304 HB2 GLN 70 HB2 GLN 70 9.084 -10.565 -15.411 1305 HB3 GLN 70 HB3 GLN 70 9.847 -8.981 -15.378 1306 HG2 GLN 70 HG2 GLN 70 9.607 -8.845 -12.990 1307 HG3 GLN 70 HG3 GLN 70 8.649 -10.324 -12.955 1308 HE21 GLN 70 HE21 GLN 70 10.059 -11.340 -11.544 1309 HE22 GLN 70 HE22 GLN 70 11.625 -11.888 -12.031 1310 H GLY 71 H GLY 71 6.704 -8.816 -12.775 1311 HA2 GLY 71 HA2 GLY 71 5.547 -11.481 -12.839 1312 HA3 GLY 71 HA3 GLY 71 5.634 -10.414 -11.451 1313 H VAL 72 H VAL 72 4.355 -8.393 -13.615 1314 HA VAL 72 HA VAL 72 1.619 -9.064 -12.772 1315 HB VAL 72 HB VAL 72 2.635 -6.487 -13.997 1316 HG11 VAL 72 HG11 VAL 72 -0.042 -7.186 -12.764 1317 HG12 VAL 72 HG12 VAL 72 0.272 -6.848 -14.466 1318 HG13 VAL 72 HG13 VAL 72 0.457 -5.569 -13.265 1319 HG21 VAL 72 HG21 VAL 72 2.425 -5.552 -11.738 1320 HG22 VAL 72 HG22 VAL 72 3.589 -6.878 -11.773 1321 HG23 VAL 72 HG23 VAL 72 1.972 -7.140 -11.118 1322 H PHE 73 H PHE 73 0.021 -9.559 -14.153 1323 HA PHE 73 HA PHE 73 0.629 -9.487 -17.037 1324 HB2 PHE 73 HB2 PHE 73 -1.112 -11.545 -16.935 1325 HB3 PHE 73 HB3 PHE 73 0.631 -11.731 -16.832 1326 HD1 PHE 73 HD1 PHE 73 -2.512 -11.806 -14.930 1327 HD2 PHE 73 HD2 PHE 73 1.709 -12.362 -14.788 1328 HE1 PHE 73 HE1 PHE 73 -2.733 -12.954 -12.761 1329 HE2 PHE 73 HE2 PHE 73 1.492 -13.502 -12.625 1330 HZ PHE 73 HZ PHE 73 -0.723 -13.801 -11.608 1331 H THR 74 H THR 74 -1.509 -8.419 -14.637 1332 HA THR 74 HA THR 74 -3.300 -7.437 -16.763 1333 HB THR 74 HB THR 74 -5.279 -7.869 -15.634 1334 HG1 THR 74 HG1 THR 74 -5.473 -7.820 -13.521 1335 HG21 THR 74 HG21 THR 74 -5.299 -10.226 -14.972 1336 HG22 THR 74 HG22 THR 74 -3.539 -10.212 -14.846 1337 HG23 THR 74 HG23 THR 74 -4.313 -9.989 -16.416 1338 H VAL 75 H VAL 75 -3.263 -5.295 -16.792 1339 HA VAL 75 HA VAL 75 -3.478 -3.857 -14.231 1340 HB VAL 75 HB VAL 75 -1.803 -2.880 -16.564 1341 HG11 VAL 75 HG11 VAL 75 -1.102 -1.104 -15.016 1342 HG12 VAL 75 HG12 VAL 75 -2.204 -1.737 -13.792 1343 HG13 VAL 75 HG13 VAL 75 -2.843 -1.072 -15.296 1344 HG21 VAL 75 HG21 VAL 75 -0.885 -3.946 -13.886 1345 HG22 VAL 75 HG22 VAL 75 0.151 -3.259 -15.139 1346 HG23 VAL 75 HG23 VAL 75 -0.713 -4.769 -15.438 1347 H GLU 76 H GLU 76 -5.546 -3.187 -14.318 1348 HA GLU 76 HA GLU 76 -6.510 -1.858 -16.789 1349 HB2 GLU 76 HB2 GLU 76 -8.135 -3.541 -14.861 1350 HB3 GLU 76 HB3 GLU 76 -8.763 -2.712 -16.279 1351 HG2 GLU 76 HG2 GLU 76 -7.413 -4.139 -17.725 1352 HG3 GLU 76 HG3 GLU 76 -6.740 -4.949 -16.311 1353 H ARG 77 H ARG 77 -8.418 -0.349 -16.331 1354 HA ARG 77 HA ARG 77 -7.885 1.113 -13.846 1355 HB2 ARG 77 HB2 ARG 77 -8.699 3.033 -14.851 1356 HB3 ARG 77 HB3 ARG 77 -7.928 2.213 -16.188 1357 HG2 ARG 77 HG2 ARG 77 -10.158 1.364 -16.880 1358 HG3 ARG 77 HG3 ARG 77 -10.875 2.350 -15.605 1359 HD2 ARG 77 HD2 ARG 77 -9.715 4.340 -16.660 1360 HD3 ARG 77 HD3 ARG 77 -9.349 3.293 -18.031 1361 HE ARG 77 HE ARG 77 -12.135 3.680 -17.183 1362 HH11 ARG 77 HH11 ARG 77 -9.679 3.985 -19.582 1363 HH12 ARG 77 HH12 ARG 77 -10.779 4.561 -20.786 1364 HH21 ARG 77 HH21 ARG 77 -13.536 4.412 -18.744 1365 HH22 ARG 77 HH22 ARG 77 -12.934 4.785 -20.323 1366 H LEU 78 H LEU 78 -9.351 1.356 -12.275 1367 HA LEU 78 HA LEU 78 -11.696 -0.315 -12.277 1368 HB2 LEU 78 HB2 LEU 78 -10.604 1.604 -10.210 1369 HB3 LEU 78 HB3 LEU 78 -11.983 0.547 -9.953 1370 HG LEU 78 HG LEU 78 -9.180 -0.417 -10.573 1371 HD11 LEU 78 HD11 LEU 78 -10.641 -0.334 -7.931 1372 HD12 LEU 78 HD12 LEU 78 -9.254 0.656 -8.387 1373 HD13 LEU 78 HD13 LEU 78 -9.074 -1.090 -8.228 1374 HD21 LEU 78 HD21 LEU 78 -10.893 -1.975 -11.313 1375 HD22 LEU 78 HD22 LEU 78 -11.673 -1.906 -9.733 1376 HD23 LEU 78 HD23 LEU 78 -10.066 -2.613 -9.892 1377 H SER 79 H SER 79 -13.089 0.535 -13.795 1378 HA SER 79 HA SER 79 -13.810 3.297 -13.922 1379 HB2 SER 79 HB2 SER 79 -13.968 1.733 -15.860 1380 HB3 SER 79 HB3 SER 79 -15.307 0.918 -15.056 1381 HG SER 79 HG SER 79 -16.531 2.789 -15.231 1382 H ASN 80 H ASN 80 -15.735 0.437 -12.948 1383 HA ASN 80 HA ASN 80 -17.762 2.058 -11.709 1384 HB2 ASN 80 HB2 ASN 80 -18.308 -0.105 -12.745 1385 HB3 ASN 80 HB3 ASN 80 -17.283 -0.933 -11.579 1386 HD21 ASN 80 HD21 ASN 80 -19.388 1.766 -10.775 1387 HD22 ASN 80 HD22 ASN 80 -20.477 0.848 -9.803 1388 H LEU 81 H LEU 81 -17.152 3.192 -9.949 1389 HA LEU 81 HA LEU 81 -15.482 1.900 -7.901 1390 HB2 LEU 81 HB2 LEU 81 -16.208 4.809 -8.269 1391 HB3 LEU 81 HB3 LEU 81 -15.131 4.177 -7.037 1392 HG LEU 81 HG LEU 81 -14.645 4.156 -10.020 1393 HD11 LEU 81 HD11 LEU 81 -12.820 5.699 -9.476 1394 HD12 LEU 81 HD12 LEU 81 -13.307 5.681 -7.780 1395 HD13 LEU 81 HD13 LEU 81 -14.386 6.355 -9.002 1396 HD21 LEU 81 HD21 LEU 81 -12.919 3.113 -7.767 1397 HD22 LEU 81 HD22 LEU 81 -12.430 3.249 -9.455 1398 HD23 LEU 81 HD23 LEU 81 -13.725 2.143 -9.002 1399 H GLU 82 H GLU 82 -16.095 1.762 -5.772 1400 HA GLU 82 HA GLU 82 -18.884 2.313 -5.137 1401 HB2 GLU 82 HB2 GLU 82 -18.217 1.228 -2.899 1402 HB3 GLU 82 HB3 GLU 82 -18.282 0.205 -4.328 1403 HG2 GLU 82 HG2 GLU 82 -15.832 0.383 -4.544 1404 HG3 GLU 82 HG3 GLU 82 -15.792 1.358 -3.074 1405 H HIS 83 H HIS 83 -16.455 2.645 -2.609 1406 HA HIS 83 HA HIS 83 -15.653 4.391 -1.420 1407 HB2 HIS 83 HB2 HIS 83 -16.284 5.845 -3.983 1408 HB3 HIS 83 HB3 HIS 83 -15.581 6.678 -2.605 1409 HD1 HIS 83 HD1 HIS 83 -13.094 6.568 -2.388 1410 HD2 HIS 83 HD2 HIS 83 -14.581 3.650 -4.950 1411 HE1 HIS 83 HE1 HIS 83 -11.079 5.431 -3.349 1412 HE2 HIS 83 HE2 HIS 83 -12.003 3.563 -4.755 1413 H HIS 84 H HIS 84 -18.896 4.642 -2.638 1414 HA HIS 84 HA HIS 84 -19.802 6.531 -0.667 1415 HB2 HIS 84 HB2 HIS 84 -20.840 6.089 -2.961 1416 HB3 HIS 84 HB3 HIS 84 -21.456 4.582 -2.301 1417 HD1 HIS 84 HD1 HIS 84 -21.732 8.321 -1.762 1418 HD2 HIS 84 HD2 HIS 84 -23.861 4.828 -1.021 1419 HE1 HIS 84 HE1 HIS 84 -23.968 9.067 -0.909 1420 HE2 HIS 84 HE2 HIS 84 -25.287 6.950 -0.614 1421 H HIS 85 H HIS 85 -20.343 6.035 1.410 1422 HA HIS 85 HA HIS 85 -19.385 3.750 2.608 1423 HB2 HIS 85 HB2 HIS 85 -21.474 5.683 3.608 1424 HB3 HIS 85 HB3 HIS 85 -20.733 4.446 4.618 1425 HD1 HIS 85 HD1 HIS 85 -20.164 7.818 3.240 1426 HD2 HIS 85 HD2 HIS 85 -17.924 4.851 5.092 1427 HE1 HIS 85 HE1 HIS 85 -18.030 8.930 3.944 1428 HE2 HIS 85 HE2 HIS 85 -16.619 7.071 4.883 1429 H HIS 86 H HIS 86 -22.655 4.210 1.365 1430 HA HIS 86 HA HIS 86 -23.770 1.857 2.524 1431 HB2 HIS 86 HB2 HIS 86 -25.172 3.684 1.673 1432 HB3 HIS 86 HB3 HIS 86 -24.596 3.381 0.039 1433 HD1 HIS 86 HD1 HIS 86 -25.464 1.204 -1.130 1434 HD2 HIS 86 HD2 HIS 86 -27.225 2.021 2.539 1435 HE1 HIS 86 HE1 HIS 86 -27.515 -0.234 -1.039 1436 HE2 HIS 86 HE2 HIS 86 -28.669 0.440 1.087 1437 H HIS 87 H HIS 87 -22.190 0.227 2.172 1438 HA HIS 87 HA HIS 87 -22.430 -1.203 -0.324 1439 HB2 HIS 87 HB2 HIS 87 -20.699 0.271 -1.057 1440 HB3 HIS 87 HB3 HIS 87 -19.817 0.107 0.458 1441 HD1 HIS 87 HD1 HIS 87 -18.372 -2.020 0.769 1442 HD2 HIS 87 HD2 HIS 87 -20.283 -1.803 -2.913 1443 HE1 HIS 87 HE1 HIS 87 -17.302 -3.787 -0.644 1444 HE2 HIS 87 HE2 HIS 87 -18.293 -3.457 -2.928 1445 H HIS 88 H HIS 88 -22.066 -3.358 -0.088 1446 HA HIS 88 HA HIS 88 -20.276 -4.329 2.008 1447 HB2 HIS 88 HB2 HIS 88 -23.173 -5.163 1.781 1448 HB3 HIS 88 HB3 HIS 88 -21.967 -6.162 2.583 1449 HD1 HIS 88 HD1 HIS 88 -24.506 -3.960 3.462 1450 HD2 HIS 88 HD2 HIS 88 -20.530 -4.295 4.617 1451 HE1 HIS 88 HE1 HIS 88 -24.342 -2.765 5.661 1452 HE2 HIS 88 HE2 HIS 88 -21.898 -2.823 6.243 Start of MODEL 17 1 H1 MET 1 H1 MET 1 5.500 -19.617 18.899 2 H2 MET 1 H2 MET 1 7.170 -19.426 18.710 3 H3 MET 1 H3 MET 1 6.425 -20.864 18.226 4 HA MET 1 HA MET 1 5.205 -19.720 16.516 5 HB2 MET 1 HB2 MET 1 6.703 -17.305 17.551 6 HB3 MET 1 HB3 MET 1 5.897 -17.342 15.987 7 HG2 MET 1 HG2 MET 1 4.520 -16.247 17.661 8 HG3 MET 1 HG3 MET 1 3.757 -17.729 17.085 9 HE1 MET 1 HE1 MET 1 2.598 -17.593 20.827 10 HE2 MET 1 HE2 MET 1 2.082 -17.707 19.144 11 HE3 MET 1 HE3 MET 1 2.814 -16.218 19.742 12 H THR 2 H THR 2 6.233 -18.890 14.436 13 HA THR 2 HA THR 2 9.089 -19.304 14.140 14 HB THR 2 HB THR 2 8.363 -21.616 13.996 15 HG1 THR 2 HG1 THR 2 8.896 -21.915 11.620 16 HG21 THR 2 HG21 THR 2 6.766 -22.385 12.293 17 HG22 THR 2 HG22 THR 2 6.469 -20.714 11.810 18 HG23 THR 2 HG23 THR 2 6.004 -21.262 13.420 19 H ASP 3 H ASP 3 5.956 -18.776 12.635 20 HA ASP 3 HA ASP 3 6.754 -16.334 11.456 21 HB2 ASP 3 HB2 ASP 3 7.726 -18.049 9.834 22 HB3 ASP 3 HB3 ASP 3 6.067 -18.465 9.435 23 H PHE 4 H PHE 4 4.966 -15.206 11.851 24 HA PHE 4 HA PHE 4 2.341 -16.463 11.409 25 HB2 PHE 4 HB2 PHE 4 1.472 -15.424 13.443 26 HB3 PHE 4 HB3 PHE 4 2.822 -16.484 13.822 27 HD1 PHE 4 HD1 PHE 4 1.713 -12.984 13.596 28 HD2 PHE 4 HD2 PHE 4 4.876 -15.603 14.749 29 HE1 PHE 4 HE1 PHE 4 2.818 -11.130 14.782 30 HE2 PHE 4 HE2 PHE 4 5.977 -13.752 15.937 31 HZ PHE 4 HZ PHE 4 4.956 -11.507 15.939 32 H LEU 5 H LEU 5 0.614 -15.018 10.963 33 HA LEU 5 HA LEU 5 1.432 -12.734 9.412 34 HB2 LEU 5 HB2 LEU 5 -0.334 -14.156 8.595 35 HB3 LEU 5 HB3 LEU 5 -1.271 -13.899 10.052 36 HG LEU 5 HG LEU 5 -1.616 -11.548 9.443 37 HD11 LEU 5 HD11 LEU 5 -0.045 -12.208 6.950 38 HD12 LEU 5 HD12 LEU 5 0.465 -11.134 8.254 39 HD13 LEU 5 HD13 LEU 5 -0.923 -10.708 7.255 40 HD21 LEU 5 HD21 LEU 5 -3.225 -13.211 8.667 41 HD22 LEU 5 HD22 LEU 5 -2.284 -13.442 7.193 42 HD23 LEU 5 HD23 LEU 5 -3.062 -11.890 7.510 43 H ALA 6 H ALA 6 2.088 -11.029 10.574 44 HA ALA 6 HA ALA 6 0.641 -10.171 12.962 45 HB1 ALA 6 HB1 ALA 6 2.518 -8.679 13.317 46 HB2 ALA 6 HB2 ALA 6 3.172 -9.082 11.730 47 HB3 ALA 6 HB3 ALA 6 3.097 -10.312 12.991 48 H GLY 7 H GLY 7 -0.204 -8.046 13.221 49 HA2 GLY 7 HA2 GLY 7 -0.713 -6.597 10.690 50 HA3 GLY 7 HA3 GLY 7 -1.987 -6.898 11.858 51 H ILE 8 H ILE 8 -0.728 -4.412 10.719 52 HA ILE 8 HA ILE 8 -0.422 -3.000 13.295 53 HB ILE 8 HB ILE 8 1.128 -2.297 10.775 54 HG12 ILE 8 HG12 ILE 8 2.139 -3.615 13.320 55 HG13 ILE 8 HG13 ILE 8 1.967 -4.407 11.757 56 HG21 ILE 8 HG21 ILE 8 2.344 -0.740 12.229 57 HG22 ILE 8 HG22 ILE 8 1.319 -1.206 13.588 58 HG23 ILE 8 HG23 ILE 8 0.618 -0.378 12.199 59 HD11 ILE 8 HD11 ILE 8 3.829 -2.126 12.391 60 HD12 ILE 8 HD12 ILE 8 3.651 -2.901 10.816 61 HD13 ILE 8 HD13 ILE 8 4.275 -3.819 12.186 62 H ARG 9 H ARG 9 -1.494 -0.968 13.379 63 HA ARG 9 HA ARG 9 -2.872 -0.162 10.896 64 HB2 ARG 9 HB2 ARG 9 -4.423 -1.080 12.649 65 HB3 ARG 9 HB3 ARG 9 -3.971 0.275 13.681 66 HG2 ARG 9 HG2 ARG 9 -4.859 1.851 12.075 67 HG3 ARG 9 HG3 ARG 9 -5.184 0.550 10.930 68 HD2 ARG 9 HD2 ARG 9 -6.751 -0.430 12.631 69 HD3 ARG 9 HD3 ARG 9 -6.532 1.041 13.585 70 HE ARG 9 HE ARG 9 -7.239 1.902 11.078 71 HH11 ARG 9 HH11 ARG 9 -8.697 -0.073 13.504 72 HH12 ARG 9 HH12 ARG 9 -10.302 0.263 12.954 73 HH21 ARG 9 HH21 ARG 9 -9.280 2.308 10.388 74 HH22 ARG 9 HH22 ARG 9 -10.629 1.587 11.195 75 H ILE 10 H ILE 10 -2.677 1.881 10.245 76 HA ILE 10 HA ILE 10 -1.203 3.782 11.974 77 HB ILE 10 HB ILE 10 -1.120 3.701 8.950 78 HG12 ILE 10 HG12 ILE 10 1.007 2.591 10.795 79 HG13 ILE 10 HG13 ILE 10 -0.213 1.587 10.014 80 HG21 ILE 10 HG21 ILE 10 0.658 5.054 10.985 81 HG22 ILE 10 HG22 ILE 10 -0.526 5.843 9.941 82 HG23 ILE 10 HG23 ILE 10 0.897 5.078 9.237 83 HD11 ILE 10 HD11 ILE 10 1.851 1.515 8.780 84 HD12 ILE 10 HD12 ILE 10 1.862 3.273 8.633 85 HD13 ILE 10 HD13 ILE 10 0.610 2.327 7.825 86 H VAL 11 H VAL 11 -2.576 5.438 12.557 87 HA VAL 11 HA VAL 11 -4.289 6.545 10.413 88 HB VAL 11 HB VAL 11 -4.906 6.352 13.363 89 HG11 VAL 11 HG11 VAL 11 -6.947 7.658 12.898 90 HG12 VAL 11 HG12 VAL 11 -6.356 7.973 11.265 91 HG13 VAL 11 HG13 VAL 11 -5.480 8.607 12.659 92 HG21 VAL 11 HG21 VAL 11 -6.401 5.425 10.900 93 HG22 VAL 11 HG22 VAL 11 -6.927 5.211 12.573 94 HG23 VAL 11 HG23 VAL 11 -5.474 4.397 11.995 95 H GLY 12 H GLY 12 -3.697 8.445 9.737 96 HA2 GLY 12 HA2 GLY 12 -2.607 10.430 11.606 97 HA3 GLY 12 HA3 GLY 12 -1.611 9.961 10.236 98 H GLU 13 H GLU 13 -2.493 12.587 10.721 99 HA GLU 13 HA GLU 13 -4.827 13.235 9.228 100 HB2 GLU 13 HB2 GLU 13 -4.024 15.573 9.443 101 HB3 GLU 13 HB3 GLU 13 -4.029 14.704 10.973 102 HG2 GLU 13 HG2 GLU 13 -1.581 14.282 10.642 103 HG3 GLU 13 HG3 GLU 13 -1.644 15.368 9.258 104 H ASP 14 H ASP 14 -5.103 13.507 7.087 105 HA ASP 14 HA ASP 14 -2.976 12.900 5.272 106 HB2 ASP 14 HB2 ASP 14 -5.249 12.180 4.797 107 HB3 ASP 14 HB3 ASP 14 -5.814 13.848 4.793 108 H LYS 15 H LYS 15 -1.410 14.343 4.808 109 HA LYS 15 HA LYS 15 -2.122 17.059 4.013 110 HB2 LYS 15 HB2 LYS 15 -0.378 18.024 5.559 111 HB3 LYS 15 HB3 LYS 15 -1.819 17.403 6.355 112 HG2 LYS 15 HG2 LYS 15 -0.605 15.340 6.918 113 HG3 LYS 15 HG3 LYS 15 0.842 15.994 6.154 114 HD2 LYS 15 HD2 LYS 15 -0.587 17.210 8.528 115 HD3 LYS 15 HD3 LYS 15 0.873 16.225 8.615 116 HE2 LYS 15 HE2 LYS 15 2.052 17.899 7.234 117 HE3 LYS 15 HE3 LYS 15 0.595 18.892 7.223 118 HZ1 LYS 15 HZ1 LYS 15 2.183 18.139 9.618 119 HZ2 LYS 15 HZ2 LYS 15 0.745 19.029 9.646 120 HZ3 LYS 15 HZ3 LYS 15 2.117 19.665 8.892 121 H ASN 16 H ASN 16 -0.990 17.648 2.282 122 HA ASN 16 HA ASN 16 0.633 17.886 0.716 123 HB2 ASN 16 HB2 ASN 16 2.464 17.302 3.055 124 HB3 ASN 16 HB3 ASN 16 2.953 18.041 1.532 125 HD21 ASN 16 HD21 ASN 16 1.239 18.489 4.505 126 HD22 ASN 16 HD22 ASN 16 1.064 20.201 4.389 127 H GLY 17 H GLY 17 -0.400 15.093 1.141 128 HA2 GLY 17 HA2 GLY 17 -0.056 13.223 -0.218 129 HA3 GLY 17 HA3 GLY 17 1.547 13.821 -0.603 130 H MET 18 H MET 18 0.253 13.273 2.651 131 HA MET 18 HA MET 18 2.498 11.754 3.475 132 HB2 MET 18 HB2 MET 18 -0.187 12.315 4.690 133 HB3 MET 18 HB3 MET 18 0.880 11.129 5.428 134 HG2 MET 18 HG2 MET 18 2.647 12.932 5.482 135 HG3 MET 18 HG3 MET 18 1.375 14.064 5.029 136 HE1 MET 18 HE1 MET 18 2.294 11.238 7.566 137 HE2 MET 18 HE2 MET 18 0.584 10.942 7.255 138 HE3 MET 18 HE3 MET 18 1.107 11.499 8.845 139 H THR 19 H THR 19 -0.766 10.749 2.495 140 HA THR 19 HA THR 19 -0.697 8.056 3.073 141 HB THR 19 HB THR 19 -2.225 7.734 1.124 142 HG1 THR 19 HG1 THR 19 -2.604 9.404 -0.263 143 HG21 THR 19 HG21 THR 19 -4.005 9.204 1.935 144 HG22 THR 19 HG22 THR 19 -2.820 10.193 2.787 145 HG23 THR 19 HG23 THR 19 -3.102 8.525 3.288 146 H ASN 20 H ASN 20 0.988 9.747 0.509 147 HA ASN 20 HA ASN 20 1.729 7.430 -0.997 148 HB2 ASN 20 HB2 ASN 20 2.957 10.201 -0.914 149 HB3 ASN 20 HB3 ASN 20 3.337 8.963 -2.108 150 HD21 ASN 20 HD21 ASN 20 1.892 8.546 -3.743 151 HD22 ASN 20 HD22 ASN 20 0.535 9.557 -4.070 152 H GLN 21 H GLN 21 3.405 9.468 1.386 153 HA GLN 21 HA GLN 21 5.867 8.073 1.300 154 HB2 GLN 21 HB2 GLN 21 6.559 9.462 3.050 155 HB3 GLN 21 HB3 GLN 21 5.360 10.436 2.224 156 HG2 GLN 21 HG2 GLN 21 3.697 9.761 3.932 157 HG3 GLN 21 HG3 GLN 21 4.965 8.886 4.779 158 HE21 GLN 21 HE21 GLN 21 5.350 12.000 3.202 159 HE22 GLN 21 HE22 GLN 21 5.632 12.892 4.647 160 H ILE 22 H ILE 22 2.970 7.691 3.262 161 HA ILE 22 HA ILE 22 4.041 6.091 5.304 162 HB ILE 22 HB ILE 22 1.236 6.441 4.257 163 HG12 ILE 22 HG12 ILE 22 2.232 8.350 5.418 164 HG13 ILE 22 HG13 ILE 22 0.943 7.653 6.393 165 HG21 ILE 22 HG21 ILE 22 0.423 5.241 6.267 166 HG22 ILE 22 HG22 ILE 22 2.084 4.769 6.634 167 HG23 ILE 22 HG23 ILE 22 1.307 4.189 5.161 168 HD11 ILE 22 HD11 ILE 22 3.894 7.217 6.790 169 HD12 ILE 22 HD12 ILE 22 2.609 6.500 7.762 170 HD13 ILE 22 HD13 ILE 22 2.847 8.249 7.765 171 H THR 23 H THR 23 2.172 5.063 2.412 172 HA THR 23 HA THR 23 2.590 2.306 3.018 173 HB THR 23 HB THR 23 1.800 3.346 0.286 174 HG1 THR 23 HG1 THR 23 0.354 3.240 2.700 175 HG21 THR 23 HG21 THR 23 0.597 1.206 0.154 176 HG22 THR 23 HG22 THR 23 1.169 0.781 1.767 177 HG23 THR 23 HG23 THR 23 2.320 0.948 0.439 178 H GLY 24 H GLY 24 4.322 4.695 1.156 179 HA2 GLY 24 HA2 GLY 24 6.110 3.046 -0.247 180 HA3 GLY 24 HA3 GLY 24 6.472 4.666 0.335 181 H VAL 25 H VAL 25 6.360 4.363 3.063 182 HA VAL 25 HA VAL 25 8.815 3.161 3.741 183 HB VAL 25 HB VAL 25 6.512 3.971 5.531 184 HG11 VAL 25 HG11 VAL 25 8.150 3.977 7.369 185 HG12 VAL 25 HG12 VAL 25 9.361 3.293 6.284 186 HG13 VAL 25 HG13 VAL 25 7.921 2.361 6.699 187 HG21 VAL 25 HG21 VAL 25 7.896 5.968 5.963 188 HG22 VAL 25 HG22 VAL 25 7.437 5.825 4.267 189 HG23 VAL 25 HG23 VAL 25 9.069 5.392 4.776 190 H ILE 26 H ILE 26 5.501 1.956 3.927 191 HA ILE 26 HA ILE 26 5.800 -0.362 5.405 192 HB ILE 26 HB ILE 26 4.127 -0.002 2.907 193 HG12 ILE 26 HG12 ILE 26 3.601 1.650 4.645 194 HG13 ILE 26 HG13 ILE 26 2.281 0.504 4.453 195 HG21 ILE 26 HG21 ILE 26 3.901 -2.082 5.084 196 HG22 ILE 26 HG22 ILE 26 4.385 -2.361 3.411 197 HG23 ILE 26 HG23 ILE 26 2.741 -1.839 3.778 198 HD11 ILE 26 HD11 ILE 26 3.040 -0.679 6.459 199 HD12 ILE 26 HD12 ILE 26 2.657 1.011 6.782 200 HD13 ILE 26 HD13 ILE 26 4.339 0.498 6.649 201 H SER 27 H SER 27 6.488 0.123 1.960 202 HA SER 27 HA SER 27 7.190 -2.491 1.251 203 HB2 SER 27 HB2 SER 27 8.515 -0.001 0.150 204 HB3 SER 27 HB3 SER 27 8.259 -1.539 -0.674 205 HG SER 27 HG SER 27 6.589 0.595 -0.386 206 H LYS 28 H LYS 28 8.987 -0.058 2.989 207 HA LYS 28 HA LYS 28 11.568 -1.298 2.481 208 HB2 LYS 28 HB2 LYS 28 10.972 1.083 4.249 209 HB3 LYS 28 HB3 LYS 28 12.518 0.639 3.532 210 HG2 LYS 28 HG2 LYS 28 11.442 0.990 1.273 211 HG3 LYS 28 HG3 LYS 28 10.065 1.687 2.129 212 HD2 LYS 28 HD2 LYS 28 12.916 2.693 2.169 213 HD3 LYS 28 HD3 LYS 28 11.542 3.441 1.351 214 HE2 LYS 28 HE2 LYS 28 10.464 3.841 3.509 215 HE3 LYS 28 HE3 LYS 28 11.812 3.060 4.338 216 HZ1 LYS 28 HZ1 LYS 28 12.049 5.445 4.412 217 HZ2 LYS 28 HZ2 LYS 28 11.961 5.551 2.726 218 HZ3 LYS 28 HZ3 LYS 28 13.279 4.785 3.458 219 H PHE 29 H PHE 29 9.336 -2.460 4.322 220 HA PHE 29 HA PHE 29 10.822 -2.757 6.818 221 HB2 PHE 29 HB2 PHE 29 8.181 -3.905 5.899 222 HB3 PHE 29 HB3 PHE 29 8.893 -4.212 7.480 223 HD1 PHE 29 HD2 PHE 29 10.032 -1.275 7.630 224 HD2 PHE 29 HD1 PHE 29 6.200 -2.966 6.886 225 HE1 PHE 29 HE2 PHE 29 8.972 0.758 8.522 226 HE2 PHE 29 HE1 PHE 29 5.131 -0.932 7.781 227 HZ PHE 29 HZ PHE 29 6.522 0.928 8.601 228 H ASP 30 H ASP 30 10.889 -4.204 3.836 229 HA ASP 30 HA ASP 30 12.017 -5.978 2.999 230 HB2 ASP 30 HB2 ASP 30 13.004 -6.359 5.837 231 HB3 ASP 30 HB3 ASP 30 13.662 -7.157 4.410 232 H THR 31 H THR 31 9.445 -6.277 4.999 233 HA THR 31 HA THR 31 9.350 -9.221 4.814 234 HB THR 31 HB THR 31 8.781 -8.430 7.018 235 HG1 THR 31 HG1 THR 31 6.999 -9.647 7.204 236 HG21 THR 31 HG21 THR 31 8.119 -6.141 6.469 237 HG22 THR 31 HG22 THR 31 6.876 -6.935 7.436 238 HG23 THR 31 HG23 THR 31 6.650 -6.740 5.697 239 H ASN 32 H ASN 32 7.583 -10.285 3.819 240 HA ASN 32 HA ASN 32 6.782 -9.006 1.386 241 HB2 ASN 32 HB2 ASN 32 7.357 -11.402 1.483 242 HB3 ASN 32 HB3 ASN 32 5.955 -11.699 2.505 243 HD21 ASN 32 HD21 ASN 32 7.025 -10.845 -0.706 244 HD22 ASN 32 HD22 ASN 32 5.537 -11.216 -1.502 245 H ILE 33 H ILE 33 5.059 -7.779 1.068 246 HA ILE 33 HA ILE 33 3.071 -7.379 3.084 247 HB ILE 33 HB ILE 33 3.161 -6.386 0.225 248 HG12 ILE 33 HG12 ILE 33 3.913 -4.976 2.805 249 HG13 ILE 33 HG13 ILE 33 5.065 -5.657 1.662 250 HG21 ILE 33 HG21 ILE 33 1.436 -5.479 2.540 251 HG22 ILE 33 HG22 ILE 33 0.881 -6.326 1.095 252 HG23 ILE 33 HG23 ILE 33 1.530 -4.691 0.964 253 HD11 ILE 33 HD11 ILE 33 4.878 -3.263 1.385 254 HD12 ILE 33 HD12 ILE 33 3.142 -3.408 1.112 255 HD13 ILE 33 HD13 ILE 33 4.279 -4.099 -0.048 256 H ARG 34 H ARG 34 1.748 -9.116 3.455 257 HA ARG 34 HA ARG 34 0.578 -10.595 1.263 258 HB2 ARG 34 HB2 ARG 34 1.254 -11.527 3.577 259 HB3 ARG 34 HB3 ARG 34 -0.253 -10.831 4.157 260 HG2 ARG 34 HG2 ARG 34 -0.235 -12.696 1.805 261 HG3 ARG 34 HG3 ARG 34 -0.189 -13.323 3.451 262 HD2 ARG 34 HD2 ARG 34 -2.314 -12.440 3.962 263 HD3 ARG 34 HD3 ARG 34 -2.296 -11.367 2.565 264 HE ARG 34 HE ARG 34 -2.906 -13.141 1.200 265 HH11 ARG 34 HH11 ARG 34 -2.350 -14.274 4.403 266 HH12 ARG 34 HH12 ARG 34 -3.156 -15.773 4.129 267 HH21 ARG 34 HH21 ARG 34 -3.936 -15.042 0.856 268 HH22 ARG 34 HH22 ARG 34 -4.050 -16.212 2.126 269 H THR 35 H THR 35 -0.426 -8.078 3.516 270 HA THR 35 HA THR 35 -2.603 -7.378 1.739 271 HB THR 35 HB THR 35 -3.259 -8.031 4.626 272 HG1 THR 35 HG1 THR 35 -3.542 -9.464 2.235 273 HG21 THR 35 HG21 THR 35 -5.045 -7.116 2.363 274 HG22 THR 35 HG22 THR 35 -4.573 -6.149 3.760 275 HG23 THR 35 HG23 THR 35 -5.583 -7.580 3.977 276 H ILE 36 H ILE 36 -2.830 -5.214 1.636 277 HA ILE 36 HA ILE 36 -2.289 -3.571 4.011 278 HB ILE 36 HB ILE 36 -0.223 -3.483 2.628 279 HG12 ILE 36 HG12 ILE 36 -0.120 -0.969 2.402 280 HG13 ILE 36 HG13 ILE 36 -1.838 -0.925 2.781 281 HG21 ILE 36 HG21 ILE 36 -0.244 -2.327 0.458 282 HG22 ILE 36 HG22 ILE 36 -2.007 -2.286 0.509 283 HG23 ILE 36 HG23 ILE 36 -1.163 -3.833 0.422 284 HD11 ILE 36 HD11 ILE 36 -0.490 -0.417 4.725 285 HD12 ILE 36 HD12 ILE 36 0.341 -1.964 4.575 286 HD13 ILE 36 HD13 ILE 36 -1.379 -1.919 4.960 287 H VAL 37 H VAL 37 -3.841 -2.044 4.328 288 HA VAL 37 HA VAL 37 -5.502 -1.206 2.036 289 HB VAL 37 HB VAL 37 -6.622 -2.026 4.733 290 HG11 VAL 37 HG11 VAL 37 -7.851 -0.155 3.763 291 HG12 VAL 37 HG12 VAL 37 -8.821 -1.626 3.721 292 HG13 VAL 37 HG13 VAL 37 -8.039 -1.043 2.251 293 HG21 VAL 37 HG21 VAL 37 -6.921 -3.355 2.031 294 HG22 VAL 37 HG22 VAL 37 -7.721 -3.852 3.524 295 HG23 VAL 37 HG23 VAL 37 -5.967 -3.965 3.384 296 H LEU 38 H LEU 38 -4.921 0.907 1.892 297 HA LEU 38 HA LEU 38 -5.179 2.576 4.324 298 HB2 LEU 38 HB2 LEU 38 -2.922 2.586 3.291 299 HB3 LEU 38 HB3 LEU 38 -3.614 3.161 1.791 300 HG LEU 38 HG LEU 38 -3.846 4.775 4.340 301 HD11 LEU 38 HD11 LEU 38 -1.472 4.363 4.016 302 HD12 LEU 38 HD12 LEU 38 -1.862 6.040 3.630 303 HD13 LEU 38 HD13 LEU 38 -1.590 4.876 2.332 304 HD21 LEU 38 HD21 LEU 38 -3.887 5.575 1.423 305 HD22 LEU 38 HD22 LEU 38 -4.054 6.664 2.800 306 HD23 LEU 38 HD23 LEU 38 -5.292 5.453 2.481 307 H ASN 39 H ASN 39 -6.896 3.907 4.391 308 HA ASN 39 HA ASN 39 -7.831 5.129 1.885 309 HB2 ASN 39 HB2 ASN 39 -10.193 4.849 2.544 310 HB3 ASN 39 HB3 ASN 39 -9.393 3.299 2.302 311 HD21 ASN 39 HD21 ASN 39 -8.933 2.013 4.109 312 HD22 ASN 39 HD22 ASN 39 -9.734 2.259 5.616 313 H ALA 40 H ALA 40 -8.155 7.271 2.029 314 HA ALA 40 HA ALA 40 -7.883 8.553 4.671 315 HB1 ALA 40 HB1 ALA 40 -7.371 10.588 3.424 316 HB2 ALA 40 HB2 ALA 40 -7.710 9.764 1.902 317 HB3 ALA 40 HB3 ALA 40 -6.341 9.258 2.892 318 H LYS 41 H LYS 41 -9.788 8.741 5.646 319 HA LYS 41 HA LYS 41 -11.935 10.175 4.226 320 HB2 LYS 41 HB2 LYS 41 -13.644 8.822 5.134 321 HB3 LYS 41 HB3 LYS 41 -12.435 7.698 4.536 322 HG2 LYS 41 HG2 LYS 41 -12.705 8.511 7.425 323 HG3 LYS 41 HG3 LYS 41 -13.468 7.091 6.722 324 HD2 LYS 41 HD2 LYS 41 -11.615 5.951 7.233 325 HD3 LYS 41 HD3 LYS 41 -10.770 6.876 5.993 326 HE2 LYS 41 HE2 LYS 41 -9.638 6.909 8.206 327 HE3 LYS 41 HE3 LYS 41 -10.073 8.515 7.619 328 HZ1 LYS 41 HZ1 LYS 41 -11.587 6.933 9.623 329 HZ2 LYS 41 HZ2 LYS 41 -12.016 8.469 9.062 330 HZ3 LYS 41 HZ3 LYS 41 -10.600 8.261 9.957 331 H ASP 42 H ASP 42 -13.290 11.512 5.593 332 HA ASP 42 HA ASP 42 -13.633 13.100 7.201 333 HB2 ASP 42 HB2 ASP 42 -11.840 11.506 9.047 334 HB3 ASP 42 HB3 ASP 42 -13.103 12.645 9.495 335 H GLY 43 H GLY 43 -10.941 12.807 5.555 336 HA2 GLY 43 HA2 GLY 43 -9.229 14.375 5.196 337 HA3 GLY 43 HA3 GLY 43 -9.595 15.112 6.749 338 H ILE 44 H ILE 44 -9.433 11.846 7.212 339 HA ILE 44 HA ILE 44 -6.551 11.858 7.896 340 HB ILE 44 HB ILE 44 -8.709 10.432 9.473 341 HG12 ILE 44 HG12 ILE 44 -7.416 13.112 10.048 342 HG13 ILE 44 HG13 ILE 44 -9.101 12.836 9.605 343 HG21 ILE 44 HG21 ILE 44 -6.983 10.259 11.204 344 HG22 ILE 44 HG22 ILE 44 -5.841 11.095 10.152 345 HG23 ILE 44 HG23 ILE 44 -6.456 9.506 9.699 346 HD11 ILE 44 HD11 ILE 44 -8.815 13.231 12.002 347 HD12 ILE 44 HD12 ILE 44 -7.764 11.818 12.102 348 HD13 ILE 44 HD13 ILE 44 -9.464 11.625 11.672 349 H PHE 45 H PHE 45 -5.523 9.723 7.806 350 HA PHE 45 HA PHE 45 -7.037 7.841 6.090 351 HB2 PHE 45 HB2 PHE 45 -4.979 7.151 5.043 352 HB3 PHE 45 HB3 PHE 45 -5.083 8.904 4.960 353 HD1 PHE 45 HD1 PHE 45 -3.387 6.066 6.581 354 HD2 PHE 45 HD2 PHE 45 -3.490 10.295 6.081 355 HE1 PHE 45 HE1 PHE 45 -1.168 6.236 7.620 356 HE2 PHE 45 HE2 PHE 45 -1.265 10.473 7.121 357 HZ PHE 45 HZ PHE 45 -0.108 8.439 7.893 358 H THR 46 H THR 46 -6.977 5.657 6.514 359 HA THR 46 HA THR 46 -5.511 4.789 8.932 360 HB THR 46 HB THR 46 -7.789 4.686 9.571 361 HG1 THR 46 HG1 THR 46 -7.051 2.059 8.692 362 HG21 THR 46 HG21 THR 46 -9.536 3.555 8.274 363 HG22 THR 46 HG22 THR 46 -8.379 3.256 6.977 364 HG23 THR 46 HG23 THR 46 -8.840 4.909 7.382 365 H CYS 47 H CYS 47 -3.753 3.866 8.062 366 HA CYS 47 HA CYS 47 -3.996 2.010 5.810 367 HB2 CYS 47 HB2 CYS 47 -2.199 3.727 5.809 368 HB3 CYS 47 HB3 CYS 47 -1.515 2.987 7.252 369 HG CYS 47 HG CYS 47 -1.904 1.028 4.511 370 H ASN 48 H ASN 48 -4.428 -0.062 6.267 371 HA ASN 48 HA ASN 48 -3.535 -1.232 8.808 372 HB2 ASN 48 HB2 ASN 48 -5.561 -2.223 6.787 373 HB3 ASN 48 HB3 ASN 48 -5.138 -3.053 8.280 374 HD21 ASN 48 HD21 ASN 48 -7.210 -2.937 9.071 375 HD22 ASN 48 HD22 ASN 48 -7.928 -1.465 9.616 376 H LEU 49 H LEU 49 -1.645 -2.251 8.723 377 HA LEU 49 HA LEU 49 -0.731 -3.511 6.240 378 HB2 LEU 49 HB2 LEU 49 0.818 -1.953 7.219 379 HB3 LEU 49 HB3 LEU 49 0.706 -2.743 8.780 380 HG LEU 49 HG LEU 49 1.834 -4.734 7.864 381 HD11 LEU 49 HD11 LEU 49 2.015 -3.117 5.324 382 HD12 LEU 49 HD12 LEU 49 1.123 -4.619 5.557 383 HD13 LEU 49 HD13 LEU 49 2.884 -4.620 5.634 384 HD21 LEU 49 HD21 LEU 49 4.060 -3.743 7.580 385 HD22 LEU 49 HD22 LEU 49 3.182 -3.001 8.918 386 HD23 LEU 49 HD23 LEU 49 3.324 -2.154 7.376 387 H MET 50 H MET 50 -0.515 -5.659 6.000 388 HA MET 50 HA MET 50 -0.497 -7.392 8.390 389 HB2 MET 50 HB2 MET 50 -1.949 -7.993 5.808 390 HB3 MET 50 HB3 MET 50 -1.860 -9.045 7.211 391 HG2 MET 50 HG2 MET 50 -3.225 -6.365 7.077 392 HG3 MET 50 HG3 MET 50 -4.007 -7.942 7.084 393 HE1 MET 50 HE1 MET 50 -1.730 -9.210 9.282 394 HE2 MET 50 HE2 MET 50 -3.417 -9.717 9.183 395 HE3 MET 50 HE3 MET 50 -2.752 -9.156 10.718 396 H ILE 51 H ILE 51 1.429 -8.346 8.445 397 HA ILE 51 HA ILE 51 2.569 -9.512 6.005 398 HB ILE 51 HB ILE 51 4.859 -8.604 6.745 399 HG12 ILE 51 HG12 ILE 51 4.553 -6.233 7.797 400 HG13 ILE 51 HG13 ILE 51 3.012 -6.854 8.374 401 HG21 ILE 51 HG21 ILE 51 4.552 -6.516 5.480 402 HG22 ILE 51 HG22 ILE 51 2.804 -6.718 5.590 403 HG23 ILE 51 HG23 ILE 51 3.773 -7.894 4.701 404 HD11 ILE 51 HD11 ILE 51 4.181 -8.606 9.597 405 HD12 ILE 51 HD12 ILE 51 4.741 -7.002 10.068 406 HD13 ILE 51 HD13 ILE 51 5.725 -7.999 8.996 407 H PHE 52 H PHE 52 4.343 -11.051 6.450 408 HA PHE 52 HA PHE 52 3.798 -12.511 8.927 409 HB2 PHE 52 HB2 PHE 52 5.055 -13.260 6.303 410 HB3 PHE 52 HB3 PHE 52 5.332 -14.259 7.725 411 HD1 PHE 52 HD2 PHE 52 3.510 -15.481 8.768 412 HD2 PHE 52 HD1 PHE 52 2.877 -13.190 5.233 413 HE1 PHE 52 HE2 PHE 52 1.372 -16.637 8.411 414 HE2 PHE 52 HE1 PHE 52 0.734 -14.346 4.865 415 HZ PHE 52 HZ PHE 52 -0.020 -16.072 6.454 416 H VAL 53 H VAL 53 5.400 -13.193 10.379 417 HA VAL 53 HA VAL 53 8.099 -12.089 10.146 418 HB VAL 53 HB VAL 53 8.090 -10.933 12.262 419 HG11 VAL 53 HG11 VAL 53 5.684 -10.061 10.668 420 HG12 VAL 53 HG12 VAL 53 7.358 -9.587 10.370 421 HG13 VAL 53 HG13 VAL 53 6.548 -9.083 11.856 422 HG21 VAL 53 HG21 VAL 53 5.202 -11.749 12.533 423 HG22 VAL 53 HG22 VAL 53 6.079 -10.680 13.630 424 HG23 VAL 53 HG23 VAL 53 6.556 -12.370 13.476 425 H LYS 54 H LYS 54 9.599 -13.021 11.646 426 HA LYS 54 HA LYS 54 8.797 -15.680 12.538 427 HB2 LYS 54 HB2 LYS 54 11.475 -15.576 13.106 428 HB3 LYS 54 HB3 LYS 54 10.786 -16.157 11.599 429 HG2 LYS 54 HG2 LYS 54 11.516 -13.266 11.967 430 HG3 LYS 54 HG3 LYS 54 12.716 -14.472 11.489 431 HD2 LYS 54 HD2 LYS 54 11.445 -15.030 9.511 432 HD3 LYS 54 HD3 LYS 54 10.117 -13.983 10.017 433 HE2 LYS 54 HE2 LYS 54 11.557 -12.030 9.803 434 HE3 LYS 54 HE3 LYS 54 12.912 -13.061 9.340 435 HZ1 LYS 54 HZ1 LYS 54 11.680 -13.738 7.378 436 HZ2 LYS 54 HZ2 LYS 54 11.853 -12.060 7.411 437 HZ3 LYS 54 HZ3 LYS 54 10.373 -12.764 7.827 438 H ASN 55 H ASN 55 9.057 -12.648 13.933 439 HA ASN 55 HA ASN 55 8.736 -13.706 16.587 440 HB2 ASN 55 HB2 ASN 55 10.664 -12.490 17.585 441 HB3 ASN 55 HB3 ASN 55 11.164 -13.778 16.490 442 HD21 ASN 55 HD21 ASN 55 12.174 -13.244 14.564 443 HD22 ASN 55 HD22 ASN 55 12.751 -11.650 14.229 444 H THR 56 H THR 56 8.285 -12.011 18.202 445 HA THR 56 HA THR 56 6.543 -10.011 17.122 446 HB THR 56 HB THR 56 6.133 -9.351 19.455 447 HG1 THR 56 HG1 THR 56 7.557 -9.787 20.963 448 HG21 THR 56 HG21 THR 56 4.934 -11.296 18.563 449 HG22 THR 56 HG22 THR 56 5.272 -11.497 20.283 450 HG23 THR 56 HG23 THR 56 6.245 -12.353 19.088 451 H ASP 57 H ASP 57 9.859 -9.987 18.122 452 HA ASP 57 HA ASP 57 10.176 -7.243 18.747 453 HB2 ASP 57 HB2 ASP 57 11.826 -9.043 19.295 454 HB3 ASP 57 HB3 ASP 57 12.221 -9.164 17.585 455 H LYS 58 H LYS 58 10.471 -9.095 15.786 456 HA LYS 58 HA LYS 58 11.203 -7.099 13.992 457 HB2 LYS 58 HB2 LYS 58 11.301 -9.389 13.330 458 HB3 LYS 58 HB3 LYS 58 9.599 -9.640 13.693 459 HG2 LYS 58 HG2 LYS 58 9.994 -9.562 11.298 460 HG3 LYS 58 HG3 LYS 58 8.969 -8.226 11.833 461 HD2 LYS 58 HD2 LYS 58 10.908 -6.717 11.779 462 HD3 LYS 58 HD3 LYS 58 11.943 -8.056 11.281 463 HE2 LYS 58 HE2 LYS 58 10.651 -8.283 9.210 464 HE3 LYS 58 HE3 LYS 58 9.609 -6.948 9.709 465 HZ1 LYS 58 HZ1 LYS 58 11.313 -6.203 8.181 466 HZ2 LYS 58 HZ2 LYS 58 12.529 -6.778 9.203 467 HZ3 LYS 58 HZ3 LYS 58 11.544 -5.498 9.700 468 H LEU 59 H LEU 59 7.980 -8.110 15.098 469 HA LEU 59 HA LEU 59 6.480 -6.434 13.385 470 HB2 LEU 59 HB2 LEU 59 5.468 -8.336 14.479 471 HB3 LEU 59 HB3 LEU 59 5.805 -7.659 16.062 472 HG LEU 59 HG LEU 59 4.198 -5.850 15.655 473 HD11 LEU 59 HD11 LEU 59 4.430 -5.617 13.254 474 HD12 LEU 59 HD12 LEU 59 2.743 -5.907 13.673 475 HD13 LEU 59 HD13 LEU 59 3.723 -7.213 13.004 476 HD21 LEU 59 HD21 LEU 59 3.036 -8.584 15.101 477 HD22 LEU 59 HD22 LEU 59 2.152 -7.182 15.709 478 HD23 LEU 59 HD23 LEU 59 3.413 -7.924 16.692 479 H THR 60 H THR 60 7.518 -5.970 16.776 480 HA THR 60 HA THR 60 6.296 -3.441 17.116 481 HB THR 60 HB THR 60 7.770 -3.154 19.071 482 HG1 THR 60 HG1 THR 60 9.016 -5.452 19.232 483 HG21 THR 60 HG21 THR 60 5.752 -4.538 19.283 484 HG22 THR 60 HG22 THR 60 7.046 -5.127 20.327 485 HG23 THR 60 HG23 THR 60 6.680 -5.964 18.818 486 H THR 61 H THR 61 9.342 -4.396 15.695 487 HA THR 61 HA THR 61 10.694 -1.932 15.762 488 HB THR 61 HB THR 61 10.862 -4.163 13.715 489 HG1 THR 61 HG1 THR 61 11.512 -4.441 16.063 490 HG21 THR 61 HG21 THR 61 11.721 -2.094 12.729 491 HG22 THR 61 HG22 THR 61 13.040 -3.210 13.080 492 HG23 THR 61 HG23 THR 61 12.746 -1.834 14.142 493 H LEU 62 H LEU 62 8.398 -3.256 13.407 494 HA LEU 62 HA LEU 62 8.670 -1.209 11.477 495 HB2 LEU 62 HB2 LEU 62 6.199 -2.871 11.970 496 HB3 LEU 62 HB3 LEU 62 6.665 -2.081 10.476 497 HG LEU 62 HG LEU 62 7.840 -4.553 11.729 498 HD11 LEU 62 HD11 LEU 62 7.390 -5.513 9.526 499 HD12 LEU 62 HD12 LEU 62 6.751 -3.961 8.981 500 HD13 LEU 62 HD13 LEU 62 5.928 -4.854 10.261 501 HD21 LEU 62 HD21 LEU 62 9.740 -3.175 11.130 502 HD22 LEU 62 HD22 LEU 62 9.063 -2.894 9.526 503 HD23 LEU 62 HD23 LEU 62 9.580 -4.514 9.994 504 H MET 63 H MET 63 6.535 -1.568 14.272 505 HA MET 63 HA MET 63 4.831 0.611 13.877 506 HB2 MET 63 HB2 MET 63 5.952 -0.300 16.538 507 HB3 MET 63 HB3 MET 63 4.461 0.592 16.276 508 HG2 MET 63 HG2 MET 63 3.485 -1.318 15.147 509 HG3 MET 63 HG3 MET 63 4.997 -2.214 15.324 510 HE1 MET 63 HE1 MET 63 2.306 -3.505 16.289 511 HE2 MET 63 HE2 MET 63 2.802 -4.137 17.860 512 HE3 MET 63 HE3 MET 63 3.898 -4.239 16.483 513 H ASP 64 H ASP 64 7.946 0.476 15.574 514 HA ASP 64 HA ASP 64 8.134 3.154 16.344 515 HB2 ASP 64 HB2 ASP 64 9.574 1.145 17.039 516 HB3 ASP 64 HB3 ASP 64 10.484 1.423 15.560 517 H LYS 65 H LYS 65 9.287 1.545 13.377 518 HA LYS 65 HA LYS 65 10.512 3.734 12.131 519 HB2 LYS 65 HB2 LYS 65 9.090 1.353 10.917 520 HB3 LYS 65 HB3 LYS 65 10.072 2.477 9.992 521 HG2 LYS 65 HG2 LYS 65 11.994 1.881 11.513 522 HG3 LYS 65 HG3 LYS 65 10.974 0.602 12.170 523 HD2 LYS 65 HD2 LYS 65 12.447 -0.301 10.458 524 HD3 LYS 65 HD3 LYS 65 10.771 -0.376 9.912 525 HE2 LYS 65 HE2 LYS 65 11.083 1.566 8.516 526 HE3 LYS 65 HE3 LYS 65 12.705 1.821 9.161 527 HZ1 LYS 65 HZ1 LYS 65 12.760 0.778 6.985 528 HZ2 LYS 65 HZ2 LYS 65 11.841 -0.520 7.551 529 HZ3 LYS 65 HZ3 LYS 65 13.394 -0.261 8.156 530 H LEU 66 H LEU 66 7.124 2.709 12.070 531 HA LEU 66 HA LEU 66 6.270 4.732 10.217 532 HB2 LEU 66 HB2 LEU 66 4.718 2.969 12.119 533 HB3 LEU 66 HB3 LEU 66 3.992 3.983 10.883 534 HG LEU 66 HG LEU 66 5.978 1.813 10.213 535 HD11 LEU 66 HD11 LEU 66 4.123 0.758 11.380 536 HD12 LEU 66 HD12 LEU 66 4.072 0.377 9.659 537 HD13 LEU 66 HD13 LEU 66 2.971 1.582 10.330 538 HD21 LEU 66 HD21 LEU 66 3.901 3.290 8.585 539 HD22 LEU 66 HD22 LEU 66 4.924 1.980 7.991 540 HD23 LEU 66 HD23 LEU 66 5.650 3.504 8.498 541 H ARG 67 H ARG 67 6.530 4.525 13.693 542 HA ARG 67 HA ARG 67 4.657 6.580 14.315 543 HB2 ARG 67 HB2 ARG 67 5.361 4.689 15.814 544 HB3 ARG 67 HB3 ARG 67 6.890 5.523 16.058 545 HG2 ARG 67 HG2 ARG 67 5.816 7.342 17.166 546 HG3 ARG 67 HG3 ARG 67 4.217 6.755 16.705 547 HD2 ARG 67 HD2 ARG 67 6.150 5.372 18.568 548 HD3 ARG 67 HD3 ARG 67 4.696 6.248 19.046 549 HE ARG 67 HE ARG 67 3.764 4.371 17.326 550 HH11 ARG 67 HH11 ARG 67 5.656 4.259 20.191 551 HH12 ARG 67 HH12 ARG 67 5.139 2.663 20.604 552 HH21 ARG 67 HH21 ARG 67 3.075 2.319 17.881 553 HH22 ARG 67 HH22 ARG 67 3.712 1.563 19.301 554 H LYS 68 H LYS 68 7.728 6.821 12.986 555 HA LYS 68 HA LYS 68 8.694 9.151 14.338 556 HB2 LYS 68 HB2 LYS 68 9.440 8.206 11.561 557 HB3 LYS 68 HB3 LYS 68 10.380 9.257 12.613 558 HG2 LYS 68 HG2 LYS 68 9.801 6.325 13.018 559 HG3 LYS 68 HG3 LYS 68 11.352 7.066 12.613 560 HD2 LYS 68 HD2 LYS 68 11.354 8.230 14.778 561 HD3 LYS 68 HD3 LYS 68 9.806 7.483 15.181 562 HE2 LYS 68 HE2 LYS 68 10.919 5.250 14.919 563 HE3 LYS 68 HE3 LYS 68 12.453 6.098 14.744 564 HZ1 LYS 68 HZ1 LYS 68 10.690 6.390 17.109 565 HZ2 LYS 68 HZ2 LYS 68 12.289 6.917 16.949 566 HZ3 LYS 68 HZ3 LYS 68 11.944 5.260 17.016 567 H VAL 69 H VAL 69 6.280 8.709 11.969 568 HA VAL 69 HA VAL 69 6.693 11.143 10.506 569 HB VAL 69 HB VAL 69 4.319 9.268 10.516 570 HG11 VAL 69 HG11 VAL 69 5.085 11.454 8.575 571 HG12 VAL 69 HG12 VAL 69 3.715 11.475 9.685 572 HG13 VAL 69 HG13 VAL 69 3.759 10.311 8.360 573 HG21 VAL 69 HG21 VAL 69 5.286 8.341 8.470 574 HG22 VAL 69 HG22 VAL 69 6.399 8.169 9.826 575 HG23 VAL 69 HG23 VAL 69 6.670 9.425 8.619 576 H GLN 70 H GLN 70 6.078 13.104 11.081 577 HA GLN 70 HA GLN 70 4.865 13.796 13.477 578 HB2 GLN 70 HB2 GLN 70 4.636 16.059 12.537 579 HB3 GLN 70 HB3 GLN 70 6.206 15.356 12.172 580 HG2 GLN 70 HG2 GLN 70 5.689 15.054 9.915 581 HG3 GLN 70 HG3 GLN 70 3.956 15.193 10.197 582 HE21 GLN 70 HE21 GLN 70 6.950 16.955 9.868 583 HE22 GLN 70 HE22 GLN 70 6.227 18.503 9.618 584 H GLY 71 H GLY 71 3.332 13.163 10.374 585 HA2 GLY 71 HA2 GLY 71 0.820 14.375 11.057 586 HA3 GLY 71 HA3 GLY 71 1.148 13.380 9.652 587 H VAL 72 H VAL 72 2.172 11.227 11.608 588 HA VAL 72 HA VAL 72 -0.452 9.980 11.907 589 HB VAL 72 HB VAL 72 2.289 8.780 12.377 590 HG11 VAL 72 HG11 VAL 72 1.131 6.623 12.302 591 HG12 VAL 72 HG12 VAL 72 -0.417 7.448 12.118 592 HG13 VAL 72 HG13 VAL 72 0.505 7.627 13.610 593 HG21 VAL 72 HG21 VAL 72 1.994 7.704 10.198 594 HG22 VAL 72 HG22 VAL 72 1.973 9.460 10.040 595 HG23 VAL 72 HG23 VAL 72 0.463 8.550 9.973 596 H PHE 73 H PHE 73 -1.461 9.604 13.805 597 HA PHE 73 HA PHE 73 0.019 10.232 16.278 598 HB2 PHE 73 HB2 PHE 73 -2.473 10.703 17.115 599 HB3 PHE 73 HB3 PHE 73 -1.479 11.930 16.355 600 HD1 PHE 73 HD1 PHE 73 -4.356 9.692 15.892 601 HD2 PHE 73 HD2 PHE 73 -1.979 12.786 14.173 602 HE1 PHE 73 HE1 PHE 73 -6.094 10.088 14.195 603 HE2 PHE 73 HE2 PHE 73 -3.713 13.180 12.477 604 HZ PHE 73 HZ PHE 73 -5.771 11.838 12.484 605 H THR 74 H THR 74 -1.552 7.753 14.620 606 HA THR 74 HA THR 74 -1.481 6.137 17.088 607 HB THR 74 HB THR 74 -3.460 4.964 16.618 608 HG1 THR 74 HG1 THR 74 -4.482 4.969 14.647 609 HG21 THR 74 HG21 THR 74 -3.960 7.205 17.463 610 HG22 THR 74 HG22 THR 74 -5.222 6.666 16.354 611 HG23 THR 74 HG23 THR 74 -4.007 7.826 15.813 612 H VAL 75 H VAL 75 0.071 4.665 16.866 613 HA VAL 75 HA VAL 75 0.062 3.008 14.423 614 HB VAL 75 HB VAL 75 2.594 3.757 15.919 615 HG11 VAL 75 HG11 VAL 75 2.673 1.560 14.866 616 HG12 VAL 75 HG12 VAL 75 3.743 2.689 14.035 617 HG13 VAL 75 HG13 VAL 75 2.184 2.265 13.325 618 HG21 VAL 75 HG21 VAL 75 1.624 4.788 13.246 619 HG22 VAL 75 HG22 VAL 75 3.205 5.105 13.962 620 HG23 VAL 75 HG23 VAL 75 1.746 5.721 14.739 621 H GLU 76 H GLU 76 -0.844 1.170 15.210 622 HA GLU 76 HA GLU 76 0.283 -0.038 17.651 623 HB2 GLU 76 HB2 GLU 76 -2.685 0.314 17.128 624 HB3 GLU 76 HB3 GLU 76 -1.984 -0.563 18.481 625 HG2 GLU 76 HG2 GLU 76 -0.969 1.524 19.294 626 HG3 GLU 76 HG3 GLU 76 -1.702 2.392 17.947 627 H ARG 77 H ARG 77 -0.712 -2.289 17.987 628 HA ARG 77 HA ARG 77 -0.400 -3.794 15.522 629 HB2 ARG 77 HB2 ARG 77 0.767 -4.499 17.560 630 HB3 ARG 77 HB3 ARG 77 -0.770 -4.685 18.392 631 HG2 ARG 77 HG2 ARG 77 -1.382 -6.477 16.811 632 HG3 ARG 77 HG3 ARG 77 0.198 -6.311 16.041 633 HD2 ARG 77 HD2 ARG 77 0.214 -8.166 17.614 634 HD3 ARG 77 HD3 ARG 77 1.282 -6.878 18.170 635 HE ARG 77 HE ARG 77 -1.453 -7.049 19.229 636 HH11 ARG 77 HH11 ARG 77 1.956 -7.225 19.756 637 HH12 ARG 77 HH12 ARG 77 1.787 -7.232 21.477 638 HH21 ARG 77 HH21 ARG 77 -1.635 -7.044 21.430 639 HH22 ARG 77 HH22 ARG 77 -0.209 -7.134 22.406 640 H LEU 78 H LEU 78 -1.933 -5.185 14.639 641 HA LEU 78 HA LEU 78 -4.718 -4.786 15.467 642 HB2 LEU 78 HB2 LEU 78 -3.500 -6.027 12.994 643 HB3 LEU 78 HB3 LEU 78 -5.224 -6.016 13.321 644 HG LEU 78 HG LEU 78 -3.515 -3.541 12.992 645 HD11 LEU 78 HD11 LEU 78 -5.473 -4.811 11.075 646 HD12 LEU 78 HD12 LEU 78 -3.719 -4.765 10.891 647 HD13 LEU 78 HD13 LEU 78 -4.648 -3.268 10.847 648 HD21 LEU 78 HD21 LEU 78 -6.506 -3.875 13.271 649 HD22 LEU 78 HD22 LEU 78 -5.679 -2.365 12.892 650 HD23 LEU 78 HD23 LEU 78 -5.416 -3.144 14.450 651 H SER 79 H SER 79 -5.269 -6.126 17.090 652 HA SER 79 HA SER 79 -4.181 -8.788 17.344 653 HB2 SER 79 HB2 SER 79 -5.672 -8.929 19.351 654 HB3 SER 79 HB3 SER 79 -4.597 -7.532 19.374 655 HG SER 79 HG SER 79 -7.219 -7.541 19.596 656 H ASN 80 H ASN 80 -7.547 -7.583 17.089 657 HA ASN 80 HA ASN 80 -8.536 -10.182 16.370 658 HB2 ASN 80 HB2 ASN 80 -9.910 -8.557 17.639 659 HB3 ASN 80 HB3 ASN 80 -9.929 -7.490 16.241 660 HD21 ASN 80 HD21 ASN 80 -11.110 -10.471 17.582 661 HD22 ASN 80 HD22 ASN 80 -12.363 -10.723 16.422 662 H LEU 81 H LEU 81 -7.930 -10.993 14.463 663 HA LEU 81 HA LEU 81 -7.831 -9.249 12.100 664 HB2 LEU 81 HB2 LEU 81 -6.734 -12.032 12.528 665 HB3 LEU 81 HB3 LEU 81 -6.570 -11.102 11.051 666 HG LEU 81 HG LEU 81 -5.349 -10.459 13.742 667 HD11 LEU 81 HD11 LEU 81 -4.083 -11.154 11.080 668 HD12 LEU 81 HD12 LEU 81 -4.202 -12.223 12.481 669 HD13 LEU 81 HD13 LEU 81 -3.223 -10.759 12.570 670 HD21 LEU 81 HD21 LEU 81 -4.310 -8.526 12.628 671 HD22 LEU 81 HD22 LEU 81 -6.067 -8.388 12.674 672 HD23 LEU 81 HD23 LEU 81 -5.259 -8.856 11.178 673 H GLU 82 H GLU 82 -9.187 -9.465 10.411 674 HA GLU 82 HA GLU 82 -11.382 -11.390 10.643 675 HB2 GLU 82 HB2 GLU 82 -12.516 -9.982 8.983 676 HB3 GLU 82 HB3 GLU 82 -11.955 -9.023 10.345 677 HG2 GLU 82 HG2 GLU 82 -10.022 -8.287 9.013 678 HG3 GLU 82 HG3 GLU 82 -10.627 -9.218 7.645 679 H HIS 83 H HIS 83 -8.720 -12.233 9.774 680 HA HIS 83 HA HIS 83 -8.815 -12.516 6.893 681 HB2 HIS 83 HB2 HIS 83 -6.823 -13.454 8.963 682 HB3 HIS 83 HB3 HIS 83 -6.659 -13.768 7.243 683 HD1 HIS 83 HD1 HIS 83 -5.326 -12.093 6.005 684 HD2 HIS 83 HD2 HIS 83 -6.995 -10.488 9.454 685 HE1 HIS 83 HE1 HIS 83 -4.422 -9.759 6.166 686 HE2 HIS 83 HE2 HIS 83 -5.339 -8.853 8.324 687 H HIS 84 H HIS 84 -10.933 -13.677 7.171 688 HA HIS 84 HA HIS 84 -11.136 -16.338 8.023 689 HB2 HIS 84 HB2 HIS 84 -13.056 -16.382 6.293 690 HB3 HIS 84 HB3 HIS 84 -13.159 -15.219 7.609 691 HD1 HIS 84 HD1 HIS 84 -13.054 -12.727 7.010 692 HD2 HIS 84 HD2 HIS 84 -12.577 -15.237 3.728 693 HE1 HIS 84 HE1 HIS 84 -13.237 -11.244 4.995 694 HE2 HIS 84 HE2 HIS 84 -13.091 -12.799 3.029 695 H HIS 85 H HIS 85 -10.641 -18.294 7.115 696 HA HIS 85 HA HIS 85 -9.057 -18.208 4.617 697 HB2 HIS 85 HB2 HIS 85 -8.883 -20.111 6.965 698 HB3 HIS 85 HB3 HIS 85 -7.931 -20.255 5.492 699 HD1 HIS 85 HD1 HIS 85 -8.053 -18.522 8.737 700 HD2 HIS 85 HD2 HIS 85 -5.979 -18.171 5.155 701 HE1 HIS 85 HE1 HIS 85 -6.085 -17.056 9.246 702 HE2 HIS 85 HE2 HIS 85 -4.740 -17.036 7.122 703 H HIS 86 H HIS 86 -9.986 -19.107 2.883 704 HA HIS 86 HA HIS 86 -10.814 -21.823 2.921 705 HB2 HIS 86 HB2 HIS 86 -13.140 -21.580 2.191 706 HB3 HIS 86 HB3 HIS 86 -12.910 -20.874 3.784 707 HD1 HIS 86 HD1 HIS 86 -13.236 -18.334 4.012 708 HD2 HIS 86 HD2 HIS 86 -13.818 -19.760 0.155 709 HE1 HIS 86 HE1 HIS 86 -14.312 -16.451 2.755 710 HE2 HIS 86 HE2 HIS 86 -14.860 -17.419 0.504 711 H HIS 87 H HIS 87 -10.089 -22.634 1.071 712 HA HIS 87 HA HIS 87 -9.935 -20.899 -1.317 713 HB2 HIS 87 HB2 HIS 87 -7.752 -21.684 -0.632 714 HB3 HIS 87 HB3 HIS 87 -8.325 -23.346 -0.538 715 HD1 HIS 87 HD1 HIS 87 -7.746 -20.648 -3.157 716 HD2 HIS 87 HD2 HIS 87 -7.988 -24.784 -2.837 717 HE1 HIS 87 HE1 HIS 87 -7.113 -21.535 -5.414 718 HE2 HIS 87 HE2 HIS 87 -7.375 -24.026 -5.231 719 H HIS 88 H HIS 88 -11.081 -21.405 -3.103 720 HA HIS 88 HA HIS 88 -12.686 -23.868 -3.078 721 HB2 HIS 88 HB2 HIS 88 -13.899 -21.753 -3.378 722 HB3 HIS 88 HB3 HIS 88 -12.938 -21.391 -4.809 723 HD1 HIS 88 HD1 HIS 88 -13.859 -22.200 -6.986 724 HD2 HIS 88 HD2 HIS 88 -15.604 -24.116 -3.738 725 HE1 HIS 88 HE1 HIS 88 -15.702 -23.604 -7.945 726 HE2 HIS 88 HE2 HIS 88 -16.628 -24.877 -5.987 727 H1 MET 1 H1 MET 1 -5.991 23.981 -15.616 728 H2 MET 1 H2 MET 1 -7.339 24.182 -14.616 729 H3 MET 1 H3 MET 1 -7.520 23.502 -16.154 730 HA MET 1 HA MET 1 -6.289 21.571 -15.543 731 HB2 MET 1 HB2 MET 1 -5.992 22.936 -12.853 732 HB3 MET 1 HB3 MET 1 -5.528 21.273 -13.190 733 HG2 MET 1 HG2 MET 1 -3.593 22.720 -13.211 734 HG3 MET 1 HG3 MET 1 -3.886 22.063 -14.821 735 HE1 MET 1 HE1 MET 1 -4.879 26.393 -13.563 736 HE2 MET 1 HE2 MET 1 -4.123 25.206 -12.498 737 HE3 MET 1 HE3 MET 1 -5.801 25.000 -12.998 738 H THR 2 H THR 2 -7.002 19.996 -13.548 739 HA THR 2 HA THR 2 -9.484 20.425 -12.284 740 HB THR 2 HB THR 2 -10.410 20.257 -14.578 741 HG1 THR 2 HG1 THR 2 -11.965 19.479 -13.350 742 HG21 THR 2 HG21 THR 2 -8.718 18.794 -15.577 743 HG22 THR 2 HG22 THR 2 -10.334 18.118 -15.783 744 HG23 THR 2 HG23 THR 2 -9.253 17.460 -14.554 745 H ASP 3 H ASP 3 -10.466 18.015 -11.773 746 HA ASP 3 HA ASP 3 -8.386 16.017 -11.525 747 HB2 ASP 3 HB2 ASP 3 -8.581 15.842 -9.053 748 HB3 ASP 3 HB3 ASP 3 -7.869 17.360 -9.579 749 H PHE 4 H PHE 4 -9.164 13.956 -11.279 750 HA PHE 4 HA PHE 4 -11.786 13.537 -10.108 751 HB2 PHE 4 HB2 PHE 4 -12.650 12.128 -11.868 752 HB3 PHE 4 HB3 PHE 4 -12.262 13.702 -12.542 753 HD1 PHE 4 HD1 PHE 4 -11.283 10.157 -12.408 754 HD2 PHE 4 HD2 PHE 4 -10.577 13.934 -14.254 755 HE1 PHE 4 HE1 PHE 4 -9.978 9.049 -14.174 756 HE2 PHE 4 HE2 PHE 4 -9.274 12.826 -16.024 757 HZ PHE 4 HZ PHE 4 -8.967 10.379 -15.979 758 H LEU 5 H LEU 5 -12.067 11.429 -9.256 759 HA LEU 5 HA LEU 5 -9.578 10.242 -8.430 760 HB2 LEU 5 HB2 LEU 5 -11.473 10.507 -6.886 761 HB3 LEU 5 HB3 LEU 5 -12.428 9.414 -7.868 762 HG LEU 5 HG LEU 5 -10.901 7.564 -7.320 763 HD11 LEU 5 HD11 LEU 5 -8.839 8.846 -7.038 764 HD12 LEU 5 HD12 LEU 5 -9.161 7.840 -5.627 765 HD13 LEU 5 HD13 LEU 5 -9.481 9.574 -5.565 766 HD21 LEU 5 HD21 LEU 5 -11.891 9.042 -4.881 767 HD22 LEU 5 HD22 LEU 5 -11.504 7.323 -4.970 768 HD23 LEU 5 HD23 LEU 5 -12.852 7.972 -5.904 769 H ALA 6 H ALA 6 -8.549 9.108 -9.953 770 HA ALA 6 HA ALA 6 -10.002 7.253 -11.686 771 HB1 ALA 6 HB1 ALA 6 -7.926 7.097 -12.940 772 HB2 ALA 6 HB2 ALA 6 -7.091 8.057 -11.717 773 HB3 ALA 6 HB3 ALA 6 -8.365 8.787 -12.692 774 H GLY 7 H GLY 7 -9.779 5.052 -11.599 775 HA2 GLY 7 HA2 GLY 7 -8.187 3.982 -9.347 776 HA3 GLY 7 HA3 GLY 7 -9.706 3.298 -9.897 777 H ILE 8 H ILE 8 -6.878 2.262 -9.612 778 HA ILE 8 HA ILE 8 -6.791 0.931 -12.248 779 HB ILE 8 HB ILE 8 -4.357 1.490 -10.522 780 HG12 ILE 8 HG12 ILE 8 -5.214 2.911 -13.064 781 HG13 ILE 8 HG13 ILE 8 -5.279 3.602 -11.447 782 HG21 ILE 8 HG21 ILE 8 -4.652 0.408 -13.328 783 HG22 ILE 8 HG22 ILE 8 -4.113 -0.480 -11.901 784 HG23 ILE 8 HG23 ILE 8 -3.117 0.817 -12.561 785 HD11 ILE 8 HD11 ILE 8 -3.353 4.414 -12.686 786 HD12 ILE 8 HD12 ILE 8 -2.777 2.762 -12.903 787 HD13 ILE 8 HD13 ILE 8 -2.847 3.467 -11.288 788 H ARG 9 H ARG 9 -6.460 -1.328 -12.172 789 HA ARG 9 HA ARG 9 -6.192 -2.494 -9.467 790 HB2 ARG 9 HB2 ARG 9 -8.466 -2.828 -10.525 791 HB3 ARG 9 HB3 ARG 9 -7.672 -3.806 -11.755 792 HG2 ARG 9 HG2 ARG 9 -6.840 -5.306 -9.952 793 HG3 ARG 9 HG3 ARG 9 -7.773 -4.364 -8.788 794 HD2 ARG 9 HD2 ARG 9 -9.817 -4.892 -10.161 795 HD3 ARG 9 HD3 ARG 9 -8.817 -6.012 -11.089 796 HE ARG 9 HE ARG 9 -9.099 -6.307 -8.173 797 HH11 ARG 9 HH11 ARG 9 -9.272 -7.638 -11.342 798 HH12 ARG 9 HH12 ARG 9 -9.834 -9.172 -10.780 799 HH21 ARG 9 HH21 ARG 9 -9.804 -8.279 -7.466 800 HH22 ARG 9 HH22 ARG 9 -10.119 -9.538 -8.613 801 H ILE 10 H ILE 10 -4.469 -3.714 -9.169 802 HA ILE 10 HA ILE 10 -2.984 -4.718 -11.522 803 HB ILE 10 HB ILE 10 -1.888 -4.152 -8.754 804 HG12 ILE 10 HG12 ILE 10 -1.601 -2.428 -11.231 805 HG13 ILE 10 HG13 ILE 10 -2.717 -2.083 -9.912 806 HG21 ILE 10 HG21 ILE 10 -0.598 -5.790 -10.003 807 HG22 ILE 10 HG22 ILE 10 0.303 -4.282 -9.862 808 HG23 ILE 10 HG23 ILE 10 -0.497 -4.693 -11.380 809 HD11 ILE 10 HD11 ILE 10 -0.722 -0.749 -9.705 810 HD12 ILE 10 HD12 ILE 10 0.284 -2.198 -9.722 811 HD13 ILE 10 HD13 ILE 10 -0.816 -1.903 -8.375 812 H VAL 11 H VAL 11 -3.186 -6.883 -11.758 813 HA VAL 11 HA VAL 11 -3.226 -8.534 -9.307 814 HB VAL 11 HB VAL 11 -4.685 -9.041 -11.908 815 HG11 VAL 11 HG11 VAL 11 -5.421 -11.173 -10.946 816 HG12 VAL 11 HG12 VAL 11 -4.366 -10.913 -9.557 817 HG13 VAL 11 HG13 VAL 11 -3.671 -11.137 -11.163 818 HG21 VAL 11 HG21 VAL 11 -5.815 -7.549 -10.318 819 HG22 VAL 11 HG22 VAL 11 -5.665 -8.776 -9.056 820 HG23 VAL 11 HG23 VAL 11 -6.670 -9.083 -10.474 821 H GLY 12 H GLY 12 -1.385 -9.516 -9.032 822 HA2 GLY 12 HA2 GLY 12 -0.010 -10.725 -11.345 823 HA3 GLY 12 HA3 GLY 12 0.880 -9.661 -10.267 824 H GLU 13 H GLU 13 1.831 -12.150 -10.621 825 HA GLU 13 HA GLU 13 0.755 -14.069 -8.774 826 HB2 GLU 13 HB2 GLU 13 2.714 -15.422 -9.435 827 HB3 GLU 13 HB3 GLU 13 1.833 -14.794 -10.823 828 HG2 GLU 13 HG2 GLU 13 3.526 -12.943 -10.952 829 HG3 GLU 13 HG3 GLU 13 4.446 -13.790 -9.709 830 H ASP 14 H ASP 14 1.520 -14.702 -6.779 831 HA ASP 14 HA ASP 14 2.921 -12.889 -5.147 832 HB2 ASP 14 HB2 ASP 14 2.132 -15.770 -4.835 833 HB3 ASP 14 HB3 ASP 14 3.193 -15.028 -3.646 834 H LYS 15 H LYS 15 4.918 -12.328 -6.059 835 HA LYS 15 HA LYS 15 6.997 -14.422 -5.965 836 HB2 LYS 15 HB2 LYS 15 7.160 -11.655 -7.161 837 HB3 LYS 15 HB3 LYS 15 8.454 -12.833 -7.151 838 HG2 LYS 15 HG2 LYS 15 5.827 -13.096 -8.592 839 HG3 LYS 15 HG3 LYS 15 7.383 -12.691 -9.311 840 HD2 LYS 15 HD2 LYS 15 6.920 -15.267 -7.824 841 HD3 LYS 15 HD3 LYS 15 6.581 -15.096 -9.545 842 HE2 LYS 15 HE2 LYS 15 8.755 -16.055 -9.330 843 HE3 LYS 15 HE3 LYS 15 8.965 -14.390 -9.863 844 HZ1 LYS 15 HZ1 LYS 15 9.539 -13.764 -7.621 845 HZ2 LYS 15 HZ2 LYS 15 10.541 -15.020 -8.132 846 HZ3 LYS 15 HZ3 LYS 15 9.264 -15.339 -7.068 847 H ASN 16 H ASN 16 8.666 -14.303 -4.596 848 HA ASN 16 HA ASN 16 9.598 -13.504 -2.506 849 HB2 ASN 16 HB2 ASN 16 10.733 -12.072 -4.913 850 HB3 ASN 16 HB3 ASN 16 11.587 -12.319 -3.386 851 HD21 ASN 16 HD21 ASN 16 11.942 -13.271 -6.251 852 HD22 ASN 16 HD22 ASN 16 12.187 -14.974 -6.086 853 H GLY 17 H GLY 17 9.230 -10.664 -4.620 854 HA2 GLY 17 HA2 GLY 17 8.286 -9.075 -2.324 855 HA3 GLY 17 HA3 GLY 17 9.748 -8.550 -3.141 856 H MET 18 H MET 18 7.005 -9.961 -4.831 857 HA MET 18 HA MET 18 6.815 -7.787 -6.645 858 HB2 MET 18 HB2 MET 18 5.398 -10.344 -6.206 859 HB3 MET 18 HB3 MET 18 4.433 -9.097 -6.975 860 HG2 MET 18 HG2 MET 18 7.138 -9.965 -7.958 861 HG3 MET 18 HG3 MET 18 5.610 -10.619 -8.548 862 HE1 MET 18 HE1 MET 18 3.817 -9.229 -9.871 863 HE2 MET 18 HE2 MET 18 3.955 -7.503 -10.206 864 HE3 MET 18 HE3 MET 18 3.728 -8.066 -8.549 865 H THR 19 H THR 19 4.680 -8.771 -3.958 866 HA THR 19 HA THR 19 2.784 -6.715 -4.223 867 HB THR 19 HB THR 19 2.249 -7.119 -1.836 868 HG1 THR 19 HG1 THR 19 3.533 -8.765 -0.758 869 HG21 THR 19 HG21 THR 19 1.679 -9.495 -2.029 870 HG22 THR 19 HG22 THR 19 2.795 -9.662 -3.384 871 HG23 THR 19 HG23 THR 19 1.359 -8.649 -3.542 872 H ASN 20 H ASN 20 5.964 -6.727 -2.767 873 HA ASN 20 HA ASN 20 5.693 -4.221 -1.393 874 HB2 ASN 20 HB2 ASN 20 8.167 -5.799 -2.155 875 HB3 ASN 20 HB3 ASN 20 8.143 -4.419 -1.060 876 HD21 ASN 20 HD21 ASN 20 7.412 -4.689 1.009 877 HD22 ASN 20 HD22 ASN 20 7.046 -6.234 1.687 878 H GLN 21 H GLN 21 7.291 -5.275 -4.402 879 HA GLN 21 HA GLN 21 8.338 -2.726 -5.048 880 HB2 GLN 21 HB2 GLN 21 8.987 -3.652 -7.133 881 HB3 GLN 21 HB3 GLN 21 9.171 -4.924 -5.942 882 HG2 GLN 21 HG2 GLN 21 7.095 -5.948 -6.683 883 HG3 GLN 21 HG3 GLN 21 6.843 -4.641 -7.838 884 HE21 GLN 21 HE21 GLN 21 8.706 -7.471 -7.093 885 HE22 GLN 21 HE22 GLN 21 9.402 -7.660 -8.659 886 H ILE 22 H ILE 22 5.343 -4.365 -5.962 887 HA ILE 22 HA ILE 22 4.490 -2.691 -8.015 888 HB ILE 22 HB ILE 22 3.026 -4.406 -6.029 889 HG12 ILE 22 HG12 ILE 22 4.232 -5.500 -7.856 890 HG13 ILE 22 HG13 ILE 22 2.495 -5.716 -8.042 891 HG21 ILE 22 HG21 ILE 22 0.915 -4.011 -7.240 892 HG22 ILE 22 HG22 ILE 22 1.697 -2.715 -8.150 893 HG23 ILE 22 HG23 ILE 22 1.493 -2.570 -6.404 894 HD11 ILE 22 HD11 ILE 22 2.449 -3.955 -9.726 895 HD12 ILE 22 HD12 ILE 22 3.561 -5.248 -10.171 896 HD13 ILE 22 HD13 ILE 22 4.187 -3.726 -9.536 897 H THR 23 H THR 23 3.603 -2.456 -4.547 898 HA THR 23 HA THR 23 2.280 0.056 -4.950 899 HB THR 23 HB THR 23 3.146 -1.095 -2.283 900 HG1 THR 23 HG1 THR 23 1.795 -2.657 -2.828 901 HG21 THR 23 HG21 THR 23 0.940 0.816 -3.081 902 HG22 THR 23 HG22 THR 23 2.398 1.220 -2.174 903 HG23 THR 23 HG23 THR 23 1.181 0.163 -1.460 904 H GLY 24 H GLY 24 5.503 -0.947 -4.008 905 HA2 GLY 24 HA2 GLY 24 6.557 1.489 -3.102 906 HA3 GLY 24 HA3 GLY 24 7.475 0.223 -3.902 907 H VAL 25 H VAL 25 6.193 0.264 -6.423 908 HA VAL 25 HA VAL 25 7.387 2.549 -7.659 909 HB VAL 25 HB VAL 25 5.502 0.477 -8.822 910 HG11 VAL 25 HG11 VAL 25 5.449 2.504 -10.169 911 HG12 VAL 25 HG12 VAL 25 6.325 1.233 -11.021 912 HG13 VAL 25 HG13 VAL 25 7.211 2.537 -10.231 913 HG21 VAL 25 HG21 VAL 25 7.538 -0.524 -9.761 914 HG22 VAL 25 HG22 VAL 25 7.604 -0.473 -8.000 915 HG23 VAL 25 HG23 VAL 25 8.516 0.701 -8.947 916 H ILE 26 H ILE 26 4.065 1.653 -6.815 917 HA ILE 26 HA ILE 26 2.675 3.746 -8.018 918 HB ILE 26 HB ILE 26 2.123 2.332 -5.404 919 HG12 ILE 26 HG12 ILE 26 0.945 1.982 -8.181 920 HG13 ILE 26 HG13 ILE 26 2.104 0.901 -7.417 921 HG21 ILE 26 HG21 ILE 26 -0.165 3.191 -5.560 922 HG22 ILE 26 HG22 ILE 26 0.287 4.151 -6.969 923 HG23 ILE 26 HG23 ILE 26 1.005 4.500 -5.397 924 HD11 ILE 26 HD11 ILE 26 0.447 0.384 -5.680 925 HD12 ILE 26 HD12 ILE 26 -0.117 -0.023 -7.300 926 HD13 ILE 26 HD13 ILE 26 -0.712 1.431 -6.501 927 H SER 27 H SER 27 4.383 3.709 -4.890 928 HA SER 27 HA SER 27 3.593 6.278 -4.017 929 HB2 SER 27 HB2 SER 27 5.402 6.177 -2.433 930 HB3 SER 27 HB3 SER 27 4.760 4.544 -2.591 931 HG SER 27 HG SER 27 6.531 3.927 -3.676 932 H LYS 28 H LYS 28 5.814 5.320 -6.476 933 HA LYS 28 HA LYS 28 7.338 7.777 -6.514 934 HB2 LYS 28 HB2 LYS 28 7.177 5.550 -8.562 935 HB3 LYS 28 HB3 LYS 28 8.358 6.854 -8.560 936 HG2 LYS 28 HG2 LYS 28 9.232 6.030 -6.408 937 HG3 LYS 28 HG3 LYS 28 8.072 4.698 -6.465 938 HD2 LYS 28 HD2 LYS 28 9.100 3.802 -8.442 939 HD3 LYS 28 HD3 LYS 28 10.147 5.215 -8.600 940 HE2 LYS 28 HE2 LYS 28 10.205 3.238 -6.316 941 HE3 LYS 28 HE3 LYS 28 11.333 3.268 -7.671 942 HZ1 LYS 28 HZ1 LYS 28 12.289 4.357 -5.765 943 HZ2 LYS 28 HZ2 LYS 28 10.974 5.414 -5.644 944 HZ3 LYS 28 HZ3 LYS 28 12.011 5.503 -6.979 945 H PHE 29 H PHE 29 4.223 7.145 -7.403 946 HA PHE 29 HA PHE 29 4.108 8.429 -9.955 947 HB2 PHE 29 HB2 PHE 29 1.950 7.741 -7.953 948 HB3 PHE 29 HB3 PHE 29 1.618 8.483 -9.514 949 HD1 PHE 29 HD1 PHE 29 4.246 6.540 -10.374 950 HD2 PHE 29 HD2 PHE 29 0.236 6.092 -8.996 951 HE1 PHE 29 HE1 PHE 29 4.134 4.325 -11.424 952 HE2 PHE 29 HE2 PHE 29 0.126 3.870 -10.047 953 HZ PHE 29 HZ PHE 29 2.075 2.985 -11.262 954 H ASP 30 H ASP 30 3.116 10.406 -10.484 955 HA ASP 30 HA ASP 30 3.880 12.605 -8.810 956 HB2 ASP 30 HB2 ASP 30 4.119 12.569 -11.284 957 HB3 ASP 30 HB3 ASP 30 2.368 12.555 -11.443 958 H THR 31 H THR 31 1.406 10.710 -8.235 959 HA THR 31 HA THR 31 -0.518 12.875 -7.632 960 HB THR 31 HB THR 31 -1.546 11.699 -9.405 961 HG1 THR 31 HG1 THR 31 -2.769 10.282 -7.326 962 HG21 THR 31 HG21 THR 31 -0.891 9.122 -7.964 963 HG22 THR 31 HG22 THR 31 -0.105 9.717 -9.427 964 HG23 THR 31 HG23 THR 31 -1.808 9.263 -9.466 965 H ASN 32 H ASN 32 -2.065 12.355 -5.899 966 HA ASN 32 HA ASN 32 -0.687 11.114 -3.653 967 HB2 ASN 32 HB2 ASN 32 -1.678 13.269 -3.218 968 HB3 ASN 32 HB3 ASN 32 -3.240 12.733 -3.828 969 HD21 ASN 32 HD21 ASN 32 -0.910 12.308 -1.239 970 HD22 ASN 32 HD22 ASN 32 -2.041 11.718 -0.074 971 H ILE 33 H ILE 33 -1.192 9.199 -2.744 972 HA ILE 33 HA ILE 33 -3.129 7.466 -3.994 973 HB ILE 33 HB ILE 33 -1.464 6.997 -1.506 974 HG12 ILE 33 HG12 ILE 33 -0.933 6.144 -4.370 975 HG13 ILE 33 HG13 ILE 33 -0.100 7.454 -3.540 976 HG21 ILE 33 HG21 ILE 33 -2.954 5.052 -3.278 977 HG22 ILE 33 HG22 ILE 33 -3.390 5.510 -1.630 978 HG23 ILE 33 HG23 ILE 33 -1.902 4.612 -1.931 979 HD11 ILE 33 HD11 ILE 33 1.264 5.466 -3.568 980 HD12 ILE 33 HD12 ILE 33 -0.020 4.536 -2.801 981 HD13 ILE 33 HD13 ILE 33 0.778 5.837 -1.914 982 H ARG 34 H ARG 34 -5.232 8.045 -3.588 983 HA ARG 34 HA ARG 34 -6.033 9.020 -1.003 984 HB2 ARG 34 HB2 ARG 34 -7.059 9.327 -3.536 985 HB3 ARG 34 HB3 ARG 34 -8.199 8.189 -2.826 986 HG2 ARG 34 HG2 ARG 34 -8.967 10.464 -2.493 987 HG3 ARG 34 HG3 ARG 34 -8.543 9.735 -0.939 988 HD2 ARG 34 HD2 ARG 34 -6.241 10.821 -1.263 989 HD3 ARG 34 HD3 ARG 34 -7.005 11.774 -2.535 990 HE ARG 34 HE ARG 34 -8.640 12.329 -0.571 991 HH11 ARG 34 HH11 ARG 34 -5.207 12.018 -0.450 992 HH12 ARG 34 HH12 ARG 34 -5.049 13.107 0.890 993 HH21 ARG 34 HH21 ARG 34 -8.419 13.743 1.140 994 HH22 ARG 34 HH22 ARG 34 -6.835 14.078 1.761 995 H THR 35 H THR 35 -6.201 5.977 -2.712 996 HA THR 35 HA THR 35 -6.663 4.575 -0.219 997 HB THR 35 HB THR 35 -8.643 4.208 -2.491 998 HG1 THR 35 HG1 THR 35 -8.685 5.752 -0.204 999 HG21 THR 35 HG21 THR 35 -8.457 2.845 0.205 1000 HG22 THR 35 HG22 THR 35 -8.182 2.094 -1.367 1001 HG23 THR 35 HG23 THR 35 -9.792 2.667 -0.936 1002 H ILE 36 H ILE 36 -5.549 2.688 -0.217 1003 HA ILE 36 HA ILE 36 -5.032 1.351 -2.786 1004 HB ILE 36 HB ILE 36 -2.981 2.607 -2.105 1005 HG12 ILE 36 HG12 ILE 36 -1.411 0.655 -2.304 1006 HG13 ILE 36 HG13 ILE 36 -2.790 -0.418 -2.102 1007 HG21 ILE 36 HG21 ILE 36 -1.648 1.804 -0.206 1008 HG22 ILE 36 HG22 ILE 36 -2.968 0.727 0.255 1009 HG23 ILE 36 HG23 ILE 36 -3.196 2.475 0.313 1010 HD11 ILE 36 HD11 ILE 36 -2.154 -0.181 -4.436 1011 HD12 ILE 36 HD12 ILE 36 -2.420 1.559 -4.341 1012 HD13 ILE 36 HD13 ILE 36 -3.775 0.448 -4.149 1013 H VAL 37 H VAL 37 -5.501 -0.758 -2.757 1014 HA VAL 37 HA VAL 37 -5.620 -2.182 -0.163 1015 HB VAL 37 HB VAL 37 -7.527 -2.532 -2.502 1016 HG11 VAL 37 HG11 VAL 37 -7.457 -3.990 0.150 1017 HG12 VAL 37 HG12 VAL 37 -7.034 -4.677 -1.418 1018 HG13 VAL 37 HG13 VAL 37 -8.693 -4.173 -1.096 1019 HG21 VAL 37 HG21 VAL 37 -8.052 -1.498 0.292 1020 HG22 VAL 37 HG22 VAL 37 -9.255 -1.714 -0.980 1021 HG23 VAL 37 HG23 VAL 37 -7.977 -0.515 -1.170 1022 H LEU 38 H LEU 38 -4.633 -4.162 -0.115 1023 HA LEU 38 HA LEU 38 -4.049 -5.520 -2.640 1024 HB2 LEU 38 HB2 LEU 38 -2.080 -4.079 -2.022 1025 HB3 LEU 38 HB3 LEU 38 -1.904 -5.029 -0.562 1026 HG LEU 38 HG LEU 38 -1.769 -6.313 -3.293 1027 HD11 LEU 38 HD11 LEU 38 0.670 -6.104 -3.184 1028 HD12 LEU 38 HD12 LEU 38 0.523 -5.113 -1.731 1029 HD13 LEU 38 HD13 LEU 38 -0.112 -4.525 -3.268 1030 HD21 LEU 38 HD21 LEU 38 -2.047 -7.833 -1.407 1031 HD22 LEU 38 HD22 LEU 38 -0.663 -7.106 -0.590 1032 HD23 LEU 38 HD23 LEU 38 -0.432 -7.998 -2.096 1033 H ASN 39 H ASN 39 -4.898 -7.475 -2.417 1034 HA ASN 39 HA ASN 39 -4.462 -8.939 0.097 1035 HB2 ASN 39 HB2 ASN 39 -6.835 -9.904 -0.278 1036 HB3 ASN 39 HB3 ASN 39 -6.685 -8.291 0.405 1037 HD21 ASN 39 HD21 ASN 39 -8.933 -9.442 -0.993 1038 HD22 ASN 39 HD22 ASN 39 -9.227 -8.421 -2.356 1039 H ALA 40 H ALA 40 -3.201 -10.589 -0.406 1040 HA ALA 40 HA ALA 40 -3.305 -11.835 -3.057 1041 HB1 ALA 40 HB1 ALA 40 -1.138 -11.184 -2.116 1042 HB2 ALA 40 HB2 ALA 40 -1.226 -12.924 -2.396 1043 HB3 ALA 40 HB3 ALA 40 -1.389 -12.283 -0.760 1044 H LYS 41 H LYS 41 -4.180 -13.731 -3.477 1045 HA LYS 41 HA LYS 41 -4.294 -15.876 -1.535 1046 HB2 LYS 41 HB2 LYS 41 -6.661 -16.261 -1.625 1047 HB3 LYS 41 HB3 LYS 41 -6.427 -14.578 -1.172 1048 HG2 LYS 41 HG2 LYS 41 -7.037 -15.503 -3.975 1049 HG3 LYS 41 HG3 LYS 41 -8.258 -14.975 -2.818 1050 HD2 LYS 41 HD2 LYS 41 -7.365 -12.756 -2.766 1051 HD3 LYS 41 HD3 LYS 41 -5.932 -13.246 -3.674 1052 HE2 LYS 41 HE2 LYS 41 -7.589 -12.023 -5.052 1053 HE3 LYS 41 HE3 LYS 41 -7.263 -13.652 -5.647 1054 HZ1 LYS 41 HZ1 LYS 41 -9.606 -13.221 -5.704 1055 HZ2 LYS 41 HZ2 LYS 41 -9.627 -12.791 -4.073 1056 HZ3 LYS 41 HZ3 LYS 41 -9.303 -14.386 -4.519 1057 H ASP 42 H ASP 42 -4.829 -17.954 -2.557 1058 HA ASP 42 HA ASP 42 -4.738 -19.517 -4.209 1059 HB2 ASP 42 HB2 ASP 42 -5.573 -17.310 -6.107 1060 HB3 ASP 42 HB3 ASP 42 -5.754 -19.043 -6.355 1061 H GLY 43 H GLY 43 -2.472 -17.359 -3.820 1062 HA2 GLY 43 HA2 GLY 43 -0.236 -17.512 -4.550 1063 HA3 GLY 43 HA3 GLY 43 -0.773 -18.399 -5.967 1064 H ILE 44 H ILE 44 -2.626 -15.631 -5.382 1065 HA ILE 44 HA ILE 44 -1.011 -13.924 -7.163 1066 HB ILE 44 HB ILE 44 -4.009 -14.148 -7.472 1067 HG12 ILE 44 HG12 ILE 44 -1.896 -15.687 -9.009 1068 HG13 ILE 44 HG13 ILE 44 -3.111 -16.362 -7.925 1069 HG21 ILE 44 HG21 ILE 44 -1.847 -13.121 -9.313 1070 HG22 ILE 44 HG22 ILE 44 -2.952 -12.135 -8.355 1071 HG23 ILE 44 HG23 ILE 44 -3.576 -13.141 -9.663 1072 HD11 ILE 44 HD11 ILE 44 -3.708 -16.677 -10.264 1073 HD12 ILE 44 HD12 ILE 44 -3.666 -14.931 -10.516 1074 HD13 ILE 44 HD13 ILE 44 -4.874 -15.639 -9.441 1075 H PHE 45 H PHE 45 -1.596 -11.620 -7.004 1076 HA PHE 45 HA PHE 45 -3.238 -10.953 -4.643 1077 HB2 PHE 45 HB2 PHE 45 -1.699 -9.249 -3.931 1078 HB3 PHE 45 HB3 PHE 45 -0.800 -10.747 -4.120 1079 HD1 PHE 45 HD1 PHE 45 0.841 -11.005 -5.911 1080 HD2 PHE 45 HD2 PHE 45 -1.315 -7.361 -5.395 1081 HE1 PHE 45 HE1 PHE 45 2.441 -9.846 -7.378 1082 HE2 PHE 45 HE2 PHE 45 0.284 -6.206 -6.863 1083 HZ PHE 45 HZ PHE 45 2.153 -7.447 -7.855 1084 H THR 46 H THR 46 -4.613 -9.255 -4.832 1085 HA THR 46 HA THR 46 -4.576 -7.754 -7.382 1086 HB THR 46 HB THR 46 -6.630 -8.912 -7.324 1087 HG1 THR 46 HG1 THR 46 -7.469 -6.454 -6.204 1088 HG21 THR 46 HG21 THR 46 -7.041 -7.948 -4.492 1089 HG22 THR 46 HG22 THR 46 -6.610 -9.589 -4.968 1090 HG23 THR 46 HG23 THR 46 -8.175 -8.919 -5.432 1091 H CYS 47 H CYS 47 -3.433 -5.946 -6.968 1092 HA CYS 47 HA CYS 47 -3.937 -4.365 -4.569 1093 HB2 CYS 47 HB2 CYS 47 -1.620 -4.635 -5.291 1094 HB3 CYS 47 HB3 CYS 47 -2.000 -3.926 -6.856 1095 HG CYS 47 HG CYS 47 -0.861 -2.420 -4.274 1096 H ASN 48 H ASN 48 -5.617 -2.994 -4.561 1097 HA ASN 48 HA ASN 48 -6.595 -1.799 -7.053 1098 HB2 ASN 48 HB2 ASN 48 -7.777 -1.703 -4.262 1099 HB3 ASN 48 HB3 ASN 48 -8.550 -1.116 -5.731 1100 HD21 ASN 48 HD21 ASN 48 -9.324 -2.625 -7.237 1101 HD22 ASN 48 HD22 ASN 48 -9.609 -4.268 -6.793 1102 H LEU 49 H LEU 49 -5.657 0.066 -7.622 1103 HA LEU 49 HA LEU 49 -4.679 1.915 -5.572 1104 HB2 LEU 49 HB2 LEU 49 -3.096 1.297 -7.292 1105 HB3 LEU 49 HB3 LEU 49 -4.214 1.786 -8.551 1106 HG LEU 49 HG LEU 49 -4.014 4.129 -7.846 1107 HD11 LEU 49 HD11 LEU 49 -3.615 3.813 -5.476 1108 HD12 LEU 49 HD12 LEU 49 -2.320 4.779 -6.184 1109 HD13 LEU 49 HD13 LEU 49 -2.047 3.076 -5.811 1110 HD21 LEU 49 HD21 LEU 49 -1.710 4.506 -8.571 1111 HD22 LEU 49 HD22 LEU 49 -2.491 3.268 -9.554 1112 HD23 LEU 49 HD23 LEU 49 -1.338 2.803 -8.304 1113 H MET 50 H MET 50 -5.628 3.805 -5.131 1114 HA MET 50 HA MET 50 -7.573 4.932 -7.053 1115 HB2 MET 50 HB2 MET 50 -7.759 4.963 -4.034 1116 HB3 MET 50 HB3 MET 50 -8.886 5.745 -5.134 1117 HG2 MET 50 HG2 MET 50 -8.523 2.905 -5.700 1118 HG3 MET 50 HG3 MET 50 -9.138 3.227 -4.086 1119 HE1 MET 50 HE1 MET 50 -11.222 4.847 -7.859 1120 HE2 MET 50 HE2 MET 50 -9.649 4.049 -7.891 1121 HE3 MET 50 HE3 MET 50 -9.825 5.625 -7.120 1122 H ILE 51 H ILE 51 -6.747 6.735 -7.870 1123 HA ILE 51 HA ILE 51 -5.419 8.671 -6.103 1124 HB ILE 51 HB ILE 51 -3.665 9.038 -7.932 1125 HG12 ILE 51 HG12 ILE 51 -3.130 6.758 -9.099 1126 HG13 ILE 51 HG13 ILE 51 -4.833 6.410 -8.836 1127 HG21 ILE 51 HG21 ILE 51 -3.586 6.477 -6.339 1128 HG22 ILE 51 HG22 ILE 51 -3.126 8.081 -5.766 1129 HG23 ILE 51 HG23 ILE 51 -2.191 7.298 -7.039 1130 HD11 ILE 51 HD11 ILE 51 -4.443 7.261 -11.063 1131 HD12 ILE 51 HD12 ILE 51 -3.706 8.721 -10.401 1132 HD13 ILE 51 HD13 ILE 51 -5.421 8.398 -10.134 1133 H PHE 52 H PHE 52 -5.177 10.841 -7.069 1134 HA PHE 52 HA PHE 52 -7.452 11.435 -8.827 1135 HB2 PHE 52 HB2 PHE 52 -5.928 13.036 -6.801 1136 HB3 PHE 52 HB3 PHE 52 -6.786 13.880 -8.087 1137 HD1 PHE 52 HD2 PHE 52 -9.245 13.618 -8.308 1138 HD2 PHE 52 HD1 PHE 52 -7.105 12.076 -4.960 1139 HE1 PHE 52 HE2 PHE 52 -11.350 13.447 -7.049 1140 HE2 PHE 52 HE1 PHE 52 -9.209 11.906 -3.695 1141 HZ PHE 52 HZ PHE 52 -11.333 12.595 -4.734 1142 H VAL 53 H VAL 53 -7.231 12.193 -10.853 1143 HA VAL 53 HA VAL 53 -4.535 13.025 -11.755 1144 HB VAL 53 HB VAL 53 -4.893 11.966 -13.903 1145 HG11 VAL 53 HG11 VAL 53 -4.941 9.599 -13.259 1146 HG12 VAL 53 HG12 VAL 53 -5.526 10.051 -11.658 1147 HG13 VAL 53 HG13 VAL 53 -3.917 10.553 -12.182 1148 HG21 VAL 53 HG21 VAL 53 -7.288 12.280 -14.101 1149 HG22 VAL 53 HG22 VAL 53 -7.572 11.107 -12.815 1150 HG23 VAL 53 HG23 VAL 53 -6.874 10.582 -14.347 1151 H LYS 54 H LYS 54 -4.466 14.527 -13.521 1152 HA LYS 54 HA LYS 54 -6.703 16.388 -13.536 1153 HB2 LYS 54 HB2 LYS 54 -3.951 16.538 -14.772 1154 HB3 LYS 54 HB3 LYS 54 -5.150 17.821 -14.883 1155 HG2 LYS 54 HG2 LYS 54 -5.142 18.079 -12.472 1156 HG3 LYS 54 HG3 LYS 54 -4.004 16.742 -12.312 1157 HD2 LYS 54 HD2 LYS 54 -3.373 19.214 -13.918 1158 HD3 LYS 54 HD3 LYS 54 -3.055 19.112 -12.186 1159 HE2 LYS 54 HE2 LYS 54 -1.040 18.569 -13.380 1160 HE3 LYS 54 HE3 LYS 54 -1.654 17.110 -12.609 1161 HZ1 LYS 54 HZ1 LYS 54 -2.213 17.766 -15.435 1162 HZ2 LYS 54 HZ2 LYS 54 -2.395 16.277 -14.648 1163 HZ3 LYS 54 HZ3 LYS 54 -0.851 16.888 -14.960 1164 H ASN 55 H ASN 55 -5.697 13.775 -15.425 1165 HA ASN 55 HA ASN 55 -7.659 14.251 -17.450 1166 HB2 ASN 55 HB2 ASN 55 -6.077 14.292 -19.373 1167 HB3 ASN 55 HB3 ASN 55 -5.951 15.719 -18.351 1168 HD21 ASN 55 HD21 ASN 55 -4.108 15.980 -17.046 1169 HD22 ASN 55 HD22 ASN 55 -2.659 15.091 -17.354 1170 H THR 56 H THR 56 -7.579 12.496 -19.173 1171 HA THR 56 HA THR 56 -7.479 9.973 -17.826 1172 HB THR 56 HB THR 56 -8.212 9.014 -20.003 1173 HG1 THR 56 HG1 THR 56 -8.021 10.153 -21.790 1174 HG21 THR 56 HG21 THR 56 -9.872 9.899 -18.426 1175 HG22 THR 56 HG22 THR 56 -10.378 10.167 -20.093 1176 HG23 THR 56 HG23 THR 56 -9.714 11.501 -19.149 1177 H ASP 57 H ASP 57 -5.419 11.520 -20.240 1178 HA ASP 57 HA ASP 57 -3.911 9.249 -20.997 1179 HB2 ASP 57 HB2 ASP 57 -3.047 12.157 -20.962 1180 HB3 ASP 57 HB3 ASP 57 -2.272 10.857 -21.867 1181 H LYS 58 H LYS 58 -3.620 11.535 -18.371 1182 HA LYS 58 HA LYS 58 -1.183 10.750 -17.266 1183 HB2 LYS 58 HB2 LYS 58 -2.244 12.702 -16.425 1184 HB3 LYS 58 HB3 LYS 58 -3.733 11.838 -16.073 1185 HG2 LYS 58 HG2 LYS 58 -2.525 12.383 -14.038 1186 HG3 LYS 58 HG3 LYS 58 -2.638 10.637 -14.280 1187 HD2 LYS 58 HD2 LYS 58 -0.338 10.655 -15.207 1188 HD3 LYS 58 HD3 LYS 58 -0.238 12.382 -14.869 1189 HE2 LYS 58 HE2 LYS 58 -0.449 11.971 -12.496 1190 HE3 LYS 58 HE3 LYS 58 -0.709 10.250 -12.783 1191 HZ1 LYS 58 HZ1 LYS 58 1.557 10.630 -12.139 1192 HZ2 LYS 58 HZ2 LYS 58 1.767 11.773 -13.365 1193 HZ3 LYS 58 HZ3 LYS 58 1.519 10.150 -13.758 1194 H LEU 59 H LEU 59 -4.443 9.416 -16.787 1195 HA LEU 59 HA LEU 59 -3.713 7.469 -14.857 1196 HB2 LEU 59 HB2 LEU 59 -6.005 8.227 -15.119 1197 HB3 LEU 59 HB3 LEU 59 -6.055 7.604 -16.757 1198 HG LEU 59 HG LEU 59 -5.835 5.304 -15.884 1199 HD11 LEU 59 HD11 LEU 59 -4.619 5.755 -13.840 1200 HD12 LEU 59 HD12 LEU 59 -6.112 4.888 -13.484 1201 HD13 LEU 59 HD13 LEU 59 -6.004 6.622 -13.175 1202 HD21 LEU 59 HD21 LEU 59 -8.043 6.159 -16.333 1203 HD22 LEU 59 HD22 LEU 59 -8.110 6.930 -14.748 1204 HD23 LEU 59 HD23 LEU 59 -8.091 5.170 -14.875 1205 H THR 60 H THR 60 -4.208 7.249 -18.390 1206 HA THR 60 HA THR 60 -3.718 4.492 -18.651 1207 HB THR 60 HB THR 60 -3.252 4.915 -21.027 1208 HG1 THR 60 HG1 THR 60 -2.948 6.952 -21.798 1209 HG21 THR 60 HG21 THR 60 -5.520 6.617 -19.976 1210 HG22 THR 60 HG22 THR 60 -5.589 4.878 -20.268 1211 HG23 THR 60 HG23 THR 60 -5.370 5.992 -21.618 1212 H THR 61 H THR 61 -1.487 7.241 -18.631 1213 HA THR 61 HA THR 61 0.865 5.835 -19.309 1214 HB THR 61 HB THR 61 0.547 8.320 -17.600 1215 HG1 THR 61 HG1 THR 61 -0.129 8.590 -19.770 1216 HG21 THR 61 HG21 THR 61 2.704 7.252 -17.142 1217 HG22 THR 61 HG22 THR 61 2.930 8.734 -18.068 1218 HG23 THR 61 HG23 THR 61 3.044 7.167 -18.870 1219 H LEU 62 H LEU 62 -0.648 6.479 -16.141 1220 HA LEU 62 HA LEU 62 1.319 5.276 -14.537 1221 HB2 LEU 62 HB2 LEU 62 -1.665 5.423 -14.095 1222 HB3 LEU 62 HB3 LEU 62 -0.503 4.930 -12.877 1223 HG LEU 62 HG LEU 62 -0.795 7.667 -14.119 1224 HD11 LEU 62 HD11 LEU 62 -1.249 8.342 -11.816 1225 HD12 LEU 62 HD12 LEU 62 -1.077 6.666 -11.289 1226 HD13 LEU 62 HD13 LEU 62 -2.398 7.122 -12.366 1227 HD21 LEU 62 HD21 LEU 62 1.313 6.681 -12.194 1228 HD22 LEU 62 HD22 LEU 62 1.062 8.360 -12.675 1229 HD23 LEU 62 HD23 LEU 62 1.582 7.169 -13.868 1230 H MET 63 H MET 63 -1.630 3.845 -15.964 1231 HA MET 63 HA MET 63 -1.182 1.226 -15.059 1232 HB2 MET 63 HB2 MET 63 -2.666 2.262 -17.482 1233 HB3 MET 63 HB3 MET 63 -2.615 0.553 -17.062 1234 HG2 MET 63 HG2 MET 63 -3.503 1.270 -14.775 1235 HG3 MET 63 HG3 MET 63 -3.866 2.816 -15.538 1236 HE1 MET 63 HE1 MET 63 -6.678 2.000 -18.028 1237 HE2 MET 63 HE2 MET 63 -4.970 2.298 -18.357 1238 HE3 MET 63 HE3 MET 63 -5.815 3.254 -17.137 1239 H ASP 64 H ASP 64 -0.041 2.869 -17.989 1240 HA ASP 64 HA ASP 64 1.273 0.693 -19.187 1241 HB2 ASP 64 HB2 ASP 64 0.831 2.889 -20.274 1242 HB3 ASP 64 HB3 ASP 64 2.071 3.612 -19.259 1243 H LYS 65 H LYS 65 2.368 3.005 -16.734 1244 HA LYS 65 HA LYS 65 5.017 2.098 -16.429 1245 HB2 LYS 65 HB2 LYS 65 3.093 3.387 -14.481 1246 HB3 LYS 65 HB3 LYS 65 4.779 3.087 -14.091 1247 HG2 LYS 65 HG2 LYS 65 5.453 4.528 -15.975 1248 HG3 LYS 65 HG3 LYS 65 3.752 4.840 -16.323 1249 HD2 LYS 65 HD2 LYS 65 4.621 6.698 -15.070 1250 HD3 LYS 65 HD3 LYS 65 3.519 5.797 -14.028 1251 HE2 LYS 65 HE2 LYS 65 5.506 6.432 -12.786 1252 HE3 LYS 65 HE3 LYS 65 5.455 4.680 -12.984 1253 HZ1 LYS 65 HZ1 LYS 65 7.058 6.528 -14.666 1254 HZ2 LYS 65 HZ2 LYS 65 7.064 4.841 -14.749 1255 HZ3 LYS 65 HZ3 LYS 65 7.669 5.619 -13.378 1256 H LEU 66 H LEU 66 2.005 1.061 -14.882 1257 HA LEU 66 HA LEU 66 3.202 -0.864 -13.150 1258 HB2 LEU 66 HB2 LEU 66 0.347 -0.622 -14.118 1259 HB3 LEU 66 HB3 LEU 66 0.885 -1.609 -12.768 1260 HG LEU 66 HG LEU 66 1.166 1.402 -12.875 1261 HD11 LEU 66 HD11 LEU 66 -1.187 0.807 -12.855 1262 HD12 LEU 66 HD12 LEU 66 -0.703 1.475 -11.296 1263 HD13 LEU 66 HD13 LEU 66 -0.925 -0.266 -11.481 1264 HD21 LEU 66 HD21 LEU 66 1.521 -0.575 -10.618 1265 HD22 LEU 66 HD22 LEU 66 1.594 1.181 -10.464 1266 HD23 LEU 66 HD23 LEU 66 2.798 0.331 -11.431 1267 H ARG 67 H ARG 67 2.082 -0.967 -16.457 1268 HA ARG 67 HA ARG 67 1.907 -3.793 -16.758 1269 HB2 ARG 67 HB2 ARG 67 2.408 -1.589 -18.777 1270 HB3 ARG 67 HB3 ARG 67 2.164 -3.273 -19.219 1271 HG2 ARG 67 HG2 ARG 67 -0.086 -3.220 -18.312 1272 HG3 ARG 67 HG3 ARG 67 0.157 -1.566 -17.752 1273 HD2 ARG 67 HD2 ARG 67 0.549 -0.884 -20.118 1274 HD3 ARG 67 HD3 ARG 67 0.132 -2.523 -20.615 1275 HE ARG 67 HE ARG 67 -1.972 -1.535 -19.074 1276 HH11 ARG 67 HH11 ARG 67 -0.438 -0.911 -22.097 1277 HH12 ARG 67 HH12 ARG 67 -1.875 -0.268 -22.815 1278 HH21 ARG 67 HH21 ARG 67 -3.817 -0.715 -20.020 1279 HH22 ARG 67 HH22 ARG 67 -3.767 -0.166 -21.659 1280 H LYS 68 H LYS 68 4.608 -1.870 -16.184 1281 HA LYS 68 HA LYS 68 6.495 -3.163 -17.925 1282 HB2 LYS 68 HB2 LYS 68 6.921 -1.381 -15.517 1283 HB3 LYS 68 HB3 LYS 68 8.195 -1.909 -16.607 1284 HG2 LYS 68 HG2 LYS 68 5.817 -0.224 -17.381 1285 HG3 LYS 68 HG3 LYS 68 7.453 0.370 -17.089 1286 HD2 LYS 68 HD2 LYS 68 8.269 -1.051 -18.942 1287 HD3 LYS 68 HD3 LYS 68 6.609 -1.564 -19.257 1288 HE2 LYS 68 HE2 LYS 68 7.607 1.279 -19.369 1289 HE3 LYS 68 HE3 LYS 68 7.360 0.236 -20.769 1290 HZ1 LYS 68 HZ1 LYS 68 5.004 0.104 -20.174 1291 HZ2 LYS 68 HZ2 LYS 68 5.484 1.697 -20.462 1292 HZ3 LYS 68 HZ3 LYS 68 5.266 1.158 -18.876 1293 H VAL 69 H VAL 69 5.035 -4.216 -15.087 1294 HA VAL 69 HA VAL 69 7.416 -5.544 -14.038 1295 HB VAL 69 HB VAL 69 4.608 -5.547 -12.919 1296 HG11 VAL 69 HG11 VAL 69 7.263 -6.407 -11.744 1297 HG12 VAL 69 HG12 VAL 69 5.885 -7.441 -12.117 1298 HG13 VAL 69 HG13 VAL 69 5.766 -6.249 -10.823 1299 HG21 VAL 69 HG21 VAL 69 5.538 -3.280 -13.034 1300 HG22 VAL 69 HG22 VAL 69 6.992 -3.825 -12.196 1301 HG23 VAL 69 HG23 VAL 69 5.437 -3.837 -11.362 1302 H GLN 70 H GLN 70 7.924 -7.564 -14.395 1303 HA GLN 70 HA GLN 70 6.679 -9.206 -16.278 1304 HB2 GLN 70 HB2 GLN 70 8.274 -10.913 -15.555 1305 HB3 GLN 70 HB3 GLN 70 9.054 -9.339 -15.658 1306 HG2 GLN 70 HG2 GLN 70 8.784 -9.097 -13.198 1307 HG3 GLN 70 HG3 GLN 70 8.138 -10.735 -13.146 1308 HE21 GLN 70 HE21 GLN 70 10.002 -11.621 -15.243 1309 HE22 GLN 70 HE22 GLN 70 11.527 -11.784 -14.454 1310 H GLY 71 H GLY 71 6.194 -9.034 -12.810 1311 HA2 GLY 71 HA2 GLY 71 4.951 -11.621 -12.577 1312 HA3 GLY 71 HA3 GLY 71 5.061 -10.398 -11.326 1313 H VAL 72 H VAL 72 3.758 -8.612 -13.652 1314 HA VAL 72 HA VAL 72 1.037 -9.150 -12.674 1315 HB VAL 72 HB VAL 72 2.092 -6.717 -14.136 1316 HG11 VAL 72 HG11 VAL 72 -0.304 -7.063 -14.524 1317 HG12 VAL 72 HG12 VAL 72 -0.027 -5.655 -13.501 1318 HG13 VAL 72 HG13 VAL 72 -0.581 -7.170 -12.785 1319 HG21 VAL 72 HG21 VAL 72 1.934 -5.598 -11.955 1320 HG22 VAL 72 HG22 VAL 72 3.076 -6.941 -11.914 1321 HG23 VAL 72 HG23 VAL 72 1.471 -7.126 -11.206 1322 H PHE 73 H PHE 73 -0.581 -9.838 -13.948 1323 HA PHE 73 HA PHE 73 -0.129 -9.877 -16.863 1324 HB2 PHE 73 HB2 PHE 73 -2.007 -11.788 -16.616 1325 HB3 PHE 73 HB3 PHE 73 -0.282 -12.113 -16.550 1326 HD1 PHE 73 HD2 PHE 73 0.823 -12.585 -14.424 1327 HD2 PHE 73 HD1 PHE 73 -3.394 -12.013 -14.643 1328 HE1 PHE 73 HE2 PHE 73 0.570 -13.619 -12.209 1329 HE2 PHE 73 HE1 PHE 73 -3.648 -13.049 -12.426 1330 HZ PHE 73 HZ PHE 73 -1.666 -13.854 -11.207 1331 H THR 74 H THR 74 -2.247 -8.771 -14.354 1332 HA THR 74 HA THR 74 -4.025 -7.696 -16.469 1333 HB THR 74 HB THR 74 -5.948 -8.031 -15.299 1334 HG1 THR 74 HG1 THR 74 -4.380 -7.664 -13.001 1335 HG21 THR 74 HG21 THR 74 -5.003 -10.255 -15.663 1336 HG22 THR 74 HG22 THR 74 -5.969 -10.220 -14.188 1337 HG23 THR 74 HG23 THR 74 -4.208 -10.180 -14.090 1338 H VAL 75 H VAL 75 -3.699 -5.616 -16.712 1339 HA VAL 75 HA VAL 75 -3.681 -3.895 -14.307 1340 HB VAL 75 HB VAL 75 -2.290 -3.239 -16.926 1341 HG11 VAL 75 HG11 VAL 75 -2.240 -1.835 -14.251 1342 HG12 VAL 75 HG12 VAL 75 -3.088 -1.285 -15.696 1343 HG13 VAL 75 HG13 VAL 75 -1.326 -1.361 -15.686 1344 HG21 VAL 75 HG21 VAL 75 -0.168 -3.562 -15.734 1345 HG22 VAL 75 HG22 VAL 75 -1.100 -5.058 -15.815 1346 HG23 VAL 75 HG23 VAL 75 -1.051 -4.130 -14.315 1347 H GLU 76 H GLU 76 -5.650 -2.926 -14.244 1348 HA GLU 76 HA GLU 76 -6.847 -1.983 -16.768 1349 HB2 GLU 76 HB2 GLU 76 -9.062 -2.898 -16.005 1350 HB3 GLU 76 HB3 GLU 76 -7.873 -4.114 -16.457 1351 HG2 GLU 76 HG2 GLU 76 -7.408 -4.619 -14.165 1352 HG3 GLU 76 HG3 GLU 76 -8.409 -3.271 -13.614 1353 H ARG 77 H ARG 77 -8.625 -0.480 -16.504 1354 HA ARG 77 HA ARG 77 -8.218 1.330 -14.265 1355 HB2 ARG 77 HB2 ARG 77 -8.329 2.293 -16.484 1356 HB3 ARG 77 HB3 ARG 77 -9.889 1.540 -16.778 1357 HG2 ARG 77 HG2 ARG 77 -10.878 2.939 -15.003 1358 HG3 ARG 77 HG3 ARG 77 -9.313 3.724 -14.777 1359 HD2 ARG 77 HD2 ARG 77 -9.361 4.532 -17.068 1360 HD3 ARG 77 HD3 ARG 77 -10.890 3.700 -17.355 1361 HE ARG 77 HE ARG 77 -10.488 6.209 -16.006 1362 HH11 ARG 77 HH11 ARG 77 -12.620 3.524 -16.382 1363 HH12 ARG 77 HH12 ARG 77 -14.020 4.445 -15.952 1364 HH21 ARG 77 HH21 ARG 77 -12.309 7.377 -15.470 1365 HH22 ARG 77 HH22 ARG 77 -13.844 6.580 -15.423 1366 H LEU 78 H LEU 78 -9.449 1.275 -12.484 1367 HA LEU 78 HA LEU 78 -11.801 -0.320 -12.238 1368 HB2 LEU 78 HB2 LEU 78 -10.627 1.794 -10.421 1369 HB3 LEU 78 HB3 LEU 78 -12.005 0.795 -9.994 1370 HG LEU 78 HG LEU 78 -9.220 -0.237 -10.580 1371 HD11 LEU 78 HD11 LEU 78 -9.099 -0.704 -8.188 1372 HD12 LEU 78 HD12 LEU 78 -10.685 0.034 -7.951 1373 HD13 LEU 78 HD13 LEU 78 -9.322 1.021 -8.484 1374 HD21 LEU 78 HD21 LEU 78 -11.703 -1.659 -9.614 1375 HD22 LEU 78 HD22 LEU 78 -10.093 -2.370 -9.715 1376 HD23 LEU 78 HD23 LEU 78 -10.926 -1.860 -11.183 1377 H SER 79 H SER 79 -13.461 0.283 -13.539 1378 HA SER 79 HA SER 79 -14.255 2.997 -13.979 1379 HB2 SER 79 HB2 SER 79 -16.216 1.981 -15.139 1380 HB3 SER 79 HB3 SER 79 -14.680 1.313 -15.687 1381 HG SER 79 HG SER 79 -16.357 -0.267 -15.255 1382 H ASN 80 H ASN 80 -15.953 0.308 -12.338 1383 HA ASN 80 HA ASN 80 -17.735 2.155 -10.988 1384 HB2 ASN 80 HB2 ASN 80 -18.558 -0.019 -11.795 1385 HB3 ASN 80 HB3 ASN 80 -17.440 -0.849 -10.718 1386 HD21 ASN 80 HD21 ASN 80 -19.018 -1.882 -9.556 1387 HD22 ASN 80 HD22 ASN 80 -20.092 -1.054 -8.487 1388 H LEU 81 H LEU 81 -17.265 3.128 -9.098 1389 HA LEU 81 HA LEU 81 -15.213 1.900 -7.365 1390 HB2 LEU 81 HB2 LEU 81 -16.059 4.792 -7.519 1391 HB3 LEU 81 HB3 LEU 81 -14.843 4.145 -6.438 1392 HG LEU 81 HG LEU 81 -14.683 4.397 -9.441 1393 HD11 LEU 81 HD11 LEU 81 -13.038 5.585 -7.198 1394 HD12 LEU 81 HD12 LEU 81 -14.243 6.435 -8.174 1395 HD13 LEU 81 HD13 LEU 81 -12.768 5.829 -8.929 1396 HD21 LEU 81 HD21 LEU 81 -12.731 3.043 -7.571 1397 HD22 LEU 81 HD22 LEU 81 -12.452 3.384 -9.280 1398 HD23 LEU 81 HD23 LEU 81 -13.714 2.249 -8.802 1399 H GLU 82 H GLU 82 -15.493 1.839 -5.141 1400 HA GLU 82 HA GLU 82 -18.230 1.977 -4.132 1401 HB2 GLU 82 HB2 GLU 82 -17.174 1.063 -2.038 1402 HB3 GLU 82 HB3 GLU 82 -16.941 0.053 -3.461 1403 HG2 GLU 82 HG2 GLU 82 -14.677 1.024 -3.731 1404 HG3 GLU 82 HG3 GLU 82 -14.920 1.934 -2.243 1405 H HIS 83 H HIS 83 -16.601 4.416 -4.887 1406 HA HIS 83 HA HIS 83 -16.101 5.684 -2.288 1407 HB2 HIS 83 HB2 HIS 83 -15.253 6.439 -5.087 1408 HB3 HIS 83 HB3 HIS 83 -14.909 7.414 -3.662 1409 HD1 HIS 83 HD1 HIS 83 -12.771 6.918 -2.524 1410 HD2 HIS 83 HD2 HIS 83 -14.055 3.737 -4.860 1411 HE1 HIS 83 HE1 HIS 83 -10.924 5.228 -2.440 1412 HE2 HIS 83 HE2 HIS 83 -11.834 3.222 -3.645 1413 H HIS 84 H HIS 84 -17.533 6.684 -5.436 1414 HA HIS 84 HA HIS 84 -18.407 9.167 -4.347 1415 HB2 HIS 84 HB2 HIS 84 -17.742 8.638 -6.766 1416 HB3 HIS 84 HB3 HIS 84 -19.363 7.979 -6.952 1417 HD1 HIS 84 HD1 HIS 84 -17.548 11.218 -6.355 1418 HD2 HIS 84 HD2 HIS 84 -21.372 9.872 -7.261 1419 HE1 HIS 84 HE1 HIS 84 -18.856 13.270 -6.961 1420 HE2 HIS 84 HE2 HIS 84 -21.119 12.414 -7.647 1421 H HIS 85 H HIS 85 -19.684 6.298 -3.620 1422 HA HIS 85 HA HIS 85 -22.498 7.126 -3.710 1423 HB2 HIS 85 HB2 HIS 85 -21.394 4.557 -2.550 1424 HB3 HIS 85 HB3 HIS 85 -23.044 4.887 -3.071 1425 HD1 HIS 85 HD1 HIS 85 -23.140 5.486 -5.810 1426 HD2 HIS 85 HD2 HIS 85 -19.993 3.178 -4.388 1427 HE1 HIS 85 HE1 HIS 85 -22.166 4.359 -7.828 1428 HE2 HIS 85 HE2 HIS 85 -20.160 3.112 -6.967 1429 H HIS 86 H HIS 86 -20.111 8.077 -1.936 1430 HA HIS 86 HA HIS 86 -20.687 7.370 0.736 1431 HB2 HIS 86 HB2 HIS 86 -18.491 8.140 0.105 1432 HB3 HIS 86 HB3 HIS 86 -19.136 9.679 -0.448 1433 HD1 HIS 86 HD1 HIS 86 -19.119 7.771 2.874 1434 HD2 HIS 86 HD2 HIS 86 -18.693 11.616 1.355 1435 HE1 HIS 86 HE1 HIS 86 -18.612 9.225 4.852 1436 HE2 HIS 86 HE2 HIS 86 -18.137 11.489 3.871 1437 H HIS 87 H HIS 87 -23.001 7.687 0.852 1438 HA HIS 87 HA HIS 87 -23.807 10.494 1.287 1439 HB2 HIS 87 HB2 HIS 87 -26.140 9.551 1.420 1440 HB3 HIS 87 HB3 HIS 87 -25.354 9.346 -0.141 1441 HD1 HIS 87 HD1 HIS 87 -24.817 6.958 -0.898 1442 HD2 HIS 87 HD2 HIS 87 -26.630 7.148 2.840 1443 HE1 HIS 87 HE1 HIS 87 -25.510 4.605 -0.364 1444 HE2 HIS 87 HE2 HIS 87 -26.683 4.755 1.855 1445 H HIS 88 H HIS 88 -22.429 8.120 2.961 1446 HA HIS 88 HA HIS 88 -23.296 9.186 5.527 1447 HB2 HIS 88 HB2 HIS 88 -24.833 7.344 5.300 1448 HB3 HIS 88 HB3 HIS 88 -23.544 6.258 4.793 1449 HD1 HIS 88 HD1 HIS 88 -22.467 4.917 6.579 1450 HD2 HIS 88 HD2 HIS 88 -24.569 8.148 8.119 1451 HE1 HIS 88 HE1 HIS 88 -22.405 4.633 9.070 1452 HE2 HIS 88 HE2 HIS 88 -23.498 6.705 9.977 Start of MODEL 18 1 H1 MET 1 H1 MET 1 10.958 -22.337 11.382 2 H2 MET 1 H2 MET 1 11.084 -22.732 9.746 3 H3 MET 1 H3 MET 1 9.910 -23.481 10.703 4 HA MET 1 HA MET 1 10.029 -20.608 9.981 5 HB2 MET 1 HB2 MET 1 8.242 -22.861 9.063 6 HB3 MET 1 HB3 MET 1 7.778 -21.176 8.891 7 HG2 MET 1 HG2 MET 1 9.837 -20.801 7.553 8 HG3 MET 1 HG3 MET 1 10.152 -22.535 7.636 9 HE1 MET 1 HE1 MET 1 9.799 -20.718 4.919 10 HE2 MET 1 HE2 MET 1 8.919 -21.875 3.921 11 HE3 MET 1 HE3 MET 1 10.266 -22.419 4.921 12 H THR 2 H THR 2 9.607 -19.599 11.871 13 HA THR 2 HA THR 2 7.065 -20.295 13.219 14 HB THR 2 HB THR 2 9.262 -18.639 14.484 15 HG1 THR 2 HG1 THR 2 10.027 -20.537 15.435 16 HG21 THR 2 HG21 THR 2 8.170 -19.322 16.574 17 HG22 THR 2 HG22 THR 2 7.000 -20.277 15.661 18 HG23 THR 2 HG23 THR 2 7.020 -18.521 15.503 19 H ASP 3 H ASP 3 8.100 -18.384 10.910 20 HA ASP 3 HA ASP 3 7.464 -15.747 11.626 21 HB2 ASP 3 HB2 ASP 3 7.177 -17.046 8.901 22 HB3 ASP 3 HB3 ASP 3 7.313 -15.320 9.225 23 H PHE 4 H PHE 4 5.555 -14.855 12.151 24 HA PHE 4 HA PHE 4 3.074 -16.184 11.293 25 HB2 PHE 4 HB2 PHE 4 1.995 -15.216 13.273 26 HB3 PHE 4 HB3 PHE 4 3.374 -16.201 13.742 27 HD1 PHE 4 HD1 PHE 4 2.071 -12.771 13.476 28 HD2 PHE 4 HD2 PHE 4 5.309 -15.215 14.786 29 HE1 PHE 4 HE1 PHE 4 2.987 -10.874 14.743 30 HE2 PHE 4 HE2 PHE 4 6.221 -13.319 16.059 31 HZ PHE 4 HZ PHE 4 5.073 -11.137 16.023 32 H LEU 5 H LEU 5 1.291 -14.805 10.748 33 HA LEU 5 HA LEU 5 2.123 -12.497 9.252 34 HB2 LEU 5 HB2 LEU 5 0.434 -14.021 8.389 35 HB3 LEU 5 HB3 LEU 5 -0.598 -13.676 9.761 36 HG LEU 5 HG LEU 5 -0.870 -11.354 8.996 37 HD11 LEU 5 HD11 LEU 5 -0.023 -10.677 6.783 38 HD12 LEU 5 HD12 LEU 5 0.879 -12.191 6.680 39 HD13 LEU 5 HD13 LEU 5 1.275 -11.010 7.928 40 HD21 LEU 5 HD21 LEU 5 -2.452 -13.044 8.220 41 HD22 LEU 5 HD22 LEU 5 -1.428 -13.368 6.820 42 HD23 LEU 5 HD23 LEU 5 -2.201 -11.793 7.004 43 H ALA 6 H ALA 6 2.621 -10.736 10.381 44 HA ALA 6 HA ALA 6 1.109 -9.970 12.753 45 HB1 ALA 6 HB1 ALA 6 3.599 -8.746 11.570 46 HB2 ALA 6 HB2 ALA 6 3.564 -9.980 12.829 47 HB3 ALA 6 HB3 ALA 6 2.893 -8.381 13.145 48 H GLY 7 H GLY 7 -0.192 -8.207 12.898 49 HA2 GLY 7 HA2 GLY 7 -0.618 -6.638 10.425 50 HA3 GLY 7 HA3 GLY 7 -1.885 -7.042 11.570 51 H ILE 8 H ILE 8 -0.609 -4.470 10.479 52 HA ILE 8 HA ILE 8 -0.430 -3.093 13.088 53 HB ILE 8 HB ILE 8 1.109 -2.286 10.593 54 HG12 ILE 8 HG12 ILE 8 2.162 -3.634 13.101 55 HG13 ILE 8 HG13 ILE 8 1.981 -4.409 11.529 56 HG21 ILE 8 HG21 ILE 8 2.292 -0.749 12.098 57 HG22 ILE 8 HG22 ILE 8 1.272 -1.274 13.439 58 HG23 ILE 8 HG23 ILE 8 0.559 -0.420 12.070 59 HD11 ILE 8 HD11 ILE 8 4.285 -3.776 11.952 60 HD12 ILE 8 HD12 ILE 8 3.801 -2.092 12.152 61 HD13 ILE 8 HD13 ILE 8 3.627 -2.879 10.582 62 H ARG 9 H ARG 9 -1.398 -0.989 13.151 63 HA ARG 9 HA ARG 9 -2.836 -0.173 10.714 64 HB2 ARG 9 HB2 ARG 9 -4.388 -1.200 12.389 65 HB3 ARG 9 HB3 ARG 9 -3.956 0.087 13.513 66 HG2 ARG 9 HG2 ARG 9 -4.827 1.756 11.964 67 HG3 ARG 9 HG3 ARG 9 -5.220 0.488 10.801 68 HD2 ARG 9 HD2 ARG 9 -6.717 -0.513 12.558 69 HD3 ARG 9 HD3 ARG 9 -6.442 0.942 13.521 70 HE ARG 9 HE ARG 9 -7.313 1.588 10.896 71 HH11 ARG 9 HH11 ARG 9 -8.433 0.546 13.981 72 HH12 ARG 9 HH12 ARG 9 -10.056 1.066 13.683 73 HH21 ARG 9 HH21 ARG 9 -9.390 2.249 10.533 74 HH22 ARG 9 HH22 ARG 9 -10.582 2.038 11.768 75 H ILE 10 H ILE 10 -2.576 1.879 10.126 76 HA ILE 10 HA ILE 10 -1.212 3.746 11.981 77 HB ILE 10 HB ILE 10 -0.976 3.674 8.962 78 HG12 ILE 10 HG12 ILE 10 1.069 2.686 10.969 79 HG13 ILE 10 HG13 ILE 10 -0.024 1.629 10.079 80 HG21 ILE 10 HG21 ILE 10 -0.554 5.863 9.939 81 HG22 ILE 10 HG22 ILE 10 0.940 5.166 9.310 82 HG23 ILE 10 HG23 ILE 10 0.625 5.159 11.045 83 HD11 ILE 10 HD11 ILE 10 2.118 1.647 9.013 84 HD12 ILE 10 HD12 ILE 10 2.104 3.409 8.918 85 HD13 ILE 10 HD13 ILE 10 0.953 2.465 7.972 86 H VAL 11 H VAL 11 -2.620 5.388 12.545 87 HA VAL 11 HA VAL 11 -4.307 6.476 10.370 88 HB VAL 11 HB VAL 11 -4.912 6.390 13.335 89 HG11 VAL 11 HG11 VAL 11 -6.426 7.836 11.155 90 HG12 VAL 11 HG12 VAL 11 -5.545 8.586 12.486 91 HG13 VAL 11 HG13 VAL 11 -6.979 7.618 12.818 92 HG21 VAL 11 HG21 VAL 11 -6.373 5.278 10.931 93 HG22 VAL 11 HG22 VAL 11 -6.903 5.152 12.611 94 HG23 VAL 11 HG23 VAL 11 -5.424 4.343 12.090 95 H GLY 12 H GLY 12 -3.613 8.326 9.625 96 HA2 GLY 12 HA2 GLY 12 -2.570 10.371 11.473 97 HA3 GLY 12 HA3 GLY 12 -1.582 9.889 10.102 98 H GLU 13 H GLU 13 -2.375 12.522 10.447 99 HA GLU 13 HA GLU 13 -4.792 13.115 9.040 100 HB2 GLU 13 HB2 GLU 13 -4.099 15.440 9.204 101 HB3 GLU 13 HB3 GLU 13 -3.836 14.620 10.738 102 HG2 GLU 13 HG2 GLU 13 -1.456 14.409 10.227 103 HG3 GLU 13 HG3 GLU 13 -1.711 15.212 8.680 104 H ASP 14 H ASP 14 -5.129 13.699 6.939 105 HA ASP 14 HA ASP 14 -3.195 12.874 4.989 106 HB2 ASP 14 HB2 ASP 14 -5.494 12.419 4.528 107 HB3 ASP 14 HB3 ASP 14 -5.948 14.103 4.771 108 H LYS 15 H LYS 15 -1.465 14.136 4.625 109 HA LYS 15 HA LYS 15 -1.951 16.898 3.741 110 HB2 LYS 15 HB2 LYS 15 0.509 16.128 5.310 111 HB3 LYS 15 HB3 LYS 15 0.023 17.738 4.805 112 HG2 LYS 15 HG2 LYS 15 -1.989 17.450 6.305 113 HG3 LYS 15 HG3 LYS 15 -1.177 16.023 6.948 114 HD2 LYS 15 HD2 LYS 15 -0.054 18.833 6.947 115 HD3 LYS 15 HD3 LYS 15 -0.775 18.025 8.336 116 HE2 LYS 15 HE2 LYS 15 1.620 16.932 6.870 117 HE3 LYS 15 HE3 LYS 15 1.756 18.043 8.231 118 HZ1 LYS 15 HZ1 LYS 15 1.966 15.726 8.901 119 HZ2 LYS 15 HZ2 LYS 15 0.410 15.398 8.323 120 HZ3 LYS 15 HZ3 LYS 15 0.624 16.458 9.627 121 H ASN 16 H ASN 16 -1.309 17.180 1.722 122 HA ASN 16 HA ASN 16 -0.000 17.204 -0.140 123 HB2 ASN 16 HB2 ASN 16 2.055 16.751 2.020 124 HB3 ASN 16 HB3 ASN 16 2.505 17.038 0.338 125 HD21 ASN 16 HD21 ASN 16 1.123 18.408 3.210 126 HD22 ASN 16 HD22 ASN 16 1.223 20.055 2.717 127 H GLY 17 H GLY 17 1.745 14.741 1.681 128 HA2 GLY 17 HA2 GLY 17 1.092 12.673 -0.284 129 HA3 GLY 17 HA3 GLY 17 2.779 13.158 -0.202 130 H MET 18 H MET 18 0.741 13.102 2.625 131 HA MET 18 HA MET 18 2.403 11.489 4.183 132 HB2 MET 18 HB2 MET 18 -0.498 12.276 4.368 133 HB3 MET 18 HB3 MET 18 0.177 11.144 5.529 134 HG2 MET 18 HG2 MET 18 1.306 13.887 5.019 135 HG3 MET 18 HG3 MET 18 0.126 13.520 6.278 136 HE1 MET 18 HE1 MET 18 2.133 10.893 8.429 137 HE2 MET 18 HE2 MET 18 1.174 10.510 7.001 138 HE3 MET 18 HE3 MET 18 0.573 11.677 8.179 139 H THR 19 H THR 19 -0.617 10.587 2.528 140 HA THR 19 HA THR 19 -0.659 7.872 3.155 141 HB THR 19 HB THR 19 -2.041 7.596 1.100 142 HG1 THR 19 HG1 THR 19 -2.236 9.239 -0.337 143 HG21 THR 19 HG21 THR 19 -3.843 9.118 1.753 144 HG22 THR 19 HG22 THR 19 -2.705 10.081 2.698 145 HG23 THR 19 HG23 THR 19 -3.072 8.425 3.181 146 H ASN 20 H ASN 20 1.147 9.563 0.640 147 HA ASN 20 HA ASN 20 2.017 7.194 -0.718 148 HB2 ASN 20 HB2 ASN 20 3.150 10.005 -0.785 149 HB3 ASN 20 HB3 ASN 20 3.604 8.701 -1.879 150 HD21 ASN 20 HD21 ASN 20 2.908 9.601 -3.735 151 HD22 ASN 20 HD22 ASN 20 1.256 9.949 -4.081 152 H GLN 21 H GLN 21 3.479 9.400 1.652 153 HA GLN 21 HA GLN 21 6.015 8.142 1.636 154 HB2 GLN 21 HB2 GLN 21 6.615 9.563 3.416 155 HB3 GLN 21 HB3 GLN 21 5.522 10.500 2.419 156 HG2 GLN 21 HG2 GLN 21 3.728 10.160 3.989 157 HG3 GLN 21 HG3 GLN 21 4.726 9.064 4.945 158 HE21 GLN 21 HE21 GLN 21 4.163 12.385 4.068 159 HE22 GLN 21 HE22 GLN 21 5.123 13.074 5.321 160 H ILE 22 H ILE 22 3.111 7.656 3.557 161 HA ILE 22 HA ILE 22 4.231 6.064 5.590 162 HB ILE 22 HB ILE 22 1.443 6.393 4.516 163 HG12 ILE 22 HG12 ILE 22 2.364 8.182 5.906 164 HG13 ILE 22 HG13 ILE 22 1.066 7.356 6.763 165 HG21 ILE 22 HG21 ILE 22 0.575 4.974 6.313 166 HG22 ILE 22 HG22 ILE 22 2.223 4.514 6.750 167 HG23 ILE 22 HG23 ILE 22 1.564 4.054 5.179 168 HD11 ILE 22 HD11 ILE 22 4.015 6.929 7.194 169 HD12 ILE 22 HD12 ILE 22 2.716 6.100 8.052 170 HD13 ILE 22 HD13 ILE 22 2.927 7.841 8.241 171 H THR 23 H THR 23 2.463 5.012 2.638 172 HA THR 23 HA THR 23 3.139 2.268 3.082 173 HB THR 23 HB THR 23 2.307 3.451 0.417 174 HG1 THR 23 HG1 THR 23 0.838 3.042 2.764 175 HG21 THR 23 HG21 THR 23 1.950 0.708 1.633 176 HG22 THR 23 HG22 THR 23 3.087 1.134 0.353 177 HG23 THR 23 HG23 THR 23 1.350 1.223 0.056 178 H GLY 24 H GLY 24 4.639 4.945 1.434 179 HA2 GLY 24 HA2 GLY 24 6.615 3.606 -0.050 180 HA3 GLY 24 HA3 GLY 24 6.763 5.225 0.614 181 H VAL 25 H VAL 25 6.683 4.719 3.349 182 HA VAL 25 HA VAL 25 9.281 3.739 3.929 183 HB VAL 25 HB VAL 25 6.948 4.277 5.789 184 HG11 VAL 25 HG11 VAL 25 8.468 2.702 6.859 185 HG12 VAL 25 HG12 VAL 25 8.608 4.291 7.614 186 HG13 VAL 25 HG13 VAL 25 9.845 3.742 6.483 187 HG21 VAL 25 HG21 VAL 25 9.399 5.922 5.125 188 HG22 VAL 25 HG22 VAL 25 8.180 6.342 6.329 189 HG23 VAL 25 HG23 VAL 25 7.742 6.266 4.624 190 H ILE 26 H ILE 26 6.060 2.286 4.163 191 HA ILE 26 HA ILE 26 6.690 -0.127 5.399 192 HB ILE 26 HB ILE 26 4.651 0.463 3.248 193 HG12 ILE 26 HG12 ILE 26 4.389 0.135 6.254 194 HG13 ILE 26 HG13 ILE 26 4.366 1.668 5.389 195 HG21 ILE 26 HG21 ILE 26 3.549 -1.637 3.884 196 HG22 ILE 26 HG22 ILE 26 4.902 -2.021 4.947 197 HG23 ILE 26 HG23 ILE 26 5.151 -1.920 3.204 198 HD11 ILE 26 HD11 ILE 26 2.319 0.959 4.231 199 HD12 ILE 26 HD12 ILE 26 2.129 1.002 5.984 200 HD13 ILE 26 HD13 ILE 26 2.337 -0.542 5.159 201 H SER 27 H SER 27 6.915 0.710 1.939 202 HA SER 27 HA SER 27 7.769 -1.856 1.074 203 HB2 SER 27 HB2 SER 27 8.320 -0.850 -1.031 204 HB3 SER 27 HB3 SER 27 6.877 -0.032 -0.437 205 HG SER 27 HG SER 27 8.100 1.730 0.102 206 H LYS 28 H LYS 28 9.437 0.692 2.683 207 HA LYS 28 HA LYS 28 12.096 -0.043 1.871 208 HB2 LYS 28 HB2 LYS 28 11.146 1.672 4.181 209 HB3 LYS 28 HB3 LYS 28 12.820 1.511 3.665 210 HG2 LYS 28 HG2 LYS 28 12.293 2.525 1.524 211 HG3 LYS 28 HG3 LYS 28 10.586 2.609 1.962 212 HD2 LYS 28 HD2 LYS 28 11.698 4.778 2.240 213 HD3 LYS 28 HD3 LYS 28 11.103 4.153 3.778 214 HE2 LYS 28 HE2 LYS 28 13.341 3.437 4.390 215 HE3 LYS 28 HE3 LYS 28 13.961 3.926 2.812 216 HZ1 LYS 28 HZ1 LYS 28 14.395 5.540 4.611 217 HZ2 LYS 28 HZ2 LYS 28 12.730 5.795 4.762 218 HZ3 LYS 28 HZ3 LYS 28 13.518 6.196 3.324 219 H PHE 29 H PHE 29 9.928 -1.603 3.874 220 HA PHE 29 HA PHE 29 11.697 -2.420 5.977 221 HB2 PHE 29 HB2 PHE 29 9.065 -3.580 5.038 222 HB3 PHE 29 HB3 PHE 29 9.942 -4.154 6.451 223 HD1 PHE 29 HD2 PHE 29 10.799 -1.050 6.956 224 HD2 PHE 29 HD1 PHE 29 7.157 -3.236 6.599 225 HE1 PHE 29 HE2 PHE 29 9.660 0.626 8.345 226 HE2 PHE 29 HE1 PHE 29 6.015 -1.557 7.992 227 HZ PHE 29 HZ PHE 29 7.268 0.373 8.868 228 H ASP 30 H ASP 30 12.250 -4.713 6.387 229 HA ASP 30 HA ASP 30 13.570 -5.889 4.116 230 HB2 ASP 30 HB2 ASP 30 14.466 -7.474 5.722 231 HB3 ASP 30 HB3 ASP 30 14.560 -5.852 6.396 232 H THR 31 H THR 31 10.675 -6.517 5.969 233 HA THR 31 HA THR 31 10.251 -9.187 4.969 234 HB THR 31 HB THR 31 9.419 -8.700 7.164 235 HG1 THR 31 HG1 THR 31 7.602 -9.776 6.884 236 HG21 THR 31 HG21 THR 31 7.750 -6.532 5.884 237 HG22 THR 31 HG22 THR 31 9.105 -6.305 6.992 238 HG23 THR 31 HG23 THR 31 7.617 -7.061 7.563 239 H ASN 32 H ASN 32 8.026 -9.730 4.016 240 HA ASN 32 HA ASN 32 7.685 -8.018 1.639 241 HB2 ASN 32 HB2 ASN 32 7.002 -10.949 1.997 242 HB3 ASN 32 HB3 ASN 32 6.848 -10.024 0.504 243 HD21 ASN 32 HD21 ASN 32 8.738 -9.352 -0.568 244 HD22 ASN 32 HD22 ASN 32 10.255 -10.125 -0.281 245 H ILE 33 H ILE 33 5.735 -7.207 1.076 246 HA ILE 33 HA ILE 33 3.682 -6.985 3.008 247 HB ILE 33 HB ILE 33 3.641 -6.326 0.052 248 HG12 ILE 33 HG12 ILE 33 4.117 -4.572 2.486 249 HG13 ILE 33 HG13 ILE 33 5.340 -5.081 1.327 250 HG21 ILE 33 HG21 ILE 33 1.366 -6.588 0.888 251 HG22 ILE 33 HG22 ILE 33 1.708 -4.887 0.575 252 HG23 ILE 33 HG23 ILE 33 1.709 -5.497 2.230 253 HD11 ILE 33 HD11 ILE 33 2.973 -3.321 0.726 254 HD12 ILE 33 HD12 ILE 33 4.211 -3.819 -0.427 255 HD13 ILE 33 HD13 ILE 33 4.641 -2.788 0.938 256 H ARG 34 H ARG 34 1.910 -8.210 3.381 257 HA ARG 34 HA ARG 34 1.215 -10.297 1.406 258 HB2 ARG 34 HB2 ARG 34 0.339 -10.283 4.299 259 HB3 ARG 34 HB3 ARG 34 0.357 -11.635 3.172 260 HG2 ARG 34 HG2 ARG 34 2.714 -10.306 4.494 261 HG3 ARG 34 HG3 ARG 34 2.137 -11.956 4.717 262 HD2 ARG 34 HD2 ARG 34 3.266 -10.850 2.139 263 HD3 ARG 34 HD3 ARG 34 4.178 -11.794 3.311 264 HE ARG 34 HE ARG 34 2.721 -13.674 2.793 265 HH11 ARG 34 HH11 ARG 34 2.640 -11.027 0.579 266 HH12 ARG 34 HH12 ARG 34 2.163 -12.026 -0.750 267 HH21 ARG 34 HH21 ARG 34 2.149 -14.930 1.071 268 HH22 ARG 34 HH22 ARG 34 1.903 -14.204 -0.483 269 H THR 35 H THR 35 -0.039 -7.705 3.405 270 HA THR 35 HA THR 35 -2.195 -7.252 1.528 271 HB THR 35 HB THR 35 -2.901 -7.750 4.441 272 HG1 THR 35 HG1 THR 35 -2.959 -9.413 2.192 273 HG21 THR 35 HG21 THR 35 -4.309 -6.050 3.381 274 HG22 THR 35 HG22 THR 35 -5.227 -7.526 3.679 275 HG23 THR 35 HG23 THR 35 -4.658 -7.156 2.051 276 H ILE 36 H ILE 36 -2.514 -5.073 1.344 277 HA ILE 36 HA ILE 36 -1.949 -3.377 3.687 278 HB ILE 36 HB ILE 36 0.010 -3.246 2.129 279 HG12 ILE 36 HG12 ILE 36 0.075 -0.743 2.031 280 HG13 ILE 36 HG13 ILE 36 -1.630 -0.717 2.467 281 HG21 ILE 36 HG21 ILE 36 -1.987 -2.018 0.229 282 HG22 ILE 36 HG22 ILE 36 -1.114 -3.535 0.002 283 HG23 ILE 36 HG23 ILE 36 -0.234 -2.003 0.016 284 HD11 ILE 36 HD11 ILE 36 0.599 -1.828 4.155 285 HD12 ILE 36 HD12 ILE 36 -1.107 -1.768 4.598 286 HD13 ILE 36 HD13 ILE 36 -0.200 -0.271 4.380 287 H VAL 37 H VAL 37 -3.548 -1.998 4.128 288 HA VAL 37 HA VAL 37 -5.471 -1.293 1.989 289 HB VAL 37 HB VAL 37 -6.147 -1.810 4.902 290 HG11 VAL 37 HG11 VAL 37 -7.944 -1.142 2.563 291 HG12 VAL 37 HG12 VAL 37 -7.559 -0.082 3.920 292 HG13 VAL 37 HG13 VAL 37 -8.484 -1.558 4.191 293 HG21 VAL 37 HG21 VAL 37 -5.635 -3.884 3.686 294 HG22 VAL 37 HG22 VAL 37 -6.829 -3.458 2.459 295 HG23 VAL 37 HG23 VAL 37 -7.343 -3.785 4.114 296 H LEU 38 H LEU 38 -5.498 0.859 1.628 297 HA LEU 38 HA LEU 38 -5.177 2.667 3.931 298 HB2 LEU 38 HB2 LEU 38 -3.030 2.496 2.702 299 HB3 LEU 38 HB3 LEU 38 -3.830 3.042 1.243 300 HG LEU 38 HG LEU 38 -3.828 4.777 3.707 301 HD11 LEU 38 HD11 LEU 38 -1.500 4.198 3.363 302 HD12 LEU 38 HD12 LEU 38 -1.787 5.869 2.878 303 HD13 LEU 38 HD13 LEU 38 -1.623 4.610 1.652 304 HD21 LEU 38 HD21 LEU 38 -5.284 5.431 1.852 305 HD22 LEU 38 HD22 LEU 38 -3.907 5.409 0.751 306 HD23 LEU 38 HD23 LEU 38 -3.970 6.586 2.063 307 H ASN 39 H ASN 39 -6.764 4.115 4.070 308 HA ASN 39 HA ASN 39 -7.819 5.360 1.679 309 HB2 ASN 39 HB2 ASN 39 -10.182 4.960 2.189 310 HB3 ASN 39 HB3 ASN 39 -9.338 3.449 1.888 311 HD21 ASN 39 HD21 ASN 39 -8.142 3.140 4.436 312 HD22 ASN 39 HD22 ASN 39 -9.400 2.830 5.566 313 H ALA 40 H ALA 40 -8.198 7.458 2.002 314 HA ALA 40 HA ALA 40 -8.094 8.490 4.762 315 HB1 ALA 40 HB1 ALA 40 -7.725 9.953 2.140 316 HB2 ALA 40 HB2 ALA 40 -6.431 9.346 3.174 317 HB3 ALA 40 HB3 ALA 40 -7.496 10.625 3.756 318 H LYS 41 H LYS 41 -9.955 8.950 5.693 319 HA LYS 41 HA LYS 41 -12.065 10.285 4.132 320 HB2 LYS 41 HB2 LYS 41 -13.799 9.090 5.312 321 HB3 LYS 41 HB3 LYS 41 -12.707 7.916 4.594 322 HG2 LYS 41 HG2 LYS 41 -12.464 8.769 7.468 323 HG3 LYS 41 HG3 LYS 41 -13.534 7.463 6.959 324 HD2 LYS 41 HD2 LYS 41 -11.630 6.242 6.039 325 HD3 LYS 41 HD3 LYS 41 -10.549 7.567 6.477 326 HE2 LYS 41 HE2 LYS 41 -10.493 5.663 8.079 327 HE3 LYS 41 HE3 LYS 41 -10.945 7.196 8.820 328 HZ1 LYS 41 HZ1 LYS 41 -13.195 6.541 8.919 329 HZ2 LYS 41 HZ2 LYS 41 -12.307 5.221 9.491 330 HZ3 LYS 41 HZ3 LYS 41 -12.940 5.195 7.926 331 H ASP 42 H ASP 42 -13.297 11.847 5.294 332 HA ASP 42 HA ASP 42 -13.541 13.610 6.710 333 HB2 ASP 42 HB2 ASP 42 -12.525 11.638 8.775 334 HB3 ASP 42 HB3 ASP 42 -13.371 13.143 9.123 335 H GLY 43 H GLY 43 -10.840 13.109 5.423 336 HA2 GLY 43 HA2 GLY 43 -8.977 14.512 5.298 337 HA3 GLY 43 HA3 GLY 43 -9.417 15.213 6.844 338 H ILE 44 H ILE 44 -9.408 11.864 7.106 339 HA ILE 44 HA ILE 44 -6.557 11.749 7.900 340 HB ILE 44 HB ILE 44 -8.781 10.411 9.460 341 HG12 ILE 44 HG12 ILE 44 -7.354 13.018 10.049 342 HG13 ILE 44 HG13 ILE 44 -9.061 12.818 9.664 343 HG21 ILE 44 HG21 ILE 44 -7.061 10.099 11.164 344 HG22 ILE 44 HG22 ILE 44 -5.881 10.924 10.146 345 HG23 ILE 44 HG23 ILE 44 -6.559 9.377 9.635 346 HD11 ILE 44 HD11 ILE 44 -9.385 11.565 11.720 347 HD12 ILE 44 HD12 ILE 44 -8.702 13.159 12.046 348 HD13 ILE 44 HD13 ILE 44 -7.669 11.729 12.095 349 H PHE 45 H PHE 45 -5.573 9.678 7.698 350 HA PHE 45 HA PHE 45 -7.155 7.754 6.097 351 HB2 PHE 45 HB2 PHE 45 -5.175 7.132 4.877 352 HB3 PHE 45 HB3 PHE 45 -5.336 8.882 4.807 353 HD1 PHE 45 HD2 PHE 45 -3.756 10.326 5.964 354 HD2 PHE 45 HD1 PHE 45 -3.375 6.084 6.102 355 HE1 PHE 45 HE2 PHE 45 -1.464 10.557 6.828 356 HE2 PHE 45 HE1 PHE 45 -1.084 6.313 6.964 357 HZ PHE 45 HZ PHE 45 -0.132 8.550 7.330 358 H THR 46 H THR 46 -7.013 5.594 6.537 359 HA THR 46 HA THR 46 -5.382 4.793 8.874 360 HB THR 46 HB THR 46 -7.617 4.578 9.606 361 HG1 THR 46 HG1 THR 46 -6.819 1.998 8.645 362 HG21 THR 46 HG21 THR 46 -8.782 4.820 7.498 363 HG22 THR 46 HG22 THR 46 -9.364 3.381 8.337 364 HG23 THR 46 HG23 THR 46 -8.246 3.219 6.984 365 H CYS 47 H CYS 47 -3.621 3.902 7.975 366 HA CYS 47 HA CYS 47 -3.874 2.044 5.728 367 HB2 CYS 47 HB2 CYS 47 -2.140 3.802 5.636 368 HB3 CYS 47 HB3 CYS 47 -1.388 3.127 7.077 369 HG CYS 47 HG CYS 47 -1.779 1.032 4.456 370 H ASN 48 H ASN 48 -4.226 -0.037 6.193 371 HA ASN 48 HA ASN 48 -3.210 -1.204 8.685 372 HB2 ASN 48 HB2 ASN 48 -5.216 -2.245 6.661 373 HB3 ASN 48 HB3 ASN 48 -4.696 -3.133 8.090 374 HD21 ASN 48 HD21 ASN 48 -6.777 -3.194 8.914 375 HD22 ASN 48 HD22 ASN 48 -7.541 -1.797 9.585 376 H LEU 49 H LEU 49 -1.256 -2.115 8.564 377 HA LEU 49 HA LEU 49 -0.308 -3.231 6.017 378 HB2 LEU 49 HB2 LEU 49 1.169 -1.613 6.990 379 HB3 LEU 49 HB3 LEU 49 1.130 -2.427 8.545 380 HG LEU 49 HG LEU 49 2.352 -4.338 7.584 381 HD11 LEU 49 HD11 LEU 49 2.397 -2.684 5.059 382 HD12 LEU 49 HD12 LEU 49 1.591 -4.236 5.292 383 HD13 LEU 49 HD13 LEU 49 3.351 -4.144 5.336 384 HD21 LEU 49 HD21 LEU 49 4.510 -3.247 7.335 385 HD22 LEU 49 HD22 LEU 49 3.586 -2.499 8.635 386 HD23 LEU 49 HD23 LEU 49 3.717 -1.693 7.071 387 H MET 50 H MET 50 -0.020 -5.354 5.701 388 HA MET 50 HA MET 50 0.041 -7.148 8.048 389 HB2 MET 50 HB2 MET 50 -1.283 -7.690 5.380 390 HB3 MET 50 HB3 MET 50 -1.171 -8.828 6.716 391 HG2 MET 50 HG2 MET 50 -2.661 -6.209 6.728 392 HG3 MET 50 HG3 MET 50 -3.370 -7.818 6.620 393 HE1 MET 50 HE1 MET 50 -2.154 -9.229 10.177 394 HE2 MET 50 HE2 MET 50 -1.134 -9.181 8.742 395 HE3 MET 50 HE3 MET 50 -2.818 -9.691 8.608 396 H ILE 51 H ILE 51 1.978 -8.041 8.209 397 HA ILE 51 HA ILE 51 3.333 -9.109 5.827 398 HB ILE 51 HB ILE 51 5.540 -8.222 6.871 399 HG12 ILE 51 HG12 ILE 51 5.144 -5.917 7.948 400 HG13 ILE 51 HG13 ILE 51 3.490 -6.454 8.218 401 HG21 ILE 51 HG21 ILE 51 5.411 -6.150 5.593 402 HG22 ILE 51 HG22 ILE 51 3.653 -6.288 5.526 403 HG23 ILE 51 HG23 ILE 51 4.663 -7.484 4.714 404 HD11 ILE 51 HD11 ILE 51 5.958 -7.799 9.286 405 HD12 ILE 51 HD12 ILE 51 4.288 -8.271 9.606 406 HD13 ILE 51 HD13 ILE 51 4.896 -6.721 10.191 407 H PHE 52 H PHE 52 5.277 -10.527 6.519 408 HA PHE 52 HA PHE 52 4.466 -12.085 8.880 409 HB2 PHE 52 HB2 PHE 52 6.018 -12.753 6.402 410 HB3 PHE 52 HB3 PHE 52 6.273 -13.714 7.854 411 HD1 PHE 52 HD2 PHE 52 4.423 -15.027 8.816 412 HD2 PHE 52 HD1 PHE 52 4.010 -12.974 5.110 413 HE1 PHE 52 HE2 PHE 52 2.440 -16.383 8.293 414 HE2 PHE 52 HE1 PHE 52 2.024 -14.323 4.582 415 HZ PHE 52 HZ PHE 52 1.235 -16.031 6.171 416 H VAL 53 H VAL 53 5.704 -12.306 10.671 417 HA VAL 53 HA VAL 53 8.539 -11.502 10.560 418 HB VAL 53 HB VAL 53 8.475 -10.250 12.569 419 HG11 VAL 53 HG11 VAL 53 7.645 -8.996 10.641 420 HG12 VAL 53 HG12 VAL 53 6.902 -8.446 12.144 421 HG13 VAL 53 HG13 VAL 53 5.994 -9.480 11.041 422 HG21 VAL 53 HG21 VAL 53 6.474 -9.985 13.964 423 HG22 VAL 53 HG22 VAL 53 7.020 -11.660 13.890 424 HG23 VAL 53 HG23 VAL 53 5.621 -11.145 12.944 425 H LYS 54 H LYS 54 9.919 -12.773 11.751 426 HA LYS 54 HA LYS 54 8.983 -15.293 12.655 427 HB2 LYS 54 HB2 LYS 54 11.241 -15.906 13.041 428 HB3 LYS 54 HB3 LYS 54 11.196 -14.933 11.580 429 HG2 LYS 54 HG2 LYS 54 12.030 -13.968 14.311 430 HG3 LYS 54 HG3 LYS 54 13.114 -14.398 12.988 431 HD2 LYS 54 HD2 LYS 54 12.190 -12.597 11.625 432 HD3 LYS 54 HD3 LYS 54 11.060 -12.184 12.919 433 HE2 LYS 54 HE2 LYS 54 12.861 -10.658 13.038 434 HE3 LYS 54 HE3 LYS 54 13.008 -11.779 14.390 435 HZ1 LYS 54 HZ1 LYS 54 14.691 -12.993 13.158 436 HZ2 LYS 54 HZ2 LYS 54 15.144 -11.371 13.317 437 HZ3 LYS 54 HZ3 LYS 54 14.534 -11.936 11.848 438 H ASN 55 H ASN 55 9.076 -12.368 14.298 439 HA ASN 55 HA ASN 55 8.219 -13.605 16.718 440 HB2 ASN 55 HB2 ASN 55 10.039 -12.552 18.171 441 HB3 ASN 55 HB3 ASN 55 10.473 -13.995 17.269 442 HD21 ASN 55 HD21 ASN 55 10.219 -10.873 15.710 443 HD22 ASN 55 HD22 ASN 55 11.911 -10.654 15.477 444 H THR 56 H THR 56 7.493 -12.087 18.359 445 HA THR 56 HA THR 56 6.059 -9.948 17.184 446 HB THR 56 HB THR 56 5.387 -9.376 19.527 447 HG1 THR 56 HG1 THR 56 6.319 -10.381 21.205 448 HG21 THR 56 HG21 THR 56 4.121 -11.051 18.281 449 HG22 THR 56 HG22 THR 56 4.221 -11.502 19.984 450 HG23 THR 56 HG23 THR 56 5.246 -12.309 18.796 451 H ASP 57 H ASP 57 9.174 -10.047 18.675 452 HA ASP 57 HA ASP 57 9.470 -7.373 19.513 453 HB2 ASP 57 HB2 ASP 57 11.648 -9.143 18.362 454 HB3 ASP 57 HB3 ASP 57 11.842 -7.823 19.514 455 H LYS 58 H LYS 58 10.297 -9.000 16.506 456 HA LYS 58 HA LYS 58 11.217 -6.865 14.992 457 HB2 LYS 58 HB2 LYS 58 11.519 -9.146 14.292 458 HB3 LYS 58 HB3 LYS 58 9.783 -9.417 14.239 459 HG2 LYS 58 HG2 LYS 58 10.698 -9.221 12.011 460 HG3 LYS 58 HG3 LYS 58 9.584 -7.900 12.373 461 HD2 LYS 58 HD2 LYS 58 11.367 -6.342 12.641 462 HD3 LYS 58 HD3 LYS 58 12.575 -7.626 12.709 463 HE2 LYS 58 HE2 LYS 58 12.693 -6.506 10.569 464 HE3 LYS 58 HE3 LYS 58 12.108 -8.149 10.338 465 HZ1 LYS 58 HZ1 LYS 58 10.912 -6.487 9.029 466 HZ2 LYS 58 HZ2 LYS 58 10.380 -5.748 10.453 467 HZ3 LYS 58 HZ3 LYS 58 9.894 -7.330 10.088 468 H LEU 59 H LEU 59 7.919 -7.897 15.688 469 HA LEU 59 HA LEU 59 6.628 -6.242 13.758 470 HB2 LEU 59 HB2 LEU 59 5.457 -8.135 14.610 471 HB3 LEU 59 HB3 LEU 59 5.676 -7.611 16.268 472 HG LEU 59 HG LEU 59 4.124 -5.752 15.919 473 HD11 LEU 59 HD11 LEU 59 3.893 -6.820 13.107 474 HD12 LEU 59 HD12 LEU 59 4.509 -5.243 13.600 475 HD13 LEU 59 HD13 LEU 59 2.804 -5.634 13.824 476 HD21 LEU 59 HD21 LEU 59 3.002 -8.405 15.012 477 HD22 LEU 59 HD22 LEU 59 2.070 -7.053 15.658 478 HD23 LEU 59 HD23 LEU 59 3.234 -7.889 16.684 479 H THR 60 H THR 60 7.184 -5.851 17.268 480 HA THR 60 HA THR 60 5.963 -3.322 17.511 481 HB THR 60 HB THR 60 7.218 -3.042 19.603 482 HG1 THR 60 HG1 THR 60 8.627 -5.381 18.750 483 HG21 THR 60 HG21 THR 60 5.233 -4.523 19.555 484 HG22 THR 60 HG22 THR 60 6.412 -5.014 20.769 485 HG23 THR 60 HG23 THR 60 6.295 -5.900 19.250 486 H THR 61 H THR 61 9.254 -4.234 16.618 487 HA THR 61 HA THR 61 10.477 -1.726 16.612 488 HB THR 61 HB THR 61 10.947 -3.972 14.626 489 HG1 THR 61 HG1 THR 61 12.649 -4.507 16.173 490 HG21 THR 61 HG21 THR 61 13.223 -3.031 14.452 491 HG22 THR 61 HG22 THR 61 12.744 -1.697 15.501 492 HG23 THR 61 HG23 THR 61 11.996 -1.881 13.915 493 H LEU 62 H LEU 62 8.498 -3.272 14.096 494 HA LEU 62 HA LEU 62 8.796 -1.275 12.120 495 HB2 LEU 62 HB2 LEU 62 6.516 -3.203 12.588 496 HB3 LEU 62 HB3 LEU 62 6.726 -2.242 11.136 497 HG LEU 62 HG LEU 62 8.567 -4.433 12.115 498 HD11 LEU 62 HD11 LEU 62 6.502 -5.278 11.155 499 HD12 LEU 62 HD12 LEU 62 7.860 -5.596 10.076 500 HD13 LEU 62 HD13 LEU 62 6.738 -4.281 9.720 501 HD21 LEU 62 HD21 LEU 62 9.773 -4.079 9.987 502 HD22 LEU 62 HD22 LEU 62 9.887 -2.697 11.073 503 HD23 LEU 62 HD23 LEU 62 8.792 -2.643 9.692 504 H MET 63 H MET 63 6.540 -1.590 14.820 505 HA MET 63 HA MET 63 4.694 0.399 14.193 506 HB2 MET 63 HB2 MET 63 5.796 -0.240 16.942 507 HB3 MET 63 HB3 MET 63 4.294 0.611 16.607 508 HG2 MET 63 HG2 MET 63 3.381 -1.394 15.563 509 HG3 MET 63 HG3 MET 63 4.895 -2.248 15.867 510 HE1 MET 63 HE1 MET 63 2.199 -3.515 16.781 511 HE2 MET 63 HE2 MET 63 2.579 -4.009 18.431 512 HE3 MET 63 HE3 MET 63 3.775 -4.216 17.150 513 H ASP 64 H ASP 64 7.823 0.713 15.844 514 HA ASP 64 HA ASP 64 7.785 3.486 16.289 515 HB2 ASP 64 HB2 ASP 64 9.437 2.025 17.334 516 HB3 ASP 64 HB3 ASP 64 10.123 1.633 15.764 517 H LYS 65 H LYS 65 9.251 1.641 13.623 518 HA LYS 65 HA LYS 65 10.375 3.694 12.165 519 HB2 LYS 65 HB2 LYS 65 9.073 1.181 11.099 520 HB3 LYS 65 HB3 LYS 65 10.241 2.166 10.225 521 HG2 LYS 65 HG2 LYS 65 11.913 1.666 11.988 522 HG3 LYS 65 HG3 LYS 65 10.732 0.615 12.768 523 HD2 LYS 65 HD2 LYS 65 12.155 -0.793 11.487 524 HD3 LYS 65 HD3 LYS 65 10.629 -0.690 10.609 525 HE2 LYS 65 HE2 LYS 65 12.562 -0.512 9.106 526 HE3 LYS 65 HE3 LYS 65 11.589 0.959 9.093 527 HZ1 LYS 65 HZ1 LYS 65 13.989 0.669 10.805 528 HZ2 LYS 65 HZ2 LYS 65 13.181 2.091 10.370 529 HZ3 LYS 65 HZ3 LYS 65 14.080 1.242 9.220 530 H LEU 66 H LEU 66 7.030 2.584 12.108 531 HA LEU 66 HA LEU 66 6.237 4.427 10.010 532 HB2 LEU 66 HB2 LEU 66 4.592 2.662 11.838 533 HB3 LEU 66 HB3 LEU 66 3.987 3.511 10.423 534 HG LEU 66 HG LEU 66 6.166 1.421 10.274 535 HD11 LEU 66 HD11 LEU 66 4.402 -0.110 9.435 536 HD12 LEU 66 HD12 LEU 66 3.190 1.067 9.942 537 HD13 LEU 66 HD13 LEU 66 4.230 0.302 11.142 538 HD21 LEU 66 HD21 LEU 66 4.372 2.627 8.163 539 HD22 LEU 66 HD22 LEU 66 5.584 1.372 7.900 540 HD23 LEU 66 HD23 LEU 66 6.083 2.986 8.402 541 H ARG 67 H ARG 67 6.292 4.378 13.497 542 HA ARG 67 HA ARG 67 4.422 6.547 13.834 543 HB2 ARG 67 HB2 ARG 67 4.684 4.764 15.516 544 HB3 ARG 67 HB3 ARG 67 6.339 5.279 15.807 545 HG2 ARG 67 HG2 ARG 67 5.586 7.373 16.724 546 HG3 ARG 67 HG3 ARG 67 3.917 7.013 16.278 547 HD2 ARG 67 HD2 ARG 67 5.582 5.441 18.249 548 HD3 ARG 67 HD3 ARG 67 4.345 6.625 18.673 549 HE ARG 67 HE ARG 67 3.525 4.379 17.007 550 HH11 ARG 67 HH11 ARG 67 3.616 5.773 20.158 551 HH12 ARG 67 HH12 ARG 67 2.339 4.772 20.750 552 HH21 ARG 67 HH21 ARG 67 1.868 3.127 17.788 553 HH22 ARG 67 HH22 ARG 67 1.339 3.322 19.418 554 H LYS 68 H LYS 68 7.683 6.427 12.918 555 HA LYS 68 HA LYS 68 8.646 8.753 14.271 556 HB2 LYS 68 HB2 LYS 68 9.688 7.553 11.694 557 HB3 LYS 68 HB3 LYS 68 10.549 8.658 12.756 558 HG2 LYS 68 HG2 LYS 68 9.739 5.822 13.372 559 HG3 LYS 68 HG3 LYS 68 11.368 6.417 13.071 560 HD2 LYS 68 HD2 LYS 68 9.636 7.322 15.377 561 HD3 LYS 68 HD3 LYS 68 10.830 6.030 15.487 562 HE2 LYS 68 HE2 LYS 68 12.595 7.620 14.856 563 HE3 LYS 68 HE3 LYS 68 11.394 8.909 14.765 564 HZ1 LYS 68 HZ1 LYS 68 12.604 8.908 16.873 565 HZ2 LYS 68 HZ2 LYS 68 12.038 7.354 17.215 566 HZ3 LYS 68 HZ3 LYS 68 10.954 8.643 17.105 567 H VAL 69 H VAL 69 6.365 8.487 11.849 568 HA VAL 69 HA VAL 69 6.994 11.003 10.520 569 HB VAL 69 HB VAL 69 4.616 9.144 10.223 570 HG11 VAL 69 HG11 VAL 69 3.959 11.433 9.674 571 HG12 VAL 69 HG12 VAL 69 4.080 10.469 8.202 572 HG13 VAL 69 HG13 VAL 69 5.363 11.604 8.619 573 HG21 VAL 69 HG21 VAL 69 5.644 8.566 8.063 574 HG22 VAL 69 HG22 VAL 69 6.698 8.166 9.419 575 HG23 VAL 69 HG23 VAL 69 7.020 9.601 8.445 576 H GLN 70 H GLN 70 6.364 12.921 11.283 577 HA GLN 70 HA GLN 70 4.978 13.269 13.691 578 HB2 GLN 70 HB2 GLN 70 5.000 15.656 13.178 579 HB3 GLN 70 HB3 GLN 70 6.548 14.922 12.779 580 HG2 GLN 70 HG2 GLN 70 5.941 14.875 10.418 581 HG3 GLN 70 HG3 GLN 70 4.365 15.564 10.801 582 HE21 GLN 70 HE21 GLN 70 6.424 16.601 9.056 583 HE22 GLN 70 HE22 GLN 70 6.825 18.166 9.665 584 H GLY 71 H GLY 71 3.747 13.103 10.417 585 HA2 GLY 71 HA2 GLY 71 1.235 14.361 10.927 586 HA3 GLY 71 HA3 GLY 71 1.644 13.391 9.524 587 H VAL 72 H VAL 72 2.374 11.210 11.679 588 HA VAL 72 HA VAL 72 -0.347 10.103 11.777 589 HB VAL 72 HB VAL 72 2.301 8.744 12.346 590 HG11 VAL 72 HG11 VAL 72 0.449 7.692 13.544 591 HG12 VAL 72 HG12 VAL 72 1.007 6.654 12.232 592 HG13 VAL 72 HG13 VAL 72 -0.479 7.587 12.047 593 HG21 VAL 72 HG21 VAL 72 2.012 7.668 10.174 594 HG22 VAL 72 HG22 VAL 72 2.068 9.422 9.993 595 HG23 VAL 72 HG23 VAL 72 0.522 8.575 9.905 596 H PHE 73 H PHE 73 -1.384 9.555 13.671 597 HA PHE 73 HA PHE 73 0.017 10.225 16.177 598 HB2 PHE 73 HB2 PHE 73 -2.454 10.808 16.945 599 HB3 PHE 73 HB3 PHE 73 -1.423 11.979 16.145 600 HD1 PHE 73 HD1 PHE 73 -4.313 9.740 15.699 601 HD2 PHE 73 HD2 PHE 73 -1.920 12.814 13.976 602 HE1 PHE 73 HE1 PHE 73 -6.025 10.104 13.967 603 HE2 PHE 73 HE2 PHE 73 -3.625 13.178 12.246 604 HZ PHE 73 HZ PHE 73 -5.680 11.826 12.238 605 H THR 74 H THR 74 -1.450 7.732 14.506 606 HA THR 74 HA THR 74 -1.447 6.147 16.985 607 HB THR 74 HB THR 74 -3.470 5.012 16.578 608 HG1 THR 74 HG1 THR 74 -4.634 5.244 14.617 609 HG21 THR 74 HG21 THR 74 -4.022 7.876 15.792 610 HG22 THR 74 HG22 THR 74 -3.888 7.272 17.444 611 HG23 THR 74 HG23 THR 74 -5.210 6.727 16.409 612 H VAL 75 H VAL 75 -0.142 4.443 16.742 613 HA VAL 75 HA VAL 75 -0.212 2.919 14.231 614 HB VAL 75 HB VAL 75 2.405 3.545 15.640 615 HG11 VAL 75 HG11 VAL 75 3.433 2.513 13.654 616 HG12 VAL 75 HG12 VAL 75 1.827 2.145 13.024 617 HG13 VAL 75 HG13 VAL 75 2.384 1.388 14.517 618 HG21 VAL 75 HG21 VAL 75 2.971 4.933 13.679 619 HG22 VAL 75 HG22 VAL 75 1.603 5.584 14.582 620 HG23 VAL 75 HG23 VAL 75 1.329 4.721 13.067 621 H GLU 76 H GLU 76 -1.142 1.079 15.013 622 HA GLU 76 HA GLU 76 -0.040 -0.122 17.485 623 HB2 GLU 76 HB2 GLU 76 -2.980 0.082 16.776 624 HB3 GLU 76 HB3 GLU 76 -2.320 -0.707 18.199 625 HG2 GLU 76 HG2 GLU 76 -2.179 2.237 17.574 626 HG3 GLU 76 HG3 GLU 76 -3.264 1.472 18.730 627 H ARG 77 H ARG 77 -1.098 -2.443 17.766 628 HA ARG 77 HA ARG 77 -0.666 -3.862 15.246 629 HB2 ARG 77 HB2 ARG 77 0.527 -4.708 17.212 630 HB3 ARG 77 HB3 ARG 77 -0.998 -4.939 18.063 631 HG2 ARG 77 HG2 ARG 77 -1.681 -6.569 16.332 632 HG3 ARG 77 HG3 ARG 77 -0.108 -6.376 15.564 633 HD2 ARG 77 HD2 ARG 77 0.977 -7.218 17.601 634 HD3 ARG 77 HD3 ARG 77 -0.608 -7.424 18.355 635 HE ARG 77 HE ARG 77 0.186 -8.871 15.905 636 HH11 ARG 77 HH11 ARG 77 -1.197 -8.826 19.046 637 HH12 ARG 77 HH12 ARG 77 -1.701 -10.475 18.967 638 HH21 ARG 77 HH21 ARG 77 -0.457 -10.979 15.802 639 HH22 ARG 77 HH22 ARG 77 -1.275 -11.695 17.148 640 H LEU 78 H LEU 78 -2.144 -5.221 14.299 641 HA LEU 78 HA LEU 78 -4.948 -4.952 15.089 642 HB2 LEU 78 HB2 LEU 78 -3.604 -6.081 12.631 643 HB3 LEU 78 HB3 LEU 78 -5.341 -6.141 12.893 644 HG LEU 78 HG LEU 78 -3.700 -3.603 12.677 645 HD11 LEU 78 HD11 LEU 78 -5.566 -4.896 10.685 646 HD12 LEU 78 HD12 LEU 78 -3.810 -4.798 10.550 647 HD13 LEU 78 HD13 LEU 78 -4.779 -3.326 10.500 648 HD21 LEU 78 HD21 LEU 78 -5.882 -2.483 12.554 649 HD22 LEU 78 HD22 LEU 78 -5.667 -3.320 14.091 650 HD23 LEU 78 HD23 LEU 78 -6.688 -4.026 12.839 651 H SER 79 H SER 79 -5.765 -6.434 16.450 652 HA SER 79 HA SER 79 -4.435 -8.973 16.879 653 HB2 SER 79 HB2 SER 79 -5.306 -7.791 18.817 654 HB3 SER 79 HB3 SER 79 -6.932 -7.798 18.133 655 HG SER 79 HG SER 79 -7.142 -9.609 19.178 656 H ASN 80 H ASN 80 -7.667 -7.961 15.761 657 HA ASN 80 HA ASN 80 -8.359 -10.689 15.017 658 HB2 ASN 80 HB2 ASN 80 -9.884 -8.085 14.743 659 HB3 ASN 80 HB3 ASN 80 -10.521 -9.664 14.286 660 HD21 ASN 80 HD21 ASN 80 -9.528 -7.639 16.945 661 HD22 ASN 80 HD22 ASN 80 -10.300 -8.561 18.185 662 H LEU 81 H LEU 81 -7.734 -11.526 13.121 663 HA LEU 81 HA LEU 81 -7.108 -9.709 10.910 664 HB2 LEU 81 HB2 LEU 81 -6.045 -12.481 11.478 665 HB3 LEU 81 HB3 LEU 81 -5.648 -11.519 10.066 666 HG LEU 81 HG LEU 81 -4.870 -10.991 12.933 667 HD11 LEU 81 HD11 LEU 81 -3.246 -11.402 10.419 668 HD12 LEU 81 HD12 LEU 81 -3.465 -12.571 11.724 669 HD13 LEU 81 HD13 LEU 81 -2.596 -11.067 12.026 670 HD21 LEU 81 HD21 LEU 81 -4.525 -9.146 10.560 671 HD22 LEU 81 HD22 LEU 81 -3.815 -8.916 12.160 672 HD23 LEU 81 HD23 LEU 81 -5.565 -8.862 11.957 673 H GLU 82 H GLU 82 -8.261 -9.802 9.189 674 HA GLU 82 HA GLU 82 -10.485 -11.632 8.935 675 HB2 GLU 82 HB2 GLU 82 -11.124 -10.152 7.059 676 HB3 GLU 82 HB3 GLU 82 -10.864 -9.276 8.562 677 HG2 GLU 82 HG2 GLU 82 -8.718 -9.536 6.491 678 HG3 GLU 82 HG3 GLU 82 -9.934 -8.272 6.418 679 H HIS 83 H HIS 83 -7.839 -12.773 8.561 680 HA HIS 83 HA HIS 83 -7.475 -12.970 5.660 681 HB2 HIS 83 HB2 HIS 83 -5.653 -13.688 7.961 682 HB3 HIS 83 HB3 HIS 83 -5.245 -13.905 6.264 683 HD1 HIS 83 HD1 HIS 83 -3.953 -12.031 5.305 684 HD2 HIS 83 HD2 HIS 83 -6.343 -10.798 8.466 685 HE1 HIS 83 HE1 HIS 83 -3.468 -9.590 5.604 686 HE2 HIS 83 HE2 HIS 83 -5.119 -8.823 7.348 687 H HIS 84 H HIS 84 -9.314 -14.648 7.668 688 HA HIS 84 HA HIS 84 -8.518 -17.337 7.129 689 HB2 HIS 84 HB2 HIS 84 -10.109 -16.601 8.966 690 HB3 HIS 84 HB3 HIS 84 -11.333 -16.383 7.719 691 HD1 HIS 84 HD1 HIS 84 -9.141 -19.118 9.169 692 HD2 HIS 84 HD2 HIS 84 -12.719 -18.666 7.100 693 HE1 HIS 84 HE1 HIS 84 -10.163 -21.404 9.087 694 HE2 HIS 84 HE2 HIS 84 -12.401 -21.072 7.994 695 H HIS 85 H HIS 85 -8.487 -18.246 5.165 696 HA HIS 85 HA HIS 85 -9.129 -16.855 2.864 697 HB2 HIS 85 HB2 HIS 85 -8.787 -19.844 3.186 698 HB3 HIS 85 HB3 HIS 85 -8.734 -18.978 1.651 699 HD1 HIS 85 HD1 HIS 85 -6.694 -17.265 1.358 700 HD2 HIS 85 HD2 HIS 85 -6.417 -19.862 4.594 701 HE1 HIS 85 HE1 HIS 85 -4.307 -17.153 2.109 702 HE2 HIS 85 HE2 HIS 85 -4.134 -18.803 3.997 703 H HIS 86 H HIS 86 -10.733 -16.980 1.295 704 HA HIS 86 HA HIS 86 -13.325 -17.066 2.431 705 HB2 HIS 86 HB2 HIS 86 -12.298 -16.533 -0.339 706 HB3 HIS 86 HB3 HIS 86 -14.026 -16.669 -0.041 707 HD1 HIS 86 HD1 HIS 86 -15.197 -14.688 0.941 708 HD2 HIS 86 HD2 HIS 86 -11.059 -14.291 1.022 709 HE1 HIS 86 HE1 HIS 86 -14.760 -12.318 1.644 710 HE2 HIS 86 HE2 HIS 86 -12.265 -12.050 1.489 711 H HIS 87 H HIS 87 -14.121 -19.022 3.016 712 HA HIS 87 HA HIS 87 -14.334 -21.258 1.236 713 HB2 HIS 87 HB2 HIS 87 -14.598 -21.401 3.732 714 HB3 HIS 87 HB3 HIS 87 -16.118 -20.526 3.584 715 HD1 HIS 87 HD1 HIS 87 -14.540 -23.814 2.585 716 HD2 HIS 87 HD2 HIS 87 -18.298 -22.094 3.004 717 HE1 HIS 87 HE1 HIS 87 -16.172 -25.698 2.318 718 HE2 HIS 87 HE2 HIS 87 -18.427 -24.663 2.721 719 H HIS 88 H HIS 88 -16.202 -18.406 1.974 720 HA HIS 88 HA HIS 88 -17.663 -18.736 -0.563 721 HB2 HIS 88 HB2 HIS 88 -18.727 -17.678 2.063 722 HB3 HIS 88 HB3 HIS 88 -19.505 -17.326 0.524 723 HD1 HIS 88 HD1 HIS 88 -19.961 -19.478 3.225 724 HD2 HIS 88 HD2 HIS 88 -19.894 -20.074 -0.882 725 HE1 HIS 88 HE1 HIS 88 -21.217 -21.613 2.838 726 HE2 HIS 88 HE2 HIS 88 -21.328 -21.844 0.336 727 H1 MET 1 H1 MET 1 -8.687 20.908 -10.318 728 H2 MET 1 H2 MET 1 -8.959 22.511 -9.851 729 H3 MET 1 H3 MET 1 -8.992 22.097 -11.487 730 HA MET 1 HA MET 1 -10.891 21.185 -9.406 731 HB2 MET 1 HB2 MET 1 -12.556 22.550 -10.608 732 HB3 MET 1 HB3 MET 1 -11.236 23.524 -9.980 733 HG2 MET 1 HG2 MET 1 -10.224 23.539 -12.237 734 HG3 MET 1 HG3 MET 1 -11.622 22.651 -12.838 735 HE1 MET 1 HE1 MET 1 -10.609 25.436 -14.078 736 HE2 MET 1 HE2 MET 1 -12.153 26.256 -14.317 737 HE3 MET 1 HE3 MET 1 -12.000 24.540 -14.692 738 H THR 2 H THR 2 -9.715 20.816 -12.703 739 HA THR 2 HA THR 2 -11.785 19.106 -13.640 740 HB THR 2 HB THR 2 -8.896 19.178 -14.566 741 HG1 THR 2 HG1 THR 2 -9.736 20.686 -16.136 742 HG21 THR 2 HG21 THR 2 -9.820 18.424 -16.722 743 HG22 THR 2 HG22 THR 2 -11.422 18.316 -15.993 744 HG23 THR 2 HG23 THR 2 -10.127 17.253 -15.438 745 H ASP 3 H ASP 3 -9.246 18.648 -11.441 746 HA ASP 3 HA ASP 3 -8.404 16.034 -11.832 747 HB2 ASP 3 HB2 ASP 3 -8.769 17.135 -9.058 748 HB3 ASP 3 HB3 ASP 3 -7.447 16.168 -9.705 749 H PHE 4 H PHE 4 -9.176 14.026 -11.288 750 HA PHE 4 HA PHE 4 -11.604 13.808 -9.663 751 HB2 PHE 4 HB2 PHE 4 -12.677 12.316 -11.279 752 HB3 PHE 4 HB3 PHE 4 -12.376 13.888 -12.005 753 HD1 PHE 4 HD2 PHE 4 -10.726 14.144 -13.791 754 HD2 PHE 4 HD1 PHE 4 -11.478 10.336 -12.028 755 HE1 PHE 4 HE2 PHE 4 -9.536 13.048 -15.650 756 HE2 PHE 4 HE1 PHE 4 -10.286 9.242 -13.879 757 HZ PHE 4 HZ PHE 4 -9.305 10.593 -15.687 758 H LEU 5 H LEU 5 -11.961 11.651 -8.823 759 HA LEU 5 HA LEU 5 -9.516 10.283 -8.184 760 HB2 LEU 5 HB2 LEU 5 -11.381 10.553 -6.570 761 HB3 LEU 5 HB3 LEU 5 -12.380 9.543 -7.591 762 HG LEU 5 HG LEU 5 -10.953 7.613 -7.151 763 HD11 LEU 5 HD11 LEU 5 -8.805 8.761 -6.961 764 HD12 LEU 5 HD12 LEU 5 -9.101 7.736 -5.556 765 HD13 LEU 5 HD13 LEU 5 -9.315 9.483 -5.433 766 HD21 LEU 5 HD21 LEU 5 -12.782 8.075 -5.598 767 HD22 LEU 5 HD22 LEU 5 -11.703 9.065 -4.613 768 HD23 LEU 5 HD23 LEU 5 -11.415 7.332 -4.771 769 H ALA 6 H ALA 6 -8.582 9.043 -9.705 770 HA ALA 6 HA ALA 6 -10.238 7.355 -11.451 771 HB1 ALA 6 HB1 ALA 6 -8.295 7.152 -12.866 772 HB2 ALA 6 HB2 ALA 6 -7.288 7.961 -11.663 773 HB3 ALA 6 HB3 ALA 6 -8.562 8.855 -12.492 774 H GLY 7 H GLY 7 -9.674 5.099 -11.767 775 HA2 GLY 7 HA2 GLY 7 -8.245 3.908 -9.464 776 HA3 GLY 7 HA3 GLY 7 -9.833 3.337 -9.940 777 H ILE 8 H ILE 8 -6.906 2.275 -9.877 778 HA ILE 8 HA ILE 8 -7.109 0.829 -12.452 779 HB ILE 8 HB ILE 8 -4.518 1.529 -11.027 780 HG12 ILE 8 HG12 ILE 8 -5.618 2.683 -13.611 781 HG13 ILE 8 HG13 ILE 8 -5.580 3.525 -12.067 782 HG21 ILE 8 HG21 ILE 8 -5.017 0.201 -13.697 783 HG22 ILE 8 HG22 ILE 8 -4.402 -0.576 -12.236 784 HG23 ILE 8 HG23 ILE 8 -3.438 0.653 -13.054 785 HD11 ILE 8 HD11 ILE 8 -3.140 3.438 -12.073 786 HD12 ILE 8 HD12 ILE 8 -3.763 4.243 -13.512 787 HD13 ILE 8 HD13 ILE 8 -3.174 2.584 -13.615 788 H ARG 9 H ARG 9 -7.322 -1.350 -12.172 789 HA ARG 9 HA ARG 9 -6.664 -2.470 -9.528 790 HB2 ARG 9 HB2 ARG 9 -8.962 -2.824 -10.232 791 HB3 ARG 9 HB3 ARG 9 -8.425 -3.562 -11.735 792 HG2 ARG 9 HG2 ARG 9 -7.674 -5.504 -10.650 793 HG3 ARG 9 HG3 ARG 9 -7.687 -4.729 -9.063 794 HD2 ARG 9 HD2 ARG 9 -10.163 -5.264 -10.711 795 HD3 ARG 9 HD3 ARG 9 -9.568 -6.335 -9.441 796 HE ARG 9 HE ARG 9 -9.778 -4.131 -8.047 797 HH11 ARG 9 HH11 ARG 9 -11.966 -5.264 -10.461 798 HH12 ARG 9 HH12 ARG 9 -13.339 -4.535 -9.703 799 HH21 ARG 9 HH21 ARG 9 -11.581 -3.150 -7.117 800 HH22 ARG 9 HH22 ARG 9 -13.125 -3.365 -7.863 801 H ILE 10 H ILE 10 -4.840 -3.526 -9.307 802 HA ILE 10 HA ILE 10 -3.493 -4.695 -11.658 803 HB ILE 10 HB ILE 10 -2.340 -4.128 -8.914 804 HG12 ILE 10 HG12 ILE 10 -2.049 -2.469 -11.437 805 HG13 ILE 10 HG13 ILE 10 -3.082 -2.049 -10.072 806 HG21 ILE 10 HG21 ILE 10 -1.137 -5.849 -10.164 807 HG22 ILE 10 HG22 ILE 10 -0.171 -4.382 -10.025 808 HG23 ILE 10 HG23 ILE 10 -0.987 -4.758 -11.543 809 HD11 ILE 10 HD11 ILE 10 -1.112 -1.927 -8.627 810 HD12 ILE 10 HD12 ILE 10 -1.004 -0.819 -9.993 811 HD13 ILE 10 HD13 ILE 10 -0.085 -2.323 -10.006 812 H VAL 11 H VAL 11 -3.753 -6.882 -11.877 813 HA VAL 11 HA VAL 11 -3.710 -8.494 -9.396 814 HB VAL 11 HB VAL 11 -5.188 -9.081 -11.970 815 HG11 VAL 11 HG11 VAL 11 -4.148 -11.142 -11.158 816 HG12 VAL 11 HG12 VAL 11 -5.896 -11.189 -10.933 817 HG13 VAL 11 HG13 VAL 11 -4.839 -10.871 -9.557 818 HG21 VAL 11 HG21 VAL 11 -6.333 -7.542 -10.441 819 HG22 VAL 11 HG22 VAL 11 -6.148 -8.702 -9.124 820 HG23 VAL 11 HG23 VAL 11 -7.167 -9.094 -10.510 821 H GLY 12 H GLY 12 -1.867 -9.493 -9.135 822 HA2 GLY 12 HA2 GLY 12 -0.520 -10.739 -11.445 823 HA3 GLY 12 HA3 GLY 12 0.392 -9.658 -10.402 824 H GLU 13 H GLU 13 1.388 -12.120 -10.647 825 HA GLU 13 HA GLU 13 0.260 -14.010 -8.814 826 HB2 GLU 13 HB2 GLU 13 2.298 -15.339 -9.293 827 HB3 GLU 13 HB3 GLU 13 1.447 -14.815 -10.738 828 HG2 GLU 13 HG2 GLU 13 3.102 -12.949 -10.948 829 HG3 GLU 13 HG3 GLU 13 4.001 -13.672 -9.613 830 H ASP 14 H ASP 14 0.614 -14.290 -6.704 831 HA ASP 14 HA ASP 14 2.111 -12.360 -5.221 832 HB2 ASP 14 HB2 ASP 14 0.084 -13.205 -4.264 833 HB3 ASP 14 HB3 ASP 14 0.636 -14.870 -4.406 834 H LYS 15 H LYS 15 4.267 -12.426 -5.462 835 HA LYS 15 HA LYS 15 5.660 -14.952 -4.855 836 HB2 LYS 15 HB2 LYS 15 6.237 -12.867 -6.930 837 HB3 LYS 15 HB3 LYS 15 7.554 -13.833 -6.282 838 HG2 LYS 15 HG2 LYS 15 6.423 -15.874 -6.961 839 HG3 LYS 15 HG3 LYS 15 5.062 -14.933 -7.575 840 HD2 LYS 15 HD2 LYS 15 6.394 -15.513 -9.454 841 HD3 LYS 15 HD3 LYS 15 6.691 -13.804 -9.141 842 HE2 LYS 15 HE2 LYS 15 8.797 -14.316 -8.085 843 HE3 LYS 15 HE3 LYS 15 8.472 -16.048 -8.187 844 HZ1 LYS 15 HZ1 LYS 15 8.523 -15.875 -10.600 845 HZ2 LYS 15 HZ2 LYS 15 9.982 -15.342 -9.931 846 HZ3 LYS 15 HZ3 LYS 15 8.851 -14.220 -10.498 847 H ASN 16 H ASN 16 8.147 -14.307 -4.449 848 HA ASN 16 HA ASN 16 8.009 -13.277 -1.787 849 HB2 ASN 16 HB2 ASN 16 10.344 -14.002 -1.657 850 HB3 ASN 16 HB3 ASN 16 9.319 -15.228 -2.392 851 HD21 ASN 16 HD21 ASN 16 9.593 -15.753 -4.543 852 HD22 ASN 16 HD22 ASN 16 10.964 -15.238 -5.458 853 H GLY 17 H GLY 17 7.433 -11.123 -3.455 854 HA2 GLY 17 HA2 GLY 17 8.852 -9.023 -2.443 855 HA3 GLY 17 HA3 GLY 17 9.774 -9.479 -3.867 856 H MET 18 H MET 18 7.154 -10.305 -5.162 857 HA MET 18 HA MET 18 6.761 -8.109 -6.798 858 HB2 MET 18 HB2 MET 18 5.245 -10.611 -6.199 859 HB3 MET 18 HB3 MET 18 4.399 -9.373 -7.104 860 HG2 MET 18 HG2 MET 18 7.064 -10.512 -7.910 861 HG3 MET 18 HG3 MET 18 5.510 -11.101 -8.501 862 HE1 MET 18 HE1 MET 18 3.980 -8.176 -8.514 863 HE2 MET 18 HE2 MET 18 3.731 -9.456 -9.702 864 HE3 MET 18 HE3 MET 18 4.126 -7.821 -10.235 865 H THR 19 H THR 19 4.644 -9.067 -4.062 866 HA THR 19 HA THR 19 2.760 -7.021 -4.276 867 HB THR 19 HB THR 19 2.381 -7.358 -1.826 868 HG1 THR 19 HG1 THR 19 3.815 -9.346 -1.164 869 HG21 THR 19 HG21 THR 19 1.720 -9.717 -1.973 870 HG22 THR 19 HG22 THR 19 2.708 -9.914 -3.421 871 HG23 THR 19 HG23 THR 19 1.299 -8.852 -3.452 872 H ASN 20 H ASN 20 5.923 -7.021 -2.719 873 HA ASN 20 HA ASN 20 5.633 -4.529 -1.378 874 HB2 ASN 20 HB2 ASN 20 7.200 -6.322 -0.664 875 HB3 ASN 20 HB3 ASN 20 8.140 -6.063 -2.130 876 HD21 ASN 20 HD21 ASN 20 7.300 -4.826 0.982 877 HD22 ASN 20 HD22 ASN 20 8.521 -3.618 1.046 878 H GLN 21 H GLN 21 7.220 -5.566 -4.390 879 HA GLN 21 HA GLN 21 8.266 -3.019 -5.028 880 HB2 GLN 21 HB2 GLN 21 8.939 -3.924 -7.090 881 HB3 GLN 21 HB3 GLN 21 9.063 -5.238 -5.942 882 HG2 GLN 21 HG2 GLN 21 7.052 -6.240 -6.782 883 HG3 GLN 21 HG3 GLN 21 6.735 -4.843 -7.810 884 HE21 GLN 21 HE21 GLN 21 8.742 -7.659 -7.360 885 HE22 GLN 21 HE22 GLN 21 9.391 -7.684 -8.956 886 H ILE 22 H ILE 22 5.259 -4.645 -5.883 887 HA ILE 22 HA ILE 22 4.369 -2.888 -7.885 888 HB ILE 22 HB ILE 22 2.925 -4.736 -5.993 889 HG12 ILE 22 HG12 ILE 22 4.244 -5.733 -7.809 890 HG13 ILE 22 HG13 ILE 22 2.523 -6.027 -8.045 891 HG21 ILE 22 HG21 ILE 22 0.854 -4.375 -7.292 892 HG22 ILE 22 HG22 ILE 22 1.629 -3.026 -8.124 893 HG23 ILE 22 HG23 ILE 22 1.346 -2.946 -6.385 894 HD11 ILE 22 HD11 ILE 22 3.635 -5.451 -10.129 895 HD12 ILE 22 HD12 ILE 22 4.150 -3.913 -9.437 896 HD13 ILE 22 HD13 ILE 22 2.433 -4.237 -9.687 897 H THR 23 H THR 23 3.487 -2.921 -4.415 898 HA THR 23 HA THR 23 1.980 -0.497 -4.659 899 HB THR 23 HB THR 23 2.956 -1.730 -2.068 900 HG1 THR 23 HG1 THR 23 1.821 -3.369 -2.993 901 HG21 THR 23 HG21 THR 23 2.003 0.523 -1.869 902 HG22 THR 23 HG22 THR 23 0.946 -0.679 -1.130 903 HG23 THR 23 HG23 THR 23 0.551 -0.012 -2.715 904 H GLY 24 H GLY 24 5.278 -1.300 -3.830 905 HA2 GLY 24 HA2 GLY 24 6.111 1.158 -2.732 906 HA3 GLY 24 HA3 GLY 24 7.145 0.011 -3.568 907 H VAL 25 H VAL 25 6.329 0.022 -6.126 908 HA VAL 25 HA VAL 25 7.318 2.409 -7.223 909 HB VAL 25 HB VAL 25 5.583 0.296 -8.536 910 HG11 VAL 25 HG11 VAL 25 6.465 1.153 -10.676 911 HG12 VAL 25 HG12 VAL 25 7.239 2.483 -9.810 912 HG13 VAL 25 HG13 VAL 25 5.480 2.350 -9.833 913 HG21 VAL 25 HG21 VAL 25 7.719 -0.548 -9.423 914 HG22 VAL 25 HG22 VAL 25 7.674 -0.588 -7.662 915 HG23 VAL 25 HG23 VAL 25 8.581 0.677 -8.490 916 H ILE 26 H ILE 26 3.990 1.379 -6.624 917 HA ILE 26 HA ILE 26 2.601 3.425 -7.911 918 HB ILE 26 HB ILE 26 1.926 1.850 -5.425 919 HG12 ILE 26 HG12 ILE 26 0.916 1.668 -8.280 920 HG13 ILE 26 HG13 ILE 26 2.101 0.592 -7.551 921 HG21 ILE 26 HG21 ILE 26 0.710 3.947 -5.303 922 HG22 ILE 26 HG22 ILE 26 -0.394 2.632 -5.695 923 HG23 ILE 26 HG23 ILE 26 0.136 3.741 -6.959 924 HD11 ILE 26 HD11 ILE 26 -0.074 -0.451 -7.625 925 HD12 ILE 26 HD12 ILE 26 -0.778 0.889 -6.722 926 HD13 ILE 26 HD13 ILE 26 0.407 -0.166 -5.952 927 H SER 27 H SER 27 3.867 3.355 -4.572 928 HA SER 27 HA SER 27 2.843 5.871 -3.786 929 HB2 SER 27 HB2 SER 27 4.266 5.743 -1.880 930 HB3 SER 27 HB3 SER 27 3.824 4.078 -2.254 931 HG SER 27 HG SER 27 5.842 3.768 -3.166 932 H LYS 28 H LYS 28 5.460 5.051 -5.846 933 HA LYS 28 HA LYS 28 6.933 7.516 -5.513 934 HB2 LYS 28 HB2 LYS 28 7.239 5.407 -7.665 935 HB3 LYS 28 HB3 LYS 28 8.403 6.654 -7.242 936 HG2 LYS 28 HG2 LYS 28 8.612 5.604 -4.983 937 HG3 LYS 28 HG3 LYS 28 7.572 4.297 -5.554 938 HD2 LYS 28 HD2 LYS 28 9.910 3.643 -5.718 939 HD3 LYS 28 HD3 LYS 28 9.199 3.780 -7.327 940 HE2 LYS 28 HE2 LYS 28 10.231 5.961 -7.623 941 HE3 LYS 28 HE3 LYS 28 10.876 5.904 -5.983 942 HZ1 LYS 28 HZ1 LYS 28 12.557 5.314 -7.594 943 HZ2 LYS 28 HZ2 LYS 28 11.594 4.064 -8.200 944 HZ3 LYS 28 HZ3 LYS 28 12.197 3.975 -6.624 945 H PHE 29 H PHE 29 4.022 7.040 -6.919 946 HA PHE 29 HA PHE 29 4.390 8.343 -9.445 947 HB2 PHE 29 HB2 PHE 29 1.898 7.842 -7.805 948 HB3 PHE 29 HB3 PHE 29 1.876 8.608 -9.389 949 HD1 PHE 29 HD1 PHE 29 4.279 6.657 -10.287 950 HD2 PHE 29 HD2 PHE 29 0.362 6.132 -8.691 951 HE1 PHE 29 HE1 PHE 29 4.136 4.452 -11.368 952 HE2 PHE 29 HE2 PHE 29 0.221 3.923 -9.765 953 HZ PHE 29 HZ PHE 29 2.106 3.080 -11.105 954 H ASP 30 H ASP 30 3.388 10.402 -10.045 955 HA ASP 30 HA ASP 30 4.222 12.582 -8.444 956 HB2 ASP 30 HB2 ASP 30 2.144 12.823 -10.614 957 HB3 ASP 30 HB3 ASP 30 3.417 13.959 -10.181 958 H THR 31 H THR 31 1.250 10.833 -8.682 959 HA THR 31 HA THR 31 -0.388 12.941 -7.520 960 HB THR 31 HB THR 31 -1.430 11.784 -9.319 961 HG1 THR 31 HG1 THR 31 -3.300 11.482 -8.327 962 HG21 THR 31 HG21 THR 31 -1.831 9.348 -9.298 963 HG22 THR 31 HG22 THR 31 -0.860 9.219 -7.831 964 HG23 THR 31 HG23 THR 31 -0.113 9.748 -9.339 965 H ASN 32 H ASN 32 -2.028 12.259 -5.851 966 HA ASN 32 HA ASN 32 -0.621 11.090 -3.565 967 HB2 ASN 32 HB2 ASN 32 -1.569 13.281 -3.198 968 HB3 ASN 32 HB3 ASN 32 -3.136 12.764 -3.805 969 HD21 ASN 32 HD21 ASN 32 -0.964 12.738 -1.115 970 HD22 ASN 32 HD22 ASN 32 -2.079 12.086 0.032 971 H ILE 33 H ILE 33 -1.069 9.069 -2.865 972 HA ILE 33 HA ILE 33 -3.165 7.501 -4.030 973 HB ILE 33 HB ILE 33 -1.234 6.913 -1.777 974 HG12 ILE 33 HG12 ILE 33 -0.420 5.184 -3.441 975 HG13 ILE 33 HG13 ILE 33 -1.501 5.902 -4.626 976 HG21 ILE 33 HG21 ILE 33 -3.293 5.719 -1.270 977 HG22 ILE 33 HG22 ILE 33 -2.057 4.586 -1.814 978 HG23 ILE 33 HG23 ILE 33 -3.350 5.072 -2.911 979 HD11 ILE 33 HD11 ILE 33 0.817 7.266 -3.280 980 HD12 ILE 33 HD12 ILE 33 -0.274 8.010 -4.450 981 HD13 ILE 33 HD13 ILE 33 0.764 6.671 -4.939 982 H ARG 34 H ARG 34 -5.186 8.153 -3.575 983 HA ARG 34 HA ARG 34 -5.953 9.051 -0.940 984 HB2 ARG 34 HB2 ARG 34 -6.866 10.028 -3.049 985 HB3 ARG 34 HB3 ARG 34 -7.688 8.509 -3.363 986 HG2 ARG 34 HG2 ARG 34 -9.123 10.318 -2.404 987 HG3 ARG 34 HG3 ARG 34 -9.138 8.803 -1.503 988 HD2 ARG 34 HD2 ARG 34 -8.977 11.007 -0.182 989 HD3 ARG 34 HD3 ARG 34 -7.891 9.692 0.258 990 HE ARG 34 HE ARG 34 -6.407 11.132 -1.476 991 HH11 ARG 34 HH11 ARG 34 -8.283 12.128 1.241 992 HH12 ARG 34 HH12 ARG 34 -7.114 13.308 1.734 993 HH21 ARG 34 HH21 ARG 34 -4.926 12.639 -0.806 994 HH22 ARG 34 HH22 ARG 34 -5.244 13.576 0.616 995 H THR 35 H THR 35 -6.193 6.128 -2.821 996 HA THR 35 HA THR 35 -6.856 4.610 -0.438 997 HB THR 35 HB THR 35 -8.663 4.364 -2.860 998 HG1 THR 35 HG1 THR 35 -8.834 5.977 -0.643 999 HG21 THR 35 HG21 THR 35 -8.783 3.036 -0.147 1000 HG22 THR 35 HG22 THR 35 -8.368 2.254 -1.674 1001 HG23 THR 35 HG23 THR 35 -9.997 2.880 -1.415 1002 H ILE 36 H ILE 36 -6.042 2.535 -0.546 1003 HA ILE 36 HA ILE 36 -5.676 1.231 -3.077 1004 HB ILE 36 HB ILE 36 -3.615 2.634 -2.897 1005 HG12 ILE 36 HG12 ILE 36 -3.010 -0.329 -2.758 1006 HG13 ILE 36 HG13 ILE 36 -3.766 0.441 -4.152 1007 HG21 ILE 36 HG21 ILE 36 -1.851 1.973 -1.320 1008 HG22 ILE 36 HG22 ILE 36 -2.964 0.838 -0.556 1009 HG23 ILE 36 HG23 ILE 36 -3.286 2.571 -0.484 1010 HD11 ILE 36 HD11 ILE 36 -1.051 1.082 -3.034 1011 HD12 ILE 36 HD12 ILE 36 -1.811 1.868 -4.419 1012 HD13 ILE 36 HD13 ILE 36 -1.391 0.155 -4.495 1013 H VAL 37 H VAL 37 -5.967 -0.906 -2.863 1014 HA VAL 37 HA VAL 37 -5.577 -2.145 -0.211 1015 HB VAL 37 HB VAL 37 -8.011 -2.566 -1.968 1016 HG11 VAL 37 HG11 VAL 37 -7.373 -4.625 -0.840 1017 HG12 VAL 37 HG12 VAL 37 -8.839 -3.969 -0.114 1018 HG13 VAL 37 HG13 VAL 37 -7.290 -3.782 0.708 1019 HG21 VAL 37 HG21 VAL 37 -9.275 -1.535 -0.130 1020 HG22 VAL 37 HG22 VAL 37 -8.087 -0.417 -0.804 1021 HG23 VAL 37 HG23 VAL 37 -7.767 -1.225 0.733 1022 H LEU 38 H LEU 38 -3.896 -3.478 -0.641 1023 HA LEU 38 HA LEU 38 -4.059 -5.272 -2.975 1024 HB2 LEU 38 HB2 LEU 38 -1.977 -3.953 -2.686 1025 HB3 LEU 38 HB3 LEU 38 -1.717 -4.714 -1.131 1026 HG LEU 38 HG LEU 38 -1.855 -6.365 -3.656 1027 HD11 LEU 38 HD11 LEU 38 0.601 -6.240 -3.784 1028 HD12 LEU 38 HD12 LEU 38 0.594 -5.011 -2.517 1029 HD13 LEU 38 HD13 LEU 38 -0.163 -4.676 -4.075 1030 HD21 LEU 38 HD21 LEU 38 -1.970 -7.604 -1.565 1031 HD22 LEU 38 HD22 LEU 38 -0.515 -6.801 -0.978 1032 HD23 LEU 38 HD23 LEU 38 -0.423 -7.901 -2.356 1033 H ASN 39 H ASN 39 -4.990 -7.186 -2.588 1034 HA ASN 39 HA ASN 39 -4.262 -8.625 -0.122 1035 HB2 ASN 39 HB2 ASN 39 -6.526 -9.443 0.177 1036 HB3 ASN 39 HB3 ASN 39 -6.552 -7.684 0.134 1037 HD21 ASN 39 HD21 ASN 39 -7.358 -6.652 -1.747 1038 HD22 ASN 39 HD22 ASN 39 -8.423 -7.481 -2.821 1039 H ALA 40 H ALA 40 -3.789 -10.757 -0.383 1040 HA ALA 40 HA ALA 40 -3.826 -11.820 -3.135 1041 HB1 ALA 40 HB1 ALA 40 -1.639 -11.680 -2.011 1042 HB2 ALA 40 HB2 ALA 40 -2.082 -13.345 -2.392 1043 HB3 ALA 40 HB3 ALA 40 -2.230 -12.749 -0.738 1044 H LYS 41 H LYS 41 -5.261 -13.310 -3.652 1045 HA LYS 41 HA LYS 41 -6.157 -15.232 -1.614 1046 HB2 LYS 41 HB2 LYS 41 -8.443 -15.104 -2.291 1047 HB3 LYS 41 HB3 LYS 41 -7.904 -13.460 -1.983 1048 HG2 LYS 41 HG2 LYS 41 -8.036 -14.670 -4.738 1049 HG3 LYS 41 HG3 LYS 41 -9.370 -13.785 -3.998 1050 HD2 LYS 41 HD2 LYS 41 -7.857 -11.814 -3.751 1051 HD3 LYS 41 HD3 LYS 41 -6.613 -12.709 -4.626 1052 HE2 LYS 41 HE2 LYS 41 -7.764 -11.210 -6.142 1053 HE3 LYS 41 HE3 LYS 41 -8.132 -12.881 -6.567 1054 HZ1 LYS 41 HZ1 LYS 41 -9.895 -11.028 -5.049 1055 HZ2 LYS 41 HZ2 LYS 41 -10.246 -12.650 -5.370 1056 HZ3 LYS 41 HZ3 LYS 41 -10.122 -11.548 -6.643 1057 H ASP 42 H ASP 42 -6.201 -17.299 -2.257 1058 HA ASP 42 HA ASP 42 -5.995 -19.175 -3.493 1059 HB2 ASP 42 HB2 ASP 42 -7.917 -18.040 -4.763 1060 HB3 ASP 42 HB3 ASP 42 -6.705 -17.596 -5.965 1061 H GLY 43 H GLY 43 -3.815 -16.935 -3.424 1062 HA2 GLY 43 HA2 GLY 43 -1.508 -17.416 -3.873 1063 HA3 GLY 43 HA3 GLY 43 -1.996 -18.306 -5.303 1064 H ILE 44 H ILE 44 -3.854 -15.677 -5.540 1065 HA ILE 44 HA ILE 44 -1.799 -14.096 -6.980 1066 HB ILE 44 HB ILE 44 -4.743 -14.102 -7.663 1067 HG12 ILE 44 HG12 ILE 44 -2.563 -15.877 -8.792 1068 HG13 ILE 44 HG13 ILE 44 -4.005 -16.384 -7.919 1069 HG21 ILE 44 HG21 ILE 44 -2.281 -13.294 -9.225 1070 HG22 ILE 44 HG22 ILE 44 -3.459 -12.207 -8.491 1071 HG23 ILE 44 HG23 ILE 44 -3.938 -13.249 -9.831 1072 HD11 ILE 44 HD11 ILE 44 -5.404 -15.590 -9.732 1073 HD12 ILE 44 HD12 ILE 44 -4.206 -16.738 -10.330 1074 HD13 ILE 44 HD13 ILE 44 -3.980 -15.008 -10.592 1075 H PHE 45 H PHE 45 -1.993 -11.794 -6.886 1076 HA PHE 45 HA PHE 45 -3.683 -10.877 -4.638 1077 HB2 PHE 45 HB2 PHE 45 -2.025 -9.293 -3.976 1078 HB3 PHE 45 HB3 PHE 45 -1.208 -10.835 -4.180 1079 HD1 PHE 45 HD2 PHE 45 -1.649 -7.457 -5.534 1080 HD2 PHE 45 HD1 PHE 45 0.439 -11.146 -5.913 1081 HE1 PHE 45 HE2 PHE 45 -0.026 -6.374 -7.033 1082 HE2 PHE 45 HE1 PHE 45 2.073 -10.065 -7.412 1083 HZ PHE 45 HZ PHE 45 1.834 -7.677 -7.975 1084 H THR 46 H THR 46 -4.897 -9.079 -4.844 1085 HA THR 46 HA THR 46 -4.815 -7.667 -7.436 1086 HB THR 46 HB THR 46 -6.919 -8.764 -7.345 1087 HG1 THR 46 HG1 THR 46 -7.513 -6.143 -6.392 1088 HG21 THR 46 HG21 THR 46 -7.281 -7.651 -4.556 1089 HG22 THR 46 HG22 THR 46 -6.982 -9.338 -4.974 1090 HG23 THR 46 HG23 THR 46 -8.488 -8.564 -5.463 1091 H CYS 47 H CYS 47 -3.646 -5.875 -7.062 1092 HA CYS 47 HA CYS 47 -4.072 -4.289 -4.650 1093 HB2 CYS 47 HB2 CYS 47 -1.773 -4.599 -5.473 1094 HB3 CYS 47 HB3 CYS 47 -2.201 -3.815 -6.991 1095 HG CYS 47 HG CYS 47 -1.246 -2.478 -4.130 1096 H ASN 48 H ASN 48 -5.966 -3.213 -4.722 1097 HA ASN 48 HA ASN 48 -6.915 -1.905 -7.129 1098 HB2 ASN 48 HB2 ASN 48 -7.982 -1.894 -4.289 1099 HB3 ASN 48 HB3 ASN 48 -8.791 -1.149 -5.664 1100 HD21 ASN 48 HD21 ASN 48 -10.601 -2.477 -5.333 1101 HD22 ASN 48 HD22 ASN 48 -10.580 -4.154 -5.758 1102 H LEU 49 H LEU 49 -5.839 -0.112 -7.734 1103 HA LEU 49 HA LEU 49 -4.814 1.744 -5.705 1104 HB2 LEU 49 HB2 LEU 49 -3.162 1.071 -7.285 1105 HB3 LEU 49 HB3 LEU 49 -4.230 1.384 -8.640 1106 HG LEU 49 HG LEU 49 -4.085 3.800 -8.225 1107 HD11 LEU 49 HD11 LEU 49 -2.218 3.036 -5.978 1108 HD12 LEU 49 HD12 LEU 49 -3.785 3.831 -5.827 1109 HD13 LEU 49 HD13 LEU 49 -2.440 4.673 -6.597 1110 HD21 LEU 49 HD21 LEU 49 -1.388 2.453 -8.400 1111 HD22 LEU 49 HD22 LEU 49 -1.747 4.112 -8.881 1112 HD23 LEU 49 HD23 LEU 49 -2.486 2.765 -9.746 1113 H MET 50 H MET 50 -5.662 3.702 -5.353 1114 HA MET 50 HA MET 50 -7.469 4.877 -7.372 1115 HB2 MET 50 HB2 MET 50 -7.905 4.937 -4.379 1116 HB3 MET 50 HB3 MET 50 -8.944 5.665 -5.596 1117 HG2 MET 50 HG2 MET 50 -8.423 2.720 -5.243 1118 HG3 MET 50 HG3 MET 50 -9.875 3.589 -4.754 1119 HE1 MET 50 HE1 MET 50 -11.261 5.092 -6.680 1120 HE2 MET 50 HE2 MET 50 -11.037 4.822 -8.409 1121 HE3 MET 50 HE3 MET 50 -9.775 5.620 -7.472 1122 H ILE 51 H ILE 51 -6.593 6.715 -8.064 1123 HA ILE 51 HA ILE 51 -5.375 8.573 -6.141 1124 HB ILE 51 HB ILE 51 -3.569 9.038 -7.925 1125 HG12 ILE 51 HG12 ILE 51 -2.937 6.772 -9.073 1126 HG13 ILE 51 HG13 ILE 51 -4.637 6.377 -8.862 1127 HG21 ILE 51 HG21 ILE 51 -3.062 8.127 -5.748 1128 HG22 ILE 51 HG22 ILE 51 -2.081 7.333 -6.978 1129 HG23 ILE 51 HG23 ILE 51 -3.479 6.503 -6.295 1130 HD11 ILE 51 HD11 ILE 51 -3.511 8.695 -10.419 1131 HD12 ILE 51 HD12 ILE 51 -5.229 8.372 -10.173 1132 HD13 ILE 51 HD13 ILE 51 -4.237 7.228 -11.076 1133 H PHE 52 H PHE 52 -5.122 10.770 -6.966 1134 HA PHE 52 HA PHE 52 -7.388 11.469 -8.673 1135 HB2 PHE 52 HB2 PHE 52 -5.666 13.013 -6.757 1136 HB3 PHE 52 HB3 PHE 52 -6.623 13.873 -7.957 1137 HD1 PHE 52 HD2 PHE 52 -9.086 13.630 -7.973 1138 HD2 PHE 52 HD1 PHE 52 -6.691 12.076 -4.810 1139 HE1 PHE 52 HE2 PHE 52 -11.082 13.487 -6.545 1140 HE2 PHE 52 HE1 PHE 52 -8.688 11.927 -3.375 1141 HZ PHE 52 HZ PHE 52 -10.883 12.634 -4.240 1142 H VAL 53 H VAL 53 -7.251 12.253 -10.703 1143 HA VAL 53 HA VAL 53 -4.597 13.080 -11.727 1144 HB VAL 53 HB VAL 53 -4.873 11.923 -13.775 1145 HG11 VAL 53 HG11 VAL 53 -5.821 10.057 -11.604 1146 HG12 VAL 53 HG12 VAL 53 -4.143 10.465 -11.969 1147 HG13 VAL 53 HG13 VAL 53 -5.112 9.575 -13.146 1148 HG21 VAL 53 HG21 VAL 53 -7.689 11.251 -12.924 1149 HG22 VAL 53 HG22 VAL 53 -6.895 10.670 -14.388 1150 HG23 VAL 53 HG23 VAL 53 -7.218 12.392 -14.185 1151 H LYS 54 H LYS 54 -4.633 14.680 -13.398 1152 HA LYS 54 HA LYS 54 -7.117 16.229 -13.519 1153 HB2 LYS 54 HB2 LYS 54 -5.741 17.979 -14.580 1154 HB3 LYS 54 HB3 LYS 54 -5.107 17.482 -13.018 1155 HG2 LYS 54 HG2 LYS 54 -3.370 16.200 -14.058 1156 HG3 LYS 54 HG3 LYS 54 -4.068 16.469 -15.652 1157 HD2 LYS 54 HD2 LYS 54 -2.171 17.929 -15.366 1158 HD3 LYS 54 HD3 LYS 54 -3.646 18.896 -15.390 1159 HE2 LYS 54 HE2 LYS 54 -3.593 19.111 -12.977 1160 HE3 LYS 54 HE3 LYS 54 -2.204 18.028 -12.880 1161 HZ1 LYS 54 HZ1 LYS 54 -0.923 19.657 -14.164 1162 HZ2 LYS 54 HZ2 LYS 54 -1.492 20.307 -12.711 1163 HZ3 LYS 54 HZ3 LYS 54 -2.253 20.707 -14.164 1164 H ASN 55 H ASN 55 -5.369 13.988 -15.441 1165 HA ASN 55 HA ASN 55 -7.317 14.338 -17.612 1166 HB2 ASN 55 HB2 ASN 55 -4.362 13.927 -18.159 1167 HB3 ASN 55 HB3 ASN 55 -5.638 14.094 -19.359 1168 HD21 ASN 55 HD21 ASN 55 -3.486 15.696 -17.250 1169 HD22 ASN 55 HD22 ASN 55 -3.888 17.313 -17.715 1170 H THR 56 H THR 56 -7.916 12.440 -18.640 1171 HA THR 56 HA THR 56 -7.513 9.942 -17.402 1172 HB THR 56 HB THR 56 -8.452 8.934 -19.470 1173 HG1 THR 56 HG1 THR 56 -8.644 10.088 -21.287 1174 HG21 THR 56 HG21 THR 56 -10.627 10.130 -19.429 1175 HG22 THR 56 HG22 THR 56 -9.876 11.420 -18.490 1176 HG23 THR 56 HG23 THR 56 -10.006 9.797 -17.812 1177 H ASP 57 H ASP 57 -5.635 11.636 -19.794 1178 HA ASP 57 HA ASP 57 -4.092 9.591 -20.890 1179 HB2 ASP 57 HB2 ASP 57 -3.952 11.861 -21.730 1180 HB3 ASP 57 HB3 ASP 57 -3.317 12.434 -20.190 1181 H LYS 58 H LYS 58 -3.529 11.454 -17.919 1182 HA LYS 58 HA LYS 58 -1.211 10.197 -17.023 1183 HB2 LYS 58 HB2 LYS 58 -1.769 12.105 -15.826 1184 HB3 LYS 58 HB3 LYS 58 -3.471 11.684 -15.742 1185 HG2 LYS 58 HG2 LYS 58 -2.514 11.595 -13.549 1186 HG3 LYS 58 HG3 LYS 58 -2.955 9.972 -14.066 1187 HD2 LYS 58 HD2 LYS 58 -0.828 9.810 -12.999 1188 HD3 LYS 58 HD3 LYS 58 -0.542 9.645 -14.732 1189 HE2 LYS 58 HE2 LYS 58 0.157 11.974 -14.860 1190 HE3 LYS 58 HE3 LYS 58 -0.201 12.192 -13.146 1191 HZ1 LYS 58 HZ1 LYS 58 1.533 10.665 -12.586 1192 HZ2 LYS 58 HZ2 LYS 58 2.173 11.847 -13.607 1193 HZ3 LYS 58 HZ3 LYS 58 1.829 10.306 -14.209 1194 H LEU 59 H LEU 59 -4.617 9.338 -16.447 1195 HA LEU 59 HA LEU 59 -4.248 7.149 -14.761 1196 HB2 LEU 59 HB2 LEU 59 -6.417 8.171 -15.144 1197 HB3 LEU 59 HB3 LEU 59 -6.397 7.666 -16.822 1198 HG LEU 59 HG LEU 59 -6.572 5.321 -16.146 1199 HD11 LEU 59 HD11 LEU 59 -6.640 6.391 -13.325 1200 HD12 LEU 59 HD12 LEU 59 -5.362 5.409 -14.041 1201 HD13 LEU 59 HD13 LEU 59 -6.969 4.724 -13.798 1202 HD21 LEU 59 HD21 LEU 59 -8.851 5.376 -15.274 1203 HD22 LEU 59 HD22 LEU 59 -8.624 6.616 -16.509 1204 HD23 LEU 59 HD23 LEU 59 -8.644 7.064 -14.802 1205 H THR 60 H THR 60 -4.430 7.192 -18.332 1206 HA THR 60 HA THR 60 -4.032 4.368 -18.611 1207 HB THR 60 HB THR 60 -3.763 4.771 -20.997 1208 HG1 THR 60 HG1 THR 60 -4.087 7.528 -20.810 1209 HG21 THR 60 HG21 THR 60 -6.046 4.823 -20.086 1210 HG22 THR 60 HG22 THR 60 -5.881 5.899 -21.475 1211 HG23 THR 60 HG23 THR 60 -5.906 6.566 -19.843 1212 H THR 61 H THR 61 -1.864 7.111 -18.393 1213 HA THR 61 HA THR 61 0.480 5.816 -19.360 1214 HB THR 61 HB THR 61 0.197 8.190 -17.495 1215 HG1 THR 61 HG1 THR 61 -0.557 8.572 -19.621 1216 HG21 THR 61 HG21 THR 61 2.395 7.137 -17.174 1217 HG22 THR 61 HG22 THR 61 2.555 8.679 -18.015 1218 HG23 THR 61 HG23 THR 61 2.671 7.169 -18.917 1219 H LEU 62 H LEU 62 -0.862 6.218 -16.083 1220 HA LEU 62 HA LEU 62 1.236 5.001 -14.664 1221 HB2 LEU 62 HB2 LEU 62 -1.719 5.034 -14.032 1222 HB3 LEU 62 HB3 LEU 62 -0.465 4.533 -12.910 1223 HG LEU 62 HG LEU 62 -0.867 7.305 -14.050 1224 HD11 LEU 62 HD11 LEU 62 -1.302 7.933 -11.746 1225 HD12 LEU 62 HD12 LEU 62 -1.048 6.268 -11.223 1226 HD13 LEU 62 HD13 LEU 62 -2.419 6.665 -12.259 1227 HD21 LEU 62 HD21 LEU 62 1.297 6.300 -12.196 1228 HD22 LEU 62 HD22 LEU 62 1.028 7.980 -12.658 1229 HD23 LEU 62 HD23 LEU 62 1.519 6.804 -13.872 1230 H MET 63 H MET 63 -1.604 3.576 -16.224 1231 HA MET 63 HA MET 63 -1.383 0.930 -15.453 1232 HB2 MET 63 HB2 MET 63 -2.037 1.940 -18.233 1233 HB3 MET 63 HB3 MET 63 -2.416 0.341 -17.606 1234 HG2 MET 63 HG2 MET 63 -3.930 1.309 -15.985 1235 HG3 MET 63 HG3 MET 63 -3.508 2.933 -16.533 1236 HE1 MET 63 HE1 MET 63 -7.086 2.738 -17.916 1237 HE2 MET 63 HE2 MET 63 -5.924 3.596 -16.903 1238 HE3 MET 63 HE3 MET 63 -6.550 2.025 -16.394 1239 H ASP 64 H ASP 64 0.250 2.528 -18.178 1240 HA ASP 64 HA ASP 64 1.763 0.411 -19.147 1241 HB2 ASP 64 HB2 ASP 64 1.516 2.626 -20.235 1242 HB3 ASP 64 HB3 ASP 64 2.550 3.328 -18.999 1243 H LYS 65 H LYS 65 2.760 2.872 -16.750 1244 HA LYS 65 HA LYS 65 5.273 1.895 -16.104 1245 HB2 LYS 65 HB2 LYS 65 3.258 3.227 -14.275 1246 HB3 LYS 65 HB3 LYS 65 4.965 3.043 -13.911 1247 HG2 LYS 65 HG2 LYS 65 5.451 4.385 -15.981 1248 HG3 LYS 65 HG3 LYS 65 3.720 4.701 -16.093 1249 HD2 LYS 65 HD2 LYS 65 4.556 6.582 -14.980 1250 HD3 LYS 65 HD3 LYS 65 3.917 5.579 -13.678 1251 HE2 LYS 65 HE2 LYS 65 6.824 5.661 -14.509 1252 HE3 LYS 65 HE3 LYS 65 6.142 6.605 -13.189 1253 HZ1 LYS 65 HZ1 LYS 65 5.578 4.568 -12.046 1254 HZ2 LYS 65 HZ2 LYS 65 7.225 4.585 -12.411 1255 HZ3 LYS 65 HZ3 LYS 65 6.172 3.637 -13.328 1256 H LEU 66 H LEU 66 2.128 0.809 -14.984 1257 HA LEU 66 HA LEU 66 3.186 -1.033 -13.024 1258 HB2 LEU 66 HB2 LEU 66 0.398 -0.750 -14.163 1259 HB3 LEU 66 HB3 LEU 66 0.833 -1.693 -12.746 1260 HG LEU 66 HG LEU 66 1.202 1.302 -12.946 1261 HD11 LEU 66 HD11 LEU 66 -0.771 1.492 -11.505 1262 HD12 LEU 66 HD12 LEU 66 -1.040 -0.245 -11.653 1263 HD13 LEU 66 HD13 LEU 66 -1.164 0.791 -13.075 1264 HD21 LEU 66 HD21 LEU 66 2.693 0.254 -11.345 1265 HD22 LEU 66 HD22 LEU 66 1.338 -0.589 -10.596 1266 HD23 LEU 66 HD23 LEU 66 1.443 1.170 -10.502 1267 H ARG 67 H ARG 67 2.164 -1.187 -16.382 1268 HA ARG 67 HA ARG 67 1.941 -4.028 -16.556 1269 HB2 ARG 67 HB2 ARG 67 2.328 -1.899 -18.673 1270 HB3 ARG 67 HB3 ARG 67 2.137 -3.607 -19.054 1271 HG2 ARG 67 HG2 ARG 67 -0.076 -3.549 -17.898 1272 HG3 ARG 67 HG3 ARG 67 0.122 -1.805 -17.716 1273 HD2 ARG 67 HD2 ARG 67 0.329 -1.619 -20.184 1274 HD3 ARG 67 HD3 ARG 67 0.004 -3.346 -20.311 1275 HE ARG 67 HE ARG 67 -1.931 -1.414 -19.206 1276 HH11 ARG 67 HH11 ARG 67 -1.192 -4.176 -21.125 1277 HH12 ARG 67 HH12 ARG 67 -2.829 -4.393 -21.633 1278 HH21 ARG 67 HH21 ARG 67 -4.026 -1.696 -19.877 1279 HH22 ARG 67 HH22 ARG 67 -4.416 -2.999 -20.942 1280 H LYS 68 H LYS 68 4.636 -1.961 -16.349 1281 HA LYS 68 HA LYS 68 6.482 -3.470 -17.926 1282 HB2 LYS 68 HB2 LYS 68 7.143 -1.593 -15.647 1283 HB3 LYS 68 HB3 LYS 68 8.203 -2.080 -16.961 1284 HG2 LYS 68 HG2 LYS 68 5.723 -0.386 -17.205 1285 HG3 LYS 68 HG3 LYS 68 7.388 0.181 -17.288 1286 HD2 LYS 68 HD2 LYS 68 6.249 -1.840 -19.220 1287 HD3 LYS 68 HD3 LYS 68 6.172 -0.103 -19.502 1288 HE2 LYS 68 HE2 LYS 68 8.067 -0.837 -20.686 1289 HE3 LYS 68 HE3 LYS 68 8.705 -0.096 -19.220 1290 HZ1 LYS 68 HZ1 LYS 68 9.786 -2.209 -19.788 1291 HZ2 LYS 68 HZ2 LYS 68 8.315 -3.018 -19.614 1292 HZ3 LYS 68 HZ3 LYS 68 9.035 -2.273 -18.276 1293 H VAL 69 H VAL 69 5.030 -4.200 -14.981 1294 HA VAL 69 HA VAL 69 7.326 -5.543 -13.805 1295 HB VAL 69 HB VAL 69 4.446 -5.516 -12.872 1296 HG11 VAL 69 HG11 VAL 69 6.991 -6.379 -11.485 1297 HG12 VAL 69 HG12 VAL 69 5.647 -7.416 -11.971 1298 HG13 VAL 69 HG13 VAL 69 5.419 -6.215 -10.699 1299 HG21 VAL 69 HG21 VAL 69 6.790 -3.818 -11.991 1300 HG22 VAL 69 HG22 VAL 69 5.189 -3.824 -11.249 1301 HG23 VAL 69 HG23 VAL 69 5.389 -3.263 -12.908 1302 H GLN 70 H GLN 70 7.896 -7.524 -14.314 1303 HA GLN 70 HA GLN 70 6.647 -9.189 -16.147 1304 HB2 GLN 70 HB2 GLN 70 8.222 -10.949 -15.269 1305 HB3 GLN 70 HB3 GLN 70 8.979 -9.421 -15.704 1306 HG2 GLN 70 HG2 GLN 70 8.899 -8.783 -13.281 1307 HG3 GLN 70 HG3 GLN 70 8.355 -10.423 -12.931 1308 HE21 GLN 70 HE21 GLN 70 11.009 -8.456 -14.014 1309 HE22 GLN 70 HE22 GLN 70 12.237 -9.648 -13.807 1310 H GLY 71 H GLY 71 6.205 -9.103 -12.651 1311 HA2 GLY 71 HA2 GLY 71 4.918 -11.677 -12.514 1312 HA3 GLY 71 HA3 GLY 71 5.063 -10.513 -11.213 1313 H VAL 72 H VAL 72 3.736 -8.630 -13.482 1314 HA VAL 72 HA VAL 72 1.009 -9.241 -12.546 1315 HB VAL 72 HB VAL 72 2.070 -6.712 -13.834 1316 HG11 VAL 72 HG11 VAL 72 -0.285 -7.012 -14.372 1317 HG12 VAL 72 HG12 VAL 72 -0.109 -5.731 -13.175 1318 HG13 VAL 72 HG13 VAL 72 -0.662 -7.332 -12.678 1319 HG21 VAL 72 HG21 VAL 72 2.943 -7.066 -11.574 1320 HG22 VAL 72 HG22 VAL 72 1.302 -7.294 -10.966 1321 HG23 VAL 72 HG23 VAL 72 1.797 -5.725 -11.601 1322 H PHE 73 H PHE 73 -0.635 -9.744 -13.890 1323 HA PHE 73 HA PHE 73 -0.046 -9.795 -16.778 1324 HB2 PHE 73 HB2 PHE 73 -1.971 -11.657 -16.642 1325 HB3 PHE 73 HB3 PHE 73 -0.263 -12.018 -16.466 1326 HD1 PHE 73 HD1 PHE 73 -3.467 -11.736 -14.709 1327 HD2 PHE 73 HD2 PHE 73 0.679 -12.641 -14.343 1328 HE1 PHE 73 HE1 PHE 73 -3.886 -12.778 -12.520 1329 HE2 PHE 73 HE2 PHE 73 0.266 -13.679 -12.154 1330 HZ PHE 73 HZ PHE 73 -2.017 -13.753 -11.240 1331 H THR 74 H THR 74 -2.273 -8.644 -14.375 1332 HA THR 74 HA THR 74 -3.890 -7.514 -16.582 1333 HB THR 74 HB THR 74 -5.910 -7.741 -15.471 1334 HG1 THR 74 HG1 THR 74 -5.340 -6.936 -13.430 1335 HG21 THR 74 HG21 THR 74 -6.123 -10.065 -14.752 1336 HG22 THR 74 HG22 THR 74 -4.372 -10.178 -14.576 1337 HG23 THR 74 HG23 THR 74 -5.081 -9.948 -16.174 1338 H VAL 75 H VAL 75 -3.561 -5.414 -16.726 1339 HA VAL 75 HA VAL 75 -3.778 -3.809 -14.256 1340 HB VAL 75 HB VAL 75 -2.142 -3.006 -16.685 1341 HG11 VAL 75 HG11 VAL 75 -1.305 -1.216 -15.204 1342 HG12 VAL 75 HG12 VAL 75 -2.422 -1.752 -13.948 1343 HG13 VAL 75 HG13 VAL 75 -3.046 -1.110 -15.468 1344 HG21 VAL 75 HG21 VAL 75 -1.185 -4.077 -14.023 1345 HG22 VAL 75 HG22 VAL 75 -0.151 -3.382 -15.272 1346 HG23 VAL 75 HG23 VAL 75 -1.037 -4.875 -15.592 1347 H GLU 76 H GLU 76 -5.813 -3.007 -14.358 1348 HA GLU 76 HA GLU 76 -6.869 -2.151 -16.984 1349 HB2 GLU 76 HB2 GLU 76 -9.048 -3.261 -16.308 1350 HB3 GLU 76 HB3 GLU 76 -7.723 -4.350 -16.697 1351 HG2 GLU 76 HG2 GLU 76 -7.253 -4.538 -14.245 1352 HG3 GLU 76 HG3 GLU 76 -8.727 -3.619 -13.948 1353 H ARG 77 H ARG 77 -8.710 -0.752 -16.944 1354 HA ARG 77 HA ARG 77 -8.559 1.168 -14.771 1355 HB2 ARG 77 HB2 ARG 77 -8.597 2.078 -17.001 1356 HB3 ARG 77 HB3 ARG 77 -10.059 1.192 -17.398 1357 HG2 ARG 77 HG2 ARG 77 -11.364 2.538 -15.898 1358 HG3 ARG 77 HG3 ARG 77 -9.915 3.332 -15.279 1359 HD2 ARG 77 HD2 ARG 77 -11.220 4.702 -16.910 1360 HD3 ARG 77 HD3 ARG 77 -9.540 4.438 -17.366 1361 HE ARG 77 HE ARG 77 -10.249 3.283 -19.212 1362 HH11 ARG 77 HH11 ARG 77 -12.930 3.649 -17.074 1363 HH12 ARG 77 HH12 ARG 77 -14.065 3.040 -18.226 1364 HH21 ARG 77 HH21 ARG 77 -11.738 2.515 -20.678 1365 HH22 ARG 77 HH22 ARG 77 -13.404 2.414 -20.223 1366 H LEU 78 H LEU 78 -9.916 1.270 -13.121 1367 HA LEU 78 HA LEU 78 -12.289 -0.350 -12.979 1368 HB2 LEU 78 HB2 LEU 78 -11.162 1.765 -11.139 1369 HB3 LEU 78 HB3 LEU 78 -12.597 0.820 -10.774 1370 HG LEU 78 HG LEU 78 -9.790 -0.252 -11.136 1371 HD11 LEU 78 HD11 LEU 78 -9.931 -0.814 -8.763 1372 HD12 LEU 78 HD12 LEU 78 -11.521 -0.054 -8.668 1373 HD13 LEU 78 HD13 LEU 78 -10.093 0.922 -9.022 1374 HD21 LEU 78 HD21 LEU 78 -10.734 -2.417 -10.469 1375 HD22 LEU 78 HD22 LEU 78 -11.423 -1.839 -11.986 1376 HD23 LEU 78 HD23 LEU 78 -12.354 -1.716 -10.491 1377 H SER 79 H SER 79 -13.834 0.276 -14.412 1378 HA SER 79 HA SER 79 -14.441 2.983 -15.060 1379 HB2 SER 79 HB2 SER 79 -14.930 1.183 -16.637 1380 HB3 SER 79 HB3 SER 79 -16.057 0.453 -15.494 1381 HG SER 79 HG SER 79 -17.455 1.630 -16.545 1382 H ASN 80 H ASN 80 -16.388 0.570 -13.276 1383 HA ASN 80 HA ASN 80 -17.861 2.742 -11.969 1384 HB2 ASN 80 HB2 ASN 80 -18.257 -0.261 -11.977 1385 HB3 ASN 80 HB3 ASN 80 -19.225 0.841 -11.004 1386 HD21 ASN 80 HD21 ASN 80 -18.123 1.706 -14.202 1387 HD22 ASN 80 HD22 ASN 80 -19.666 1.610 -14.963 1388 H LEU 81 H LEU 81 -16.555 3.609 -10.436 1389 HA LEU 81 HA LEU 81 -14.630 2.177 -8.969 1390 HB2 LEU 81 HB2 LEU 81 -15.889 4.853 -8.377 1391 HB3 LEU 81 HB3 LEU 81 -14.465 4.216 -7.573 1392 HG LEU 81 HG LEU 81 -14.719 5.005 -10.481 1393 HD11 LEU 81 HD11 LEU 81 -14.415 6.871 -8.953 1394 HD12 LEU 81 HD12 LEU 81 -12.943 6.607 -9.888 1395 HD13 LEU 81 HD13 LEU 81 -13.029 6.071 -8.207 1396 HD21 LEU 81 HD21 LEU 81 -12.344 4.372 -10.688 1397 HD22 LEU 81 HD22 LEU 81 -13.380 2.985 -10.360 1398 HD23 LEU 81 HD23 LEU 81 -12.397 3.676 -9.067 1399 H GLU 82 H GLU 82 -14.534 1.426 -6.934 1400 HA GLU 82 HA GLU 82 -16.986 0.494 -5.733 1401 HB2 GLU 82 HB2 GLU 82 -15.394 -0.663 -4.161 1402 HB3 GLU 82 HB3 GLU 82 -15.136 -1.034 -5.860 1403 HG2 GLU 82 HG2 GLU 82 -13.325 0.762 -5.827 1404 HG3 GLU 82 HG3 GLU 82 -13.482 0.736 -4.072 1405 H HIS 83 H HIS 83 -16.536 3.365 -5.681 1406 HA HIS 83 HA HIS 83 -16.014 3.943 -2.838 1407 HB2 HIS 83 HB2 HIS 83 -15.797 5.723 -5.283 1408 HB3 HIS 83 HB3 HIS 83 -15.496 6.253 -3.636 1409 HD1 HIS 83 HD1 HIS 83 -13.130 6.169 -2.948 1410 HD2 HIS 83 HD2 HIS 83 -13.973 3.444 -5.966 1411 HE1 HIS 83 HE1 HIS 83 -10.930 5.131 -3.556 1412 HE2 HIS 83 HE2 HIS 83 -11.505 3.343 -5.228 1413 H HIS 84 H HIS 84 -18.363 4.279 -5.418 1414 HA HIS 84 HA HIS 84 -20.031 6.155 -4.043 1415 HB2 HIS 84 HB2 HIS 84 -21.704 5.620 -5.816 1416 HB3 HIS 84 HB3 HIS 84 -20.132 6.101 -6.435 1417 HD1 HIS 84 HD1 HIS 84 -19.323 4.703 -8.288 1418 HD2 HIS 84 HD2 HIS 84 -21.935 2.603 -5.835 1419 HE1 HIS 84 HE1 HIS 84 -19.621 2.465 -9.384 1420 HE2 HIS 84 HE2 HIS 84 -21.313 1.268 -7.965 1421 H HIS 85 H HIS 85 -19.420 3.865 -2.399 1422 HA HIS 85 HA HIS 85 -21.831 2.307 -2.117 1423 HB2 HIS 85 HB2 HIS 85 -19.510 1.523 -1.473 1424 HB3 HIS 85 HB3 HIS 85 -19.572 2.645 -0.120 1425 HD1 HIS 85 HD1 HIS 85 -21.201 -0.499 -1.403 1426 HD2 HIS 85 HD2 HIS 85 -20.951 1.728 2.091 1427 HE1 HIS 85 HE1 HIS 85 -22.259 -1.916 0.369 1428 HE2 HIS 85 HE2 HIS 85 -21.879 -0.651 2.500 1429 H HIS 86 H HIS 86 -23.656 3.260 -1.402 1430 HA HIS 86 HA HIS 86 -23.716 5.937 -0.685 1431 HB2 HIS 86 HB2 HIS 86 -26.133 5.621 -0.270 1432 HB3 HIS 86 HB3 HIS 86 -25.585 4.914 -1.783 1433 HD1 HIS 86 HD1 HIS 86 -26.850 3.973 1.623 1434 HD2 HIS 86 HD2 HIS 86 -25.905 2.146 -1.986 1435 HE1 HIS 86 HE1 HIS 86 -27.776 1.646 1.781 1436 HE2 HIS 86 HE2 HIS 86 -27.066 0.519 -0.351 1437 H HIS 87 H HIS 87 -22.179 5.982 1.130 1438 HA HIS 87 HA HIS 87 -21.800 6.675 3.253 1439 HB2 HIS 87 HB2 HIS 87 -24.742 7.286 2.994 1440 HB3 HIS 87 HB3 HIS 87 -23.732 7.889 4.304 1441 HD1 HIS 87 HD1 HIS 87 -22.308 9.913 3.837 1442 HD2 HIS 87 HD2 HIS 87 -24.066 8.352 0.408 1443 HE1 HIS 87 HE1 HIS 87 -21.856 11.588 2.025 1444 HE2 HIS 87 HE2 HIS 87 -23.066 10.701 0.007 1445 H HIS 88 H HIS 88 -22.768 6.768 5.593 1446 HA HIS 88 HA HIS 88 -24.330 4.495 6.459 1447 HB2 HIS 88 HB2 HIS 88 -21.383 4.657 6.969 1448 HB3 HIS 88 HB3 HIS 88 -22.409 4.072 8.272 1449 HD1 HIS 88 HD1 HIS 88 -20.574 2.898 5.430 1450 HD2 HIS 88 HD2 HIS 88 -24.088 1.793 7.344 1451 HE1 HIS 88 HE1 HIS 88 -20.999 0.523 4.738 1452 HE2 HIS 88 HE2 HIS 88 -22.986 -0.189 6.109 Start of MODEL 19 1 H1 MET 1 H1 MET 1 8.677 -23.689 12.618 2 H2 MET 1 H2 MET 1 7.785 -24.595 11.508 3 H3 MET 1 H3 MET 1 7.419 -24.680 13.157 4 HA MET 1 HA MET 1 7.127 -22.294 11.424 5 HB2 MET 1 HB2 MET 1 5.062 -24.144 12.632 6 HB3 MET 1 HB3 MET 1 4.679 -22.599 11.887 7 HG2 MET 1 HG2 MET 1 5.631 -23.419 9.765 8 HG3 MET 1 HG3 MET 1 5.926 -24.981 10.527 9 HE1 MET 1 HE1 MET 1 1.699 -23.222 9.905 10 HE2 MET 1 HE2 MET 1 3.179 -22.377 9.459 11 HE3 MET 1 HE3 MET 1 2.799 -22.653 11.159 12 H THR 2 H THR 2 7.531 -20.511 12.553 13 HA THR 2 HA THR 2 6.284 -20.225 15.224 14 HB THR 2 HB THR 2 8.920 -18.961 14.402 15 HG1 THR 2 HG1 THR 2 8.761 -20.809 16.496 16 HG21 THR 2 HG21 THR 2 9.075 -18.353 16.799 17 HG22 THR 2 HG22 THR 2 7.446 -18.980 17.046 18 HG23 THR 2 HG23 THR 2 7.703 -17.585 16.000 19 H ASP 3 H ASP 3 7.116 -18.835 12.145 20 HA ASP 3 HA ASP 3 6.379 -16.170 12.522 21 HB2 ASP 3 HB2 ASP 3 6.151 -17.829 9.998 22 HB3 ASP 3 HB3 ASP 3 6.176 -16.071 10.079 23 H PHE 4 H PHE 4 4.496 -15.009 12.050 24 HA PHE 4 HA PHE 4 2.052 -16.477 11.407 25 HB2 PHE 4 HB2 PHE 4 0.766 -15.412 13.173 26 HB3 PHE 4 HB3 PHE 4 2.099 -16.311 13.881 27 HD1 PHE 4 HD1 PHE 4 0.699 -12.981 13.261 28 HD2 PHE 4 HD2 PHE 4 3.940 -15.152 14.980 29 HE1 PHE 4 HE1 PHE 4 1.411 -10.961 14.471 30 HE2 PHE 4 HE2 PHE 4 4.640 -13.132 16.193 31 HZ PHE 4 HZ PHE 4 3.392 -11.034 15.934 32 H LEU 5 H LEU 5 0.267 -15.006 10.796 33 HA LEU 5 HA LEU 5 1.244 -12.803 9.196 34 HB2 LEU 5 HB2 LEU 5 -0.470 -14.274 8.296 35 HB3 LEU 5 HB3 LEU 5 -1.535 -13.893 9.635 36 HG LEU 5 HG LEU 5 -1.730 -11.573 8.846 37 HD11 LEU 5 HD11 LEU 5 0.467 -11.306 7.832 38 HD12 LEU 5 HD12 LEU 5 -0.798 -10.921 6.667 39 HD13 LEU 5 HD13 LEU 5 0.048 -12.464 6.568 40 HD21 LEU 5 HD21 LEU 5 -3.004 -12.018 6.802 41 HD22 LEU 5 HD22 LEU 5 -3.334 -13.221 8.048 42 HD23 LEU 5 HD23 LEU 5 -2.273 -13.620 6.695 43 H ALA 6 H ALA 6 1.694 -10.971 10.196 44 HA ALA 6 HA ALA 6 0.167 -10.104 12.537 45 HB1 ALA 6 HB1 ALA 6 2.604 -10.180 12.715 46 HB2 ALA 6 HB2 ALA 6 1.998 -8.534 12.892 47 HB3 ALA 6 HB3 ALA 6 2.742 -9.039 11.377 48 H GLY 7 H GLY 7 -0.479 -7.860 12.750 49 HA2 GLY 7 HA2 GLY 7 -0.916 -6.434 10.200 50 HA3 GLY 7 HA3 GLY 7 -2.248 -6.691 11.316 51 H ILE 8 H ILE 8 -0.863 -4.218 10.282 52 HA ILE 8 HA ILE 8 -0.395 -2.930 12.903 53 HB ILE 8 HB ILE 8 1.088 -2.268 10.339 54 HG12 ILE 8 HG12 ILE 8 2.101 -3.631 12.855 55 HG13 ILE 8 HG13 ILE 8 1.862 -4.404 11.292 56 HG21 ILE 8 HG21 ILE 8 1.404 -1.161 13.130 57 HG22 ILE 8 HG22 ILE 8 0.727 -0.312 11.740 58 HG23 ILE 8 HG23 ILE 8 2.430 -0.769 11.750 59 HD11 ILE 8 HD11 ILE 8 3.602 -2.953 10.328 60 HD12 ILE 8 HD12 ILE 8 4.206 -3.934 11.664 61 HD13 ILE 8 HD13 ILE 8 3.853 -2.226 11.916 62 H ARG 9 H ARG 9 -1.388 -0.941 13.190 63 HA ARG 9 HA ARG 9 -2.919 0.137 10.895 64 HB2 ARG 9 HB2 ARG 9 -4.424 -0.690 12.601 65 HB3 ARG 9 HB3 ARG 9 -3.580 0.220 13.847 66 HG2 ARG 9 HG2 ARG 9 -4.297 2.316 12.834 67 HG3 ARG 9 HG3 ARG 9 -5.099 1.432 11.535 68 HD2 ARG 9 HD2 ARG 9 -6.645 0.437 13.124 69 HD3 ARG 9 HD3 ARG 9 -5.796 1.207 14.465 70 HE ARG 9 HE ARG 9 -6.740 3.252 13.877 71 HH11 ARG 9 HH11 ARG 9 -7.650 0.823 11.612 72 HH12 ARG 9 HH12 ARG 9 -8.952 1.758 10.972 73 HH21 ARG 9 HH21 ARG 9 -8.411 4.423 13.077 74 HH22 ARG 9 HH22 ARG 9 -9.390 3.776 11.806 75 H ILE 10 H ILE 10 -2.413 2.110 10.213 76 HA ILE 10 HA ILE 10 -0.882 3.933 11.989 77 HB ILE 10 HB ILE 10 -0.662 3.764 8.971 78 HG12 ILE 10 HG12 ILE 10 1.340 2.718 10.993 79 HG13 ILE 10 HG13 ILE 10 0.197 1.698 10.123 80 HG21 ILE 10 HG21 ILE 10 -0.111 5.949 9.891 81 HG22 ILE 10 HG22 ILE 10 1.338 5.154 9.278 82 HG23 ILE 10 HG23 ILE 10 1.029 5.208 11.014 83 HD11 ILE 10 HD11 ILE 10 1.200 2.415 8.000 84 HD12 ILE 10 HD12 ILE 10 2.362 1.627 9.067 85 HD13 ILE 10 HD13 ILE 10 2.371 3.382 8.899 86 H VAL 11 H VAL 11 -2.192 5.690 12.500 87 HA VAL 11 HA VAL 11 -3.749 6.847 10.260 88 HB VAL 11 HB VAL 11 -4.435 6.925 13.207 89 HG11 VAL 11 HG11 VAL 11 -4.996 9.053 12.180 90 HG12 VAL 11 HG12 VAL 11 -6.464 8.138 12.520 91 HG13 VAL 11 HG13 VAL 11 -5.841 8.226 10.871 92 HG21 VAL 11 HG21 VAL 11 -5.826 5.621 10.862 93 HG22 VAL 11 HG22 VAL 11 -6.449 5.683 12.512 94 HG23 VAL 11 HG23 VAL 11 -4.966 4.792 12.159 95 H GLY 12 H GLY 12 -3.053 8.721 9.559 96 HA2 GLY 12 HA2 GLY 12 -1.826 10.654 11.409 97 HA3 GLY 12 HA3 GLY 12 -0.893 10.132 10.014 98 H GLU 13 H GLU 13 -1.495 12.802 10.416 99 HA GLU 13 HA GLU 13 -3.885 13.648 9.156 100 HB2 GLU 13 HB2 GLU 13 -2.821 15.888 9.105 101 HB3 GLU 13 HB3 GLU 13 -2.727 15.115 10.684 102 HG2 GLU 13 HG2 GLU 13 -0.395 14.466 10.201 103 HG3 GLU 13 HG3 GLU 13 -0.504 15.296 8.649 104 H ASP 14 H ASP 14 -4.393 14.096 7.086 105 HA ASP 14 HA ASP 14 -2.820 12.955 5.004 106 HB2 ASP 14 HB2 ASP 14 -5.259 12.915 4.946 107 HB3 ASP 14 HB3 ASP 14 -5.309 14.674 4.890 108 H LYS 15 H LYS 15 -1.021 13.895 4.231 109 HA LYS 15 HA LYS 15 -1.012 16.827 3.809 110 HB2 LYS 15 HB2 LYS 15 1.418 15.127 4.401 111 HB3 LYS 15 HB3 LYS 15 1.381 16.871 4.205 112 HG2 LYS 15 HG2 LYS 15 0.198 15.265 6.451 113 HG3 LYS 15 HG3 LYS 15 1.586 16.350 6.510 114 HD2 LYS 15 HD2 LYS 15 -1.232 17.216 5.862 115 HD3 LYS 15 HD3 LYS 15 -0.502 17.314 7.464 116 HE2 LYS 15 HE2 LYS 15 0.553 18.690 4.990 117 HE3 LYS 15 HE3 LYS 15 -0.434 19.460 6.233 118 HZ1 LYS 15 HZ1 LYS 15 1.302 18.983 7.849 119 HZ2 LYS 15 HZ2 LYS 15 1.904 19.914 6.571 120 HZ3 LYS 15 HZ3 LYS 15 2.255 18.262 6.646 121 H ASN 16 H ASN 16 0.997 17.367 2.380 122 HA ASN 16 HA ASN 16 0.542 16.964 -0.242 123 HB2 ASN 16 HB2 ASN 16 3.170 17.370 1.185 124 HB3 ASN 16 HB3 ASN 16 2.984 17.531 -0.567 125 HD21 ASN 16 HD21 ASN 16 2.306 18.914 2.525 126 HD22 ASN 16 HD22 ASN 16 1.732 20.433 1.947 127 H GLY 17 H GLY 17 2.304 14.699 1.813 128 HA2 GLY 17 HA2 GLY 17 2.078 12.665 -0.239 129 HA3 GLY 17 HA3 GLY 17 3.728 13.173 0.074 130 H MET 18 H MET 18 1.159 12.856 2.495 131 HA MET 18 HA MET 18 2.857 11.242 4.156 132 HB2 MET 18 HB2 MET 18 0.083 12.342 4.386 133 HB3 MET 18 HB3 MET 18 0.542 11.025 5.455 134 HG2 MET 18 HG2 MET 18 2.105 13.584 5.204 135 HG3 MET 18 HG3 MET 18 0.842 13.311 6.404 136 HE1 MET 18 HE1 MET 18 1.277 10.220 7.077 137 HE2 MET 18 HE2 MET 18 0.959 11.473 8.276 138 HE3 MET 18 HE3 MET 18 2.314 10.366 8.497 139 H THR 19 H THR 19 -0.218 10.545 2.456 140 HA THR 19 HA THR 19 -0.339 7.813 3.130 141 HB THR 19 HB THR 19 -1.902 7.553 1.267 142 HG1 THR 19 HG1 THR 19 -2.115 9.080 -0.301 143 HG21 THR 19 HG21 THR 19 -2.267 10.234 2.623 144 HG22 THR 19 HG22 THR 19 -2.723 8.669 3.302 145 HG23 THR 19 HG23 THR 19 -3.535 9.276 1.858 146 H ASN 20 H ASN 20 1.460 9.516 0.675 147 HA ASN 20 HA ASN 20 2.215 7.195 -0.837 148 HB2 ASN 20 HB2 ASN 20 3.407 9.984 -0.764 149 HB3 ASN 20 HB3 ASN 20 3.799 8.746 -1.951 150 HD21 ASN 20 HD21 ASN 20 2.415 8.394 -3.638 151 HD22 ASN 20 HD22 ASN 20 1.020 9.365 -3.945 152 H GLN 21 H GLN 21 3.847 9.278 1.562 153 HA GLN 21 HA GLN 21 6.309 7.879 1.456 154 HB2 GLN 21 HB2 GLN 21 7.033 9.259 3.238 155 HB3 GLN 21 HB3 GLN 21 5.995 10.254 2.239 156 HG2 GLN 21 HG2 GLN 21 4.177 9.986 3.834 157 HG3 GLN 21 HG3 GLN 21 5.181 8.925 4.821 158 HE21 GLN 21 HE21 GLN 21 4.652 12.201 3.783 159 HE22 GLN 21 HE22 GLN 21 5.640 12.942 4.986 160 H ILE 22 H ILE 22 3.493 7.612 3.571 161 HA ILE 22 HA ILE 22 4.548 6.008 5.584 162 HB ILE 22 HB ILE 22 1.783 6.313 4.451 163 HG12 ILE 22 HG12 ILE 22 2.681 8.121 5.841 164 HG13 ILE 22 HG13 ILE 22 1.344 7.320 6.662 165 HG21 ILE 22 HG21 ILE 22 0.883 4.927 6.281 166 HG22 ILE 22 HG22 ILE 22 2.527 4.447 6.709 167 HG23 ILE 22 HG23 ILE 22 1.853 3.991 5.144 168 HD11 ILE 22 HD11 ILE 22 2.919 6.079 8.039 169 HD12 ILE 22 HD12 ILE 22 3.169 7.819 8.186 170 HD13 ILE 22 HD13 ILE 22 4.267 6.852 7.202 171 H THR 23 H THR 23 2.792 4.906 2.664 172 HA THR 23 HA THR 23 3.454 2.167 3.174 173 HB THR 23 HB THR 23 2.465 3.287 0.535 174 HG1 THR 23 HG1 THR 23 0.783 3.836 1.752 175 HG21 THR 23 HG21 THR 23 2.237 0.557 1.826 176 HG22 THR 23 HG22 THR 23 3.247 0.973 0.440 177 HG23 THR 23 HG23 THR 23 1.491 1.031 0.300 178 H GLY 24 H GLY 24 4.891 4.787 1.349 179 HA2 GLY 24 HA2 GLY 24 6.810 3.386 -0.141 180 HA3 GLY 24 HA3 GLY 24 7.011 5.013 0.491 181 H VAL 25 H VAL 25 6.888 4.430 3.255 182 HA VAL 25 HA VAL 25 9.492 3.398 3.794 183 HB VAL 25 HB VAL 25 7.210 3.979 5.704 184 HG11 VAL 25 HG11 VAL 25 8.798 2.400 6.693 185 HG12 VAL 25 HG12 VAL 25 8.907 3.977 7.474 186 HG13 VAL 25 HG13 VAL 25 10.133 3.487 6.305 187 HG21 VAL 25 HG21 VAL 25 7.950 5.965 4.507 188 HG22 VAL 25 HG22 VAL 25 9.628 5.626 4.930 189 HG23 VAL 25 HG23 VAL 25 8.468 6.049 6.191 190 H ILE 26 H ILE 26 6.213 2.091 4.143 191 HA ILE 26 HA ILE 26 6.781 -0.327 5.390 192 HB ILE 26 HB ILE 26 4.664 0.309 3.330 193 HG12 ILE 26 HG12 ILE 26 4.564 0.124 6.359 194 HG13 ILE 26 HG13 ILE 26 4.513 1.607 5.414 195 HG21 ILE 26 HG21 ILE 26 5.057 -2.097 3.357 196 HG22 ILE 26 HG22 ILE 26 3.498 -1.712 4.082 197 HG23 ILE 26 HG23 ILE 26 4.870 -2.121 5.112 198 HD11 ILE 26 HD11 ILE 26 2.308 1.009 6.198 199 HD12 ILE 26 HD12 ILE 26 2.433 -0.567 5.418 200 HD13 ILE 26 HD13 ILE 26 2.381 0.900 4.439 201 H SER 27 H SER 27 6.809 0.399 1.896 202 HA SER 27 HA SER 27 7.398 -2.185 0.974 203 HB2 SER 27 HB2 SER 27 8.149 -1.142 -1.102 204 HB3 SER 27 HB3 SER 27 6.710 -0.315 -0.514 205 HG SER 27 HG SER 27 8.178 1.262 0.409 206 H LYS 28 H LYS 28 9.416 0.070 2.612 207 HA LYS 28 HA LYS 28 11.946 -0.913 1.684 208 HB2 LYS 28 HB2 LYS 28 11.307 0.679 4.179 209 HB3 LYS 28 HB3 LYS 28 12.900 0.461 3.471 210 HG2 LYS 28 HG2 LYS 28 12.211 1.713 1.490 211 HG3 LYS 28 HG3 LYS 28 10.588 1.892 2.161 212 HD2 LYS 28 HD2 LYS 28 11.920 3.921 2.508 213 HD3 LYS 28 HD3 LYS 28 11.489 3.167 4.046 214 HE2 LYS 28 HE2 LYS 28 13.736 2.105 4.095 215 HE3 LYS 28 HE3 LYS 28 14.148 2.986 2.625 216 HZ1 LYS 28 HZ1 LYS 28 13.835 5.057 3.811 217 HZ2 LYS 28 HZ2 LYS 28 14.968 4.094 4.612 218 HZ3 LYS 28 HZ3 LYS 28 13.396 4.227 5.217 219 H PHE 29 H PHE 29 9.661 -2.217 3.822 220 HA PHE 29 HA PHE 29 11.333 -3.158 5.900 221 HB2 PHE 29 HB2 PHE 29 8.617 -4.078 4.966 222 HB3 PHE 29 HB3 PHE 29 9.426 -4.766 6.368 223 HD1 PHE 29 HD2 PHE 29 10.631 -1.783 6.909 224 HD2 PHE 29 HD1 PHE 29 6.761 -3.528 6.534 225 HE1 PHE 29 HE2 PHE 29 9.691 0.006 8.308 226 HE2 PHE 29 HE1 PHE 29 5.820 -1.738 7.937 227 HZ PHE 29 HZ PHE 29 7.286 0.030 8.824 228 H ASP 30 H ASP 30 11.712 -5.390 6.464 229 HA ASP 30 HA ASP 30 13.195 -6.733 4.407 230 HB2 ASP 30 HB2 ASP 30 12.758 -8.175 6.956 231 HB3 ASP 30 HB3 ASP 30 14.263 -7.761 6.140 232 H THR 31 H THR 31 10.041 -7.039 5.746 233 HA THR 31 HA THR 31 9.701 -9.837 4.978 234 HB THR 31 HB THR 31 8.808 -9.116 7.147 235 HG1 THR 31 HG1 THR 31 7.038 -10.325 6.932 236 HG21 THR 31 HG21 THR 31 6.881 -7.613 7.285 237 HG22 THR 31 HG22 THR 31 6.959 -7.341 5.546 238 HG23 THR 31 HG23 THR 31 8.274 -6.787 6.583 239 H ASN 32 H ASN 32 7.298 -10.229 4.093 240 HA ASN 32 HA ASN 32 7.080 -8.626 1.621 241 HB2 ASN 32 HB2 ASN 32 7.629 -11.008 1.283 242 HB3 ASN 32 HB3 ASN 32 6.167 -11.468 2.150 243 HD21 ASN 32 HD21 ASN 32 7.431 -10.042 -0.763 244 HD22 ASN 32 HD22 ASN 32 5.993 -10.223 -1.699 245 H ILE 33 H ILE 33 5.221 -7.561 1.164 246 HA ILE 33 HA ILE 33 3.199 -7.323 3.188 247 HB ILE 33 HB ILE 33 3.249 -6.181 0.382 248 HG12 ILE 33 HG12 ILE 33 4.026 -4.905 3.026 249 HG13 ILE 33 HG13 ILE 33 5.155 -5.440 1.784 250 HG21 ILE 33 HG21 ILE 33 1.525 -5.459 2.761 251 HG22 ILE 33 HG22 ILE 33 0.985 -6.227 1.268 252 HG23 ILE 33 HG23 ILE 33 1.583 -4.569 1.238 253 HD11 ILE 33 HD11 ILE 33 4.857 -3.048 1.688 254 HD12 ILE 33 HD12 ILE 33 3.113 -3.242 1.511 255 HD13 ILE 33 HD13 ILE 33 4.198 -3.796 0.234 256 H ARG 34 H ARG 34 1.762 -8.959 3.464 257 HA ARG 34 HA ARG 34 0.806 -10.513 1.220 258 HB2 ARG 34 HB2 ARG 34 1.154 -11.281 3.709 259 HB3 ARG 34 HB3 ARG 34 -0.460 -10.620 3.946 260 HG2 ARG 34 HG2 ARG 34 -1.217 -12.091 2.035 261 HG3 ARG 34 HG3 ARG 34 0.370 -12.858 2.113 262 HD2 ARG 34 HD2 ARG 34 -0.123 -13.331 4.553 263 HD3 ARG 34 HD3 ARG 34 -1.783 -12.829 4.222 264 HE ARG 34 HE ARG 34 -0.822 -14.835 2.411 265 HH11 ARG 34 HH11 ARG 34 -2.249 -14.339 5.509 266 HH12 ARG 34 HH12 ARG 34 -2.920 -15.926 5.580 267 HH21 ARG 34 HH21 ARG 34 -1.667 -16.859 2.506 268 HH22 ARG 34 HH22 ARG 34 -2.587 -17.353 3.886 269 H THR 35 H THR 35 -0.300 -7.824 3.149 270 HA THR 35 HA THR 35 -2.385 -7.204 1.247 271 HB THR 35 HB THR 35 -3.174 -7.836 4.110 272 HG1 THR 35 HG1 THR 35 -3.350 -9.260 1.723 273 HG21 THR 35 HG21 THR 35 -4.411 -5.911 3.234 274 HG22 THR 35 HG22 THR 35 -5.464 -7.316 3.402 275 HG23 THR 35 HG23 THR 35 -4.870 -6.846 1.809 276 H ILE 36 H ILE 36 -2.564 -5.017 1.097 277 HA ILE 36 HA ILE 36 -2.065 -3.401 3.512 278 HB ILE 36 HB ILE 36 -0.070 -3.234 2.030 279 HG12 ILE 36 HG12 ILE 36 -0.015 -0.723 1.907 280 HG13 ILE 36 HG13 ILE 36 -1.727 -0.711 2.318 281 HG21 ILE 36 HG21 ILE 36 -1.110 -3.540 -0.136 282 HG22 ILE 36 HG22 ILE 36 -0.230 -2.009 -0.099 283 HG23 ILE 36 HG23 ILE 36 -1.989 -2.020 0.046 284 HD11 ILE 36 HD11 ILE 36 -1.230 -1.739 4.462 285 HD12 ILE 36 HD12 ILE 36 -0.316 -0.247 4.246 286 HD13 ILE 36 HD13 ILE 36 0.482 -1.806 4.043 287 H VAL 37 H VAL 37 -3.673 -1.997 3.952 288 HA VAL 37 HA VAL 37 -5.472 -1.145 1.777 289 HB VAL 37 HB VAL 37 -6.427 -2.129 4.480 290 HG11 VAL 37 HG11 VAL 37 -7.795 -0.293 3.634 291 HG12 VAL 37 HG12 VAL 37 -8.689 -1.811 3.567 292 HG13 VAL 37 HG13 VAL 37 -7.997 -1.130 2.094 293 HG21 VAL 37 HG21 VAL 37 -7.485 -3.966 3.244 294 HG22 VAL 37 HG22 VAL 37 -5.733 -3.982 3.040 295 HG23 VAL 37 HG23 VAL 37 -6.766 -3.377 1.744 296 H LEU 38 H LEU 38 -5.026 0.987 1.707 297 HA LEU 38 HA LEU 38 -5.127 2.528 4.232 298 HB2 LEU 38 HB2 LEU 38 -2.942 2.576 3.053 299 HB3 LEU 38 HB3 LEU 38 -3.730 3.236 1.637 300 HG LEU 38 HG LEU 38 -3.749 4.704 4.281 301 HD11 LEU 38 HD11 LEU 38 -1.414 4.275 3.706 302 HD12 LEU 38 HD12 LEU 38 -1.809 5.980 3.491 303 HD13 LEU 38 HD13 LEU 38 -1.680 4.921 2.085 304 HD21 LEU 38 HD21 LEU 38 -4.114 5.594 1.412 305 HD22 LEU 38 HD22 LEU 38 -4.016 6.683 2.797 306 HD23 LEU 38 HD23 LEU 38 -5.350 5.538 2.670 307 H ASN 39 H ASN 39 -6.790 3.933 4.454 308 HA ASN 39 HA ASN 39 -8.011 5.082 2.036 309 HB2 ASN 39 HB2 ASN 39 -10.275 4.717 2.878 310 HB3 ASN 39 HB3 ASN 39 -9.434 3.183 2.703 311 HD21 ASN 39 HD21 ASN 39 -8.818 2.057 4.568 312 HD22 ASN 39 HD22 ASN 39 -9.513 2.408 6.106 313 H ALA 40 H ALA 40 -8.617 7.195 2.211 314 HA ALA 40 HA ALA 40 -8.068 8.546 4.775 315 HB1 ALA 40 HB1 ALA 40 -8.331 9.712 1.997 316 HB2 ALA 40 HB2 ALA 40 -6.817 9.341 2.823 317 HB3 ALA 40 HB3 ALA 40 -7.883 10.594 3.458 318 H LYS 41 H LYS 41 -9.688 9.187 5.987 319 HA LYS 41 HA LYS 41 -12.195 10.108 4.787 320 HB2 LYS 41 HB2 LYS 41 -13.587 8.803 6.245 321 HB3 LYS 41 HB3 LYS 41 -12.474 7.700 5.448 322 HG2 LYS 41 HG2 LYS 41 -12.069 8.765 8.243 323 HG3 LYS 41 HG3 LYS 41 -12.868 7.236 7.872 324 HD2 LYS 41 HD2 LYS 41 -10.820 6.422 6.797 325 HD3 LYS 41 HD3 LYS 41 -10.022 7.960 7.138 326 HE2 LYS 41 HE2 LYS 41 -9.377 6.243 8.760 327 HE3 LYS 41 HE3 LYS 41 -10.258 7.557 9.539 328 HZ1 LYS 41 HZ1 LYS 41 -12.249 6.189 9.524 329 HZ2 LYS 41 HZ2 LYS 41 -10.993 5.397 10.329 330 HZ3 LYS 41 HZ3 LYS 41 -11.412 4.934 8.761 331 H ASP 42 H ASP 42 -13.183 11.772 5.891 332 HA ASP 42 HA ASP 42 -13.510 13.467 7.373 333 HB2 ASP 42 HB2 ASP 42 -13.660 11.617 9.037 334 HB3 ASP 42 HB3 ASP 42 -11.929 11.754 9.320 335 H GLY 43 H GLY 43 -10.855 13.007 5.789 336 HA2 GLY 43 HA2 GLY 43 -9.231 14.653 5.285 337 HA3 GLY 43 HA3 GLY 43 -9.494 15.375 6.862 338 H ILE 44 H ILE 44 -9.220 12.136 7.381 339 HA ILE 44 HA ILE 44 -6.275 12.232 7.728 340 HB ILE 44 HB ILE 44 -8.095 10.605 9.505 341 HG12 ILE 44 HG12 ILE 44 -7.240 13.478 9.978 342 HG13 ILE 44 HG13 ILE 44 -8.884 12.915 9.675 343 HG21 ILE 44 HG21 ILE 44 -5.705 10.082 9.530 344 HG22 ILE 44 HG22 ILE 44 -6.225 10.747 11.079 345 HG23 ILE 44 HG23 ILE 44 -5.335 11.757 9.939 346 HD11 ILE 44 HD11 ILE 44 -7.187 12.217 12.062 347 HD12 ILE 44 HD12 ILE 44 -8.832 11.651 11.763 348 HD13 ILE 44 HD13 ILE 44 -8.525 13.367 12.034 349 H PHE 45 H PHE 45 -5.264 10.017 7.700 350 HA PHE 45 HA PHE 45 -6.892 8.112 6.127 351 HB2 PHE 45 HB2 PHE 45 -5.041 7.563 4.731 352 HB3 PHE 45 HB3 PHE 45 -5.144 9.318 4.762 353 HD1 PHE 45 HD2 PHE 45 -3.461 10.645 5.950 354 HD2 PHE 45 HD1 PHE 45 -3.164 6.398 5.697 355 HE1 PHE 45 HE2 PHE 45 -1.106 10.763 6.651 356 HE2 PHE 45 HE1 PHE 45 -0.813 6.518 6.399 357 HZ PHE 45 HZ PHE 45 0.217 8.699 6.875 358 H THR 46 H THR 46 -6.596 5.921 6.484 359 HA THR 46 HA THR 46 -4.808 5.160 8.713 360 HB THR 46 HB THR 46 -6.999 4.892 9.578 361 HG1 THR 46 HG1 THR 46 -6.335 2.280 8.634 362 HG21 THR 46 HG21 THR 46 -8.278 5.016 7.504 363 HG22 THR 46 HG22 THR 46 -8.769 3.615 8.456 364 HG23 THR 46 HG23 THR 46 -7.725 3.399 7.052 365 H CYS 47 H CYS 47 -3.145 4.050 7.945 366 HA CYS 47 HA CYS 47 -3.454 2.329 5.591 367 HB2 CYS 47 HB2 CYS 47 -1.537 3.869 5.633 368 HB3 CYS 47 HB3 CYS 47 -0.961 3.123 7.120 369 HG CYS 47 HG CYS 47 -0.094 2.374 4.137 370 H ASN 48 H ASN 48 -4.020 0.285 5.924 371 HA ASN 48 HA ASN 48 -3.348 -1.055 8.454 372 HB2 ASN 48 HB2 ASN 48 -5.294 -1.828 6.260 373 HB3 ASN 48 HB3 ASN 48 -5.022 -2.749 7.736 374 HD21 ASN 48 HD21 ASN 48 -7.145 -2.541 8.381 375 HD22 ASN 48 HD22 ASN 48 -7.811 -1.057 8.950 376 H LEU 49 H LEU 49 -1.419 -2.055 8.363 377 HA LEU 49 HA LEU 49 -0.519 -3.281 5.851 378 HB2 LEU 49 HB2 LEU 49 1.044 -1.750 6.868 379 HB3 LEU 49 HB3 LEU 49 0.945 -2.596 8.402 380 HG LEU 49 HG LEU 49 2.032 -4.568 7.384 381 HD11 LEU 49 HD11 LEU 49 1.293 -4.314 5.094 382 HD12 LEU 49 HD12 LEU 49 3.055 -4.370 5.152 383 HD13 LEU 49 HD13 LEU 49 2.228 -2.828 4.926 384 HD21 LEU 49 HD21 LEU 49 3.399 -2.901 8.519 385 HD22 LEU 49 HD22 LEU 49 3.564 -1.988 7.019 386 HD23 LEU 49 HD23 LEU 49 4.272 -3.599 7.154 387 H MET 50 H MET 50 -0.461 -5.420 5.553 388 HA MET 50 HA MET 50 -0.560 -7.192 7.918 389 HB2 MET 50 HB2 MET 50 -1.748 -7.723 5.187 390 HB3 MET 50 HB3 MET 50 -1.811 -8.804 6.570 391 HG2 MET 50 HG2 MET 50 -3.124 -6.100 6.356 392 HG3 MET 50 HG3 MET 50 -3.921 -7.669 6.285 393 HE1 MET 50 HE1 MET 50 -1.918 -9.044 8.614 394 HE2 MET 50 HE2 MET 50 -3.615 -9.460 8.375 395 HE3 MET 50 HE3 MET 50 -3.046 -8.966 9.967 396 H ILE 51 H ILE 51 1.338 -8.167 8.174 397 HA ILE 51 HA ILE 51 2.740 -9.295 5.857 398 HB ILE 51 HB ILE 51 4.944 -8.431 6.908 399 HG12 ILE 51 HG12 ILE 51 4.519 -6.051 7.880 400 HG13 ILE 51 HG13 ILE 51 2.908 -6.654 8.247 401 HG21 ILE 51 HG21 ILE 51 4.866 -6.383 5.584 402 HG22 ILE 51 HG22 ILE 51 3.109 -6.511 5.481 403 HG23 ILE 51 HG23 ILE 51 4.129 -7.739 4.730 404 HD11 ILE 51 HD11 ILE 51 3.903 -8.424 9.613 405 HD12 ILE 51 HD12 ILE 51 4.357 -6.813 10.170 406 HD13 ILE 51 HD13 ILE 51 5.509 -7.785 9.252 407 H PHE 52 H PHE 52 4.416 -10.870 6.443 408 HA PHE 52 HA PHE 52 3.637 -12.381 8.815 409 HB2 PHE 52 HB2 PHE 52 5.194 -13.012 6.336 410 HB3 PHE 52 HB3 PHE 52 5.461 -14.000 7.768 411 HD1 PHE 52 HD2 PHE 52 3.584 -15.269 8.763 412 HD2 PHE 52 HD1 PHE 52 3.191 -13.260 5.022 413 HE1 PHE 52 HE2 PHE 52 1.596 -16.619 8.257 414 HE2 PHE 52 HE1 PHE 52 1.201 -14.615 4.511 415 HZ PHE 52 HZ PHE 52 0.404 -16.298 6.124 416 H VAL 53 H VAL 53 4.852 -12.674 10.617 417 HA VAL 53 HA VAL 53 7.634 -11.678 10.649 418 HB VAL 53 HB VAL 53 7.363 -10.574 12.757 419 HG11 VAL 53 HG11 VAL 53 5.790 -8.788 12.249 420 HG12 VAL 53 HG12 VAL 53 5.038 -9.787 11.006 421 HG13 VAL 53 HG13 VAL 53 6.708 -9.245 10.813 422 HG21 VAL 53 HG21 VAL 53 5.831 -12.104 13.841 423 HG22 VAL 53 HG22 VAL 53 4.521 -11.589 12.778 424 HG23 VAL 53 HG23 VAL 53 5.205 -10.458 13.946 425 H LYS 54 H LYS 54 9.038 -12.741 12.094 426 HA LYS 54 HA LYS 54 8.554 -15.423 12.741 427 HB2 LYS 54 HB2 LYS 54 10.588 -15.188 14.233 428 HB3 LYS 54 HB3 LYS 54 10.816 -14.703 12.560 429 HG2 LYS 54 HG2 LYS 54 10.591 -12.346 13.210 430 HG3 LYS 54 HG3 LYS 54 10.368 -12.834 14.889 431 HD2 LYS 54 HD2 LYS 54 12.824 -13.560 13.290 432 HD3 LYS 54 HD3 LYS 54 12.705 -12.075 14.233 433 HE2 LYS 54 HE2 LYS 54 12.176 -14.754 15.491 434 HE3 LYS 54 HE3 LYS 54 13.821 -14.142 15.319 435 HZ1 LYS 54 HZ1 LYS 54 13.100 -12.154 16.563 436 HZ2 LYS 54 HZ2 LYS 54 12.975 -13.577 17.463 437 HZ3 LYS 54 HZ3 LYS 54 11.592 -12.874 16.802 438 H ASN 55 H ASN 55 8.319 -12.530 14.783 439 HA ASN 55 HA ASN 55 6.282 -13.672 16.394 440 HB2 ASN 55 HB2 ASN 55 7.605 -13.497 18.577 441 HB3 ASN 55 HB3 ASN 55 7.935 -14.885 17.551 442 HD21 ASN 55 HD21 ASN 55 9.194 -11.973 18.872 443 HD22 ASN 55 HD22 ASN 55 10.823 -12.200 18.377 444 H THR 56 H THR 56 5.762 -12.159 18.325 445 HA THR 56 HA THR 56 4.951 -9.751 17.225 446 HB THR 56 HB THR 56 4.386 -8.993 19.509 447 HG1 THR 56 HG1 THR 56 4.986 -10.279 21.276 448 HG21 THR 56 HG21 THR 56 2.883 -10.547 18.350 449 HG22 THR 56 HG22 THR 56 2.882 -10.844 20.088 450 HG23 THR 56 HG23 THR 56 3.778 -11.916 19.011 451 H ASP 57 H ASP 57 7.926 -10.348 19.019 452 HA ASP 57 HA ASP 57 8.702 -7.726 19.597 453 HB2 ASP 57 HB2 ASP 57 9.851 -9.695 20.497 454 HB3 ASP 57 HB3 ASP 57 10.423 -10.119 18.888 455 H LYS 58 H LYS 58 9.350 -9.693 16.724 456 HA LYS 58 HA LYS 58 10.726 -7.818 15.175 457 HB2 LYS 58 HB2 LYS 58 10.740 -10.016 14.368 458 HB3 LYS 58 HB3 LYS 58 9.004 -10.205 14.559 459 HG2 LYS 58 HG2 LYS 58 9.578 -10.126 12.221 460 HG3 LYS 58 HG3 LYS 58 8.636 -8.701 12.665 461 HD2 LYS 58 HD2 LYS 58 10.759 -7.412 12.832 462 HD3 LYS 58 HD3 LYS 58 11.636 -8.841 12.282 463 HE2 LYS 58 HE2 LYS 58 10.320 -8.801 10.188 464 HE3 LYS 58 HE3 LYS 58 9.526 -7.326 10.741 465 HZ1 LYS 58 HZ1 LYS 58 11.325 -6.781 9.267 466 HZ2 LYS 58 HZ2 LYS 58 12.419 -7.673 10.189 467 HZ3 LYS 58 HZ3 LYS 58 11.730 -6.268 10.826 468 H LEU 59 H LEU 59 7.264 -8.334 15.611 469 HA LEU 59 HA LEU 59 6.367 -6.593 13.573 470 HB2 LEU 59 HB2 LEU 59 4.977 -8.342 14.545 471 HB3 LEU 59 HB3 LEU 59 4.996 -7.522 16.094 472 HG LEU 59 HG LEU 59 3.730 -5.648 15.132 473 HD11 LEU 59 HD11 LEU 59 2.744 -5.870 12.883 474 HD12 LEU 59 HD12 LEU 59 3.731 -7.307 12.611 475 HD13 LEU 59 HD13 LEU 59 4.502 -5.737 12.842 476 HD21 LEU 59 HD21 LEU 59 2.510 -7.460 16.184 477 HD22 LEU 59 HD22 LEU 59 2.488 -8.361 14.669 478 HD23 LEU 59 HD23 LEU 59 1.602 -6.842 14.805 479 H THR 60 H THR 60 6.853 -6.072 17.069 480 HA THR 60 HA THR 60 5.868 -3.437 17.181 481 HB THR 60 HB THR 60 7.157 -3.179 19.267 482 HG1 THR 60 HG1 THR 60 8.327 -5.256 19.875 483 HG21 THR 60 HG21 THR 60 5.025 -4.372 19.356 484 HG22 THR 60 HG22 THR 60 6.165 -5.058 20.514 485 HG23 THR 60 HG23 THR 60 5.841 -5.893 18.994 486 H THR 61 H THR 61 9.081 -4.687 16.403 487 HA THR 61 HA THR 61 10.508 -2.292 16.269 488 HB THR 61 HB THR 61 10.833 -4.759 14.538 489 HG1 THR 61 HG1 THR 61 12.049 -5.503 16.145 490 HG21 THR 61 HG21 THR 61 13.121 -3.954 14.106 491 HG22 THR 61 HG22 THR 61 12.769 -2.466 14.985 492 HG23 THR 61 HG23 THR 61 11.922 -2.821 13.477 493 H LEU 62 H LEU 62 8.545 -3.862 13.726 494 HA LEU 62 HA LEU 62 9.015 -1.968 11.700 495 HB2 LEU 62 HB2 LEU 62 6.583 -3.683 12.213 496 HB3 LEU 62 HB3 LEU 62 6.823 -2.734 10.758 497 HG LEU 62 HG LEU 62 8.409 -5.136 11.668 498 HD11 LEU 62 HD11 LEU 62 7.666 -6.057 9.535 499 HD12 LEU 62 HD12 LEU 62 6.808 -4.555 9.180 500 HD13 LEU 62 HD13 LEU 62 6.289 -5.570 10.527 501 HD21 LEU 62 HD21 LEU 62 8.995 -3.271 9.366 502 HD22 LEU 62 HD22 LEU 62 9.805 -4.806 9.678 503 HD23 LEU 62 HD23 LEU 62 9.981 -3.470 10.815 504 H MET 63 H MET 63 6.392 -2.123 14.116 505 HA MET 63 HA MET 63 4.988 0.132 13.292 506 HB2 MET 63 HB2 MET 63 5.304 -1.033 16.063 507 HB3 MET 63 HB3 MET 63 4.180 0.265 15.677 508 HG2 MET 63 HG2 MET 63 3.191 -1.291 13.937 509 HG3 MET 63 HG3 MET 63 4.139 -2.574 14.687 510 HE1 MET 63 HE1 MET 63 3.721 -3.515 17.096 511 HE2 MET 63 HE2 MET 63 2.606 -2.789 18.255 512 HE3 MET 63 HE3 MET 63 4.049 -1.910 17.749 513 H ASP 64 H ASP 64 7.732 -0.057 15.568 514 HA ASP 64 HA ASP 64 7.867 2.651 16.250 515 HB2 ASP 64 HB2 ASP 64 9.209 0.806 17.294 516 HB3 ASP 64 HB3 ASP 64 10.237 0.803 15.863 517 H LYS 65 H LYS 65 9.415 0.932 13.545 518 HA LYS 65 HA LYS 65 10.743 3.061 12.337 519 HB2 LYS 65 HB2 LYS 65 9.433 0.638 11.077 520 HB3 LYS 65 HB3 LYS 65 10.522 1.715 10.219 521 HG2 LYS 65 HG2 LYS 65 12.286 1.165 11.907 522 HG3 LYS 65 HG3 LYS 65 11.183 -0.032 12.586 523 HD2 LYS 65 HD2 LYS 65 12.754 -1.107 11.072 524 HD3 LYS 65 HD3 LYS 65 11.124 -1.188 10.402 525 HE2 LYS 65 HE2 LYS 65 11.601 0.607 8.872 526 HE3 LYS 65 HE3 LYS 65 13.158 0.911 9.639 527 HZ1 LYS 65 HZ1 LYS 65 12.468 -1.629 8.271 528 HZ2 LYS 65 HZ2 LYS 65 13.983 -1.154 8.843 529 HZ3 LYS 65 HZ3 LYS 65 13.292 -0.352 7.529 530 H LEU 66 H LEU 66 7.355 2.148 12.184 531 HA LEU 66 HA LEU 66 6.650 4.097 10.171 532 HB2 LEU 66 HB2 LEU 66 4.914 2.475 12.046 533 HB3 LEU 66 HB3 LEU 66 4.344 3.383 10.654 534 HG LEU 66 HG LEU 66 6.331 1.115 10.426 535 HD11 LEU 66 HD11 LEU 66 4.287 0.216 11.374 536 HD12 LEU 66 HD12 LEU 66 4.466 -0.293 9.695 537 HD13 LEU 66 HD13 LEU 66 3.334 0.992 10.111 538 HD21 LEU 66 HD21 LEU 66 5.673 1.126 8.077 539 HD22 LEU 66 HD22 LEU 66 6.309 2.696 8.563 540 HD23 LEU 66 HD23 LEU 66 4.569 2.469 8.378 541 H ARG 67 H ARG 67 6.810 4.049 13.663 542 HA ARG 67 HA ARG 67 5.168 6.331 14.159 543 HB2 ARG 67 HB2 ARG 67 7.390 5.154 15.852 544 HB3 ARG 67 HB3 ARG 67 6.211 6.341 16.400 545 HG2 ARG 67 HG2 ARG 67 4.410 4.727 16.019 546 HG3 ARG 67 HG3 ARG 67 5.594 3.539 15.483 547 HD2 ARG 67 HD2 ARG 67 5.099 3.011 17.734 548 HD3 ARG 67 HD3 ARG 67 6.686 3.780 17.748 549 HE ARG 67 HE ARG 67 4.631 5.687 18.181 550 HH11 ARG 67 HH11 ARG 67 6.434 3.201 19.746 551 HH12 ARG 67 HH12 ARG 67 6.156 3.851 21.325 552 HH21 ARG 67 HH21 ARG 67 4.246 6.477 20.215 553 HH22 ARG 67 HH22 ARG 67 4.899 5.656 21.590 554 H LYS 68 H LYS 68 8.133 6.090 12.654 555 HA LYS 68 HA LYS 68 9.468 8.382 13.702 556 HB2 LYS 68 HB2 LYS 68 9.888 6.951 11.074 557 HB3 LYS 68 HB3 LYS 68 10.995 8.104 11.803 558 HG2 LYS 68 HG2 LYS 68 10.236 5.416 12.949 559 HG3 LYS 68 HG3 LYS 68 11.739 5.801 12.114 560 HD2 LYS 68 HD2 LYS 68 12.452 6.024 14.276 561 HD3 LYS 68 HD3 LYS 68 11.888 7.668 14.005 562 HE2 LYS 68 HE2 LYS 68 9.761 7.116 15.090 563 HE3 LYS 68 HE3 LYS 68 10.307 5.458 15.329 564 HZ1 LYS 68 HZ1 LYS 68 10.561 6.830 17.321 565 HZ2 LYS 68 HZ2 LYS 68 11.615 7.854 16.488 566 HZ3 LYS 68 HZ3 LYS 68 12.049 6.245 16.769 567 H VAL 69 H VAL 69 6.885 8.058 11.455 568 HA VAL 69 HA VAL 69 7.502 10.419 9.911 569 HB VAL 69 HB VAL 69 4.965 8.768 10.020 570 HG11 VAL 69 HG11 VAL 69 4.354 9.907 7.931 571 HG12 VAL 69 HG12 VAL 69 5.798 10.912 8.047 572 HG13 VAL 69 HG13 VAL 69 4.521 11.060 9.255 573 HG21 VAL 69 HG21 VAL 69 6.877 7.497 9.197 574 HG22 VAL 69 HG22 VAL 69 7.248 8.771 8.034 575 HG23 VAL 69 HG23 VAL 69 5.755 7.843 7.879 576 H GLN 70 H GLN 70 7.204 12.406 10.615 577 HA GLN 70 HA GLN 70 6.104 13.177 13.019 578 HB2 GLN 70 HB2 GLN 70 6.097 15.494 12.047 579 HB3 GLN 70 HB3 GLN 70 7.609 14.619 11.885 580 HG2 GLN 70 HG2 GLN 70 7.363 15.640 9.818 581 HG3 GLN 70 HG3 GLN 70 6.785 14.002 9.534 582 HE21 GLN 70 HE21 GLN 70 4.884 16.414 11.217 583 HE22 GLN 70 HE22 GLN 70 3.705 16.614 9.974 584 H GLY 71 H GLY 71 4.422 12.776 9.964 585 HA2 GLY 71 HA2 GLY 71 2.111 14.299 10.664 586 HA3 GLY 71 HA3 GLY 71 2.251 13.183 9.320 587 H VAL 72 H VAL 72 3.062 11.049 11.418 588 HA VAL 72 HA VAL 72 0.324 10.105 11.736 589 HB VAL 72 HB VAL 72 2.914 8.704 12.441 590 HG11 VAL 72 HG11 VAL 72 1.017 7.798 13.681 591 HG12 VAL 72 HG12 VAL 72 1.541 6.658 12.442 592 HG13 VAL 72 HG13 VAL 72 0.094 7.633 12.186 593 HG21 VAL 72 HG21 VAL 72 2.597 7.477 10.346 594 HG22 VAL 72 HG22 VAL 72 2.758 9.208 10.050 595 HG23 VAL 72 HG23 VAL 72 1.168 8.448 9.987 596 H PHE 73 H PHE 73 -0.764 9.768 13.622 597 HA PHE 73 HA PHE 73 0.621 10.474 16.129 598 HB2 PHE 73 HB2 PHE 73 -1.884 11.124 16.813 599 HB3 PHE 73 HB3 PHE 73 -0.765 12.266 16.094 600 HD1 PHE 73 HD1 PHE 73 -3.716 10.147 15.457 601 HD2 PHE 73 HD2 PHE 73 -1.118 13.152 13.923 602 HE1 PHE 73 HE1 PHE 73 -5.324 10.617 13.653 603 HE2 PHE 73 HE2 PHE 73 -2.717 13.623 12.120 604 HZ PHE 73 HZ PHE 73 -4.819 12.364 11.981 605 H THR 74 H THR 74 -1.132 8.055 14.497 606 HA THR 74 HA THR 74 -1.264 6.536 17.031 607 HB THR 74 HB THR 74 -3.321 5.508 16.536 608 HG1 THR 74 HG1 THR 74 -4.117 5.303 14.557 609 HG21 THR 74 HG21 THR 74 -4.921 7.315 16.269 610 HG22 THR 74 HG22 THR 74 -3.667 8.354 15.592 611 HG23 THR 74 HG23 THR 74 -3.580 7.855 17.282 612 H VAL 75 H VAL 75 0.112 4.899 16.922 613 HA VAL 75 HA VAL 75 0.129 3.226 14.493 614 HB VAL 75 HB VAL 75 2.596 3.869 16.136 615 HG11 VAL 75 HG11 VAL 75 2.276 2.205 13.632 616 HG12 VAL 75 HG12 VAL 75 2.630 1.598 15.251 617 HG13 VAL 75 HG13 VAL 75 3.808 2.606 14.411 618 HG21 VAL 75 HG21 VAL 75 1.982 5.787 14.782 619 HG22 VAL 75 HG22 VAL 75 1.839 4.766 13.351 620 HG23 VAL 75 HG23 VAL 75 3.415 5.013 14.104 621 H GLU 76 H GLU 76 -0.887 1.409 15.155 622 HA GLU 76 HA GLU 76 -0.052 0.196 17.703 623 HB2 GLU 76 HB2 GLU 76 -2.467 -0.332 18.180 624 HB3 GLU 76 HB3 GLU 76 -2.018 1.360 18.340 625 HG2 GLU 76 HG2 GLU 76 -3.007 1.852 16.170 626 HG3 GLU 76 HG3 GLU 76 -3.411 0.148 15.955 627 H ARG 77 H ARG 77 -0.459 -2.021 17.937 628 HA ARG 77 HA ARG 77 -0.304 -3.529 15.487 629 HB2 ARG 77 HB2 ARG 77 1.107 -4.176 17.324 630 HB3 ARG 77 HB3 ARG 77 -0.275 -4.327 18.400 631 HG2 ARG 77 HG2 ARG 77 -1.104 -6.203 17.028 632 HG3 ARG 77 HG3 ARG 77 0.345 -6.079 16.028 633 HD2 ARG 77 HD2 ARG 77 0.515 -7.849 17.743 634 HD3 ARG 77 HD3 ARG 77 1.748 -6.600 17.923 635 HE ARG 77 HE ARG 77 0.604 -5.783 19.829 636 HH11 ARG 77 HH11 ARG 77 -0.822 -8.654 18.553 637 HH12 ARG 77 HH12 ARG 77 -1.646 -9.024 20.028 638 HH21 ARG 77 HH21 ARG 77 -0.450 -6.266 21.702 639 HH22 ARG 77 HH22 ARG 77 -1.423 -7.689 21.804 640 H LEU 78 H LEU 78 -1.800 -4.929 14.640 641 HA LEU 78 HA LEU 78 -4.521 -4.831 15.708 642 HB2 LEU 78 HB2 LEU 78 -3.430 -6.009 13.144 643 HB3 LEU 78 HB3 LEU 78 -5.129 -5.966 13.586 644 HG LEU 78 HG LEU 78 -3.375 -3.550 13.080 645 HD11 LEU 78 HD11 LEU 78 -5.601 -4.753 11.431 646 HD12 LEU 78 HD12 LEU 78 -3.883 -4.754 11.030 647 HD13 LEU 78 HD13 LEU 78 -4.773 -3.234 11.090 648 HD21 LEU 78 HD21 LEU 78 -5.485 -2.274 13.234 649 HD22 LEU 78 HD22 LEU 78 -5.056 -3.050 14.758 650 HD23 LEU 78 HD23 LEU 78 -6.321 -3.743 13.741 651 H SER 79 H SER 79 -5.150 -6.360 17.113 652 HA SER 79 HA SER 79 -3.666 -8.829 17.418 653 HB2 SER 79 HB2 SER 79 -5.146 -9.243 19.341 654 HB3 SER 79 HB3 SER 79 -4.481 -7.610 19.403 655 HG SER 79 HG SER 79 -7.083 -8.444 19.150 656 H ASN 80 H ASN 80 -7.125 -8.118 16.910 657 HA ASN 80 HA ASN 80 -7.639 -10.841 16.040 658 HB2 ASN 80 HB2 ASN 80 -9.480 -8.445 16.281 659 HB3 ASN 80 HB3 ASN 80 -9.999 -10.089 15.924 660 HD21 ASN 80 HD21 ASN 80 -11.297 -10.075 17.783 661 HD22 ASN 80 HD22 ASN 80 -10.614 -10.258 19.358 662 H LEU 81 H LEU 81 -7.428 -11.468 13.976 663 HA LEU 81 HA LEU 81 -7.558 -9.430 11.850 664 HB2 LEU 81 HB2 LEU 81 -6.437 -12.235 11.769 665 HB3 LEU 81 HB3 LEU 81 -6.433 -11.102 10.431 666 HG LEU 81 HG LEU 81 -4.878 -10.889 13.014 667 HD11 LEU 81 HD11 LEU 81 -2.934 -10.950 11.536 668 HD12 LEU 81 HD12 LEU 81 -3.994 -11.095 10.132 669 HD13 LEU 81 HD13 LEU 81 -3.934 -12.391 11.331 670 HD21 LEU 81 HD21 LEU 81 -5.128 -8.844 10.797 671 HD22 LEU 81 HD22 LEU 81 -3.963 -8.779 12.120 672 HD23 LEU 81 HD23 LEU 81 -5.689 -8.667 12.460 673 H GLU 82 H GLU 82 -8.917 -9.589 10.131 674 HA GLU 82 HA GLU 82 -11.219 -11.360 10.382 675 HB2 GLU 82 HB2 GLU 82 -12.135 -9.968 8.517 676 HB3 GLU 82 HB3 GLU 82 -11.685 -9.030 9.935 677 HG2 GLU 82 HG2 GLU 82 -9.708 -8.222 8.887 678 HG3 GLU 82 HG3 GLU 82 -9.871 -9.361 7.554 679 H HIS 83 H HIS 83 -8.336 -11.944 9.231 680 HA HIS 83 HA HIS 83 -8.798 -12.625 6.481 681 HB2 HIS 83 HB2 HIS 83 -6.496 -13.242 8.346 682 HB3 HIS 83 HB3 HIS 83 -6.507 -13.617 6.628 683 HD1 HIS 83 HD1 HIS 83 -5.359 -11.920 5.256 684 HD2 HIS 83 HD2 HIS 83 -7.002 -10.260 8.690 685 HE1 HIS 83 HE1 HIS 83 -4.642 -9.519 5.255 686 HE2 HIS 83 HE2 HIS 83 -5.906 -8.487 7.165 687 H HIS 84 H HIS 84 -10.579 -14.088 6.591 688 HA HIS 84 HA HIS 84 -10.209 -16.653 7.921 689 HB2 HIS 84 HB2 HIS 84 -12.441 -15.741 6.081 690 HB3 HIS 84 HB3 HIS 84 -12.454 -17.178 7.097 691 HD1 HIS 84 HD1 HIS 84 -13.129 -13.560 7.132 692 HD2 HIS 84 HD2 HIS 84 -12.688 -16.616 9.913 693 HE1 HIS 84 HE1 HIS 84 -14.072 -12.657 9.276 694 HE2 HIS 84 HE2 HIS 84 -13.628 -14.454 10.982 695 H HIS 85 H HIS 85 -8.972 -18.192 6.974 696 HA HIS 85 HA HIS 85 -9.141 -18.501 4.040 697 HB2 HIS 85 HB2 HIS 85 -6.988 -17.380 4.944 698 HB3 HIS 85 HB3 HIS 85 -6.568 -18.983 5.541 699 HD1 HIS 85 HD1 HIS 85 -7.375 -17.221 2.292 700 HD2 HIS 85 HD2 HIS 85 -5.435 -20.634 3.647 701 HE1 HIS 85 HE1 HIS 85 -6.262 -18.201 0.274 702 HE2 HIS 85 HE2 HIS 85 -4.976 -20.175 1.137 703 H HIS 86 H HIS 86 -10.498 -19.898 6.214 704 HA HIS 86 HA HIS 86 -9.347 -22.511 6.493 705 HB2 HIS 86 HB2 HIS 86 -10.829 -21.514 8.205 706 HB3 HIS 86 HB3 HIS 86 -12.164 -21.537 7.060 707 HD1 HIS 86 HD1 HIS 86 -13.606 -23.563 7.133 708 HD2 HIS 86 HD2 HIS 86 -9.878 -24.240 8.843 709 HE1 HIS 86 HE1 HIS 86 -13.720 -25.868 8.112 710 HE2 HIS 86 HE2 HIS 86 -11.533 -26.171 9.307 711 H HIS 87 H HIS 87 -9.195 -23.819 4.758 712 HA HIS 87 HA HIS 87 -10.945 -23.623 2.498 713 HB2 HIS 87 HB2 HIS 87 -8.589 -24.207 2.217 714 HB3 HIS 87 HB3 HIS 87 -8.816 -25.673 3.165 715 HD1 HIS 87 HD1 HIS 87 -10.280 -24.169 -0.020 716 HD2 HIS 87 HD2 HIS 87 -9.207 -27.845 1.588 717 HE1 HIS 87 HE1 HIS 87 -10.674 -25.838 -1.844 718 HE2 HIS 87 HE2 HIS 87 -9.861 -28.025 -0.907 719 H HIS 88 H HIS 88 -12.919 -23.957 3.764 720 HA HIS 88 HA HIS 88 -14.189 -26.324 3.108 721 HB2 HIS 88 HB2 HIS 88 -12.812 -27.390 4.873 722 HB3 HIS 88 HB3 HIS 88 -13.468 -26.267 6.057 723 HD1 HIS 88 HD1 HIS 88 -15.711 -26.851 7.089 724 HD2 HIS 88 HD2 HIS 88 -14.712 -29.314 3.894 725 HE1 HIS 88 HE1 HIS 88 -17.410 -28.694 7.106 726 HE2 HIS 88 HE2 HIS 88 -16.678 -30.262 5.287 727 H1 MET 1 H1 MET 1 -13.113 21.522 -10.657 728 H2 MET 1 H2 MET 1 -11.981 22.548 -11.380 729 H3 MET 1 H3 MET 1 -12.050 22.415 -9.697 730 HA MET 1 HA MET 1 -10.169 21.206 -10.618 731 HB2 MET 1 HB2 MET 1 -10.612 19.055 -9.470 732 HB3 MET 1 HB3 MET 1 -11.103 20.445 -8.514 733 HG2 MET 1 HG2 MET 1 -13.428 20.068 -9.105 734 HG3 MET 1 HG3 MET 1 -12.964 18.715 -10.138 735 HE1 MET 1 HE1 MET 1 -12.472 18.709 -5.543 736 HE2 MET 1 HE2 MET 1 -13.124 20.073 -6.454 737 HE3 MET 1 HE3 MET 1 -11.424 19.632 -6.620 738 H THR 2 H THR 2 -9.391 20.243 -12.392 739 HA THR 2 HA THR 2 -11.144 18.972 -14.318 740 HB THR 2 HB THR 2 -9.270 20.261 -15.178 741 HG1 THR 2 HG1 THR 2 -8.382 17.691 -15.808 742 HG21 THR 2 HG21 THR 2 -7.479 18.267 -13.766 743 HG22 THR 2 HG22 THR 2 -7.688 19.964 -13.326 744 HG23 THR 2 HG23 THR 2 -6.941 19.536 -14.866 745 H ASP 3 H ASP 3 -9.012 17.986 -11.763 746 HA ASP 3 HA ASP 3 -8.517 15.328 -12.571 747 HB2 ASP 3 HB2 ASP 3 -8.507 16.456 -9.759 748 HB3 ASP 3 HB3 ASP 3 -7.678 15.002 -10.315 749 H PHE 4 H PHE 4 -9.590 13.448 -12.248 750 HA PHE 4 HA PHE 4 -12.010 13.461 -10.568 751 HB2 PHE 4 HB2 PHE 4 -13.049 11.867 -12.117 752 HB3 PHE 4 HB3 PHE 4 -12.639 13.359 -12.953 753 HD1 PHE 4 HD1 PHE 4 -11.764 9.805 -12.530 754 HD2 PHE 4 HD2 PHE 4 -11.020 13.379 -14.734 755 HE1 PHE 4 HE1 PHE 4 -10.527 8.507 -14.213 756 HE2 PHE 4 HE2 PHE 4 -9.784 12.079 -16.419 757 HZ PHE 4 HZ PHE 4 -9.522 9.643 -16.151 758 H LEU 5 H LEU 5 -12.489 11.415 -9.538 759 HA LEU 5 HA LEU 5 -10.112 10.117 -8.597 760 HB2 LEU 5 HB2 LEU 5 -11.966 10.611 -7.105 761 HB3 LEU 5 HB3 LEU 5 -13.026 9.591 -8.054 762 HG LEU 5 HG LEU 5 -11.724 7.604 -7.396 763 HD11 LEU 5 HD11 LEU 5 -10.004 7.782 -5.651 764 HD12 LEU 5 HD12 LEU 5 -10.112 9.542 -5.726 765 HD13 LEU 5 HD13 LEU 5 -9.536 8.632 -7.124 766 HD21 LEU 5 HD21 LEU 5 -12.581 9.288 -5.039 767 HD22 LEU 5 HD22 LEU 5 -12.396 7.531 -5.054 768 HD23 LEU 5 HD23 LEU 5 -13.643 8.295 -6.038 769 H ALA 6 H ALA 6 -9.117 8.761 -9.946 770 HA ALA 6 HA ALA 6 -10.652 6.907 -11.616 771 HB1 ALA 6 HB1 ALA 6 -8.922 8.272 -12.685 772 HB2 ALA 6 HB2 ALA 6 -8.562 6.552 -12.810 773 HB3 ALA 6 HB3 ALA 6 -7.702 7.549 -11.635 774 H GLY 7 H GLY 7 -10.194 4.657 -11.668 775 HA2 GLY 7 HA2 GLY 7 -8.783 3.590 -9.294 776 HA3 GLY 7 HA3 GLY 7 -10.347 2.967 -9.791 777 H ILE 8 H ILE 8 -7.312 2.055 -9.687 778 HA ILE 8 HA ILE 8 -7.291 0.757 -12.348 779 HB ILE 8 HB ILE 8 -4.903 1.303 -10.560 780 HG12 ILE 8 HG12 ILE 8 -5.799 2.721 -13.091 781 HG13 ILE 8 HG13 ILE 8 -5.828 3.396 -11.466 782 HG21 ILE 8 HG21 ILE 8 -4.587 -0.666 -11.958 783 HG22 ILE 8 HG22 ILE 8 -3.570 0.655 -12.535 784 HG23 ILE 8 HG23 ILE 8 -5.059 0.247 -13.391 785 HD11 ILE 8 HD11 ILE 8 -3.373 2.619 -13.026 786 HD12 ILE 8 HD12 ILE 8 -3.379 3.254 -11.382 787 HD13 ILE 8 HD13 ILE 8 -3.948 4.256 -12.716 788 H ARG 9 H ARG 9 -6.753 -1.466 -12.481 789 HA ARG 9 HA ARG 9 -6.789 -2.942 -9.914 790 HB2 ARG 9 HB2 ARG 9 -8.779 -3.016 -11.770 791 HB3 ARG 9 HB3 ARG 9 -7.771 -4.332 -12.351 792 HG2 ARG 9 HG2 ARG 9 -8.832 -4.111 -9.538 793 HG3 ARG 9 HG3 ARG 9 -9.588 -5.041 -10.826 794 HD2 ARG 9 HD2 ARG 9 -6.793 -5.491 -9.808 795 HD3 ARG 9 HD3 ARG 9 -8.210 -6.395 -9.279 796 HE ARG 9 HE ARG 9 -6.842 -6.622 -11.819 797 HH11 ARG 9 HH11 ARG 9 -9.626 -7.435 -9.969 798 HH12 ARG 9 HH12 ARG 9 -10.060 -8.745 -11.004 799 HH21 ARG 9 HH21 ARG 9 -7.423 -8.311 -13.139 800 HH22 ARG 9 HH22 ARG 9 -8.826 -9.241 -12.758 801 H ILE 10 H ILE 10 -4.946 -4.005 -9.544 802 HA ILE 10 HA ILE 10 -3.222 -4.775 -11.835 803 HB ILE 10 HB ILE 10 -2.309 -4.074 -9.033 804 HG12 ILE 10 HG12 ILE 10 -2.128 -2.320 -11.500 805 HG13 ILE 10 HG13 ILE 10 -3.335 -2.118 -10.233 806 HG21 ILE 10 HG21 ILE 10 -0.785 -5.544 -10.242 807 HG22 ILE 10 HG22 ILE 10 -0.078 -3.941 -10.048 808 HG23 ILE 10 HG23 ILE 10 -0.758 -4.422 -11.603 809 HD11 ILE 10 HD11 ILE 10 -1.557 -1.704 -8.610 810 HD12 ILE 10 HD12 ILE 10 -1.511 -0.558 -9.950 811 HD13 ILE 10 HD13 ILE 10 -0.354 -1.888 -9.889 812 H VAL 11 H VAL 11 -3.108 -6.997 -12.052 813 HA VAL 11 HA VAL 11 -3.074 -8.574 -9.547 814 HB VAL 11 HB VAL 11 -4.167 -9.400 -12.243 815 HG11 VAL 11 HG11 VAL 11 -3.872 -11.036 -9.720 816 HG12 VAL 11 HG12 VAL 11 -3.013 -11.294 -11.239 817 HG13 VAL 11 HG13 VAL 11 -4.758 -11.533 -11.164 818 HG21 VAL 11 HG21 VAL 11 -5.494 -9.043 -9.551 819 HG22 VAL 11 HG22 VAL 11 -6.286 -9.612 -11.022 820 HG23 VAL 11 HG23 VAL 11 -5.659 -7.965 -10.938 821 H GLY 12 H GLY 12 -1.189 -9.396 -9.072 822 HA2 GLY 12 HA2 GLY 12 0.568 -10.410 -11.217 823 HA3 GLY 12 HA3 GLY 12 1.212 -9.284 -10.033 824 H GLU 13 H GLU 13 2.430 -11.697 -10.299 825 HA GLU 13 HA GLU 13 1.308 -13.703 -8.568 826 HB2 GLU 13 HB2 GLU 13 3.401 -14.927 -8.990 827 HB3 GLU 13 HB3 GLU 13 2.661 -14.351 -10.479 828 HG2 GLU 13 HG2 GLU 13 4.251 -12.515 -10.586 829 HG3 GLU 13 HG3 GLU 13 4.966 -13.017 -9.056 830 H ASP 14 H ASP 14 1.893 -14.311 -6.516 831 HA ASP 14 HA ASP 14 3.004 -12.391 -4.748 832 HB2 ASP 14 HB2 ASP 14 2.233 -15.289 -4.430 833 HB3 ASP 14 HB3 ASP 14 2.958 -14.384 -3.109 834 H LYS 15 H LYS 15 5.137 -12.034 -5.794 835 HA LYS 15 HA LYS 15 7.101 -14.043 -4.987 836 HB2 LYS 15 HB2 LYS 15 7.127 -11.804 -6.947 837 HB3 LYS 15 HB3 LYS 15 8.656 -12.321 -6.238 838 HG2 LYS 15 HG2 LYS 15 8.197 -14.616 -6.956 839 HG3 LYS 15 HG3 LYS 15 6.702 -14.067 -7.720 840 HD2 LYS 15 HD2 LYS 15 7.818 -12.956 -9.410 841 HD3 LYS 15 HD3 LYS 15 9.288 -12.752 -8.449 842 HE2 LYS 15 HE2 LYS 15 9.608 -14.397 -10.222 843 HE3 LYS 15 HE3 LYS 15 9.756 -15.114 -8.619 844 HZ1 LYS 15 HZ1 LYS 15 7.527 -15.992 -8.825 845 HZ2 LYS 15 HZ2 LYS 15 8.473 -16.517 -10.124 846 HZ3 LYS 15 HZ3 LYS 15 7.345 -15.280 -10.352 847 H ASN 16 H ASN 16 9.124 -13.322 -4.161 848 HA ASN 16 HA ASN 16 9.065 -12.557 -1.602 849 HB2 ASN 16 HB2 ASN 16 11.529 -12.025 -1.896 850 HB3 ASN 16 HB3 ASN 16 10.990 -13.585 -2.512 851 HD21 ASN 16 HD21 ASN 16 12.467 -13.894 -4.092 852 HD22 ASN 16 HD22 ASN 16 12.657 -12.866 -5.464 853 H GLY 17 H GLY 17 9.319 -10.248 -4.268 854 HA2 GLY 17 HA2 GLY 17 8.967 -8.080 -2.285 855 HA3 GLY 17 HA3 GLY 17 10.218 -7.953 -3.507 856 H MET 18 H MET 18 7.525 -9.506 -4.796 857 HA MET 18 HA MET 18 6.965 -7.420 -6.609 858 HB2 MET 18 HB2 MET 18 5.803 -10.082 -5.981 859 HB3 MET 18 HB3 MET 18 4.724 -8.958 -6.790 860 HG2 MET 18 HG2 MET 18 7.452 -9.738 -7.796 861 HG3 MET 18 HG3 MET 18 5.928 -10.442 -8.340 862 HE1 MET 18 HE1 MET 18 4.094 -7.750 -8.157 863 HE2 MET 18 HE2 MET 18 3.959 -8.951 -9.442 864 HE3 MET 18 HE3 MET 18 4.152 -7.245 -9.846 865 H THR 19 H THR 19 5.022 -8.548 -3.824 866 HA THR 19 HA THR 19 2.953 -6.668 -4.086 867 HB THR 19 HB THR 19 2.513 -7.117 -1.662 868 HG1 THR 19 HG1 THR 19 3.883 -8.676 -0.650 869 HG21 THR 19 HG21 THR 19 2.053 -9.523 -1.924 870 HG22 THR 19 HG22 THR 19 3.072 -9.555 -3.363 871 HG23 THR 19 HG23 THR 19 1.582 -8.610 -3.358 872 H ASN 20 H ASN 20 6.081 -6.448 -2.463 873 HA ASN 20 HA ASN 20 5.566 -3.965 -1.152 874 HB2 ASN 20 HB2 ASN 20 8.213 -5.265 -1.854 875 HB3 ASN 20 HB3 ASN 20 8.000 -3.916 -0.743 876 HD21 ASN 20 HD21 ASN 20 8.824 -4.981 1.010 877 HD22 ASN 20 HD22 ASN 20 8.020 -6.301 1.776 878 H GLN 21 H GLN 21 7.226 -4.887 -4.145 879 HA GLN 21 HA GLN 21 8.117 -2.268 -4.766 880 HB2 GLN 21 HB2 GLN 21 8.917 -3.142 -6.802 881 HB3 GLN 21 HB3 GLN 21 9.124 -4.418 -5.619 882 HG2 GLN 21 HG2 GLN 21 7.126 -5.533 -6.471 883 HG3 GLN 21 HG3 GLN 21 6.902 -4.238 -7.648 884 HE21 GLN 21 HE21 GLN 21 8.822 -6.991 -6.766 885 HE22 GLN 21 HE22 GLN 21 9.638 -7.144 -8.277 886 H ILE 22 H ILE 22 5.209 -4.070 -5.571 887 HA ILE 22 HA ILE 22 4.295 -2.467 -7.695 888 HB ILE 22 HB ILE 22 2.933 -4.333 -5.774 889 HG12 ILE 22 HG12 ILE 22 4.241 -5.278 -7.613 890 HG13 ILE 22 HG13 ILE 22 2.528 -5.619 -7.840 891 HG21 ILE 22 HG21 ILE 22 1.265 -2.614 -6.120 892 HG22 ILE 22 HG22 ILE 22 0.817 -4.065 -7.017 893 HG23 ILE 22 HG23 ILE 22 1.510 -2.682 -7.866 894 HD11 ILE 22 HD11 ILE 22 2.371 -3.829 -9.469 895 HD12 ILE 22 HD12 ILE 22 3.621 -4.987 -9.924 896 HD13 ILE 22 HD13 ILE 22 4.072 -3.434 -9.220 897 H THR 23 H THR 23 3.334 -2.353 -4.236 898 HA THR 23 HA THR 23 1.859 0.076 -4.610 899 HB THR 23 HB THR 23 2.863 -0.893 -1.926 900 HG1 THR 23 HG1 THR 23 0.871 -1.988 -3.604 901 HG21 THR 23 HG21 THR 23 0.358 0.566 -2.806 902 HG22 THR 23 HG22 THR 23 1.731 1.277 -1.958 903 HG23 THR 23 HG23 THR 23 0.727 0.074 -1.150 904 H GLY 24 H GLY 24 5.144 -0.735 -3.765 905 HA2 GLY 24 HA2 GLY 24 6.062 1.747 -2.819 906 HA3 GLY 24 HA3 GLY 24 7.046 0.538 -3.630 907 H VAL 25 H VAL 25 5.923 0.501 -6.168 908 HA VAL 25 HA VAL 25 6.955 2.868 -7.368 909 HB VAL 25 HB VAL 25 5.288 0.623 -8.541 910 HG11 VAL 25 HG11 VAL 25 6.714 2.876 -9.977 911 HG12 VAL 25 HG12 VAL 25 4.969 2.620 -9.902 912 HG13 VAL 25 HG13 VAL 25 5.994 1.464 -10.754 913 HG21 VAL 25 HG21 VAL 25 8.247 1.230 -8.679 914 HG22 VAL 25 HG22 VAL 25 7.436 -0.094 -9.521 915 HG23 VAL 25 HG23 VAL 25 7.489 -0.070 -7.759 916 H ILE 26 H ILE 26 3.689 1.766 -6.597 917 HA ILE 26 HA ILE 26 2.210 3.800 -7.830 918 HB ILE 26 HB ILE 26 1.655 2.234 -5.305 919 HG12 ILE 26 HG12 ILE 26 0.531 2.002 -8.112 920 HG13 ILE 26 HG13 ILE 26 1.751 0.943 -7.414 921 HG21 ILE 26 HG21 ILE 26 -0.218 4.082 -6.791 922 HG22 ILE 26 HG22 ILE 26 0.419 4.322 -5.163 923 HG23 ILE 26 HG23 ILE 26 -0.682 2.984 -5.489 924 HD11 ILE 26 HD11 ILE 26 0.124 0.202 -5.737 925 HD12 ILE 26 HD12 ILE 26 -0.420 -0.111 -7.384 926 HD13 ILE 26 HD13 ILE 26 -1.094 1.242 -6.476 927 H SER 27 H SER 27 3.675 3.717 -4.579 928 HA SER 27 HA SER 27 2.712 6.207 -3.688 929 HB2 SER 27 HB2 SER 27 4.350 6.097 -1.947 930 HB3 SER 27 HB3 SER 27 3.852 4.438 -2.268 931 HG SER 27 HG SER 27 5.768 4.014 -3.176 932 H LYS 28 H LYS 28 5.172 5.446 -5.970 933 HA LYS 28 HA LYS 28 6.599 7.952 -5.748 934 HB2 LYS 28 HB2 LYS 28 6.809 5.765 -7.835 935 HB3 LYS 28 HB3 LYS 28 7.926 7.108 -7.639 936 HG2 LYS 28 HG2 LYS 28 8.512 6.259 -5.391 937 HG3 LYS 28 HG3 LYS 28 7.442 4.880 -5.660 938 HD2 LYS 28 HD2 LYS 28 8.796 4.134 -7.519 939 HD3 LYS 28 HD3 LYS 28 9.812 5.572 -7.400 940 HE2 LYS 28 HE2 LYS 28 10.920 3.647 -6.397 941 HE3 LYS 28 HE3 LYS 28 10.559 4.864 -5.177 942 HZ1 LYS 28 HZ1 LYS 28 8.597 3.549 -4.548 943 HZ2 LYS 28 HZ2 LYS 28 10.033 2.684 -4.346 944 HZ3 LYS 28 HZ3 LYS 28 9.036 2.362 -5.671 945 H PHE 29 H PHE 29 3.619 7.353 -6.991 946 HA PHE 29 HA PHE 29 3.798 8.720 -9.511 947 HB2 PHE 29 HB2 PHE 29 1.430 8.013 -7.766 948 HB3 PHE 29 HB3 PHE 29 1.270 8.839 -9.310 949 HD1 PHE 29 HD1 PHE 29 3.561 7.233 -10.675 950 HD2 PHE 29 HD2 PHE 29 0.146 6.097 -8.396 951 HE1 PHE 29 HE1 PHE 29 3.496 5.071 -11.847 952 HE2 PHE 29 HE2 PHE 29 0.084 3.934 -9.561 953 HZ PHE 29 HZ PHE 29 1.759 3.419 -11.292 954 H ASP 30 H ASP 30 2.489 10.712 -9.969 955 HA ASP 30 HA ASP 30 3.336 12.908 -8.355 956 HB2 ASP 30 HB2 ASP 30 1.165 13.064 -10.443 957 HB3 ASP 30 HB3 ASP 30 2.359 14.284 -10.009 958 H THR 31 H THR 31 0.553 10.913 -8.362 959 HA THR 31 HA THR 31 -1.191 12.898 -7.122 960 HB THR 31 HB THR 31 -2.168 11.566 -8.884 961 HG1 THR 31 HG1 THR 31 -3.847 11.846 -7.628 962 HG21 THR 31 HG21 THR 31 -0.729 9.582 -8.668 963 HG22 THR 31 HG22 THR 31 -2.436 9.148 -8.706 964 HG23 THR 31 HG23 THR 31 -1.562 9.145 -7.175 965 H ASN 32 H ASN 32 -2.399 12.422 -5.194 966 HA ASN 32 HA ASN 32 -0.749 11.039 -3.205 967 HB2 ASN 32 HB2 ASN 32 -2.992 13.054 -2.936 968 HB3 ASN 32 HB3 ASN 32 -2.256 12.238 -1.559 969 HD21 ASN 32 HD21 ASN 32 0.408 12.218 -2.538 970 HD22 ASN 32 HD22 ASN 32 0.976 13.847 -2.494 971 H ILE 33 H ILE 33 -1.243 9.053 -2.617 972 HA ILE 33 HA ILE 33 -3.385 7.563 -3.542 973 HB ILE 33 HB ILE 33 -1.799 7.091 -1.002 974 HG12 ILE 33 HG12 ILE 33 -1.341 6.092 -3.833 975 HG13 ILE 33 HG13 ILE 33 -0.387 7.328 -3.016 976 HG21 ILE 33 HG21 ILE 33 -2.416 4.735 -1.267 977 HG22 ILE 33 HG22 ILE 33 -3.411 5.146 -2.663 978 HG23 ILE 33 HG23 ILE 33 -3.845 5.749 -1.063 979 HD11 ILE 33 HD11 ILE 33 0.762 5.198 -3.025 980 HD12 ILE 33 HD12 ILE 33 -0.603 4.433 -2.211 981 HD13 ILE 33 HD13 ILE 33 0.344 5.666 -1.377 982 H ARG 34 H ARG 34 -5.487 8.087 -3.219 983 HA ARG 34 HA ARG 34 -6.432 9.085 -0.661 984 HB2 ARG 34 HB2 ARG 34 -7.996 8.307 -3.138 985 HB3 ARG 34 HB3 ARG 34 -8.648 9.149 -1.740 986 HG2 ARG 34 HG2 ARG 34 -6.555 10.208 -3.644 987 HG3 ARG 34 HG3 ARG 34 -8.250 10.687 -3.581 988 HD2 ARG 34 HD2 ARG 34 -7.057 12.393 -2.458 989 HD3 ARG 34 HD3 ARG 34 -7.814 11.429 -1.189 990 HE ARG 34 HE ARG 34 -5.150 10.574 -1.789 991 HH11 ARG 34 HH11 ARG 34 -6.957 12.914 -0.006 992 HH12 ARG 34 HH12 ARG 34 -5.698 13.137 1.161 993 HH21 ARG 34 HH21 ARG 34 -3.577 10.869 -0.256 994 HH22 ARG 34 HH22 ARG 34 -3.834 11.991 1.034 995 H THR 35 H THR 35 -6.744 6.137 -2.599 996 HA THR 35 HA THR 35 -6.991 4.588 -0.149 997 HB THR 35 HB THR 35 -9.082 4.325 -2.336 998 HG1 THR 35 HG1 THR 35 -9.013 5.716 0.051 999 HG21 THR 35 HG21 THR 35 -8.512 2.154 -1.370 1000 HG22 THR 35 HG22 THR 35 -10.113 2.659 -0.829 1001 HG23 THR 35 HG23 THR 35 -8.730 2.801 0.256 1002 H ILE 36 H ILE 36 -5.842 2.743 -0.305 1003 HA ILE 36 HA ILE 36 -5.364 1.560 -2.961 1004 HB ILE 36 HB ILE 36 -3.341 2.858 -2.331 1005 HG12 ILE 36 HG12 ILE 36 -1.688 0.980 -2.571 1006 HG13 ILE 36 HG13 ILE 36 -3.006 -0.158 -2.324 1007 HG21 ILE 36 HG21 ILE 36 -3.179 0.970 0.021 1008 HG22 ILE 36 HG22 ILE 36 -3.523 2.699 0.095 1009 HG23 ILE 36 HG23 ILE 36 -1.943 2.140 -0.452 1010 HD11 ILE 36 HD11 ILE 36 -4.080 0.619 -4.352 1011 HD12 ILE 36 HD12 ILE 36 -2.425 0.100 -4.677 1012 HD13 ILE 36 HD13 ILE 36 -2.809 1.819 -4.584 1013 H VAL 37 H VAL 37 -5.557 -0.606 -3.021 1014 HA VAL 37 HA VAL 37 -5.658 -2.113 -0.478 1015 HB VAL 37 HB VAL 37 -7.462 -2.526 -2.883 1016 HG11 VAL 37 HG11 VAL 37 -6.901 -4.647 -1.813 1017 HG12 VAL 37 HG12 VAL 37 -8.589 -4.230 -1.519 1018 HG13 VAL 37 HG13 VAL 37 -7.388 -4.000 -0.246 1019 HG21 VAL 37 HG21 VAL 37 -8.118 -0.562 -1.594 1020 HG22 VAL 37 HG22 VAL 37 -8.118 -1.517 -0.109 1021 HG23 VAL 37 HG23 VAL 37 -9.293 -1.861 -1.381 1022 H LEU 38 H LEU 38 -4.664 -4.109 -0.496 1023 HA LEU 38 HA LEU 38 -4.007 -5.348 -3.062 1024 HB2 LEU 38 HB2 LEU 38 -2.008 -4.046 -2.330 1025 HB3 LEU 38 HB3 LEU 38 -1.955 -4.996 -0.861 1026 HG LEU 38 HG LEU 38 -1.753 -6.334 -3.556 1027 HD11 LEU 38 HD11 LEU 38 -0.048 -4.607 -3.569 1028 HD12 LEU 38 HD12 LEU 38 0.694 -6.195 -3.372 1029 HD13 LEU 38 HD13 LEU 38 0.520 -5.123 -1.981 1030 HD21 LEU 38 HD21 LEU 38 -0.717 -7.068 -0.812 1031 HD22 LEU 38 HD22 LEU 38 -0.506 -8.019 -2.285 1032 HD23 LEU 38 HD23 LEU 38 -2.119 -7.775 -1.617 1033 H ASN 39 H ASN 39 -5.084 -7.205 -2.933 1034 HA ASN 39 HA ASN 39 -4.885 -8.768 -0.440 1035 HB2 ASN 39 HB2 ASN 39 -7.211 -9.698 -1.194 1036 HB3 ASN 39 HB3 ASN 39 -7.111 -8.159 -0.352 1037 HD21 ASN 39 HD21 ASN 39 -9.141 -9.217 -2.182 1038 HD22 ASN 39 HD22 ASN 39 -9.290 -8.027 -3.426 1039 H ALA 40 H ALA 40 -3.896 -10.606 -0.657 1040 HA ALA 40 HA ALA 40 -3.587 -11.838 -3.321 1041 HB1 ALA 40 HB1 ALA 40 -1.537 -11.143 -2.151 1042 HB2 ALA 40 HB2 ALA 40 -1.591 -12.887 -2.404 1043 HB3 ALA 40 HB3 ALA 40 -1.943 -12.212 -0.811 1044 H LYS 41 H LYS 41 -4.407 -13.774 -3.760 1045 HA LYS 41 HA LYS 41 -4.935 -15.698 -1.621 1046 HB2 LYS 41 HB2 LYS 41 -7.194 -16.204 -2.365 1047 HB3 LYS 41 HB3 LYS 41 -7.078 -14.515 -1.904 1048 HG2 LYS 41 HG2 LYS 41 -6.926 -15.466 -4.759 1049 HG3 LYS 41 HG3 LYS 41 -8.430 -14.996 -3.966 1050 HD2 LYS 41 HD2 LYS 41 -7.461 -12.752 -3.538 1051 HD3 LYS 41 HD3 LYS 41 -6.010 -13.235 -4.418 1052 HE2 LYS 41 HE2 LYS 41 -7.439 -11.942 -5.876 1053 HE3 LYS 41 HE3 LYS 41 -7.397 -13.615 -6.433 1054 HZ1 LYS 41 HZ1 LYS 41 -9.640 -12.698 -6.471 1055 HZ2 LYS 41 HZ2 LYS 41 -9.572 -12.403 -4.809 1056 HZ3 LYS 41 HZ3 LYS 41 -9.534 -13.990 -5.387 1057 H ASP 42 H ASP 42 -4.842 -17.842 -2.244 1058 HA ASP 42 HA ASP 42 -4.425 -19.698 -3.478 1059 HB2 ASP 42 HB2 ASP 42 -4.770 -17.989 -5.947 1060 HB3 ASP 42 HB3 ASP 42 -4.760 -19.747 -5.886 1061 H GLY 43 H GLY 43 -2.642 -16.787 -4.202 1062 HA2 GLY 43 HA2 GLY 43 -0.106 -17.318 -4.083 1063 HA3 GLY 43 HA3 GLY 43 -0.467 -18.292 -5.501 1064 H ILE 44 H ILE 44 -2.527 -15.751 -5.621 1065 HA ILE 44 HA ILE 44 -0.671 -13.939 -7.044 1066 HB ILE 44 HB ILE 44 -3.581 -14.242 -7.795 1067 HG12 ILE 44 HG12 ILE 44 -1.243 -15.773 -8.961 1068 HG13 ILE 44 HG13 ILE 44 -2.592 -16.445 -8.044 1069 HG21 ILE 44 HG21 ILE 44 -1.181 -13.239 -9.331 1070 HG22 ILE 44 HG22 ILE 44 -2.398 -12.233 -8.548 1071 HG23 ILE 44 HG23 ILE 44 -2.849 -13.262 -9.905 1072 HD11 ILE 44 HD11 ILE 44 -2.816 -16.803 -10.459 1073 HD12 ILE 44 HD12 ILE 44 -2.821 -15.054 -10.704 1074 HD13 ILE 44 HD13 ILE 44 -4.130 -15.824 -9.804 1075 H PHE 45 H PHE 45 -1.298 -11.670 -6.969 1076 HA PHE 45 HA PHE 45 -3.263 -11.030 -4.855 1077 HB2 PHE 45 HB2 PHE 45 -1.872 -9.281 -3.987 1078 HB3 PHE 45 HB3 PHE 45 -0.904 -10.747 -4.060 1079 HD1 PHE 45 HD2 PHE 45 -1.423 -7.404 -5.472 1080 HD2 PHE 45 HD1 PHE 45 0.965 -10.930 -5.586 1081 HE1 PHE 45 HE2 PHE 45 0.290 -6.196 -6.752 1082 HE2 PHE 45 HE1 PHE 45 2.687 -9.719 -6.867 1083 HZ PHE 45 HZ PHE 45 2.343 -7.349 -7.450 1084 H THR 46 H THR 46 -4.560 -9.263 -5.144 1085 HA THR 46 HA THR 46 -4.268 -7.801 -7.698 1086 HB THR 46 HB THR 46 -6.310 -8.910 -7.933 1087 HG1 THR 46 HG1 THR 46 -7.154 -6.460 -6.748 1088 HG21 THR 46 HG21 THR 46 -7.054 -8.114 -5.118 1089 HG22 THR 46 HG22 THR 46 -6.538 -9.721 -5.627 1090 HG23 THR 46 HG23 THR 46 -8.048 -9.046 -6.237 1091 H CYS 47 H CYS 47 -3.327 -5.916 -7.273 1092 HA CYS 47 HA CYS 47 -3.988 -4.396 -4.880 1093 HB2 CYS 47 HB2 CYS 47 -1.646 -4.503 -5.669 1094 HB3 CYS 47 HB3 CYS 47 -2.117 -3.693 -7.160 1095 HG CYS 47 HG CYS 47 -2.874 -2.094 -4.286 1096 H ASN 48 H ASN 48 -5.564 -2.920 -4.807 1097 HA ASN 48 HA ASN 48 -6.688 -1.871 -7.324 1098 HB2 ASN 48 HB2 ASN 48 -7.887 -2.020 -4.544 1099 HB3 ASN 48 HB3 ASN 48 -8.688 -1.310 -5.942 1100 HD21 ASN 48 HD21 ASN 48 -9.562 -2.641 -7.477 1101 HD22 ASN 48 HD22 ASN 48 -9.688 -4.351 -7.284 1102 H LEU 49 H LEU 49 -5.946 0.093 -7.864 1103 HA LEU 49 HA LEU 49 -5.027 1.919 -5.754 1104 HB2 LEU 49 HB2 LEU 49 -3.405 1.457 -7.478 1105 HB3 LEU 49 HB3 LEU 49 -4.547 1.901 -8.735 1106 HG LEU 49 HG LEU 49 -4.484 4.236 -8.015 1107 HD11 LEU 49 HD11 LEU 49 -2.535 3.284 -5.913 1108 HD12 LEU 49 HD12 LEU 49 -4.150 3.935 -5.636 1109 HD13 LEU 49 HD13 LEU 49 -2.884 4.972 -6.292 1110 HD21 LEU 49 HD21 LEU 49 -2.194 4.760 -8.672 1111 HD22 LEU 49 HD22 LEU 49 -2.841 3.456 -9.666 1112 HD23 LEU 49 HD23 LEU 49 -1.708 3.093 -8.364 1113 H MET 50 H MET 50 -6.192 3.637 -5.166 1114 HA MET 50 HA MET 50 -8.130 4.774 -7.087 1115 HB2 MET 50 HB2 MET 50 -8.406 4.572 -4.082 1116 HB3 MET 50 HB3 MET 50 -9.534 5.399 -5.146 1117 HG2 MET 50 HG2 MET 50 -8.923 2.452 -5.101 1118 HG3 MET 50 HG3 MET 50 -10.404 3.240 -4.566 1119 HE1 MET 50 HE1 MET 50 -10.275 5.490 -7.115 1120 HE2 MET 50 HE2 MET 50 -11.772 4.894 -6.396 1121 HE3 MET 50 HE3 MET 50 -11.515 4.763 -8.135 1122 H ILE 51 H ILE 51 -7.288 6.615 -7.807 1123 HA ILE 51 HA ILE 51 -6.403 8.660 -5.909 1124 HB ILE 51 HB ILE 51 -4.366 9.151 -7.360 1125 HG12 ILE 51 HG12 ILE 51 -3.462 6.897 -8.391 1126 HG13 ILE 51 HG13 ILE 51 -5.168 6.475 -8.483 1127 HG21 ILE 51 HG21 ILE 51 -4.175 8.214 -5.124 1128 HG22 ILE 51 HG22 ILE 51 -2.948 7.536 -6.195 1129 HG23 ILE 51 HG23 ILE 51 -4.371 6.583 -5.773 1130 HD11 ILE 51 HD11 ILE 51 -3.859 8.864 -9.774 1131 HD12 ILE 51 HD12 ILE 51 -5.570 8.450 -9.871 1132 HD13 ILE 51 HD13 ILE 51 -4.363 7.381 -10.584 1133 H PHE 52 H PHE 52 -5.825 10.760 -7.196 1134 HA PHE 52 HA PHE 52 -8.010 11.173 -9.113 1135 HB2 PHE 52 HB2 PHE 52 -6.434 13.037 -7.356 1136 HB3 PHE 52 HB3 PHE 52 -7.346 13.659 -8.728 1137 HD1 PHE 52 HD2 PHE 52 -9.780 13.483 -8.789 1138 HD2 PHE 52 HD1 PHE 52 -7.558 12.243 -5.369 1139 HE1 PHE 52 HE2 PHE 52 -11.841 13.510 -7.441 1140 HE2 PHE 52 HE1 PHE 52 -9.617 12.265 -4.021 1141 HZ PHE 52 HZ PHE 52 -11.758 12.903 -5.053 1142 H VAL 53 H VAL 53 -7.723 11.742 -11.195 1143 HA VAL 53 HA VAL 53 -4.994 12.403 -12.136 1144 HB VAL 53 HB VAL 53 -5.281 11.134 -14.156 1145 HG11 VAL 53 HG11 VAL 53 -6.114 9.450 -11.799 1146 HG12 VAL 53 HG12 VAL 53 -4.461 9.828 -12.288 1147 HG13 VAL 53 HG13 VAL 53 -5.484 8.830 -13.325 1148 HG21 VAL 53 HG21 VAL 53 -7.636 11.503 -14.557 1149 HG22 VAL 53 HG22 VAL 53 -8.059 10.478 -13.186 1150 HG23 VAL 53 HG23 VAL 53 -7.281 9.778 -14.605 1151 H LYS 54 H LYS 54 -4.851 14.036 -13.678 1152 HA LYS 54 HA LYS 54 -7.003 15.877 -13.788 1153 HB2 LYS 54 HB2 LYS 54 -5.592 17.219 -15.231 1154 HB3 LYS 54 HB3 LYS 54 -4.674 16.598 -13.867 1155 HG2 LYS 54 HG2 LYS 54 -3.626 14.932 -15.264 1156 HG3 LYS 54 HG3 LYS 54 -4.630 15.400 -16.640 1157 HD2 LYS 54 HD2 LYS 54 -2.618 17.170 -15.242 1158 HD3 LYS 54 HD3 LYS 54 -2.369 16.357 -16.789 1159 HE2 LYS 54 HE2 LYS 54 -4.147 17.647 -17.804 1160 HE3 LYS 54 HE3 LYS 54 -4.555 18.375 -16.251 1161 HZ1 LYS 54 HZ1 LYS 54 -3.258 19.892 -17.566 1162 HZ2 LYS 54 HZ2 LYS 54 -2.023 18.756 -17.749 1163 HZ3 LYS 54 HZ3 LYS 54 -2.352 19.403 -16.227 1164 H ASN 55 H ASN 55 -6.087 13.271 -15.898 1165 HA ASN 55 HA ASN 55 -8.534 13.459 -17.342 1166 HB2 ASN 55 HB2 ASN 55 -7.426 13.667 -19.640 1167 HB3 ASN 55 HB3 ASN 55 -7.591 15.135 -18.689 1168 HD21 ASN 55 HD21 ASN 55 -5.121 12.779 -17.921 1169 HD22 ASN 55 HD22 ASN 55 -3.792 13.730 -18.478 1170 H THR 56 H THR 56 -8.728 11.766 -19.065 1171 HA THR 56 HA THR 56 -8.196 9.265 -17.978 1172 HB THR 56 HB THR 56 -8.898 8.295 -20.141 1173 HG1 THR 56 HG1 THR 56 -8.959 9.480 -21.937 1174 HG21 THR 56 HG21 THR 56 -10.544 10.672 -19.245 1175 HG22 THR 56 HG22 THR 56 -10.619 9.040 -18.581 1176 HG23 THR 56 HG23 THR 56 -11.133 9.340 -20.240 1177 H ASP 57 H ASP 57 -6.263 11.045 -20.353 1178 HA ASP 57 HA ASP 57 -4.656 8.863 -21.184 1179 HB2 ASP 57 HB2 ASP 57 -4.787 10.966 -22.466 1180 HB3 ASP 57 HB3 ASP 57 -3.956 11.813 -21.163 1181 H LYS 58 H LYS 58 -4.331 11.214 -18.582 1182 HA LYS 58 HA LYS 58 -1.850 10.466 -17.559 1183 HB2 LYS 58 HB2 LYS 58 -2.892 12.417 -16.692 1184 HB3 LYS 58 HB3 LYS 58 -4.355 11.541 -16.267 1185 HG2 LYS 58 HG2 LYS 58 -3.067 12.108 -14.287 1186 HG3 LYS 58 HG3 LYS 58 -3.166 10.358 -14.520 1187 HD2 LYS 58 HD2 LYS 58 -0.906 10.338 -15.453 1188 HD3 LYS 58 HD3 LYS 58 -0.814 12.093 -15.317 1189 HE2 LYS 58 HE2 LYS 58 -1.032 11.878 -12.861 1190 HE3 LYS 58 HE3 LYS 58 -1.030 10.122 -13.039 1191 HZ1 LYS 58 HZ1 LYS 58 1.169 11.006 -12.474 1192 HZ2 LYS 58 HZ2 LYS 58 1.172 11.925 -13.889 1193 HZ3 LYS 58 HZ3 LYS 58 1.179 10.238 -13.980 1194 H LEU 59 H LEU 59 -5.082 9.138 -16.916 1195 HA LEU 59 HA LEU 59 -4.342 7.195 -15.019 1196 HB2 LEU 59 HB2 LEU 59 -6.655 7.899 -15.391 1197 HB3 LEU 59 HB3 LEU 59 -6.627 7.205 -17.001 1198 HG LEU 59 HG LEU 59 -6.401 4.953 -16.038 1199 HD11 LEU 59 HD11 LEU 59 -6.635 6.350 -13.371 1200 HD12 LEU 59 HD12 LEU 59 -5.209 5.519 -13.990 1201 HD13 LEU 59 HD13 LEU 59 -6.673 4.606 -13.630 1202 HD21 LEU 59 HD21 LEU 59 -8.708 6.540 -14.906 1203 HD22 LEU 59 HD22 LEU 59 -8.657 4.788 -15.102 1204 HD23 LEU 59 HD23 LEU 59 -8.621 5.834 -16.520 1205 H THR 60 H THR 60 -4.727 6.925 -18.566 1206 HA THR 60 HA THR 60 -3.976 4.195 -18.734 1207 HB THR 60 HB THR 60 -3.627 4.587 -21.143 1208 HG1 THR 60 HG1 THR 60 -4.186 6.863 -21.815 1209 HG21 THR 60 HG21 THR 60 -6.087 5.954 -20.032 1210 HG22 THR 60 HG22 THR 60 -5.912 4.231 -20.370 1211 HG23 THR 60 HG23 THR 60 -5.897 5.397 -21.694 1212 H THR 61 H THR 61 -2.114 7.158 -18.594 1213 HA THR 61 HA THR 61 0.380 6.068 -19.402 1214 HB THR 61 HB THR 61 -0.129 8.416 -17.545 1215 HG1 THR 61 HG1 THR 61 -0.857 8.335 -19.936 1216 HG21 THR 61 HG21 THR 61 2.368 7.637 -19.065 1217 HG22 THR 61 HG22 THR 61 2.158 7.596 -17.314 1218 HG23 THR 61 HG23 THR 61 2.144 9.140 -18.169 1219 H LEU 62 H LEU 62 -1.189 6.413 -16.239 1220 HA LEU 62 HA LEU 62 0.886 5.372 -14.654 1221 HB2 LEU 62 HB2 LEU 62 -2.102 5.202 -14.228 1222 HB3 LEU 62 HB3 LEU 62 -0.895 4.817 -13.014 1223 HG LEU 62 HG LEU 62 -1.404 7.540 -14.235 1224 HD11 LEU 62 HD11 LEU 62 -2.076 8.153 -11.967 1225 HD12 LEU 62 HD12 LEU 62 -1.798 6.496 -11.431 1226 HD13 LEU 62 HD13 LEU 62 -3.078 6.841 -12.595 1227 HD21 LEU 62 HD21 LEU 62 0.642 6.705 -12.172 1228 HD22 LEU 62 HD22 LEU 62 0.303 8.361 -12.679 1229 HD23 LEU 62 HD23 LEU 62 0.989 7.210 -13.825 1230 H MET 63 H MET 63 -1.735 3.748 -16.395 1231 HA MET 63 HA MET 63 -1.424 1.133 -15.565 1232 HB2 MET 63 HB2 MET 63 -1.904 2.082 -18.400 1233 HB3 MET 63 HB3 MET 63 -2.208 0.457 -17.808 1234 HG2 MET 63 HG2 MET 63 -3.945 1.259 -16.354 1235 HG3 MET 63 HG3 MET 63 -3.583 2.932 -16.787 1236 HE1 MET 63 HE1 MET 63 -7.034 2.411 -18.506 1237 HE2 MET 63 HE2 MET 63 -6.097 3.328 -17.323 1238 HE3 MET 63 HE3 MET 63 -6.544 1.649 -16.993 1239 H ASP 64 H ASP 64 0.265 2.692 -18.289 1240 HA ASP 64 HA ASP 64 1.922 0.576 -19.010 1241 HB2 ASP 64 HB2 ASP 64 1.550 2.678 -20.312 1242 HB3 ASP 64 HB3 ASP 64 2.589 3.523 -19.173 1243 H LYS 65 H LYS 65 2.507 3.187 -16.667 1244 HA LYS 65 HA LYS 65 5.127 2.531 -15.911 1245 HB2 LYS 65 HB2 LYS 65 2.895 3.695 -14.235 1246 HB3 LYS 65 HB3 LYS 65 4.596 3.729 -13.794 1247 HG2 LYS 65 HG2 LYS 65 5.004 5.037 -15.905 1248 HG3 LYS 65 HG3 LYS 65 3.255 5.135 -16.094 1249 HD2 LYS 65 HD2 LYS 65 3.692 7.124 -15.013 1250 HD3 LYS 65 HD3 LYS 65 3.328 6.072 -13.648 1251 HE2 LYS 65 HE2 LYS 65 6.108 6.716 -14.648 1252 HE3 LYS 65 HE3 LYS 65 5.321 7.503 -13.283 1253 HZ1 LYS 65 HZ1 LYS 65 6.846 5.761 -12.587 1254 HZ2 LYS 65 HZ2 LYS 65 5.963 4.610 -13.455 1255 HZ3 LYS 65 HZ3 LYS 65 5.260 5.395 -12.133 1256 H LEU 66 H LEU 66 2.031 1.246 -14.828 1257 HA LEU 66 HA LEU 66 3.155 -0.455 -12.790 1258 HB2 LEU 66 HB2 LEU 66 0.408 -0.442 -14.062 1259 HB3 LEU 66 HB3 LEU 66 0.857 -1.333 -12.617 1260 HG LEU 66 HG LEU 66 0.994 1.681 -12.817 1261 HD11 LEU 66 HD11 LEU 66 -1.084 1.718 -11.515 1262 HD12 LEU 66 HD12 LEU 66 -1.208 -0.034 -11.673 1263 HD13 LEU 66 HD13 LEU 66 -1.314 0.990 -13.105 1264 HD21 LEU 66 HD21 LEU 66 1.066 -0.182 -10.438 1265 HD22 LEU 66 HD22 LEU 66 1.116 1.580 -10.378 1266 HD23 LEU 66 HD23 LEU 66 2.444 0.688 -11.116 1267 H ARG 67 H ARG 67 2.346 -0.778 -16.183 1268 HA ARG 67 HA ARG 67 2.361 -3.640 -16.244 1269 HB2 ARG 67 HB2 ARG 67 2.666 -1.661 -18.519 1270 HB3 ARG 67 HB3 ARG 67 2.388 -3.390 -18.706 1271 HG2 ARG 67 HG2 ARG 67 0.245 -3.037 -17.385 1272 HG3 ARG 67 HG3 ARG 67 0.514 -1.311 -17.610 1273 HD2 ARG 67 HD2 ARG 67 -0.957 -1.974 -19.339 1274 HD3 ARG 67 HD3 ARG 67 0.625 -1.784 -20.098 1275 HE ARG 67 HE ARG 67 0.166 -4.463 -19.246 1276 HH11 ARG 67 HH11 ARG 67 -0.587 -2.225 -21.757 1277 HH12 ARG 67 HH12 ARG 67 -0.859 -3.471 -22.923 1278 HH21 ARG 67 HH21 ARG 67 -0.190 -6.037 -20.759 1279 HH22 ARG 67 HH22 ARG 67 -0.619 -5.590 -22.372 1280 H LYS 68 H LYS 68 4.854 -1.391 -15.947 1281 HA LYS 68 HA LYS 68 6.884 -2.718 -17.456 1282 HB2 LYS 68 HB2 LYS 68 7.239 -0.849 -15.099 1283 HB3 LYS 68 HB3 LYS 68 8.470 -1.288 -16.274 1284 HG2 LYS 68 HG2 LYS 68 6.011 0.388 -16.717 1285 HG3 LYS 68 HG3 LYS 68 7.699 0.890 -16.813 1286 HD2 LYS 68 HD2 LYS 68 8.008 -0.590 -18.766 1287 HD3 LYS 68 HD3 LYS 68 6.305 -1.044 -18.675 1288 HE2 LYS 68 HE2 LYS 68 5.805 1.454 -18.878 1289 HE3 LYS 68 HE3 LYS 68 7.493 1.634 -19.353 1290 HZ1 LYS 68 HZ1 LYS 68 7.081 0.069 -21.175 1291 HZ2 LYS 68 HZ2 LYS 68 6.086 1.433 -21.279 1292 HZ3 LYS 68 HZ3 LYS 68 5.452 -0.028 -20.726 1293 H VAL 69 H VAL 69 5.369 -3.526 -14.534 1294 HA VAL 69 HA VAL 69 7.672 -4.720 -13.254 1295 HB VAL 69 HB VAL 69 4.744 -4.924 -12.511 1296 HG11 VAL 69 HG11 VAL 69 7.231 -5.538 -10.908 1297 HG12 VAL 69 HG12 VAL 69 6.089 -6.721 -11.547 1298 HG13 VAL 69 HG13 VAL 69 5.575 -5.584 -10.301 1299 HG21 VAL 69 HG21 VAL 69 5.207 -3.176 -10.873 1300 HG22 VAL 69 HG22 VAL 69 5.552 -2.597 -12.503 1301 HG23 VAL 69 HG23 VAL 69 6.876 -3.067 -11.435 1302 H GLN 70 H GLN 70 8.419 -6.670 -13.680 1303 HA GLN 70 HA GLN 70 7.442 -8.385 -15.634 1304 HB2 GLN 70 HB2 GLN 70 9.079 -10.024 -14.727 1305 HB3 GLN 70 HB3 GLN 70 9.755 -8.417 -14.957 1306 HG2 GLN 70 HG2 GLN 70 9.489 -7.970 -12.547 1307 HG3 GLN 70 HG3 GLN 70 8.854 -9.598 -12.330 1308 HE21 GLN 70 HE21 GLN 70 11.698 -7.692 -12.936 1309 HE22 GLN 70 HE22 GLN 70 12.841 -8.959 -12.674 1310 H GLY 71 H GLY 71 6.783 -8.394 -12.173 1311 HA2 GLY 71 HA2 GLY 71 5.725 -11.058 -12.097 1312 HA3 GLY 71 HA3 GLY 71 5.635 -9.863 -10.818 1313 H VAL 72 H VAL 72 4.314 -8.050 -13.042 1314 HA VAL 72 HA VAL 72 1.604 -8.938 -12.370 1315 HB VAL 72 HB VAL 72 2.487 -6.392 -13.759 1316 HG11 VAL 72 HG11 VAL 72 0.187 -6.978 -14.337 1317 HG12 VAL 72 HG12 VAL 72 0.206 -5.586 -13.256 1318 HG13 VAL 72 HG13 VAL 72 -0.212 -7.182 -12.632 1319 HG21 VAL 72 HG21 VAL 72 1.675 -6.866 -10.887 1320 HG22 VAL 72 HG22 VAL 72 2.051 -5.300 -11.611 1321 HG23 VAL 72 HG23 VAL 72 3.309 -6.527 -11.462 1322 H PHE 73 H PHE 73 0.025 -9.479 -13.861 1323 HA PHE 73 HA PHE 73 0.862 -9.543 -16.690 1324 HB2 PHE 73 HB2 PHE 73 -1.024 -11.503 -16.637 1325 HB3 PHE 73 HB3 PHE 73 0.705 -11.775 -16.508 1326 HD1 PHE 73 HD2 PHE 73 1.737 -12.258 -14.349 1327 HD2 PHE 73 HD1 PHE 73 -2.484 -11.834 -14.741 1328 HE1 PHE 73 HE2 PHE 73 1.430 -13.355 -12.172 1329 HE2 PHE 73 HE1 PHE 73 -2.798 -12.933 -12.560 1330 HZ PHE 73 HZ PHE 73 -0.841 -13.696 -11.274 1331 H THR 74 H THR 74 -1.699 -8.714 -14.452 1332 HA THR 74 HA THR 74 -3.270 -7.705 -16.758 1333 HB THR 74 HB THR 74 -5.297 -8.088 -15.681 1334 HG1 THR 74 HG1 THR 74 -4.762 -7.200 -13.636 1335 HG21 THR 74 HG21 THR 74 -3.526 -10.348 -14.749 1336 HG22 THR 74 HG22 THR 74 -4.275 -10.216 -16.342 1337 HG23 THR 74 HG23 THR 74 -5.281 -10.416 -14.907 1338 H VAL 75 H VAL 75 -3.452 -5.576 -16.915 1339 HA VAL 75 HA VAL 75 -3.558 -3.935 -14.463 1340 HB VAL 75 HB VAL 75 -2.020 -3.224 -16.979 1341 HG11 VAL 75 HG11 VAL 75 -3.118 -1.267 -15.980 1342 HG12 VAL 75 HG12 VAL 75 -1.364 -1.185 -15.825 1343 HG13 VAL 75 HG13 VAL 75 -2.352 -1.628 -14.431 1344 HG21 VAL 75 HG21 VAL 75 -0.830 -4.850 -15.594 1345 HG22 VAL 75 HG22 VAL 75 -1.029 -3.813 -14.181 1346 HG23 VAL 75 HG23 VAL 75 -0.030 -3.280 -15.534 1347 H GLU 76 H GLU 76 -5.626 -3.221 -14.443 1348 HA GLU 76 HA GLU 76 -6.906 -2.507 -17.019 1349 HB2 GLU 76 HB2 GLU 76 -8.305 -3.805 -14.672 1350 HB3 GLU 76 HB3 GLU 76 -8.952 -3.530 -16.283 1351 HG2 GLU 76 HG2 GLU 76 -7.501 -5.186 -17.223 1352 HG3 GLU 76 HG3 GLU 76 -6.636 -5.363 -15.695 1353 H ARG 77 H ARG 77 -8.787 -1.115 -16.856 1354 HA ARG 77 HA ARG 77 -8.620 0.847 -14.669 1355 HB2 ARG 77 HB2 ARG 77 -8.457 1.824 -16.852 1356 HB3 ARG 77 HB3 ARG 77 -9.858 0.935 -17.426 1357 HG2 ARG 77 HG2 ARG 77 -11.299 2.244 -15.944 1358 HG3 ARG 77 HG3 ARG 77 -9.890 3.129 -15.356 1359 HD2 ARG 77 HD2 ARG 77 -11.186 4.344 -17.103 1360 HD3 ARG 77 HD3 ARG 77 -9.496 4.074 -17.525 1361 HE ARG 77 HE ARG 77 -10.206 2.351 -19.039 1362 HH11 ARG 77 HH11 ARG 77 -12.769 4.267 -17.760 1363 HH12 ARG 77 HH12 ARG 77 -13.834 3.902 -19.072 1364 HH21 ARG 77 HH21 ARG 77 -11.585 1.917 -20.719 1365 HH22 ARG 77 HH22 ARG 77 -13.177 2.594 -20.719 1366 H LEU 78 H LEU 78 -10.053 0.652 -13.046 1367 HA LEU 78 HA LEU 78 -12.190 -1.209 -13.106 1368 HB2 LEU 78 HB2 LEU 78 -11.421 0.944 -11.140 1369 HB3 LEU 78 HB3 LEU 78 -12.797 -0.117 -10.882 1370 HG LEU 78 HG LEU 78 -9.945 -1.063 -11.233 1371 HD11 LEU 78 HD11 LEU 78 -9.992 -1.568 -8.845 1372 HD12 LEU 78 HD12 LEU 78 -11.591 -0.830 -8.713 1373 HD13 LEU 78 HD13 LEU 78 -10.195 0.160 -9.137 1374 HD21 LEU 78 HD21 LEU 78 -11.590 -2.694 -11.977 1375 HD22 LEU 78 HD22 LEU 78 -12.459 -2.543 -10.450 1376 HD23 LEU 78 HD23 LEU 78 -10.832 -3.225 -10.475 1377 H SER 79 H SER 79 -12.252 2.350 -12.958 1378 HA SER 79 HA SER 79 -13.740 3.927 -13.604 1379 HB2 SER 79 HB2 SER 79 -15.077 3.632 -15.536 1380 HB3 SER 79 HB3 SER 79 -13.667 2.610 -15.794 1381 HG SER 79 HG SER 79 -14.870 0.837 -15.538 1382 H ASN 80 H ASN 80 -15.780 0.977 -13.427 1383 HA ASN 80 HA ASN 80 -17.939 2.167 -12.100 1384 HB2 ASN 80 HB2 ASN 80 -18.129 -0.011 -13.190 1385 HB3 ASN 80 HB3 ASN 80 -16.988 -0.714 -12.048 1386 HD21 ASN 80 HD21 ASN 80 -18.411 -2.235 -11.276 1387 HD22 ASN 80 HD22 ASN 80 -19.781 -1.837 -10.306 1388 H LEU 81 H LEU 81 -17.655 3.313 -10.262 1389 HA LEU 81 HA LEU 81 -16.052 2.109 -8.088 1390 HB2 LEU 81 HB2 LEU 81 -16.625 5.031 -8.602 1391 HB3 LEU 81 HB3 LEU 81 -15.671 4.394 -7.276 1392 HG LEU 81 HG LEU 81 -14.968 4.273 -10.214 1393 HD11 LEU 81 HD11 LEU 81 -14.655 6.477 -9.263 1394 HD12 LEU 81 HD12 LEU 81 -13.092 5.715 -9.557 1395 HD13 LEU 81 HD13 LEU 81 -13.738 5.795 -7.918 1396 HD21 LEU 81 HD21 LEU 81 -14.219 2.239 -9.107 1397 HD22 LEU 81 HD22 LEU 81 -13.452 3.188 -7.833 1398 HD23 LEU 81 HD23 LEU 81 -12.845 3.276 -9.488 1399 H GLU 82 H GLU 82 -16.883 1.964 -6.049 1400 HA GLU 82 HA GLU 82 -19.731 2.637 -5.699 1401 HB2 GLU 82 HB2 GLU 82 -19.717 1.025 -3.872 1402 HB3 GLU 82 HB3 GLU 82 -19.062 0.285 -5.326 1403 HG2 GLU 82 HG2 GLU 82 -16.778 0.681 -4.453 1404 HG3 GLU 82 HG3 GLU 82 -17.486 1.317 -2.970 1405 H HIS 83 H HIS 83 -17.103 4.298 -5.319 1406 HA HIS 83 HA HIS 83 -16.734 4.864 -2.601 1407 HB2 HIS 83 HB2 HIS 83 -16.154 6.527 -5.057 1408 HB3 HIS 83 HB3 HIS 83 -15.651 6.991 -3.435 1409 HD1 HIS 83 HD1 HIS 83 -13.360 6.256 -2.837 1410 HD2 HIS 83 HD2 HIS 83 -15.070 3.788 -5.716 1411 HE1 HIS 83 HE1 HIS 83 -11.579 4.599 -3.455 1412 HE2 HIS 83 HE2 HIS 83 -12.703 3.002 -5.045 1413 H HIS 84 H HIS 84 -18.797 6.584 -4.979 1414 HA HIS 84 HA HIS 84 -19.883 8.339 -2.978 1415 HB2 HIS 84 HB2 HIS 84 -20.754 7.693 -5.803 1416 HB3 HIS 84 HB3 HIS 84 -21.652 8.795 -4.765 1417 HD1 HIS 84 HD1 HIS 84 -19.401 8.989 -7.409 1418 HD2 HIS 84 HD2 HIS 84 -19.554 10.845 -3.694 1419 HE1 HIS 84 HE1 HIS 84 -18.007 11.056 -7.637 1420 HE2 HIS 84 HE2 HIS 84 -18.269 12.252 -5.445 1421 H HIS 85 H HIS 85 -20.230 6.491 -1.481 1422 HA HIS 85 HA HIS 85 -22.216 4.547 -1.885 1423 HB2 HIS 85 HB2 HIS 85 -22.246 4.464 0.684 1424 HB3 HIS 85 HB3 HIS 85 -20.723 4.112 -0.121 1425 HD1 HIS 85 HD1 HIS 85 -22.438 7.019 1.633 1426 HD2 HIS 85 HD2 HIS 85 -18.624 5.623 0.752 1427 HE1 HIS 85 HE1 HIS 85 -20.864 8.547 2.850 1428 HE2 HIS 85 HE2 HIS 85 -18.568 7.784 2.172 1429 H HIS 86 H HIS 86 -24.064 5.411 -2.743 1430 HA HIS 86 HA HIS 86 -25.369 7.713 -1.741 1431 HB2 HIS 86 HB2 HIS 86 -25.696 7.058 -4.040 1432 HB3 HIS 86 HB3 HIS 86 -26.371 5.507 -3.550 1433 HD1 HIS 86 HD1 HIS 86 -28.847 5.414 -3.179 1434 HD2 HIS 86 HD2 HIS 86 -27.422 9.314 -3.377 1435 HE1 HIS 86 HE1 HIS 86 -30.886 6.877 -3.161 1436 HE2 HIS 86 HE2 HIS 86 -29.986 9.222 -3.062 1437 H HIS 87 H HIS 87 -26.050 7.727 0.318 1438 HA HIS 87 HA HIS 87 -28.082 5.717 1.086 1439 HB2 HIS 87 HB2 HIS 87 -26.373 7.555 2.779 1440 HB3 HIS 87 HB3 HIS 87 -27.770 6.700 3.421 1441 HD1 HIS 87 HD1 HIS 87 -27.326 4.441 4.334 1442 HD2 HIS 87 HD2 HIS 87 -24.331 5.673 1.732 1443 HE1 HIS 87 HE1 HIS 87 -25.557 2.671 4.457 1444 HE2 HIS 87 HE2 HIS 87 -23.678 3.541 3.039 1445 H HIS 88 H HIS 88 -27.397 9.138 0.711 1446 HA HIS 88 HA HIS 88 -30.265 9.763 1.050 1447 HB2 HIS 88 HB2 HIS 88 -28.869 10.956 2.648 1448 HB3 HIS 88 HB3 HIS 88 -27.838 11.552 1.351 1449 HD1 HIS 88 HD1 HIS 88 -28.840 13.416 -0.195 1450 HD2 HIS 88 HD2 HIS 88 -31.206 12.409 3.072 1451 HE1 HIS 88 HE1 HIS 88 -30.528 15.264 0.010 1452 HE2 HIS 88 HE2 HIS 88 -32.017 14.577 1.917 Start of MODEL 20 1 H1 MET 1 H1 MET 1 11.383 -22.367 17.163 2 H2 MET 1 H2 MET 1 10.309 -23.255 16.200 3 H3 MET 1 H3 MET 1 9.754 -22.490 17.603 4 HA MET 1 HA MET 1 10.123 -20.337 16.691 5 HB2 MET 1 HB2 MET 1 11.193 -21.845 14.292 6 HB3 MET 1 HB3 MET 1 10.827 -20.125 14.290 7 HG2 MET 1 HG2 MET 1 12.484 -19.808 16.095 8 HG3 MET 1 HG3 MET 1 12.892 -21.521 15.975 9 HE1 MET 1 HE1 MET 1 15.456 -20.874 15.612 10 HE2 MET 1 HE2 MET 1 15.037 -19.165 15.735 11 HE3 MET 1 HE3 MET 1 16.007 -19.740 14.379 12 H THR 2 H THR 2 8.475 -19.272 15.591 13 HA THR 2 HA THR 2 6.623 -20.856 13.937 14 HB THR 2 HB THR 2 4.669 -19.740 15.036 15 HG1 THR 2 HG1 THR 2 4.955 -18.402 16.672 16 HG21 THR 2 HG21 THR 2 6.350 -21.401 16.918 17 HG22 THR 2 HG22 THR 2 5.278 -22.032 15.667 18 HG23 THR 2 HG23 THR 2 4.610 -21.140 17.035 19 H ASP 3 H ASP 3 5.016 -19.377 12.806 20 HA ASP 3 HA ASP 3 5.848 -16.561 12.649 21 HB2 ASP 3 HB2 ASP 3 5.176 -18.276 10.236 22 HB3 ASP 3 HB3 ASP 3 5.413 -16.536 10.203 23 H PHE 4 H PHE 4 4.137 -15.141 12.646 24 HA PHE 4 HA PHE 4 1.458 -16.225 12.121 25 HB2 PHE 4 HB2 PHE 4 0.505 -14.922 13.939 26 HB3 PHE 4 HB3 PHE 4 1.730 -16.018 14.558 27 HD1 PHE 4 HD1 PHE 4 0.850 -12.516 13.949 28 HD2 PHE 4 HD2 PHE 4 3.806 -15.167 15.499 29 HE1 PHE 4 HE1 PHE 4 1.961 -10.624 15.067 30 HE2 PHE 4 HE2 PHE 4 4.915 -13.275 16.619 31 HZ PHE 4 HZ PHE 4 3.997 -11.001 16.395 32 H LEU 5 H LEU 5 -0.089 -14.716 11.375 33 HA LEU 5 HA LEU 5 1.036 -12.660 9.697 34 HB2 LEU 5 HB2 LEU 5 -0.739 -14.121 8.888 35 HB3 LEU 5 HB3 LEU 5 -1.802 -13.559 10.159 36 HG LEU 5 HG LEU 5 -1.844 -11.316 9.159 37 HD11 LEU 5 HD11 LEU 5 -0.844 -10.929 6.944 38 HD12 LEU 5 HD12 LEU 5 -0.081 -12.518 7.019 39 HD13 LEU 5 HD13 LEU 5 0.375 -11.265 8.172 40 HD21 LEU 5 HD21 LEU 5 -3.120 -11.868 7.154 41 HD22 LEU 5 HD22 LEU 5 -3.523 -12.953 8.483 42 HD23 LEU 5 HD23 LEU 5 -2.472 -13.509 7.180 43 H ALA 6 H ALA 6 1.646 -10.860 10.713 44 HA ALA 6 HA ALA 6 0.137 -9.818 12.980 45 HB1 ALA 6 HB1 ALA 6 2.064 -8.372 13.329 46 HB2 ALA 6 HB2 ALA 6 2.782 -8.941 11.822 47 HB3 ALA 6 HB3 ALA 6 2.565 -10.056 13.171 48 H GLY 7 H GLY 7 -0.952 -7.909 12.996 49 HA2 GLY 7 HA2 GLY 7 -1.086 -6.406 10.450 50 HA3 GLY 7 HA3 GLY 7 -2.437 -6.595 11.555 51 H ILE 8 H ILE 8 -1.089 -4.173 10.462 52 HA ILE 8 HA ILE 8 -0.712 -2.806 13.050 53 HB ILE 8 HB ILE 8 0.872 -2.137 10.544 54 HG12 ILE 8 HG12 ILE 8 1.832 -3.517 13.072 55 HG13 ILE 8 HG13 ILE 8 1.613 -4.295 11.507 56 HG21 ILE 8 HG21 ILE 8 1.109 -1.092 13.372 57 HG22 ILE 8 HG22 ILE 8 0.439 -0.215 11.995 58 HG23 ILE 8 HG23 ILE 8 2.149 -0.650 12.018 59 HD11 ILE 8 HD11 ILE 8 3.355 -2.838 10.563 60 HD12 ILE 8 HD12 ILE 8 3.948 -3.821 11.901 61 HD13 ILE 8 HD13 ILE 8 3.590 -2.113 12.156 62 H ARG 9 H ARG 9 -1.788 -0.837 13.217 63 HA ARG 9 HA ARG 9 -3.103 0.164 10.766 64 HB2 ARG 9 HB2 ARG 9 -4.707 -0.656 12.463 65 HB3 ARG 9 HB3 ARG 9 -4.049 0.490 13.624 66 HG2 ARG 9 HG2 ARG 9 -4.764 2.353 12.204 67 HG3 ARG 9 HG3 ARG 9 -5.417 1.209 11.030 68 HD2 ARG 9 HD2 ARG 9 -6.975 0.371 12.742 69 HD3 ARG 9 HD3 ARG 9 -6.336 1.552 13.888 70 HE ARG 9 HE ARG 9 -7.230 2.848 11.535 71 HH11 ARG 9 HH11 ARG 9 -8.424 1.286 14.369 72 HH12 ARG 9 HH12 ARG 9 -9.900 2.189 14.375 73 HH21 ARG 9 HH21 ARG 9 -9.145 4.006 11.568 74 HH22 ARG 9 HH22 ARG 9 -10.299 3.701 12.817 75 H ILE 10 H ILE 10 -2.404 2.057 10.050 76 HA ILE 10 HA ILE 10 -0.967 3.884 11.886 77 HB ILE 10 HB ILE 10 -0.839 3.819 8.860 78 HG12 ILE 10 HG12 ILE 10 1.199 2.652 10.775 79 HG13 ILE 10 HG13 ILE 10 -0.002 1.691 9.917 80 HG21 ILE 10 HG21 ILE 10 -0.213 5.957 9.875 81 HG22 ILE 10 HG22 ILE 10 1.178 5.168 9.134 82 HG23 ILE 10 HG23 ILE 10 0.977 5.135 10.886 83 HD11 ILE 10 HD11 ILE 10 2.161 1.623 8.809 84 HD12 ILE 10 HD12 ILE 10 2.136 3.377 8.635 85 HD13 ILE 10 HD13 ILE 10 0.944 2.390 7.788 86 H VAL 11 H VAL 11 -2.224 5.611 12.501 87 HA VAL 11 HA VAL 11 -3.916 6.837 10.409 88 HB VAL 11 HB VAL 11 -4.472 6.707 13.380 89 HG11 VAL 11 HG11 VAL 11 -5.998 8.195 11.240 90 HG12 VAL 11 HG12 VAL 11 -5.055 8.922 12.543 91 HG13 VAL 11 HG13 VAL 11 -6.505 7.992 12.917 92 HG21 VAL 11 HG21 VAL 11 -6.042 5.655 11.017 93 HG22 VAL 11 HG22 VAL 11 -6.482 5.495 12.719 94 HG23 VAL 11 HG23 VAL 11 -5.046 4.681 12.100 95 H GLY 12 H GLY 12 -3.189 8.684 9.738 96 HA2 GLY 12 HA2 GLY 12 -2.138 10.657 11.644 97 HA3 GLY 12 HA3 GLY 12 -1.126 10.210 10.276 98 H GLU 13 H GLU 13 -1.902 12.842 10.620 99 HA GLU 13 HA GLU 13 -4.315 13.436 9.200 100 HB2 GLU 13 HB2 GLU 13 -3.489 15.789 9.259 101 HB3 GLU 13 HB3 GLU 13 -3.548 15.008 10.832 102 HG2 GLU 13 HG2 GLU 13 -1.104 14.586 10.662 103 HG3 GLU 13 HG3 GLU 13 -1.087 15.506 9.157 104 H ASP 14 H ASP 14 -4.651 13.908 7.084 105 HA ASP 14 HA ASP 14 -2.817 12.921 5.166 106 HB2 ASP 14 HB2 ASP 14 -5.231 12.828 4.831 107 HB3 ASP 14 HB3 ASP 14 -5.326 14.584 4.821 108 H LYS 15 H LYS 15 -0.868 14.074 5.371 109 HA LYS 15 HA LYS 15 -0.883 16.902 4.543 110 HB2 LYS 15 HB2 LYS 15 1.411 15.234 5.579 111 HB3 LYS 15 HB3 LYS 15 1.455 16.958 5.251 112 HG2 LYS 15 HG2 LYS 15 -0.271 15.644 7.327 113 HG3 LYS 15 HG3 LYS 15 1.289 16.410 7.637 114 HD2 LYS 15 HD2 LYS 15 -1.135 17.794 6.489 115 HD3 LYS 15 HD3 LYS 15 -0.620 17.877 8.174 116 HE2 LYS 15 HE2 LYS 15 1.473 18.930 7.501 117 HE3 LYS 15 HE3 LYS 15 1.011 18.796 5.803 118 HZ1 LYS 15 HZ1 LYS 15 0.588 21.006 6.666 119 HZ2 LYS 15 HZ2 LYS 15 -0.426 20.378 7.863 120 HZ3 LYS 15 HZ3 LYS 15 -0.861 20.254 6.232 121 H ASN 16 H ASN 16 -0.509 17.386 2.497 122 HA ASN 16 HA ASN 16 0.510 17.472 0.456 123 HB2 ASN 16 HB2 ASN 16 2.784 16.422 2.151 124 HB3 ASN 16 HB3 ASN 16 2.972 17.186 0.568 125 HD21 ASN 16 HD21 ASN 16 3.847 17.923 3.344 126 HD22 ASN 16 HD22 ASN 16 3.302 19.548 3.551 127 H GLY 17 H GLY 17 2.130 14.609 1.741 128 HA2 GLY 17 HA2 GLY 17 0.948 12.845 -0.247 129 HA3 GLY 17 HA3 GLY 17 2.657 13.179 -0.497 130 H MET 18 H MET 18 1.075 12.891 2.639 131 HA MET 18 HA MET 18 3.048 11.141 3.652 132 HB2 MET 18 HB2 MET 18 0.366 12.023 4.689 133 HB3 MET 18 HB3 MET 18 1.337 10.843 5.560 134 HG2 MET 18 HG2 MET 18 3.169 12.464 5.699 135 HG3 MET 18 HG3 MET 18 2.174 13.650 4.853 136 HE1 MET 18 HE1 MET 18 0.752 11.048 7.355 137 HE2 MET 18 HE2 MET 18 0.858 11.885 8.902 138 HE3 MET 18 HE3 MET 18 2.327 11.346 8.090 139 H THR 19 H THR 19 -0.298 10.532 2.596 140 HA THR 19 HA THR 19 -0.486 7.819 3.135 141 HB THR 19 HB THR 19 -2.089 7.672 1.262 142 HG1 THR 19 HG1 THR 19 -2.359 9.424 -0.123 143 HG21 THR 19 HG21 THR 19 -2.355 10.252 2.825 144 HG22 THR 19 HG22 THR 19 -2.836 8.654 3.393 145 HG23 THR 19 HG23 THR 19 -3.668 9.387 2.021 146 H ASN 20 H ASN 20 1.317 9.444 0.618 147 HA ASN 20 HA ASN 20 1.848 7.097 -0.951 148 HB2 ASN 20 HB2 ASN 20 3.226 9.799 -0.950 149 HB3 ASN 20 HB3 ASN 20 3.400 8.556 -2.186 150 HD21 ASN 20 HD21 ASN 20 1.832 8.333 -3.722 151 HD22 ASN 20 HD22 ASN 20 0.514 9.430 -3.899 152 H GLN 21 H GLN 21 3.758 9.087 1.313 153 HA GLN 21 HA GLN 21 6.114 7.501 1.087 154 HB2 GLN 21 HB2 GLN 21 7.027 8.854 2.823 155 HB3 GLN 21 HB3 GLN 21 6.050 9.905 1.819 156 HG2 GLN 21 HG2 GLN 21 4.260 9.848 3.466 157 HG3 GLN 21 HG3 GLN 21 5.190 8.731 4.459 158 HE21 GLN 21 HE21 GLN 21 4.932 12.015 3.338 159 HE22 GLN 21 HE22 GLN 21 5.997 12.702 4.508 160 H ILE 22 H ILE 22 3.415 7.507 3.370 161 HA ILE 22 HA ILE 22 4.450 5.907 5.395 162 HB ILE 22 HB ILE 22 1.652 6.336 4.364 163 HG12 ILE 22 HG12 ILE 22 2.799 8.139 5.631 164 HG13 ILE 22 HG13 ILE 22 1.358 7.546 6.450 165 HG21 ILE 22 HG21 ILE 22 1.621 4.061 5.195 166 HG22 ILE 22 HG22 ILE 22 0.774 5.116 6.325 167 HG23 ILE 22 HG23 ILE 22 2.408 4.563 6.693 168 HD11 ILE 22 HD11 ILE 22 2.735 6.227 7.952 169 HD12 ILE 22 HD12 ILE 22 3.198 7.928 8.000 170 HD13 ILE 22 HD13 ILE 22 4.188 6.770 7.111 171 H THR 23 H THR 23 2.474 4.856 2.613 172 HA THR 23 HA THR 23 2.905 2.090 3.200 173 HB THR 23 HB THR 23 1.951 3.117 0.523 174 HG1 THR 23 HG1 THR 23 0.400 4.071 1.636 175 HG21 THR 23 HG21 THR 23 2.348 0.691 0.787 176 HG22 THR 23 HG22 THR 23 0.643 1.062 0.530 177 HG23 THR 23 HG23 THR 23 1.224 0.673 2.147 178 H GLY 24 H GLY 24 4.486 4.489 1.199 179 HA2 GLY 24 HA2 GLY 24 6.081 2.849 -0.419 180 HA3 GLY 24 HA3 GLY 24 6.521 4.459 0.132 181 H VAL 25 H VAL 25 6.828 4.186 2.813 182 HA VAL 25 HA VAL 25 9.305 2.918 3.167 183 HB VAL 25 HB VAL 25 7.275 3.676 5.293 184 HG11 VAL 25 HG11 VAL 25 10.244 3.157 5.543 185 HG12 VAL 25 HG12 VAL 25 8.955 2.128 6.165 186 HG13 VAL 25 HG13 VAL 25 9.189 3.744 6.831 187 HG21 VAL 25 HG21 VAL 25 8.569 5.747 5.506 188 HG22 VAL 25 HG22 VAL 25 7.909 5.576 3.880 189 HG23 VAL 25 HG23 VAL 25 9.614 5.237 4.179 190 H ILE 26 H ILE 26 6.015 1.817 3.902 191 HA ILE 26 HA ILE 26 6.620 -0.632 5.126 192 HB ILE 26 HB ILE 26 4.252 0.138 3.410 193 HG12 ILE 26 HG12 ILE 26 4.592 0.007 6.421 194 HG13 ILE 26 HG13 ILE 26 4.533 1.480 5.460 195 HG21 ILE 26 HG21 ILE 26 4.476 -2.290 3.452 196 HG22 ILE 26 HG22 ILE 26 3.077 -1.772 4.392 197 HG23 ILE 26 HG23 ILE 26 4.559 -2.261 5.213 198 HD11 ILE 26 HD11 ILE 26 2.229 0.968 4.826 199 HD12 ILE 26 HD12 ILE 26 2.425 1.076 6.575 200 HD13 ILE 26 HD13 ILE 26 2.294 -0.501 5.799 201 H SER 27 H SER 27 6.261 0.196 1.705 202 HA SER 27 HA SER 27 6.341 -2.296 0.506 203 HB2 SER 27 HB2 SER 27 7.854 0.087 -0.586 204 HB3 SER 27 HB3 SER 27 7.059 -1.200 -1.492 205 HG SER 27 HG SER 27 5.892 0.905 -0.018 206 H LYS 28 H LYS 28 9.008 -0.336 1.690 207 HA LYS 28 HA LYS 28 10.963 -2.337 0.814 208 HB2 LYS 28 HB2 LYS 28 12.571 -0.441 1.661 209 HB3 LYS 28 HB3 LYS 28 11.748 -0.287 0.115 210 HG2 LYS 28 HG2 LYS 28 10.094 1.166 1.084 211 HG3 LYS 28 HG3 LYS 28 10.775 0.953 2.690 212 HD2 LYS 28 HD2 LYS 28 12.181 2.222 0.325 213 HD3 LYS 28 HD3 LYS 28 11.422 3.103 1.647 214 HE2 LYS 28 HE2 LYS 28 13.752 3.072 2.102 215 HE3 LYS 28 HE3 LYS 28 13.014 1.915 3.208 216 HZ1 LYS 28 HZ1 LYS 28 13.824 0.118 1.937 217 HZ2 LYS 28 HZ2 LYS 28 15.120 1.188 2.073 218 HZ3 LYS 28 HZ3 LYS 28 14.242 1.106 0.632 219 H PHE 29 H PHE 29 9.158 -2.659 3.214 220 HA PHE 29 HA PHE 29 10.914 -2.689 5.483 221 HB2 PHE 29 HB2 PHE 29 8.171 -3.751 4.922 222 HB3 PHE 29 HB3 PHE 29 9.045 -4.376 6.315 223 HD1 PHE 29 HD2 PHE 29 10.330 -1.281 6.335 224 HD2 PHE 29 HD1 PHE 29 6.535 -3.161 6.774 225 HE1 PHE 29 HE2 PHE 29 9.554 0.619 7.683 226 HE2 PHE 29 HE1 PHE 29 5.750 -1.258 8.128 227 HZ PHE 29 HZ PHE 29 7.265 0.633 8.585 228 H ASP 30 H ASP 30 11.310 -4.725 6.708 229 HA ASP 30 HA ASP 30 12.582 -6.703 5.013 230 HB2 ASP 30 HB2 ASP 30 13.686 -5.771 7.031 231 HB3 ASP 30 HB3 ASP 30 12.422 -6.473 8.032 232 H THR 31 H THR 31 9.664 -6.593 4.940 233 HA THR 31 HA THR 31 9.226 -9.445 5.284 234 HB THR 31 HB THR 31 8.448 -8.663 7.440 235 HG1 THR 31 HG1 THR 31 6.770 -9.948 7.286 236 HG21 THR 31 HG21 THR 31 6.599 -7.050 7.644 237 HG22 THR 31 HG22 THR 31 6.640 -6.787 5.901 238 HG23 THR 31 HG23 THR 31 8.020 -6.321 6.897 239 H ASN 32 H ASN 32 7.244 -10.201 4.212 240 HA ASN 32 HA ASN 32 6.846 -8.693 1.742 241 HB2 ASN 32 HB2 ASN 32 6.157 -11.539 2.508 242 HB3 ASN 32 HB3 ASN 32 5.783 -10.825 0.943 243 HD21 ASN 32 HD21 ASN 32 8.184 -9.297 0.707 244 HD22 ASN 32 HD22 ASN 32 9.457 -10.424 0.408 245 H ILE 33 H ILE 33 5.141 -7.397 1.519 246 HA ILE 33 HA ILE 33 2.933 -7.265 3.247 247 HB ILE 33 HB ILE 33 3.040 -6.335 0.364 248 HG12 ILE 33 HG12 ILE 33 3.717 -4.822 2.909 249 HG13 ILE 33 HG13 ILE 33 4.892 -5.419 1.743 250 HG21 ILE 33 HG21 ILE 33 0.762 -6.400 1.235 251 HG22 ILE 33 HG22 ILE 33 1.298 -4.730 1.054 252 HG23 ILE 33 HG23 ILE 33 1.257 -5.474 2.653 253 HD11 ILE 33 HD11 ILE 33 2.786 -3.330 1.231 254 HD12 ILE 33 HD12 ILE 33 3.927 -3.948 0.037 255 HD13 ILE 33 HD13 ILE 33 4.515 -3.054 1.439 256 H ARG 34 H ARG 34 1.530 -8.913 3.557 257 HA ARG 34 HA ARG 34 0.671 -10.576 1.309 258 HB2 ARG 34 HB2 ARG 34 0.812 -10.903 4.197 259 HB3 ARG 34 HB3 ARG 34 -0.779 -11.340 3.601 260 HG2 ARG 34 HG2 ARG 34 0.578 -13.309 3.674 261 HG3 ARG 34 HG3 ARG 34 0.289 -12.893 1.986 262 HD2 ARG 34 HD2 ARG 34 2.812 -12.266 3.535 263 HD3 ARG 34 HD3 ARG 34 2.618 -13.610 2.413 264 HE ARG 34 HE ARG 34 2.791 -10.774 1.725 265 HH11 ARG 34 HH11 ARG 34 2.568 -14.054 0.682 266 HH12 ARG 34 HH12 ARG 34 2.969 -13.665 -0.957 267 HH21 ARG 34 HH21 ARG 34 3.274 -10.304 -0.399 268 HH22 ARG 34 HH22 ARG 34 3.353 -11.592 -1.554 269 H THR 35 H THR 35 -0.602 -8.154 3.506 270 HA THR 35 HA THR 35 -2.709 -7.537 1.601 271 HB THR 35 HB THR 35 -3.479 -8.047 4.485 272 HG1 THR 35 HG1 THR 35 -3.461 -9.769 2.268 273 HG21 THR 35 HG21 THR 35 -4.893 -6.424 3.342 274 HG22 THR 35 HG22 THR 35 -5.783 -7.923 3.601 275 HG23 THR 35 HG23 THR 35 -5.139 -7.550 2.003 276 H ILE 36 H ILE 36 -3.403 -5.368 1.775 277 HA ILE 36 HA ILE 36 -2.863 -3.841 4.143 278 HB ILE 36 HB ILE 36 -0.633 -3.818 3.036 279 HG12 ILE 36 HG12 ILE 36 -1.873 -1.059 3.001 280 HG13 ILE 36 HG13 ILE 36 -1.553 -1.938 4.494 281 HG21 ILE 36 HG21 ILE 36 -2.075 -2.323 0.843 282 HG22 ILE 36 HG22 ILE 36 -1.282 -3.894 0.708 283 HG23 ILE 36 HG23 ILE 36 -0.322 -2.442 1.003 284 HD11 ILE 36 HD11 ILE 36 0.497 -1.138 2.445 285 HD12 ILE 36 HD12 ILE 36 0.817 -2.024 3.937 286 HD13 ILE 36 HD13 ILE 36 0.219 -0.365 4.004 287 H VAL 37 H VAL 37 -4.210 -2.142 4.342 288 HA VAL 37 HA VAL 37 -5.730 -1.238 1.979 289 HB VAL 37 HB VAL 37 -6.973 -1.921 4.662 290 HG11 VAL 37 HG11 VAL 37 -9.116 -1.393 3.597 291 HG12 VAL 37 HG12 VAL 37 -8.275 -0.922 2.120 292 HG13 VAL 37 HG13 VAL 37 -8.049 0.011 3.601 293 HG21 VAL 37 HG21 VAL 37 -7.240 -3.298 1.981 294 HG22 VAL 37 HG22 VAL 37 -8.179 -3.683 3.424 295 HG23 VAL 37 HG23 VAL 37 -6.434 -3.940 3.413 296 H LEU 38 H LEU 38 -4.994 0.816 1.821 297 HA LEU 38 HA LEU 38 -5.073 2.532 4.225 298 HB2 LEU 38 HB2 LEU 38 -2.925 2.486 3.026 299 HB3 LEU 38 HB3 LEU 38 -3.720 2.987 1.549 300 HG LEU 38 HG LEU 38 -3.806 4.769 3.983 301 HD11 LEU 38 HD11 LEU 38 -1.563 4.645 1.960 302 HD12 LEU 38 HD12 LEU 38 -1.446 4.238 3.672 303 HD13 LEU 38 HD13 LEU 38 -1.778 5.900 3.182 304 HD21 LEU 38 HD21 LEU 38 -5.246 5.371 2.104 305 HD22 LEU 38 HD22 LEU 38 -3.866 5.322 1.007 306 HD23 LEU 38 HD23 LEU 38 -3.940 6.543 2.277 307 H ASN 39 H ASN 39 -6.592 4.106 4.392 308 HA ASN 39 HA ASN 39 -7.744 5.260 1.971 309 HB2 ASN 39 HB2 ASN 39 -10.060 5.003 2.735 310 HB3 ASN 39 HB3 ASN 39 -9.295 3.432 2.528 311 HD21 ASN 39 HD21 ASN 39 -8.767 2.218 4.378 312 HD22 ASN 39 HD22 ASN 39 -9.499 2.550 5.904 313 H ALA 40 H ALA 40 -8.097 7.403 2.149 314 HA ALA 40 HA ALA 40 -7.622 8.658 4.771 315 HB1 ALA 40 HB1 ALA 40 -7.592 9.880 2.009 316 HB2 ALA 40 HB2 ALA 40 -6.178 9.363 2.926 317 HB3 ALA 40 HB3 ALA 40 -7.169 10.700 3.511 318 H LYS 41 H LYS 41 -9.159 9.693 5.850 319 HA LYS 41 HA LYS 41 -11.630 10.564 4.570 320 HB2 LYS 41 HB2 LYS 41 -13.057 9.244 6.026 321 HB3 LYS 41 HB3 LYS 41 -11.968 8.162 5.161 322 HG2 LYS 41 HG2 LYS 41 -10.517 8.060 7.147 323 HG3 LYS 41 HG3 LYS 41 -11.655 9.095 8.015 324 HD2 LYS 41 HD2 LYS 41 -13.400 7.403 7.760 325 HD3 LYS 41 HD3 LYS 41 -12.286 6.377 6.851 326 HE2 LYS 41 HE2 LYS 41 -10.815 6.273 8.837 327 HE3 LYS 41 HE3 LYS 41 -11.990 7.232 9.734 328 HZ1 LYS 41 HZ1 LYS 41 -13.610 5.482 9.445 329 HZ2 LYS 41 HZ2 LYS 41 -12.218 4.860 10.168 330 HZ3 LYS 41 HZ3 LYS 41 -12.519 4.570 8.532 331 H ASP 42 H ASP 42 -12.708 12.172 5.738 332 HA ASP 42 HA ASP 42 -13.058 13.844 7.240 333 HB2 ASP 42 HB2 ASP 42 -13.546 11.814 8.643 334 HB3 ASP 42 HB3 ASP 42 -11.901 11.906 9.261 335 H GLY 43 H GLY 43 -10.404 13.682 5.898 336 HA2 GLY 43 HA2 GLY 43 -8.658 15.258 5.870 337 HA3 GLY 43 HA3 GLY 43 -9.020 15.667 7.539 338 H ILE 44 H ILE 44 -8.981 12.511 7.791 339 HA ILE 44 HA ILE 44 -6.080 12.346 8.354 340 HB ILE 44 HB ILE 44 -8.067 10.402 9.503 341 HG12 ILE 44 HG12 ILE 44 -7.633 13.208 10.572 342 HG13 ILE 44 HG13 ILE 44 -9.120 12.586 9.861 343 HG21 ILE 44 HG21 ILE 44 -5.711 10.044 9.956 344 HG22 ILE 44 HG22 ILE 44 -6.539 10.501 11.440 345 HG23 ILE 44 HG23 ILE 44 -5.552 11.684 10.583 346 HD11 ILE 44 HD11 ILE 44 -9.354 11.007 11.694 347 HD12 ILE 44 HD12 ILE 44 -9.237 12.661 12.294 348 HD13 ILE 44 HD13 ILE 44 -7.843 11.585 12.397 349 H PHE 45 H PHE 45 -5.324 9.881 8.255 350 HA PHE 45 HA PHE 45 -6.890 8.302 6.346 351 HB2 PHE 45 HB2 PHE 45 -5.005 7.717 4.981 352 HB3 PHE 45 HB3 PHE 45 -5.055 9.472 5.080 353 HD1 PHE 45 HD1 PHE 45 -3.241 6.447 6.094 354 HD2 PHE 45 HD2 PHE 45 -3.326 10.704 6.220 355 HE1 PHE 45 HE1 PHE 45 -0.907 6.468 6.864 356 HE2 PHE 45 HE2 PHE 45 -0.993 10.728 6.993 357 HZ PHE 45 HZ PHE 45 0.216 8.606 7.320 358 H THR 46 H THR 46 -6.688 6.054 6.577 359 HA THR 46 HA THR 46 -5.017 5.135 8.835 360 HB THR 46 HB THR 46 -7.289 5.045 9.615 361 HG1 THR 46 HG1 THR 46 -6.593 2.384 8.839 362 HG21 THR 46 HG21 THR 46 -7.951 3.422 7.153 363 HG22 THR 46 HG22 THR 46 -8.461 5.081 7.467 364 HG23 THR 46 HG23 THR 46 -9.047 3.770 8.491 365 H CYS 47 H CYS 47 -3.375 4.044 7.972 366 HA CYS 47 HA CYS 47 -3.824 2.262 5.677 367 HB2 CYS 47 HB2 CYS 47 -1.926 3.823 5.523 368 HB3 CYS 47 HB3 CYS 47 -1.231 3.131 6.984 369 HG CYS 47 HG CYS 47 -0.604 2.293 3.963 370 H ASN 48 H ASN 48 -4.379 0.243 6.144 371 HA ASN 48 HA ASN 48 -3.501 -1.011 8.648 372 HB2 ASN 48 HB2 ASN 48 -5.602 -1.842 6.629 373 HB3 ASN 48 HB3 ASN 48 -5.207 -2.747 8.086 374 HD21 ASN 48 HD21 ASN 48 -7.296 -2.532 8.865 375 HD22 ASN 48 HD22 ASN 48 -7.901 -1.040 9.483 376 H LEU 49 H LEU 49 -1.606 -2.064 8.490 377 HA LEU 49 HA LEU 49 -0.850 -3.392 5.984 378 HB2 LEU 49 HB2 LEU 49 0.804 -1.894 6.853 379 HB3 LEU 49 HB3 LEU 49 0.713 -2.621 8.447 380 HG LEU 49 HG LEU 49 1.710 -4.699 7.550 381 HD11 LEU 49 HD11 LEU 49 0.935 -4.555 5.252 382 HD12 LEU 49 HD12 LEU 49 2.690 -4.710 5.301 383 HD13 LEU 49 HD13 LEU 49 1.952 -3.141 4.975 384 HD21 LEU 49 HD21 LEU 49 3.333 -2.218 6.965 385 HD22 LEU 49 HD22 LEU 49 3.974 -3.838 7.242 386 HD23 LEU 49 HD23 LEU 49 3.146 -2.982 8.544 387 H MET 50 H MET 50 -0.588 -5.564 5.788 388 HA MET 50 HA MET 50 -0.750 -7.244 8.213 389 HB2 MET 50 HB2 MET 50 -2.056 -7.831 5.547 390 HB3 MET 50 HB3 MET 50 -2.068 -8.888 6.950 391 HG2 MET 50 HG2 MET 50 -3.374 -6.183 6.729 392 HG3 MET 50 HG3 MET 50 -4.178 -7.750 6.743 393 HE1 MET 50 HE1 MET 50 -3.778 -9.476 8.876 394 HE2 MET 50 HE2 MET 50 -3.108 -8.933 10.414 395 HE3 MET 50 HE3 MET 50 -2.066 -9.061 8.998 396 H ILE 51 H ILE 51 1.150 -8.239 8.434 397 HA ILE 51 HA ILE 51 2.410 -9.534 6.122 398 HB ILE 51 HB ILE 51 4.669 -8.661 6.902 399 HG12 ILE 51 HG12 ILE 51 4.343 -6.246 7.940 400 HG13 ILE 51 HG13 ILE 51 2.850 -6.935 8.564 401 HG21 ILE 51 HG21 ILE 51 2.711 -6.688 5.729 402 HG22 ILE 51 HG22 ILE 51 3.622 -7.912 4.845 403 HG23 ILE 51 HG23 ILE 51 4.469 -6.578 5.626 404 HD11 ILE 51 HD11 ILE 51 4.622 -7.047 10.207 405 HD12 ILE 51 HD12 ILE 51 5.637 -7.953 9.084 406 HD13 ILE 51 HD13 ILE 51 4.150 -8.672 9.705 407 H PHE 52 H PHE 52 4.146 -11.085 6.762 408 HA PHE 52 HA PHE 52 3.352 -12.440 9.232 409 HB2 PHE 52 HB2 PHE 52 4.728 -13.323 6.722 410 HB3 PHE 52 HB3 PHE 52 5.000 -14.243 8.198 411 HD1 PHE 52 HD2 PHE 52 3.098 -15.327 9.353 412 HD2 PHE 52 HD1 PHE 52 2.660 -13.486 5.531 413 HE1 PHE 52 HE2 PHE 52 0.988 -16.541 9.019 414 HE2 PHE 52 HE1 PHE 52 0.550 -14.703 5.186 415 HZ PHE 52 HZ PHE 52 -0.289 -16.232 6.925 416 H VAL 53 H VAL 53 4.684 -12.953 10.909 417 HA VAL 53 HA VAL 53 7.522 -12.196 10.809 418 HB VAL 53 HB VAL 53 7.494 -10.955 12.852 419 HG11 VAL 53 HG11 VAL 53 6.059 -9.032 12.350 420 HG12 VAL 53 HG12 VAL 53 5.203 -9.995 11.144 421 HG13 VAL 53 HG13 VAL 53 6.913 -9.614 10.918 422 HG21 VAL 53 HG21 VAL 53 4.555 -11.596 13.078 423 HG22 VAL 53 HG22 VAL 53 5.457 -10.526 14.151 424 HG23 VAL 53 HG23 VAL 53 5.851 -12.243 14.086 425 H LYS 54 H LYS 54 8.832 -13.303 12.358 426 HA LYS 54 HA LYS 54 7.872 -15.865 13.178 427 HB2 LYS 54 HB2 LYS 54 10.130 -16.101 14.227 428 HB3 LYS 54 HB3 LYS 54 10.161 -15.673 12.522 429 HG2 LYS 54 HG2 LYS 54 10.532 -13.296 13.184 430 HG3 LYS 54 HG3 LYS 54 10.660 -13.831 14.861 431 HD2 LYS 54 HD2 LYS 54 12.419 -14.796 12.599 432 HD3 LYS 54 HD3 LYS 54 12.861 -13.538 13.753 433 HE2 LYS 54 HE2 LYS 54 12.069 -16.307 14.613 434 HE3 LYS 54 HE3 LYS 54 13.731 -15.885 14.211 435 HZ1 LYS 54 HZ1 LYS 54 12.075 -14.698 16.368 436 HZ2 LYS 54 HZ2 LYS 54 13.614 -14.151 15.938 437 HZ3 LYS 54 HZ3 LYS 54 13.415 -15.714 16.554 438 H ASN 55 H ASN 55 8.512 -12.857 14.922 439 HA ASN 55 HA ASN 55 6.786 -13.679 17.072 440 HB2 ASN 55 HB2 ASN 55 8.623 -13.152 18.826 441 HB3 ASN 55 HB3 ASN 55 8.613 -14.730 18.057 442 HD21 ASN 55 HD21 ASN 55 9.735 -11.901 16.345 443 HD22 ASN 55 HD22 ASN 55 11.399 -12.319 16.370 444 H THR 56 H THR 56 6.575 -11.939 18.769 445 HA THR 56 HA THR 56 5.596 -9.683 17.467 446 HB THR 56 HB THR 56 5.268 -8.683 19.719 447 HG1 THR 56 HG1 THR 56 6.341 -11.055 20.829 448 HG21 THR 56 HG21 THR 56 4.519 -11.603 19.486 449 HG22 THR 56 HG22 THR 56 3.609 -10.240 18.834 450 HG23 THR 56 HG23 THR 56 3.772 -10.438 20.579 451 H ASP 57 H ASP 57 8.756 -10.084 18.985 452 HA ASP 57 HA ASP 57 9.467 -7.388 19.303 453 HB2 ASP 57 HB2 ASP 57 10.755 -9.297 20.226 454 HB3 ASP 57 HB3 ASP 57 11.281 -9.716 18.599 455 H LYS 58 H LYS 58 9.694 -9.542 16.555 456 HA LYS 58 HA LYS 58 10.999 -7.851 14.734 457 HB2 LYS 58 HB2 LYS 58 10.872 -10.152 14.197 458 HB3 LYS 58 HB3 LYS 58 9.135 -10.205 14.451 459 HG2 LYS 58 HG2 LYS 58 9.658 -10.369 12.097 460 HG3 LYS 58 HG3 LYS 58 8.791 -8.873 12.448 461 HD2 LYS 58 HD2 LYS 58 10.894 -7.625 12.388 462 HD3 LYS 58 HD3 LYS 58 11.789 -9.119 12.100 463 HE2 LYS 58 HE2 LYS 58 10.644 -9.412 9.969 464 HE3 LYS 58 HE3 LYS 58 9.687 -7.958 10.264 465 HZ1 LYS 58 HZ1 LYS 58 11.575 -7.556 8.798 466 HZ2 LYS 58 HZ2 LYS 58 12.645 -8.037 10.010 467 HZ3 LYS 58 HZ3 LYS 58 11.695 -6.651 10.221 468 H LEU 59 H LEU 59 7.575 -8.221 15.550 469 HA LEU 59 HA LEU 59 6.569 -6.519 13.495 470 HB2 LEU 59 HB2 LEU 59 5.177 -8.206 14.559 471 HB3 LEU 59 HB3 LEU 59 5.353 -7.412 16.113 472 HG LEU 59 HG LEU 59 4.131 -5.443 15.217 473 HD11 LEU 59 HD11 LEU 59 4.640 -5.683 12.862 474 HD12 LEU 59 HD12 LEU 59 2.894 -5.675 13.105 475 HD13 LEU 59 HD13 LEU 59 3.733 -7.194 12.792 476 HD21 LEU 59 HD21 LEU 59 2.692 -8.092 15.043 477 HD22 LEU 59 HD22 LEU 59 1.908 -6.519 15.182 478 HD23 LEU 59 HD23 LEU 59 2.928 -7.114 16.491 479 H THR 60 H THR 60 7.243 -5.993 16.956 480 HA THR 60 HA THR 60 6.268 -3.370 17.147 481 HB THR 60 HB THR 60 7.668 -3.137 19.161 482 HG1 THR 60 HG1 THR 60 9.105 -4.806 19.717 483 HG21 THR 60 HG21 THR 60 5.556 -4.351 19.346 484 HG22 THR 60 HG22 THR 60 6.767 -5.055 20.418 485 HG23 THR 60 HG23 THR 60 6.365 -5.855 18.899 486 H THR 61 H THR 61 9.324 -4.582 15.925 487 HA THR 61 HA THR 61 10.800 -2.207 15.898 488 HB THR 61 HB THR 61 10.849 -4.472 13.880 489 HG1 THR 61 HG1 THR 61 12.130 -4.013 16.361 490 HG21 THR 61 HG21 THR 61 11.896 -2.461 12.956 491 HG22 THR 61 HG22 THR 61 13.111 -3.685 13.323 492 HG23 THR 61 HG23 THR 61 12.895 -2.304 14.401 493 H LEU 62 H LEU 62 8.444 -3.477 13.577 494 HA LEU 62 HA LEU 62 8.744 -1.448 11.625 495 HB2 LEU 62 HB2 LEU 62 6.315 -3.146 12.220 496 HB3 LEU 62 HB3 LEU 62 6.588 -2.229 10.749 497 HG LEU 62 HG LEU 62 8.183 -4.620 11.688 498 HD11 LEU 62 HD11 LEU 62 6.320 -4.256 9.345 499 HD12 LEU 62 HD12 LEU 62 5.993 -5.197 10.802 500 HD13 LEU 62 HD13 LEU 62 7.271 -5.701 9.696 501 HD21 LEU 62 HD21 LEU 62 9.636 -3.007 10.575 502 HD22 LEU 62 HD22 LEU 62 8.523 -2.933 9.207 503 HD23 LEU 62 HD23 LEU 62 9.385 -4.431 9.565 504 H MET 63 H MET 63 6.585 -1.748 14.431 505 HA MET 63 HA MET 63 4.901 0.421 14.050 506 HB2 MET 63 HB2 MET 63 6.150 -0.422 16.678 507 HB3 MET 63 HB3 MET 63 4.695 0.547 16.493 508 HG2 MET 63 HG2 MET 63 3.542 -1.331 15.486 509 HG3 MET 63 HG3 MET 63 5.012 -2.305 15.581 510 HE1 MET 63 HE1 MET 63 2.345 -3.448 16.778 511 HE2 MET 63 HE2 MET 63 2.923 -4.053 18.332 512 HE3 MET 63 HE3 MET 63 3.915 -4.248 16.885 513 H ASP 64 H ASP 64 8.044 0.422 15.726 514 HA ASP 64 HA ASP 64 8.214 3.152 16.265 515 HB2 ASP 64 HB2 ASP 64 9.685 1.312 17.166 516 HB3 ASP 64 HB3 ASP 64 10.527 1.316 15.624 517 H LYS 65 H LYS 65 9.337 1.326 13.428 518 HA LYS 65 HA LYS 65 10.577 3.406 12.025 519 HB2 LYS 65 HB2 LYS 65 9.104 0.984 10.957 520 HB3 LYS 65 HB3 LYS 65 10.132 2.025 9.983 521 HG2 LYS 65 HG2 LYS 65 12.020 1.449 11.546 522 HG3 LYS 65 HG3 LYS 65 10.951 0.247 12.269 523 HD2 LYS 65 HD2 LYS 65 12.095 -1.035 10.723 524 HD3 LYS 65 HD3 LYS 65 10.664 -0.580 9.799 525 HE2 LYS 65 HE2 LYS 65 13.384 0.738 9.660 526 HE3 LYS 65 HE3 LYS 65 12.691 -0.344 8.456 527 HZ1 LYS 65 HZ1 LYS 65 11.612 2.326 9.201 528 HZ2 LYS 65 HZ2 LYS 65 10.968 1.294 8.030 529 HZ3 LYS 65 HZ3 LYS 65 12.498 1.973 7.807 530 H LEU 66 H LEU 66 7.182 2.471 12.171 531 HA LEU 66 HA LEU 66 6.330 4.346 10.149 532 HB2 LEU 66 HB2 LEU 66 4.743 2.767 12.183 533 HB3 LEU 66 HB3 LEU 66 4.065 3.631 10.813 534 HG LEU 66 HG LEU 66 6.031 1.352 10.532 535 HD11 LEU 66 HD11 LEU 66 4.027 0.495 11.586 536 HD12 LEU 66 HD12 LEU 66 4.104 -0.040 9.908 537 HD13 LEU 66 HD13 LEU 66 3.020 1.273 10.367 538 HD21 LEU 66 HD21 LEU 66 5.986 2.851 8.624 539 HD22 LEU 66 HD22 LEU 66 4.228 2.732 8.541 540 HD23 LEU 66 HD23 LEU 66 5.226 1.316 8.206 541 H ARG 67 H ARG 67 6.585 4.334 13.643 542 HA ARG 67 HA ARG 67 5.016 6.672 14.103 543 HB2 ARG 67 HB2 ARG 67 7.043 5.222 15.813 544 HB3 ARG 67 HB3 ARG 67 6.141 6.630 16.374 545 HG2 ARG 67 HG2 ARG 67 4.032 5.406 15.928 546 HG3 ARG 67 HG3 ARG 67 4.981 3.989 15.490 547 HD2 ARG 67 HD2 ARG 67 5.917 3.913 17.753 548 HD3 ARG 67 HD3 ARG 67 4.989 5.352 18.187 549 HE ARG 67 HE ARG 67 3.417 3.126 17.209 550 HH11 ARG 67 HH11 ARG 67 4.702 4.692 19.991 551 HH12 ARG 67 HH12 ARG 67 3.549 3.977 21.056 552 HH21 ARG 67 HH21 ARG 67 1.934 2.234 18.592 553 HH22 ARG 67 HH22 ARG 67 1.996 2.624 20.275 554 H LYS 68 H LYS 68 8.018 6.358 12.656 555 HA LYS 68 HA LYS 68 9.335 8.681 13.668 556 HB2 LYS 68 HB2 LYS 68 9.743 7.289 11.010 557 HB3 LYS 68 HB3 LYS 68 10.851 8.427 11.767 558 HG2 LYS 68 HG2 LYS 68 10.107 5.693 12.798 559 HG3 LYS 68 HG3 LYS 68 11.639 6.163 12.054 560 HD2 LYS 68 HD2 LYS 68 12.077 7.700 13.906 561 HD3 LYS 68 HD3 LYS 68 10.531 7.270 14.645 562 HE2 LYS 68 HE2 LYS 68 11.309 4.927 14.815 563 HE3 LYS 68 HE3 LYS 68 12.871 5.422 14.165 564 HZ1 LYS 68 HZ1 LYS 68 11.674 6.451 16.678 565 HZ2 LYS 68 HZ2 LYS 68 13.203 6.836 16.072 566 HZ3 LYS 68 HZ3 LYS 68 12.872 5.262 16.593 567 H VAL 69 H VAL 69 6.705 8.295 11.507 568 HA VAL 69 HA VAL 69 7.231 10.606 9.885 569 HB VAL 69 HB VAL 69 4.694 9.000 10.221 570 HG11 VAL 69 HG11 VAL 69 4.125 11.237 9.448 571 HG12 VAL 69 HG12 VAL 69 3.964 10.096 8.115 572 HG13 VAL 69 HG13 VAL 69 5.371 11.155 8.201 573 HG21 VAL 69 HG21 VAL 69 6.828 8.963 8.079 574 HG22 VAL 69 HG22 VAL 69 5.329 8.037 8.044 575 HG23 VAL 69 HG23 VAL 69 6.535 7.710 9.286 576 H GLN 70 H GLN 70 6.966 12.604 10.423 577 HA GLN 70 HA GLN 70 6.224 13.600 12.872 578 HB2 GLN 70 HB2 GLN 70 6.159 15.802 11.740 579 HB3 GLN 70 HB3 GLN 70 7.558 14.836 11.289 580 HG2 GLN 70 HG2 GLN 70 6.222 14.124 9.239 581 HG3 GLN 70 HG3 GLN 70 5.097 15.414 9.658 582 HE21 GLN 70 HE21 GLN 70 5.767 17.567 9.439 583 HE22 GLN 70 HE22 GLN 70 7.165 17.994 8.521 584 H GLY 71 H GLY 71 4.071 12.894 10.186 585 HA2 GLY 71 HA2 GLY 71 1.908 14.492 11.351 586 HA3 GLY 71 HA3 GLY 71 1.905 13.742 9.768 587 H VAL 72 H VAL 72 2.923 11.287 11.689 588 HA VAL 72 HA VAL 72 0.191 10.228 11.878 589 HB VAL 72 HB VAL 72 2.832 8.778 12.196 590 HG11 VAL 72 HG11 VAL 72 1.014 7.734 13.497 591 HG12 VAL 72 HG12 VAL 72 1.509 6.722 12.140 592 HG13 VAL 72 HG13 VAL 72 0.021 7.662 12.042 593 HG21 VAL 72 HG21 VAL 72 0.857 8.792 9.904 594 HG22 VAL 72 HG22 VAL 72 2.311 7.799 10.008 595 HG23 VAL 72 HG23 VAL 72 2.449 9.554 9.907 596 H PHE 73 H PHE 73 -0.831 9.782 13.753 597 HA PHE 73 HA PHE 73 0.680 10.233 16.246 598 HB2 PHE 73 HB2 PHE 73 -1.756 10.846 17.106 599 HB3 PHE 73 HB3 PHE 73 -0.706 12.023 16.337 600 HD1 PHE 73 HD1 PHE 73 -3.693 9.903 15.874 601 HD2 PHE 73 HD2 PHE 73 -1.235 12.961 14.204 602 HE1 PHE 73 HE1 PHE 73 -5.435 10.401 14.206 603 HE2 PHE 73 HE2 PHE 73 -2.975 13.453 12.539 604 HZ PHE 73 HZ PHE 73 -5.076 12.179 12.538 605 H THR 74 H THR 74 -1.073 7.895 14.524 606 HA THR 74 HA THR 74 -1.053 6.221 16.957 607 HB THR 74 HB THR 74 -3.117 5.209 16.558 608 HG1 THR 74 HG1 THR 74 -4.193 5.269 14.627 609 HG21 THR 74 HG21 THR 74 -3.459 7.468 17.423 610 HG22 THR 74 HG22 THR 74 -4.780 7.016 16.344 611 HG23 THR 74 HG23 THR 74 -3.513 8.103 15.776 612 H VAL 75 H VAL 75 0.213 4.528 16.691 613 HA VAL 75 HA VAL 75 0.031 2.983 14.201 614 HB VAL 75 HB VAL 75 2.673 3.565 15.581 615 HG11 VAL 75 HG11 VAL 75 2.069 2.006 13.062 616 HG12 VAL 75 HG12 VAL 75 2.577 1.327 14.609 617 HG13 VAL 75 HG13 VAL 75 3.676 2.358 13.694 618 HG21 VAL 75 HG21 VAL 75 1.892 5.539 14.358 619 HG22 VAL 75 HG22 VAL 75 1.651 4.560 12.911 620 HG23 VAL 75 HG23 VAL 75 3.279 4.808 13.543 621 H GLU 76 H GLU 76 -0.952 1.192 14.973 622 HA GLU 76 HA GLU 76 0.062 -0.039 17.458 623 HB2 GLU 76 HB2 GLU 76 -2.323 -0.468 18.123 624 HB3 GLU 76 HB3 GLU 76 -1.847 1.224 18.160 625 HG2 GLU 76 HG2 GLU 76 -2.949 1.601 16.016 626 HG3 GLU 76 HG3 GLU 76 -3.409 -0.102 15.944 627 H ARG 77 H ARG 77 -0.850 -2.269 17.815 628 HA ARG 77 HA ARG 77 -0.673 -3.772 15.326 629 HB2 ARG 77 HB2 ARG 77 0.674 -4.541 17.197 630 HB3 ARG 77 HB3 ARG 77 -0.757 -4.677 18.214 631 HG2 ARG 77 HG2 ARG 77 -1.628 -6.442 16.747 632 HG3 ARG 77 HG3 ARG 77 -0.184 -6.315 15.742 633 HD2 ARG 77 HD2 ARG 77 -0.029 -8.204 17.285 634 HD3 ARG 77 HD3 ARG 77 1.203 -6.993 17.633 635 HE ARG 77 HE ARG 77 0.059 -6.420 19.601 636 HH11 ARG 77 HH11 ARG 77 -1.542 -8.970 17.902 637 HH12 ARG 77 HH12 ARG 77 -2.414 -9.487 19.302 638 HH21 ARG 77 HH21 ARG 77 -1.085 -7.076 21.362 639 HH22 ARG 77 HH22 ARG 77 -2.183 -8.403 21.233 640 H LEU 78 H LEU 78 -2.287 -4.824 14.359 641 HA LEU 78 HA LEU 78 -4.988 -4.707 15.434 642 HB2 LEU 78 HB2 LEU 78 -3.902 -5.795 12.827 643 HB3 LEU 78 HB3 LEU 78 -5.607 -5.738 13.247 644 HG LEU 78 HG LEU 78 -3.800 -3.330 12.912 645 HD11 LEU 78 HD11 LEU 78 -5.098 -2.892 10.888 646 HD12 LEU 78 HD12 LEU 78 -5.980 -4.401 11.118 647 HD13 LEU 78 HD13 LEU 78 -4.248 -4.432 10.786 648 HD21 LEU 78 HD21 LEU 78 -5.578 -2.957 14.560 649 HD22 LEU 78 HD22 LEU 78 -6.783 -3.477 13.380 650 HD23 LEU 78 HD23 LEU 78 -5.842 -2.011 13.096 651 H SER 79 H SER 79 -5.662 -6.248 16.795 652 HA SER 79 HA SER 79 -4.318 -8.821 16.943 653 HB2 SER 79 HB2 SER 79 -5.731 -9.206 18.929 654 HB3 SER 79 HB3 SER 79 -4.920 -7.643 19.023 655 HG SER 79 HG SER 79 -7.328 -7.852 19.486 656 H ASN 80 H ASN 80 -7.772 -7.931 16.844 657 HA ASN 80 HA ASN 80 -8.556 -10.517 15.880 658 HB2 ASN 80 HB2 ASN 80 -10.193 -7.970 16.007 659 HB3 ASN 80 HB3 ASN 80 -10.814 -9.614 15.872 660 HD21 ASN 80 HD21 ASN 80 -11.271 -7.565 17.921 661 HD22 ASN 80 HD22 ASN 80 -10.817 -8.301 19.415 662 H LEU 81 H LEU 81 -7.814 -11.014 13.866 663 HA LEU 81 HA LEU 81 -7.748 -8.988 11.783 664 HB2 LEU 81 HB2 LEU 81 -6.929 -11.893 11.689 665 HB3 LEU 81 HB3 LEU 81 -6.617 -10.699 10.441 666 HG LEU 81 HG LEU 81 -5.427 -10.804 13.214 667 HD11 LEU 81 HD11 LEU 81 -3.306 -10.962 11.969 668 HD12 LEU 81 HD12 LEU 81 -4.212 -11.008 10.453 669 HD13 LEU 81 HD13 LEU 81 -4.390 -12.312 11.631 670 HD21 LEU 81 HD21 LEU 81 -4.185 -8.770 12.597 671 HD22 LEU 81 HD22 LEU 81 -5.922 -8.484 12.699 672 HD23 LEU 81 HD23 LEU 81 -5.146 -8.642 11.123 673 H GLU 82 H GLU 82 -8.714 -9.186 9.731 674 HA GLU 82 HA GLU 82 -11.343 -10.410 9.732 675 HB2 GLU 82 HB2 GLU 82 -11.581 -9.255 7.535 676 HB3 GLU 82 HB3 GLU 82 -11.138 -8.166 8.844 677 HG2 GLU 82 HG2 GLU 82 -8.912 -7.979 8.078 678 HG3 GLU 82 HG3 GLU 82 -9.085 -9.361 6.998 679 H HIS 83 H HIS 83 -8.720 -11.998 9.470 680 HA HIS 83 HA HIS 83 -8.917 -13.022 6.734 681 HB2 HIS 83 HB2 HIS 83 -6.821 -13.372 8.881 682 HB3 HIS 83 HB3 HIS 83 -6.750 -14.155 7.308 683 HD1 HIS 83 HD1 HIS 83 -5.187 -12.947 5.817 684 HD2 HIS 83 HD2 HIS 83 -7.222 -10.345 8.337 685 HE1 HIS 83 HE1 HIS 83 -4.344 -10.658 5.251 686 HE2 HIS 83 HE2 HIS 83 -5.831 -9.110 6.546 687 H HIS 84 H HIS 84 -10.567 -13.777 9.376 688 HA HIS 84 HA HIS 84 -10.101 -16.647 9.453 689 HB2 HIS 84 HB2 HIS 84 -12.170 -14.924 10.841 690 HB3 HIS 84 HB3 HIS 84 -12.007 -16.660 11.080 691 HD1 HIS 84 HD1 HIS 84 -10.624 -17.274 13.036 692 HD2 HIS 84 HD2 HIS 84 -9.579 -13.550 11.522 693 HE1 HIS 84 HE1 HIS 84 -8.838 -16.402 14.567 694 HE2 HIS 84 HE2 HIS 84 -8.092 -14.244 13.516 695 H HIS 85 H HIS 85 -10.559 -16.581 7.002 696 HA HIS 85 HA HIS 85 -13.363 -16.573 6.266 697 HB2 HIS 85 HB2 HIS 85 -10.931 -17.431 4.666 698 HB3 HIS 85 HB3 HIS 85 -12.555 -17.195 4.024 699 HD1 HIS 85 HD1 HIS 85 -9.436 -15.476 4.308 700 HD2 HIS 85 HD2 HIS 85 -13.429 -14.339 4.549 701 HE1 HIS 85 HE1 HIS 85 -9.456 -12.989 3.957 702 HE2 HIS 85 HE2 HIS 85 -11.857 -12.306 4.261 703 H HIS 86 H HIS 86 -10.802 -18.990 6.701 704 HA HIS 86 HA HIS 86 -10.852 -21.142 7.417 705 HB2 HIS 86 HB2 HIS 86 -12.216 -20.026 9.200 706 HB3 HIS 86 HB3 HIS 86 -13.668 -20.503 8.327 707 HD1 HIS 86 HD1 HIS 86 -10.657 -22.118 9.975 708 HD2 HIS 86 HD2 HIS 86 -14.615 -22.960 9.041 709 HE1 HIS 86 HE1 HIS 86 -11.129 -24.350 11.011 710 HE2 HIS 86 HE2 HIS 86 -13.465 -24.914 10.284 711 H HIS 87 H HIS 87 -12.243 -20.357 4.719 712 HA HIS 87 HA HIS 87 -14.235 -22.374 4.319 713 HB2 HIS 87 HB2 HIS 87 -14.019 -20.117 3.107 714 HB3 HIS 87 HB3 HIS 87 -12.785 -20.896 2.123 715 HD1 HIS 87 HD1 HIS 87 -16.459 -21.259 2.989 716 HD2 HIS 87 HD2 HIS 87 -13.772 -22.328 0.006 717 HE1 HIS 87 HE1 HIS 87 -17.849 -22.260 1.157 718 HE2 HIS 87 HE2 HIS 87 -16.217 -22.853 -0.658 719 H HIS 88 H HIS 88 -13.672 -24.455 4.358 720 HA HIS 88 HA HIS 88 -11.647 -25.472 2.532 721 HB2 HIS 88 HB2 HIS 88 -10.311 -24.991 4.513 722 HB3 HIS 88 HB3 HIS 88 -11.441 -25.872 5.530 723 HD1 HIS 88 HD1 HIS 88 -8.587 -26.346 3.188 724 HD2 HIS 88 HD2 HIS 88 -11.217 -28.696 5.383 725 HE1 HIS 88 HE1 HIS 88 -7.585 -28.644 3.200 726 HE2 HIS 88 HE2 HIS 88 -9.098 -29.998 4.683 727 H1 MET 1 H1 MET 1 -14.082 21.327 -10.753 728 H2 MET 1 H2 MET 1 -14.393 20.803 -9.178 729 H3 MET 1 H3 MET 1 -14.814 19.826 -10.492 730 HA MET 1 HA MET 1 -12.057 20.575 -9.705 731 HB2 MET 1 HB2 MET 1 -13.462 17.894 -9.539 732 HB3 MET 1 HB3 MET 1 -11.792 18.210 -9.092 733 HG2 MET 1 HG2 MET 1 -13.168 18.051 -7.120 734 HG3 MET 1 HG3 MET 1 -12.565 19.700 -7.301 735 HE1 MET 1 HE1 MET 1 -16.138 20.150 -5.687 736 HE2 MET 1 HE2 MET 1 -14.405 20.407 -5.477 737 HE3 MET 1 HE3 MET 1 -15.071 18.774 -5.410 738 H THR 2 H THR 2 -10.496 20.187 -11.197 739 HA THR 2 HA THR 2 -11.240 19.214 -13.833 740 HB THR 2 HB THR 2 -8.498 19.989 -12.786 741 HG1 THR 2 HG1 THR 2 -10.470 21.574 -13.032 742 HG21 THR 2 HG21 THR 2 -7.916 20.260 -15.165 743 HG22 THR 2 HG22 THR 2 -9.514 19.667 -15.621 744 HG23 THR 2 HG23 THR 2 -8.376 18.597 -14.800 745 H ASP 3 H ASP 3 -9.729 18.008 -10.961 746 HA ASP 3 HA ASP 3 -8.765 15.571 -12.233 747 HB2 ASP 3 HB2 ASP 3 -8.734 16.427 -9.324 748 HB3 ASP 3 HB3 ASP 3 -7.954 14.986 -9.971 749 H PHE 4 H PHE 4 -9.542 13.496 -11.737 750 HA PHE 4 HA PHE 4 -12.046 13.329 -10.208 751 HB2 PHE 4 HB2 PHE 4 -12.923 11.688 -11.800 752 HB3 PHE 4 HB3 PHE 4 -12.605 13.219 -12.603 753 HD1 PHE 4 HD1 PHE 4 -11.537 9.723 -12.249 754 HD2 PHE 4 HD2 PHE 4 -10.891 13.406 -14.294 755 HE1 PHE 4 HE1 PHE 4 -10.147 8.554 -13.910 756 HE2 PHE 4 HE2 PHE 4 -9.508 12.239 -15.959 757 HZ PHE 4 HZ PHE 4 -9.116 9.815 -15.760 758 H LEU 5 H LEU 5 -12.419 11.233 -9.234 759 HA LEU 5 HA LEU 5 -9.956 10.070 -8.283 760 HB2 LEU 5 HB2 LEU 5 -11.829 10.498 -6.771 761 HB3 LEU 5 HB3 LEU 5 -12.831 9.392 -7.687 762 HG LEU 5 HG LEU 5 -11.421 7.505 -7.009 763 HD11 LEU 5 HD11 LEU 5 -9.622 7.781 -5.395 764 HD12 LEU 5 HD12 LEU 5 -9.846 9.531 -5.417 765 HD13 LEU 5 HD13 LEU 5 -9.283 8.695 -6.864 766 HD21 LEU 5 HD21 LEU 5 -13.308 8.137 -5.585 767 HD22 LEU 5 HD22 LEU 5 -12.257 9.214 -4.663 768 HD23 LEU 5 HD23 LEU 5 -11.979 7.473 -4.636 769 H ALA 6 H ALA 6 -8.945 8.778 -9.666 770 HA ALA 6 HA ALA 6 -10.429 6.919 -11.365 771 HB1 ALA 6 HB1 ALA 6 -8.312 6.626 -12.539 772 HB2 ALA 6 HB2 ALA 6 -7.499 7.637 -11.344 773 HB3 ALA 6 HB3 ALA 6 -8.730 8.333 -12.398 774 H GLY 7 H GLY 7 -10.205 4.701 -11.291 775 HA2 GLY 7 HA2 GLY 7 -8.686 3.594 -8.999 776 HA3 GLY 7 HA3 GLY 7 -10.202 2.925 -9.582 777 H ILE 8 H ILE 8 -7.270 1.965 -9.332 778 HA ILE 8 HA ILE 8 -7.099 0.786 -12.036 779 HB ILE 8 HB ILE 8 -4.748 1.414 -10.225 780 HG12 ILE 8 HG12 ILE 8 -5.655 2.820 -12.757 781 HG13 ILE 8 HG13 ILE 8 -5.754 3.480 -11.128 782 HG21 ILE 8 HG21 ILE 8 -3.383 0.836 -12.198 783 HG22 ILE 8 HG22 ILE 8 -4.851 0.389 -13.068 784 HG23 ILE 8 HG23 ILE 8 -4.358 -0.525 -11.642 785 HD11 ILE 8 HD11 ILE 8 -3.877 4.420 -12.339 786 HD12 ILE 8 HD12 ILE 8 -3.224 2.807 -12.623 787 HD13 ILE 8 HD13 ILE 8 -3.307 3.448 -10.982 788 H ARG 9 H ARG 9 -6.652 -1.399 -12.169 789 HA ARG 9 HA ARG 9 -6.507 -2.907 -9.630 790 HB2 ARG 9 HB2 ARG 9 -8.612 -3.386 -10.608 791 HB3 ARG 9 HB3 ARG 9 -7.929 -3.508 -12.222 792 HG2 ARG 9 HG2 ARG 9 -6.861 -5.610 -11.653 793 HG3 ARG 9 HG3 ARG 9 -7.419 -5.475 -9.983 794 HD2 ARG 9 HD2 ARG 9 -9.673 -5.784 -10.599 795 HD3 ARG 9 HD3 ARG 9 -9.337 -5.484 -12.304 796 HE ARG 9 HE ARG 9 -7.928 -7.763 -11.413 797 HH11 ARG 9 HH11 ARG 9 -11.087 -6.688 -12.261 798 HH12 ARG 9 HH12 ARG 9 -11.620 -8.264 -12.731 799 HH21 ARG 9 HH21 ARG 9 -8.610 -9.774 -12.054 800 HH22 ARG 9 HH22 ARG 9 -10.232 -9.997 -12.607 801 H ILE 10 H ILE 10 -4.592 -3.834 -9.322 802 HA ILE 10 HA ILE 10 -2.940 -4.602 -11.661 803 HB ILE 10 HB ILE 10 -2.012 -4.114 -8.818 804 HG12 ILE 10 HG12 ILE 10 -1.787 -2.213 -11.170 805 HG13 ILE 10 HG13 ILE 10 -2.962 -2.050 -9.868 806 HG21 ILE 10 HG21 ILE 10 0.227 -3.996 -9.818 807 HG22 ILE 10 HG22 ILE 10 -0.463 -4.357 -11.401 808 HG23 ILE 10 HG23 ILE 10 -0.538 -5.559 -10.112 809 HD11 ILE 10 HD11 ILE 10 0.034 -1.949 -9.573 810 HD12 ILE 10 HD12 ILE 10 -1.136 -1.804 -8.259 811 HD13 ILE 10 HD13 ILE 10 -1.073 -0.577 -9.523 812 H VAL 11 H VAL 11 -2.930 -6.800 -12.021 813 HA VAL 11 HA VAL 11 -2.877 -8.554 -9.643 814 HB VAL 11 HB VAL 11 -4.275 -9.030 -12.278 815 HG11 VAL 11 HG11 VAL 11 -3.726 -11.043 -10.091 816 HG12 VAL 11 HG12 VAL 11 -3.070 -11.075 -11.727 817 HG13 VAL 11 HG13 VAL 11 -4.800 -11.296 -11.468 818 HG21 VAL 11 HG21 VAL 11 -6.236 -9.381 -10.843 819 HG22 VAL 11 HG22 VAL 11 -5.534 -7.783 -10.587 820 HG23 VAL 11 HG23 VAL 11 -5.248 -9.071 -9.412 821 H GLY 12 H GLY 12 -0.969 -9.413 -9.374 822 HA2 GLY 12 HA2 GLY 12 0.515 -10.483 -11.690 823 HA3 GLY 12 HA3 GLY 12 1.326 -9.382 -10.585 824 H GLU 13 H GLU 13 2.519 -11.738 -10.855 825 HA GLU 13 HA GLU 13 1.467 -13.800 -9.171 826 HB2 GLU 13 HB2 GLU 13 3.560 -14.978 -9.628 827 HB3 GLU 13 HB3 GLU 13 2.858 -14.331 -11.105 828 HG2 GLU 13 HG2 GLU 13 4.454 -12.441 -11.004 829 HG3 GLU 13 HG3 GLU 13 5.183 -13.161 -9.567 830 H ASP 14 H ASP 14 1.853 -14.268 -7.071 831 HA ASP 14 HA ASP 14 3.070 -12.341 -5.358 832 HB2 ASP 14 HB2 ASP 14 1.206 -13.709 -4.581 833 HB3 ASP 14 HB3 ASP 14 2.145 -15.179 -4.824 834 H LYS 15 H LYS 15 5.200 -12.079 -5.008 835 HA LYS 15 HA LYS 15 6.965 -14.416 -4.943 836 HB2 LYS 15 HB2 LYS 15 7.159 -12.155 -6.882 837 HB3 LYS 15 HB3 LYS 15 8.632 -12.927 -6.324 838 HG2 LYS 15 HG2 LYS 15 7.828 -15.076 -7.150 839 HG3 LYS 15 HG3 LYS 15 6.326 -14.314 -7.688 840 HD2 LYS 15 HD2 LYS 15 7.887 -14.598 -9.547 841 HD3 LYS 15 HD3 LYS 15 7.591 -12.891 -9.225 842 HE2 LYS 15 HE2 LYS 15 9.715 -12.808 -7.948 843 HE3 LYS 15 HE3 LYS 15 10.011 -14.491 -8.386 844 HZ1 LYS 15 HZ1 LYS 15 11.193 -13.050 -9.871 845 HZ2 LYS 15 HZ2 LYS 15 9.786 -12.189 -10.248 846 HZ3 LYS 15 HZ3 LYS 15 9.946 -13.802 -10.732 847 H ASN 16 H ASN 16 9.231 -13.777 -4.501 848 HA ASN 16 HA ASN 16 9.866 -13.068 -2.068 849 HB2 ASN 16 HB2 ASN 16 12.075 -12.196 -3.033 850 HB3 ASN 16 HB3 ASN 16 11.561 -13.813 -3.513 851 HD21 ASN 16 HD21 ASN 16 12.532 -13.919 -5.482 852 HD22 ASN 16 HD22 ASN 16 12.176 -12.864 -6.800 853 H GLY 17 H GLY 17 9.228 -10.568 -4.500 854 HA2 GLY 17 HA2 GLY 17 8.782 -8.635 -2.367 855 HA3 GLY 17 HA3 GLY 17 10.160 -8.284 -3.398 856 H MET 18 H MET 18 7.231 -9.787 -4.613 857 HA MET 18 HA MET 18 6.972 -7.755 -6.625 858 HB2 MET 18 HB2 MET 18 5.516 -10.278 -5.935 859 HB3 MET 18 HB3 MET 18 4.721 -9.129 -6.996 860 HG2 MET 18 HG2 MET 18 7.424 -10.361 -7.474 861 HG3 MET 18 HG3 MET 18 5.914 -10.850 -8.243 862 HE1 MET 18 HE1 MET 18 4.428 -9.092 -9.713 863 HE2 MET 18 HE2 MET 18 5.001 -7.479 -10.134 864 HE3 MET 18 HE3 MET 18 4.605 -7.864 -8.458 865 H THR 19 H THR 19 4.836 -8.710 -3.910 866 HA THR 19 HA THR 19 2.961 -6.620 -4.265 867 HB THR 19 HB THR 19 2.245 -7.077 -1.952 868 HG1 THR 19 HG1 THR 19 3.562 -7.979 -0.554 869 HG21 THR 19 HG21 THR 19 1.699 -9.454 -2.191 870 HG22 THR 19 HG22 THR 19 2.927 -9.622 -3.445 871 HG23 THR 19 HG23 THR 19 1.508 -8.615 -3.731 872 H ASN 20 H ASN 20 6.085 -6.755 -2.773 873 HA ASN 20 HA ASN 20 5.881 -4.308 -1.295 874 HB2 ASN 20 HB2 ASN 20 8.253 -6.001 -2.129 875 HB3 ASN 20 HB3 ASN 20 8.381 -4.581 -1.097 876 HD21 ASN 20 HD21 ASN 20 7.767 -4.722 1.020 877 HD22 ASN 20 HD22 ASN 20 7.357 -6.211 1.791 878 H GLN 21 H GLN 21 7.436 -5.257 -4.367 879 HA GLN 21 HA GLN 21 8.522 -2.707 -4.908 880 HB2 GLN 21 HB2 GLN 21 9.098 -3.542 -7.056 881 HB3 GLN 21 HB3 GLN 21 9.288 -4.865 -5.926 882 HG2 GLN 21 HG2 GLN 21 7.225 -5.860 -6.683 883 HG3 GLN 21 HG3 GLN 21 6.896 -4.474 -7.721 884 HE21 GLN 21 HE21 GLN 21 8.904 -7.280 -7.260 885 HE22 GLN 21 HE22 GLN 21 9.503 -7.352 -8.876 886 H ILE 22 H ILE 22 5.476 -4.220 -5.820 887 HA ILE 22 HA ILE 22 4.639 -2.429 -7.796 888 HB ILE 22 HB ILE 22 3.162 -4.264 -5.930 889 HG12 ILE 22 HG12 ILE 22 4.424 -5.256 -7.780 890 HG13 ILE 22 HG13 ILE 22 2.695 -5.471 -8.032 891 HG21 ILE 22 HG21 ILE 22 1.078 -3.821 -7.166 892 HG22 ILE 22 HG22 ILE 22 1.869 -2.485 -8.004 893 HG23 ILE 22 HG23 ILE 22 1.627 -2.413 -6.258 894 HD11 ILE 22 HD11 ILE 22 3.870 -4.873 -10.086 895 HD12 ILE 22 HD12 ILE 22 4.392 -3.361 -9.344 896 HD13 ILE 22 HD13 ILE 22 2.677 -3.657 -9.633 897 H THR 23 H THR 23 3.752 -2.401 -4.315 898 HA THR 23 HA THR 23 2.290 0.031 -4.591 899 HB THR 23 HB THR 23 3.336 -1.124 -1.991 900 HG1 THR 23 HG1 THR 23 2.083 -2.723 -2.926 901 HG21 THR 23 HG21 THR 23 1.374 0.036 -1.040 902 HG22 THR 23 HG22 THR 23 1.021 0.712 -2.630 903 HG23 THR 23 HG23 THR 23 2.509 1.158 -1.795 904 H GLY 24 H GLY 24 5.616 -0.743 -3.836 905 HA2 GLY 24 HA2 GLY 24 6.533 1.780 -2.993 906 HA3 GLY 24 HA3 GLY 24 7.495 0.583 -3.850 907 H VAL 25 H VAL 25 6.256 0.434 -6.289 908 HA VAL 25 HA VAL 25 7.103 2.742 -7.670 909 HB VAL 25 HB VAL 25 5.222 0.542 -8.573 910 HG11 VAL 25 HG11 VAL 25 6.647 2.637 -10.224 911 HG12 VAL 25 HG12 VAL 25 4.907 2.529 -9.955 912 HG13 VAL 25 HG13 VAL 25 5.737 1.269 -10.867 913 HG21 VAL 25 HG21 VAL 25 7.446 -0.258 -7.966 914 HG22 VAL 25 HG22 VAL 25 8.187 0.959 -9.004 915 HG23 VAL 25 HG23 VAL 25 7.225 -0.340 -9.715 916 H ILE 26 H ILE 26 3.936 1.810 -6.415 917 HA ILE 26 HA ILE 26 2.339 3.776 -7.609 918 HB ILE 26 HB ILE 26 2.047 2.644 -4.811 919 HG12 ILE 26 HG12 ILE 26 2.115 0.870 -6.511 920 HG13 ILE 26 HG13 ILE 26 0.499 1.021 -5.836 921 HG21 ILE 26 HG21 ILE 26 0.710 4.646 -5.108 922 HG22 ILE 26 HG22 ILE 26 -0.336 3.227 -5.060 923 HG23 ILE 26 HG23 ILE 26 0.029 4.004 -6.602 924 HD11 ILE 26 HD11 ILE 26 1.415 2.095 -8.495 925 HD12 ILE 26 HD12 ILE 26 -0.207 2.259 -7.822 926 HD13 ILE 26 HD13 ILE 26 0.424 0.663 -8.225 927 H SER 27 H SER 27 4.252 3.933 -4.603 928 HA SER 27 HA SER 27 3.438 6.534 -3.828 929 HB2 SER 27 HB2 SER 27 5.235 6.514 -2.249 930 HB3 SER 27 HB3 SER 27 4.649 4.857 -2.355 931 HG SER 27 HG SER 27 6.423 4.319 -3.585 932 H LYS 28 H LYS 28 5.612 5.468 -6.261 933 HA LYS 28 HA LYS 28 7.157 7.895 -6.446 934 HB2 LYS 28 HB2 LYS 28 6.907 5.604 -8.413 935 HB3 LYS 28 HB3 LYS 28 8.138 6.861 -8.439 936 HG2 LYS 28 HG2 LYS 28 9.053 6.058 -6.338 937 HG3 LYS 28 HG3 LYS 28 7.770 4.851 -6.216 938 HD2 LYS 28 HD2 LYS 28 9.840 3.839 -7.008 939 HD3 LYS 28 HD3 LYS 28 8.596 3.765 -8.254 940 HE2 LYS 28 HE2 LYS 28 10.779 4.367 -9.185 941 HE3 LYS 28 HE3 LYS 28 9.611 5.670 -9.394 942 HZ1 LYS 28 HZ1 LYS 28 10.615 6.914 -7.688 943 HZ2 LYS 28 HZ2 LYS 28 11.896 6.331 -8.622 944 HZ3 LYS 28 HZ3 LYS 28 11.533 5.604 -7.140 945 H PHE 29 H PHE 29 4.002 7.208 -7.323 946 HA PHE 29 HA PHE 29 3.865 8.372 -9.916 947 HB2 PHE 29 HB2 PHE 29 1.772 7.772 -7.836 948 HB3 PHE 29 HB3 PHE 29 1.365 8.576 -9.347 949 HD1 PHE 29 HD1 PHE 29 3.843 6.664 -10.523 950 HD2 PHE 29 HD2 PHE 29 0.006 6.154 -8.741 951 HE1 PHE 29 HE1 PHE 29 3.615 4.492 -11.648 952 HE2 PHE 29 HE2 PHE 29 -0.220 3.975 -9.861 953 HZ PHE 29 HZ PHE 29 1.582 3.144 -11.315 954 H ASP 30 H ASP 30 2.417 10.261 -10.395 955 HA ASP 30 HA ASP 30 3.486 12.628 -9.164 956 HB2 ASP 30 HB2 ASP 30 1.189 12.647 -11.108 957 HB3 ASP 30 HB3 ASP 30 2.516 13.792 -10.949 958 H THR 31 H THR 31 0.890 10.654 -8.383 959 HA THR 31 HA THR 31 -0.789 12.877 -7.393 960 HB THR 31 HB THR 31 -1.924 11.763 -9.176 961 HG1 THR 31 HG1 THR 31 -3.695 11.828 -8.049 962 HG21 THR 31 HG21 THR 31 -2.447 9.345 -9.098 963 HG22 THR 31 HG22 THR 31 -1.382 9.187 -7.701 964 HG23 THR 31 HG23 THR 31 -0.723 9.679 -9.264 965 H ASN 32 H ASN 32 -2.430 12.034 -5.699 966 HA ASN 32 HA ASN 32 -0.790 10.995 -3.495 967 HB2 ASN 32 HB2 ASN 32 -1.703 13.181 -3.083 968 HB3 ASN 32 HB3 ASN 32 -3.318 12.657 -3.547 969 HD21 ASN 32 HD21 ASN 32 -0.864 12.510 -1.084 970 HD22 ASN 32 HD22 ASN 32 -1.895 11.925 0.171 971 H ILE 33 H ILE 33 -1.209 9.089 -2.543 972 HA ILE 33 HA ILE 33 -3.186 7.312 -3.582 973 HB ILE 33 HB ILE 33 -1.518 7.023 -1.067 974 HG12 ILE 33 HG12 ILE 33 -1.032 5.947 -3.863 975 HG13 ILE 33 HG13 ILE 33 -0.163 7.291 -3.128 976 HG21 ILE 33 HG21 ILE 33 -1.978 4.619 -1.273 977 HG22 ILE 33 HG22 ILE 33 -3.025 4.935 -2.656 978 HG23 ILE 33 HG23 ILE 33 -3.467 5.540 -1.059 979 HD11 ILE 33 HD11 ILE 33 0.706 5.774 -1.412 980 HD12 ILE 33 HD12 ILE 33 1.148 5.263 -3.040 981 HD13 ILE 33 HD13 ILE 33 -0.148 4.433 -2.180 982 H ARG 34 H ARG 34 -5.278 7.959 -3.250 983 HA ARG 34 HA ARG 34 -6.135 8.963 -0.668 984 HB2 ARG 34 HB2 ARG 34 -6.977 9.854 -2.856 985 HB3 ARG 34 HB3 ARG 34 -7.803 8.326 -3.113 986 HG2 ARG 34 HG2 ARG 34 -9.231 10.203 -2.268 987 HG3 ARG 34 HG3 ARG 34 -9.296 8.722 -1.318 988 HD2 ARG 34 HD2 ARG 34 -9.140 10.968 -0.070 989 HD3 ARG 34 HD3 ARG 34 -8.094 9.650 0.450 990 HE ARG 34 HE ARG 34 -6.545 11.037 -1.300 991 HH11 ARG 34 HH11 ARG 34 -8.432 12.066 1.392 992 HH12 ARG 34 HH12 ARG 34 -7.237 13.191 1.930 993 HH21 ARG 34 HH21 ARG 34 -5.017 12.475 -0.580 994 HH22 ARG 34 HH22 ARG 34 -5.326 13.415 0.837 995 H THR 35 H THR 35 -6.348 5.998 -2.511 996 HA THR 35 HA THR 35 -6.887 4.517 -0.077 997 HB THR 35 HB THR 35 -8.741 4.030 -2.420 998 HG1 THR 35 HG1 THR 35 -9.038 5.744 -0.200 999 HG21 THR 35 HG21 THR 35 -10.029 2.719 -0.801 1000 HG22 THR 35 HG22 THR 35 -8.853 3.106 0.455 1001 HG23 THR 35 HG23 THR 35 -8.374 2.120 -0.926 1002 H ILE 36 H ILE 36 -6.168 2.336 -0.238 1003 HA ILE 36 HA ILE 36 -5.692 1.181 -2.834 1004 HB ILE 36 HB ILE 36 -3.611 2.543 -2.411 1005 HG12 ILE 36 HG12 ILE 36 -3.067 -0.429 -2.580 1006 HG13 ILE 36 HG13 ILE 36 -3.770 0.495 -3.905 1007 HG21 ILE 36 HG21 ILE 36 -1.925 1.625 -0.860 1008 HG22 ILE 36 HG22 ILE 36 -3.124 0.487 -0.247 1009 HG23 ILE 36 HG23 ILE 36 -3.358 2.222 -0.019 1010 HD11 ILE 36 HD11 ILE 36 -1.404 0.227 -4.241 1011 HD12 ILE 36 HD12 ILE 36 -1.066 0.933 -2.660 1012 HD13 ILE 36 HD13 ILE 36 -1.776 1.923 -3.935 1013 H VAL 37 H VAL 37 -5.877 -0.986 -2.810 1014 HA VAL 37 HA VAL 37 -5.879 -2.385 -0.204 1015 HB VAL 37 HB VAL 37 -7.928 -2.730 -2.411 1016 HG11 VAL 37 HG11 VAL 37 -7.734 -4.109 0.273 1017 HG12 VAL 37 HG12 VAL 37 -7.454 -4.850 -1.305 1018 HG13 VAL 37 HG13 VAL 37 -9.062 -4.272 -0.877 1019 HG21 VAL 37 HG21 VAL 37 -8.302 -0.673 -1.181 1020 HG22 VAL 37 HG22 VAL 37 -8.218 -1.543 0.353 1021 HG23 VAL 37 HG23 VAL 37 -9.544 -1.857 -0.770 1022 H LEU 38 H LEU 38 -4.088 -3.660 -0.424 1023 HA LEU 38 HA LEU 38 -3.863 -5.317 -2.862 1024 HB2 LEU 38 HB2 LEU 38 -1.936 -3.836 -2.385 1025 HB3 LEU 38 HB3 LEU 38 -1.720 -4.620 -0.835 1026 HG LEU 38 HG LEU 38 -1.532 -6.201 -3.403 1027 HD11 LEU 38 HD11 LEU 38 0.715 -4.685 -2.065 1028 HD12 LEU 38 HD12 LEU 38 0.012 -4.325 -3.642 1029 HD13 LEU 38 HD13 LEU 38 0.891 -5.834 -3.394 1030 HD21 LEU 38 HD21 LEU 38 -0.328 -6.584 -0.652 1031 HD22 LEU 38 HD22 LEU 38 -0.055 -7.635 -2.042 1032 HD23 LEU 38 HD23 LEU 38 -1.666 -7.499 -1.345 1033 H ASN 39 H ASN 39 -4.172 -7.461 -2.708 1034 HA ASN 39 HA ASN 39 -3.500 -8.857 -0.234 1035 HB2 ASN 39 HB2 ASN 39 -5.605 -10.029 -0.046 1036 HB3 ASN 39 HB3 ASN 39 -5.940 -8.301 -0.062 1037 HD21 ASN 39 HD21 ASN 39 -6.909 -7.395 -1.896 1038 HD22 ASN 39 HD22 ASN 39 -7.730 -8.369 -3.058 1039 H ALA 40 H ALA 40 -2.925 -11.021 -0.538 1040 HA ALA 40 HA ALA 40 -2.682 -11.879 -3.367 1041 HB1 ALA 40 HB1 ALA 40 -0.869 -12.574 -1.047 1042 HB2 ALA 40 HB2 ALA 40 -0.529 -11.367 -2.287 1043 HB3 ALA 40 HB3 ALA 40 -0.660 -13.069 -2.727 1044 H LYS 41 H LYS 41 -3.919 -13.523 -3.900 1045 HA LYS 41 HA LYS 41 -4.180 -15.805 -2.083 1046 HB2 LYS 41 HB2 LYS 41 -6.504 -15.941 -2.177 1047 HB3 LYS 41 HB3 LYS 41 -6.240 -14.211 -2.035 1048 HG2 LYS 41 HG2 LYS 41 -6.831 -15.684 -4.603 1049 HG3 LYS 41 HG3 LYS 41 -8.000 -14.776 -3.646 1050 HD2 LYS 41 HD2 LYS 41 -6.696 -12.719 -4.022 1051 HD3 LYS 41 HD3 LYS 41 -5.545 -13.636 -4.997 1052 HE2 LYS 41 HE2 LYS 41 -8.474 -13.201 -5.601 1053 HE3 LYS 41 HE3 LYS 41 -7.108 -12.466 -6.436 1054 HZ1 LYS 41 HZ1 LYS 41 -7.932 -14.290 -7.724 1055 HZ2 LYS 41 HZ2 LYS 41 -7.819 -15.354 -6.411 1056 HZ3 LYS 41 HZ3 LYS 41 -6.416 -14.723 -7.111 1057 H ASP 42 H ASP 42 -4.605 -17.827 -3.183 1058 HA ASP 42 HA ASP 42 -4.273 -19.378 -4.820 1059 HB2 ASP 42 HB2 ASP 42 -4.909 -17.175 -6.799 1060 HB3 ASP 42 HB3 ASP 42 -5.032 -18.910 -7.068 1061 H GLY 43 H GLY 43 -2.075 -17.352 -4.046 1062 HA2 GLY 43 HA2 GLY 43 0.195 -17.237 -4.548 1063 HA3 GLY 43 HA3 GLY 43 -0.095 -18.228 -5.970 1064 H ILE 44 H ILE 44 -2.187 -15.583 -5.770 1065 HA ILE 44 HA ILE 44 -0.474 -13.852 -7.447 1066 HB ILE 44 HB ILE 44 -3.446 -14.154 -7.922 1067 HG12 ILE 44 HG12 ILE 44 -1.215 -15.676 -9.299 1068 HG13 ILE 44 HG13 ILE 44 -2.466 -16.361 -8.260 1069 HG21 ILE 44 HG21 ILE 44 -2.894 -13.204 -10.125 1070 HG22 ILE 44 HG22 ILE 44 -1.196 -13.113 -9.655 1071 HG23 ILE 44 HG23 ILE 44 -2.399 -12.140 -8.809 1072 HD11 ILE 44 HD11 ILE 44 -4.164 -15.689 -9.884 1073 HD12 ILE 44 HD12 ILE 44 -2.955 -16.754 -10.601 1074 HD13 ILE 44 HD13 ILE 44 -2.904 -15.018 -10.919 1075 H PHE 45 H PHE 45 -1.086 -11.557 -7.330 1076 HA PHE 45 HA PHE 45 -2.772 -10.942 -4.979 1077 HB2 PHE 45 HB2 PHE 45 -1.303 -9.173 -4.294 1078 HB3 PHE 45 HB3 PHE 45 -0.329 -10.621 -4.505 1079 HD1 PHE 45 HD2 PHE 45 -1.083 -7.283 -5.801 1080 HD2 PHE 45 HD1 PHE 45 1.305 -10.779 -6.298 1081 HE1 PHE 45 HE2 PHE 45 0.406 -6.048 -7.316 1082 HE2 PHE 45 HE1 PHE 45 2.798 -9.541 -7.814 1083 HZ PHE 45 HZ PHE 45 2.338 -7.178 -8.326 1084 H THR 46 H THR 46 -4.113 -9.177 -5.091 1085 HA THR 46 HA THR 46 -4.134 -7.665 -7.630 1086 HB THR 46 HB THR 46 -6.137 -8.938 -7.663 1087 HG1 THR 46 HG1 THR 46 -7.101 -6.498 -6.597 1088 HG21 THR 46 HG21 THR 46 -7.778 -8.954 -5.839 1089 HG22 THR 46 HG22 THR 46 -6.685 -7.988 -4.849 1090 HG23 THR 46 HG23 THR 46 -6.228 -9.625 -5.323 1091 H CYS 47 H CYS 47 -3.244 -5.743 -7.218 1092 HA CYS 47 HA CYS 47 -3.838 -4.359 -4.704 1093 HB2 CYS 47 HB2 CYS 47 -1.497 -4.406 -5.359 1094 HB3 CYS 47 HB3 CYS 47 -1.878 -3.675 -6.912 1095 HG CYS 47 HG CYS 47 -2.010 -2.182 -3.840 1096 H ASN 48 H ASN 48 -5.763 -3.381 -4.764 1097 HA ASN 48 HA ASN 48 -6.757 -1.956 -7.077 1098 HB2 ASN 48 HB2 ASN 48 -7.796 -2.153 -4.235 1099 HB3 ASN 48 HB3 ASN 48 -8.656 -1.388 -5.568 1100 HD21 ASN 48 HD21 ASN 48 -9.690 -2.650 -7.048 1101 HD22 ASN 48 HD22 ASN 48 -9.861 -4.357 -6.886 1102 H LEU 49 H LEU 49 -5.789 -0.046 -7.562 1103 HA LEU 49 HA LEU 49 -4.927 1.738 -5.393 1104 HB2 LEU 49 HB2 LEU 49 -3.242 1.292 -7.050 1105 HB3 LEU 49 HB3 LEU 49 -4.336 1.718 -8.353 1106 HG LEU 49 HG LEU 49 -4.342 4.067 -7.564 1107 HD11 LEU 49 HD11 LEU 49 -3.874 3.721 -5.212 1108 HD12 LEU 49 HD12 LEU 49 -2.674 4.799 -5.924 1109 HD13 LEU 49 HD13 LEU 49 -2.260 3.116 -5.596 1110 HD21 LEU 49 HD21 LEU 49 -2.090 4.628 -8.313 1111 HD22 LEU 49 HD22 LEU 49 -2.803 3.372 -9.324 1112 HD23 LEU 49 HD23 LEU 49 -1.594 2.948 -8.112 1113 H MET 50 H MET 50 -5.899 3.646 -4.950 1114 HA MET 50 HA MET 50 -7.833 4.739 -6.900 1115 HB2 MET 50 HB2 MET 50 -8.087 4.784 -3.889 1116 HB3 MET 50 HB3 MET 50 -9.188 5.561 -5.016 1117 HG2 MET 50 HG2 MET 50 -8.707 2.604 -4.735 1118 HG3 MET 50 HG3 MET 50 -10.132 3.495 -4.207 1119 HE1 MET 50 HE1 MET 50 -11.506 5.047 -6.073 1120 HE2 MET 50 HE2 MET 50 -11.357 4.783 -7.809 1121 HE3 MET 50 HE3 MET 50 -10.039 5.544 -6.920 1122 H ILE 51 H ILE 51 -7.002 6.544 -7.709 1123 HA ILE 51 HA ILE 51 -5.818 8.542 -5.916 1124 HB ILE 51 HB ILE 51 -4.019 8.934 -7.751 1125 HG12 ILE 51 HG12 ILE 51 -3.294 6.675 -8.758 1126 HG13 ILE 51 HG13 ILE 51 -4.919 6.115 -8.383 1127 HG21 ILE 51 HG21 ILE 51 -3.831 6.537 -5.927 1128 HG22 ILE 51 HG22 ILE 51 -3.508 8.212 -5.485 1129 HG23 ILE 51 HG23 ILE 51 -2.470 7.396 -6.651 1130 HD11 ILE 51 HD11 ILE 51 -4.235 8.428 -10.181 1131 HD12 ILE 51 HD12 ILE 51 -5.853 7.809 -9.843 1132 HD13 ILE 51 HD13 ILE 51 -4.688 6.805 -10.705 1133 H PHE 52 H PHE 52 -5.514 10.687 -7.023 1134 HA PHE 52 HA PHE 52 -7.810 11.179 -8.787 1135 HB2 PHE 52 HB2 PHE 52 -6.228 12.898 -6.902 1136 HB3 PHE 52 HB3 PHE 52 -7.114 13.661 -8.217 1137 HD1 PHE 52 HD2 PHE 52 -9.574 13.361 -8.377 1138 HD2 PHE 52 HD1 PHE 52 -7.362 12.105 -4.957 1139 HE1 PHE 52 HE2 PHE 52 -11.652 13.287 -7.071 1140 HE2 PHE 52 HE1 PHE 52 -9.443 12.025 -3.642 1141 HZ PHE 52 HZ PHE 52 -11.590 12.618 -4.696 1142 H VAL 53 H VAL 53 -7.603 11.755 -10.880 1143 HA VAL 53 HA VAL 53 -4.998 12.778 -11.822 1144 HB VAL 53 HB VAL 53 -4.969 11.445 -13.769 1145 HG11 VAL 53 HG11 VAL 53 -4.965 9.142 -12.964 1146 HG12 VAL 53 HG12 VAL 53 -5.852 9.642 -11.523 1147 HG13 VAL 53 HG13 VAL 53 -4.213 10.237 -11.802 1148 HG21 VAL 53 HG21 VAL 53 -6.744 9.915 -14.441 1149 HG22 VAL 53 HG22 VAL 53 -7.323 11.580 -14.358 1150 HG23 VAL 53 HG23 VAL 53 -7.724 10.443 -13.070 1151 H LYS 54 H LYS 54 -5.063 14.237 -13.530 1152 HA LYS 54 HA LYS 54 -7.429 15.827 -13.726 1153 HB2 LYS 54 HB2 LYS 54 -6.046 17.195 -15.301 1154 HB3 LYS 54 HB3 LYS 54 -5.308 16.924 -13.729 1155 HG2 LYS 54 HG2 LYS 54 -3.963 15.088 -14.727 1156 HG3 LYS 54 HG3 LYS 54 -4.636 15.509 -16.300 1157 HD2 LYS 54 HD2 LYS 54 -2.473 16.543 -16.084 1158 HD3 LYS 54 HD3 LYS 54 -3.710 17.800 -16.030 1159 HE2 LYS 54 HE2 LYS 54 -3.537 17.922 -13.620 1160 HE3 LYS 54 HE3 LYS 54 -2.405 16.572 -13.599 1161 HZ1 LYS 54 HZ1 LYS 54 -0.822 17.929 -14.822 1162 HZ2 LYS 54 HZ2 LYS 54 -1.270 18.687 -13.378 1163 HZ3 LYS 54 HZ3 LYS 54 -1.913 19.221 -14.844 1164 H ASN 55 H ASN 55 -5.894 13.479 -15.887 1165 HA ASN 55 HA ASN 55 -8.258 13.618 -17.638 1166 HB2 ASN 55 HB2 ASN 55 -5.407 13.501 -18.668 1167 HB3 ASN 55 HB3 ASN 55 -6.861 13.430 -19.656 1168 HD21 ASN 55 HD21 ASN 55 -4.621 15.444 -18.065 1169 HD22 ASN 55 HD22 ASN 55 -5.353 16.958 -18.457 1170 H THR 56 H THR 56 -8.786 11.659 -18.709 1171 HA THR 56 HA THR 56 -8.107 9.240 -17.417 1172 HB THR 56 HB THR 56 -9.215 8.079 -19.298 1173 HG1 THR 56 HG1 THR 56 -9.895 9.209 -21.094 1174 HG21 THR 56 HG21 THR 56 -10.694 10.563 -18.401 1175 HG22 THR 56 HG22 THR 56 -10.600 9.041 -17.514 1176 HG23 THR 56 HG23 THR 56 -11.431 9.107 -19.067 1177 H ASP 57 H ASP 57 -6.524 11.015 -19.898 1178 HA ASP 57 HA ASP 57 -4.927 8.925 -21.010 1179 HB2 ASP 57 HB2 ASP 57 -4.159 11.848 -20.842 1180 HB3 ASP 57 HB3 ASP 57 -3.698 10.675 -22.074 1181 H LYS 58 H LYS 58 -4.478 11.305 -18.448 1182 HA LYS 58 HA LYS 58 -1.934 10.599 -17.546 1183 HB2 LYS 58 HB2 LYS 58 -3.060 12.616 -16.793 1184 HB3 LYS 58 HB3 LYS 58 -4.347 11.671 -16.060 1185 HG2 LYS 58 HG2 LYS 58 -2.952 12.414 -14.307 1186 HG3 LYS 58 HG3 LYS 58 -2.648 10.691 -14.535 1187 HD2 LYS 58 HD2 LYS 58 -0.636 11.265 -15.879 1188 HD3 LYS 58 HD3 LYS 58 -0.939 12.972 -15.563 1189 HE2 LYS 58 HE2 LYS 58 0.691 12.390 -13.987 1190 HE3 LYS 58 HE3 LYS 58 -0.812 12.330 -13.069 1191 HZ1 LYS 58 HZ1 LYS 58 0.380 9.933 -14.323 1192 HZ2 LYS 58 HZ2 LYS 58 -0.820 10.004 -13.130 1193 HZ3 LYS 58 HZ3 LYS 58 0.776 10.432 -12.759 1194 H LEU 59 H LEU 59 -5.115 9.241 -16.826 1195 HA LEU 59 HA LEU 59 -4.294 7.430 -14.801 1196 HB2 LEU 59 HB2 LEU 59 -6.609 8.056 -15.006 1197 HB3 LEU 59 HB3 LEU 59 -6.678 7.452 -16.652 1198 HG LEU 59 HG LEU 59 -6.408 5.149 -15.828 1199 HD11 LEU 59 HD11 LEU 59 -6.570 4.680 -13.420 1200 HD12 LEU 59 HD12 LEU 59 -6.453 6.408 -13.085 1201 HD13 LEU 59 HD13 LEU 59 -5.100 5.561 -13.834 1202 HD21 LEU 59 HD21 LEU 59 -8.649 6.669 -14.489 1203 HD22 LEU 59 HD22 LEU 59 -8.608 4.928 -14.771 1204 HD23 LEU 59 HD23 LEU 59 -8.653 6.041 -16.138 1205 H THR 60 H THR 60 -4.878 6.950 -18.306 1206 HA THR 60 HA THR 60 -4.213 4.215 -18.374 1207 HB THR 60 HB THR 60 -3.805 4.504 -20.795 1208 HG1 THR 60 HG1 THR 60 -4.480 6.965 -21.275 1209 HG21 THR 60 HG21 THR 60 -6.109 4.260 -20.007 1210 HG22 THR 60 HG22 THR 60 -6.040 5.338 -21.401 1211 HG23 THR 60 HG23 THR 60 -6.228 6.006 -19.781 1212 H THR 61 H THR 61 -2.206 7.104 -18.760 1213 HA THR 61 HA THR 61 0.261 5.980 -19.341 1214 HB THR 61 HB THR 61 -0.269 8.323 -17.487 1215 HG1 THR 61 HG1 THR 61 -0.908 8.167 -19.965 1216 HG21 THR 61 HG21 THR 61 1.998 9.060 -18.084 1217 HG22 THR 61 HG22 THR 61 2.236 7.583 -19.018 1218 HG23 THR 61 HG23 THR 61 2.029 7.496 -17.268 1219 H LEU 62 H LEU 62 -1.220 6.419 -16.108 1220 HA LEU 62 HA LEU 62 0.913 5.398 -14.593 1221 HB2 LEU 62 HB2 LEU 62 -2.053 5.368 -14.045 1222 HB3 LEU 62 HB3 LEU 62 -0.847 4.869 -12.872 1223 HG LEU 62 HG LEU 62 -1.233 7.637 -14.018 1224 HD11 LEU 62 HD11 LEU 62 -2.818 7.018 -12.281 1225 HD12 LEU 62 HD12 LEU 62 -1.677 8.225 -11.686 1226 HD13 LEU 62 HD13 LEU 62 -1.491 6.532 -11.225 1227 HD21 LEU 62 HD21 LEU 62 1.157 7.165 -13.787 1228 HD22 LEU 62 HD22 LEU 62 0.898 6.657 -12.116 1229 HD23 LEU 62 HD23 LEU 62 0.616 8.335 -12.584 1230 H MET 63 H MET 63 -1.945 3.719 -15.911 1231 HA MET 63 HA MET 63 -1.308 1.172 -14.934 1232 HB2 MET 63 HB2 MET 63 -2.893 1.992 -17.375 1233 HB3 MET 63 HB3 MET 63 -2.776 0.330 -16.810 1234 HG2 MET 63 HG2 MET 63 -3.689 1.096 -14.610 1235 HG3 MET 63 HG3 MET 63 -3.970 2.673 -15.343 1236 HE1 MET 63 HE1 MET 63 -5.778 3.178 -17.138 1237 HE2 MET 63 HE2 MET 63 -6.722 1.945 -17.971 1238 HE3 MET 63 HE3 MET 63 -4.983 2.056 -18.246 1239 H ASP 64 H ASP 64 -0.335 2.762 -17.959 1240 HA ASP 64 HA ASP 64 1.148 0.675 -19.091 1241 HB2 ASP 64 HB2 ASP 64 1.242 3.657 -19.254 1242 HB3 ASP 64 HB3 ASP 64 2.590 2.753 -19.925 1243 H LYS 65 H LYS 65 2.202 3.219 -16.841 1244 HA LYS 65 HA LYS 65 4.859 2.493 -16.498 1245 HB2 LYS 65 HB2 LYS 65 2.896 3.648 -14.516 1246 HB3 LYS 65 HB3 LYS 65 4.626 3.576 -14.228 1247 HG2 LYS 65 HG2 LYS 65 4.914 4.956 -16.318 1248 HG3 LYS 65 HG3 LYS 65 3.164 5.159 -16.333 1249 HD2 LYS 65 HD2 LYS 65 3.863 7.074 -15.229 1250 HD3 LYS 65 HD3 LYS 65 3.495 5.996 -13.885 1251 HE2 LYS 65 HE2 LYS 65 6.241 6.515 -15.041 1252 HE3 LYS 65 HE3 LYS 65 5.611 7.200 -13.548 1253 HZ1 LYS 65 HZ1 LYS 65 5.468 4.968 -12.631 1254 HZ2 LYS 65 HZ2 LYS 65 7.045 5.326 -13.112 1255 HZ3 LYS 65 HZ3 LYS 65 6.086 4.316 -14.064 1256 H LEU 66 H LEU 66 1.984 1.218 -14.890 1257 HA LEU 66 HA LEU 66 3.412 -0.523 -13.111 1258 HB2 LEU 66 HB2 LEU 66 0.514 -0.472 -13.956 1259 HB3 LEU 66 HB3 LEU 66 1.153 -1.442 -12.640 1260 HG LEU 66 HG LEU 66 1.311 1.574 -12.717 1261 HD11 LEU 66 HD11 LEU 66 -0.726 -0.174 -11.344 1262 HD12 LEU 66 HD12 LEU 66 -1.021 0.941 -12.679 1263 HD13 LEU 66 HD13 LEU 66 -0.538 1.564 -11.102 1264 HD21 LEU 66 HD21 LEU 66 1.728 -0.401 -10.469 1265 HD22 LEU 66 HD22 LEU 66 1.813 1.357 -10.337 1266 HD23 LEU 66 HD23 LEU 66 2.993 0.489 -11.316 1267 H ARG 67 H ARG 67 2.062 -0.849 -16.332 1268 HA ARG 67 HA ARG 67 2.187 -3.698 -16.468 1269 HB2 ARG 67 HB2 ARG 67 2.075 -1.576 -18.626 1270 HB3 ARG 67 HB3 ARG 67 2.036 -3.303 -18.967 1271 HG2 ARG 67 HG2 ARG 67 -0.023 -3.544 -17.712 1272 HG3 ARG 67 HG3 ARG 67 0.036 -1.846 -17.246 1273 HD2 ARG 67 HD2 ARG 67 -0.107 -1.243 -19.663 1274 HD3 ARG 67 HD3 ARG 67 -0.339 -2.955 -20.029 1275 HE ARG 67 HE ARG 67 -2.267 -2.395 -18.183 1276 HH11 ARG 67 HH11 ARG 67 -1.412 -1.110 -21.258 1277 HH12 ARG 67 HH12 ARG 67 -3.022 -0.588 -21.603 1278 HH21 ARG 67 HH21 ARG 67 -4.322 -1.725 -18.635 1279 HH22 ARG 67 HH22 ARG 67 -4.644 -0.912 -20.131 1280 H LYS 68 H LYS 68 4.637 -1.396 -16.390 1281 HA LYS 68 HA LYS 68 6.546 -2.869 -18.000 1282 HB2 LYS 68 HB2 LYS 68 7.026 -0.568 -16.087 1283 HB3 LYS 68 HB3 LYS 68 8.174 -1.195 -17.264 1284 HG2 LYS 68 HG2 LYS 68 5.591 0.254 -17.808 1285 HG3 LYS 68 HG3 LYS 68 7.234 0.790 -18.172 1286 HD2 LYS 68 HD2 LYS 68 7.478 -1.014 -19.802 1287 HD3 LYS 68 HD3 LYS 68 5.864 -1.608 -19.408 1288 HE2 LYS 68 HE2 LYS 68 5.713 -0.351 -21.432 1289 HE3 LYS 68 HE3 LYS 68 4.952 0.588 -20.148 1290 HZ1 LYS 68 HZ1 LYS 68 6.361 1.941 -21.585 1291 HZ2 LYS 68 HZ2 LYS 68 7.711 1.015 -21.167 1292 HZ3 LYS 68 HZ3 LYS 68 6.928 1.947 -19.993 1293 H VAL 69 H VAL 69 5.202 -3.533 -15.114 1294 HA VAL 69 HA VAL 69 7.585 -4.527 -13.767 1295 HB VAL 69 HB VAL 69 4.661 -4.818 -13.026 1296 HG11 VAL 69 HG11 VAL 69 6.024 -6.598 -12.047 1297 HG12 VAL 69 HG12 VAL 69 5.492 -5.465 -10.805 1298 HG13 VAL 69 HG13 VAL 69 7.149 -5.400 -11.405 1299 HG21 VAL 69 HG21 VAL 69 6.758 -2.919 -11.956 1300 HG22 VAL 69 HG22 VAL 69 5.088 -3.045 -11.404 1301 HG23 VAL 69 HG23 VAL 69 5.437 -2.482 -13.042 1302 H GLN 70 H GLN 70 8.433 -6.443 -14.244 1303 HA GLN 70 HA GLN 70 7.315 -8.148 -16.201 1304 HB2 GLN 70 HB2 GLN 70 9.270 -9.587 -15.763 1305 HB3 GLN 70 HB3 GLN 70 9.710 -7.896 -15.956 1306 HG2 GLN 70 HG2 GLN 70 9.707 -7.747 -13.420 1307 HG3 GLN 70 HG3 GLN 70 9.609 -9.508 -13.418 1308 HE21 GLN 70 HE21 GLN 70 11.621 -9.734 -12.443 1309 HE22 GLN 70 HE22 GLN 70 13.096 -9.414 -13.283 1310 H GLY 71 H GLY 71 6.753 -8.043 -12.848 1311 HA2 GLY 71 HA2 GLY 71 6.006 -10.864 -12.657 1312 HA3 GLY 71 HA3 GLY 71 6.021 -9.702 -11.345 1313 H VAL 72 H VAL 72 4.455 -7.979 -13.556 1314 HA VAL 72 HA VAL 72 1.827 -8.970 -12.643 1315 HB VAL 72 HB VAL 72 2.582 -6.203 -13.622 1316 HG11 VAL 72 HG11 VAL 72 -0.058 -7.249 -12.576 1317 HG12 VAL 72 HG12 VAL 72 0.282 -6.729 -14.227 1318 HG13 VAL 72 HG13 VAL 72 0.310 -5.557 -12.910 1319 HG21 VAL 72 HG21 VAL 72 3.482 -6.705 -11.407 1320 HG22 VAL 72 HG22 VAL 72 1.884 -7.204 -10.853 1321 HG23 VAL 72 HG23 VAL 72 2.179 -5.522 -11.296 1322 H PHE 73 H PHE 73 0.294 -9.581 -14.056 1323 HA PHE 73 HA PHE 73 0.936 -9.362 -16.923 1324 HB2 PHE 73 HB2 PHE 73 -0.861 -11.375 -16.910 1325 HB3 PHE 73 HB3 PHE 73 0.870 -11.605 -16.749 1326 HD1 PHE 73 HD2 PHE 73 1.868 -12.235 -14.651 1327 HD2 PHE 73 HD1 PHE 73 -2.343 -11.681 -14.986 1328 HE1 PHE 73 HE2 PHE 73 1.551 -13.400 -12.513 1329 HE2 PHE 73 HE1 PHE 73 -2.665 -12.851 -12.842 1330 HZ PHE 73 HZ PHE 73 -0.716 -13.714 -11.606 1331 H THR 74 H THR 74 -1.385 -8.412 -14.555 1332 HA THR 74 HA THR 74 -3.014 -7.306 -16.763 1333 HB THR 74 HB THR 74 -5.052 -7.862 -15.872 1334 HG1 THR 74 HG1 THR 74 -4.776 -6.976 -13.801 1335 HG21 THR 74 HG21 THR 74 -3.342 -10.085 -14.763 1336 HG22 THR 74 HG22 THR 74 -3.907 -9.966 -16.432 1337 HG23 THR 74 HG23 THR 74 -5.065 -10.180 -15.118 1338 H VAL 75 H VAL 75 -3.049 -5.176 -16.705 1339 HA VAL 75 HA VAL 75 -3.427 -3.838 -14.113 1340 HB VAL 75 HB VAL 75 -1.656 -2.686 -16.288 1341 HG11 VAL 75 HG11 VAL 75 -1.080 -1.014 -14.608 1342 HG12 VAL 75 HG12 VAL 75 -2.145 -1.797 -13.441 1343 HG13 VAL 75 HG13 VAL 75 -2.822 -1.042 -14.885 1344 HG21 VAL 75 HG21 VAL 75 0.259 -3.141 -14.834 1345 HG22 VAL 75 HG22 VAL 75 -0.555 -4.643 -15.278 1346 HG23 VAL 75 HG23 VAL 75 -0.797 -3.949 -13.674 1347 H GLU 76 H GLU 76 -5.465 -3.123 -14.303 1348 HA GLU 76 HA GLU 76 -6.357 -1.978 -16.864 1349 HB2 GLU 76 HB2 GLU 76 -8.498 -3.305 -16.580 1350 HB3 GLU 76 HB3 GLU 76 -7.069 -4.244 -16.992 1351 HG2 GLU 76 HG2 GLU 76 -6.809 -4.769 -14.556 1352 HG3 GLU 76 HG3 GLU 76 -8.377 -4.006 -14.287 1353 H ARG 77 H ARG 77 -8.403 -0.804 -16.723 1354 HA ARG 77 HA ARG 77 -8.370 0.923 -14.403 1355 HB2 ARG 77 HB2 ARG 77 -8.474 1.924 -16.594 1356 HB3 ARG 77 HB3 ARG 77 -9.911 1.001 -17.001 1357 HG2 ARG 77 HG2 ARG 77 -11.200 2.234 -15.345 1358 HG3 ARG 77 HG3 ARG 77 -9.758 3.136 -14.876 1359 HD2 ARG 77 HD2 ARG 77 -11.173 4.438 -16.387 1360 HD3 ARG 77 HD3 ARG 77 -9.605 4.091 -17.116 1361 HE ARG 77 HE ARG 77 -10.865 2.204 -18.278 1362 HH11 ARG 77 HH11 ARG 77 -12.332 5.194 -17.391 1363 HH12 ARG 77 HH12 ARG 77 -13.496 5.124 -18.669 1364 HH21 ARG 77 HH21 ARG 77 -12.366 2.118 -19.901 1365 HH22 ARG 77 HH22 ARG 77 -13.530 3.390 -20.062 1366 H LEU 78 H LEU 78 -10.097 1.359 -13.022 1367 HA LEU 78 HA LEU 78 -12.262 -0.637 -12.946 1368 HB2 LEU 78 HB2 LEU 78 -11.225 1.249 -10.819 1369 HB3 LEU 78 HB3 LEU 78 -12.597 0.177 -10.605 1370 HG LEU 78 HG LEU 78 -9.751 -0.709 -11.132 1371 HD11 LEU 78 HD11 LEU 78 -11.395 -0.808 -8.600 1372 HD12 LEU 78 HD12 LEU 78 -10.015 0.246 -8.904 1373 HD13 LEU 78 HD13 LEU 78 -9.786 -1.499 -8.816 1374 HD21 LEU 78 HD21 LEU 78 -12.245 -2.314 -10.549 1375 HD22 LEU 78 HD22 LEU 78 -10.607 -2.962 -10.611 1376 HD23 LEU 78 HD23 LEU 78 -11.341 -2.286 -12.064 1377 H SER 79 H SER 79 -14.317 -0.057 -13.379 1378 HA SER 79 HA SER 79 -14.878 2.771 -13.940 1379 HB2 SER 79 HB2 SER 79 -16.865 1.931 -15.160 1380 HB3 SER 79 HB3 SER 79 -15.371 1.208 -15.755 1381 HG SER 79 HG SER 79 -16.164 -0.666 -15.273 1382 H ASN 80 H ASN 80 -16.127 0.052 -12.052 1383 HA ASN 80 HA ASN 80 -18.024 1.844 -10.691 1384 HB2 ASN 80 HB2 ASN 80 -17.789 -1.173 -10.716 1385 HB3 ASN 80 HB3 ASN 80 -18.940 -0.286 -9.721 1386 HD21 ASN 80 HD21 ASN 80 -19.407 -2.212 -11.857 1387 HD22 ASN 80 HD22 ASN 80 -20.388 -1.397 -13.019 1388 H LEU 81 H LEU 81 -17.715 2.504 -8.647 1389 HA LEU 81 HA LEU 81 -15.496 1.306 -7.097 1390 HB2 LEU 81 HB2 LEU 81 -16.324 4.216 -7.145 1391 HB3 LEU 81 HB3 LEU 81 -15.022 3.531 -6.190 1392 HG LEU 81 HG LEU 81 -15.098 3.703 -9.212 1393 HD11 LEU 81 HD11 LEU 81 -14.778 5.876 -8.161 1394 HD12 LEU 81 HD12 LEU 81 -13.282 5.331 -8.921 1395 HD13 LEU 81 HD13 LEU 81 -13.471 5.226 -7.168 1396 HD21 LEU 81 HD21 LEU 81 -12.780 2.913 -9.115 1397 HD22 LEU 81 HD22 LEU 81 -13.890 1.713 -8.460 1398 HD23 LEU 81 HD23 LEU 81 -12.916 2.699 -7.369 1399 H GLU 82 H GLU 82 -15.718 1.302 -4.800 1400 HA GLU 82 HA GLU 82 -18.442 1.161 -3.832 1401 HB2 GLU 82 HB2 GLU 82 -17.374 0.476 -1.681 1402 HB3 GLU 82 HB3 GLU 82 -16.913 -0.530 -3.046 1403 HG2 GLU 82 HG2 GLU 82 -14.784 0.641 -3.220 1404 HG3 GLU 82 HG3 GLU 82 -15.249 1.701 -1.891 1405 H HIS 83 H HIS 83 -16.502 3.652 -4.414 1406 HA HIS 83 HA HIS 83 -16.734 5.224 -2.035 1407 HB2 HIS 83 HB2 HIS 83 -16.073 5.977 -4.892 1408 HB3 HIS 83 HB3 HIS 83 -15.950 7.071 -3.524 1409 HD1 HIS 83 HD1 HIS 83 -13.665 7.215 -2.554 1410 HD2 HIS 83 HD2 HIS 83 -14.327 3.565 -4.426 1411 HE1 HIS 83 HE1 HIS 83 -11.480 5.994 -2.444 1412 HE2 HIS 83 HE2 HIS 83 -11.986 3.708 -3.344 1413 H HIS 84 H HIS 84 -18.678 4.707 -4.881 1414 HA HIS 84 HA HIS 84 -20.990 5.776 -3.612 1415 HB2 HIS 84 HB2 HIS 84 -21.550 7.541 -5.214 1416 HB3 HIS 84 HB3 HIS 84 -20.034 7.910 -4.408 1417 HD1 HIS 84 HD1 HIS 84 -21.402 6.837 -7.750 1418 HD2 HIS 84 HD2 HIS 84 -17.836 8.155 -6.073 1419 HE1 HIS 84 HE1 HIS 84 -19.884 7.310 -9.686 1420 HE2 HIS 84 HE2 HIS 84 -17.837 8.335 -8.654 1421 H HIS 85 H HIS 85 -22.736 4.687 -4.336 1422 HA HIS 85 HA HIS 85 -22.789 3.537 -7.018 1423 HB2 HIS 85 HB2 HIS 85 -21.571 1.900 -5.519 1424 HB3 HIS 85 HB3 HIS 85 -23.056 1.743 -4.588 1425 HD1 HIS 85 HD1 HIS 85 -21.764 1.139 -8.101 1426 HD2 HIS 85 HD2 HIS 85 -24.795 -0.132 -5.562 1427 HE1 HIS 85 HE1 HIS 85 -22.907 -0.735 -9.310 1428 HE2 HIS 85 HE2 HIS 85 -24.608 -1.607 -7.683 1429 H HIS 86 H HIS 86 -24.699 4.413 -7.638 1430 HA HIS 86 HA HIS 86 -26.679 5.096 -5.657 1431 HB2 HIS 86 HB2 HIS 86 -25.932 6.558 -7.597 1432 HB3 HIS 86 HB3 HIS 86 -26.895 5.519 -8.640 1433 HD1 HIS 86 HD1 HIS 86 -29.113 6.494 -9.109 1434 HD2 HIS 86 HD2 HIS 86 -27.726 7.582 -5.344 1435 HE1 HIS 86 HE1 HIS 86 -30.882 7.988 -8.145 1436 HE2 HIS 86 HE2 HIS 86 -29.938 8.775 -5.952 1437 H HIS 87 H HIS 87 -26.995 2.659 -5.253 1438 HA HIS 87 HA HIS 87 -28.397 0.874 -5.227 1439 HB2 HIS 87 HB2 HIS 87 -30.238 3.140 -5.948 1440 HB3 HIS 87 HB3 HIS 87 -30.847 1.519 -5.635 1441 HD1 HIS 87 HD1 HIS 87 -31.559 1.180 -3.298 1442 HD2 HIS 87 HD2 HIS 87 -28.555 4.039 -3.572 1443 HE1 HIS 87 HE1 HIS 87 -31.219 2.022 -0.961 1444 HE2 HIS 87 HE2 HIS 87 -29.531 3.868 -1.182 1445 H HIS 88 H HIS 88 -26.989 1.021 -7.732 1446 HA HIS 88 HA HIS 88 -28.671 -0.931 -9.060 1447 HB2 HIS 88 HB2 HIS 88 -28.031 0.057 -11.361 1448 HB3 HIS 88 HB3 HIS 88 -29.354 0.787 -10.468 1449 HD1 HIS 88 HD1 HIS 88 -29.211 3.083 -11.440 1450 HD2 HIS 88 HD2 HIS 88 -25.564 1.805 -9.911 1451 HE1 HIS 88 HE1 HIS 88 -27.719 5.094 -11.495 1452 HE2 HIS 88 HE2 HIS 88 -25.468 4.242 -10.785