HEADER PROTEIN FIBRIL 03-SEP-08 SMS20046 TITLE SOLUTION NMR STRUCTURE OF RAT ISLET AMYLOID POLYPEPTIDE-1-19 COMPND MOL_ID: 1; COMPND 2 MOLECULE: ISLET AMYLOID POLYPEPTIDE; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 38-56; COMPND 5 SYNONYM: IAPP, AMYLIN, DIABETES-ASSOCIATED PEPTIDE, DAP; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; SOURCE 4 ORGANISM_COMMON: RAT; SOURCE 5 ORGANISM_TAXID: 10116; SOURCE 6 OTHER_DETAILS: SOLID-PHASE SYNTHESIS USING FMOC CHEMISTRY KEYWDS ISLET AMYLOID POLY PEPTIDE, AMYLIN, IAPP, TYPE II DIABETES, PROTEIN KEYWDS 2 FIBRIL EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR R.P.R.NANGA,J.R.BRENDER,J.XU,G.VEGLIA,A.RAMAMOORTHY JRNL AUTH R.P.R.NANGA,J.R.BRENDER,J.XU,G.VEGLIA,A.RAMAMOORTHY JRNL TITL STRUCTURES OF RAT AND HUMAN ISLET AMYLOID POLYPEPTIDE JRNL TITL 2 IAPP(1-19) IN MICELLES BY NMR SPECTROSCOPY JRNL REF BIOCHEMISTRY V. 47 12689 2008 JRNL REFN ISSN 0006-2960 JRNL PMID 18989932 JRNL DOI 10.1021/BI8014357 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR_NIH, TALOS REMARK 3 AUTHORS : SCHWIETERS, KUSZEWSKI, TJANDRA AND CLORE (X-PLOR_ REMARK 3 NIH), CORNILESCU, DELAGLIO AND BAX (TALOS) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 27-SEP-10. REMARK 100 THE BMRB ID CODE IS SMS20046. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 7.3 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 1.625MM IAPP; 200MM [U-100% 2H] REMARK 210 DPC; 0.02% SODIUM AZIDE; 20MM REMARK 210 SODIUM PHOSPHATE; 120MM SODIUM REMARK 210 CHLORIDE; 95% H2O/5% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H TOCSY; 2D 1H-1H NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 900 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : TOPSPIN 2.1, SPARKY, X-PLOR_NIH, REMARK 210 PROCHECKNMR REMARK 210 METHOD USED : SIMULATED ANNEALING, MOLECULAR REMARK 210 DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O LEU A 12 H LEU A 16 1.27 REMARK 500 HD22 LEU A 12 HD12 LEU A 16 1.35 REMARK 500 O THR A 9 H ALA A 13 1.54 REMARK 500 O ALA A 13 HG12 VAL A 17 1.55 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 1 ALA A 5 -69.69 -101.87 REMARK 500 2 ALA A 5 -69.45 -101.92 REMARK 500 3 ALA A 5 -69.15 -101.16 REMARK 500 4 ALA A 5 -69.01 -101.99 REMARK 500 5 ALA A 5 -69.51 -101.05 REMARK 500 6 ALA A 5 -69.19 -100.03 REMARK 500 7 ALA A 5 -69.80 -102.12 REMARK 500 8 ALA A 5 -69.63 -101.84 REMARK 500 9 ALA A 5 -69.50 -101.63 REMARK 500 10 ALA A 5 -68.85 -100.92 REMARK 500 11 ALA A 5 -69.24 -101.95 REMARK 500 12 ALA A 5 -69.05 -100.14 REMARK 500 13 ALA A 5 -69.31 -102.98 REMARK 500 14 ALA A 5 -69.20 -101.14 REMARK 500 15 ALA A 5 -70.07 -100.74 REMARK 500 16 ALA A 5 -69.56 -101.75 REMARK 500 17 ALA A 5 -69.77 -99.79 REMARK 500 18 ALA A 5 -69.62 -101.92 REMARK 500 19 ALA A 5 -69.62 -99.79 REMARK 500 20 ALA A 5 -70.09 -100.65 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20046 RELATED DB: BMRB REMARK 900 RELATED ID: 20045 RELATED DB: BMRB REMARK 900 HUMAN ISLET AMYLOID POLYPEPTIDE IAPP(1-19) DBREF A 1 19 UNP P12969 IAPP_RAT 38 56 SEQADV NH2 A 20 UNP P12969 AMIDATION SEQRES 1 A 20 LYS CYS ASN THR ALA THR CYS ALA THR GLN ARG LEU ALA SEQRES 2 A 20 ASN PHE LEU VAL ARG SER NH2 HET NH2 A 20 3 HETNAM NH2 AMINO GROUP FORMUL 1 NH2 H2 N HELIX 1 1 ALA A 5 VAL A 17 1 13 SSBOND 1 CYS A 2 CYS A 7 1555 1555 2.02 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 MODEL 1 ATOM 1 N LYS A 1 0.512 13.025 4.419 1.00 0.00 N ATOM 2 CA LYS A 1 1.135 12.616 3.127 1.00 0.00 C ATOM 3 C LYS A 1 0.208 11.660 2.372 1.00 0.00 C ATOM 4 O LYS A 1 -0.815 11.244 2.879 1.00 0.00 O ATOM 5 CB LYS A 1 2.431 11.908 3.519 1.00 0.00 C ATOM 6 CG LYS A 1 3.437 12.008 2.372 1.00 0.00 C ATOM 7 CD LYS A 1 4.844 12.198 2.942 1.00 0.00 C ATOM 8 CE LYS A 1 5.748 11.061 2.462 1.00 0.00 C ATOM 9 NZ LYS A 1 5.728 10.062 3.567 1.00 0.00 N ATOM 10 H1 LYS A 1 0.746 12.328 5.154 1.00 0.00 H ATOM 11 H2 LYS A 1 -0.522 13.076 4.305 1.00 0.00 H ATOM 12 H3 LYS A 1 0.875 13.956 4.702 1.00 0.00 H ATOM 13 HA LYS A 1 1.355 13.483 2.524 1.00 0.00 H ATOM 14 HB2 LYS A 1 2.843 12.374 4.403 1.00 0.00 H ATOM 15 HB3 LYS A 1 2.225 10.867 3.724 1.00 0.00 H ATOM 16 HG2 LYS A 1 3.405 11.101 1.784 1.00 0.00 H ATOM 17 HG3 LYS A 1 3.187 12.852 1.747 1.00 0.00 H ATOM 18 HD2 LYS A 1 5.244 13.144 2.605 1.00 0.00 H ATOM 19 HD3 LYS A 1 4.800 12.191 4.021 1.00 0.00 H ATOM 20 HE2 LYS A 1 5.354 10.628 1.552 1.00 0.00 H ATOM 21 HE3 LYS A 1 6.753 11.419 2.305 1.00 0.00 H ATOM 22 HZ1 LYS A 1 6.355 9.267 3.329 1.00 0.00 H ATOM 23 HZ2 LYS A 1 4.757 9.709 3.697 1.00 0.00 H ATOM 24 HZ3 LYS A 1 6.056 10.509 4.446 1.00 0.00 H ATOM 25 N CYS A 2 0.558 11.305 1.165 1.00 0.00 N ATOM 26 CA CYS A 2 -0.304 10.374 0.384 1.00 0.00 C ATOM 27 C CYS A 2 -0.101 8.936 0.870 1.00 0.00 C ATOM 28 O CYS A 2 -0.957 8.089 0.716 1.00 0.00 O ATOM 29 CB CYS A 2 0.151 10.528 -1.069 1.00 0.00 C ATOM 30 SG CYS A 2 1.785 9.777 -1.282 1.00 0.00 S ATOM 31 H CYS A 2 1.388 11.649 0.774 1.00 0.00 H ATOM 32 HA CYS A 2 -1.341 10.657 0.476 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.557 10.038 -1.721 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.203 11.578 -1.320 1.00 0.00 H ATOM 35 N ASN A 3 1.030 8.657 1.461 1.00 0.00 N ATOM 36 CA ASN A 3 1.294 7.277 1.965 1.00 0.00 C ATOM 37 C ASN A 3 0.076 6.742 2.720 1.00 0.00 C ATOM 38 O ASN A 3 -0.196 5.557 2.722 1.00 0.00 O ATOM 39 CB ASN A 3 2.478 7.434 2.920 1.00 0.00 C ATOM 40 CG ASN A 3 3.784 7.407 2.125 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.624 8.270 2.285 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.992 6.448 1.266 1.00 0.00 N ATOM 43 H ASN A 3 1.705 9.356 1.577 1.00 0.00 H ATOM 44 HA ASN A 3 1.561 6.615 1.159 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.394 8.375 3.444 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.477 6.623 3.632 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.312 5.749 1.136 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.831 6.424 0.750 1.00 0.00 H ATOM 49 N THR A 4 -0.647 7.602 3.379 1.00 0.00 N ATOM 50 CA THR A 4 -1.833 7.142 4.155 1.00 0.00 C ATOM 51 C THR A 4 -2.995 6.718 3.242 1.00 0.00 C ATOM 52 O THR A 4 -3.467 5.601 3.313 1.00 0.00 O ATOM 53 CB THR A 4 -2.237 8.351 5.000 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.101 8.836 5.701 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.318 7.939 6.001 1.00 0.00 C ATOM 56 H THR A 4 -0.401 8.550 3.377 1.00 0.00 H ATOM 57 HA THR A 4 -1.557 6.327 4.804 1.00 0.00 H ATOM 58 HB THR A 4 -2.625 9.127 4.358 1.00 0.00 H ATOM 59 HG1 THR A 4 -0.595 9.389 5.100 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.189 7.566 5.463 1.00 0.00 H ATOM 61 HG22 THR A 4 -3.605 8.802 6.602 1.00 0.00 H ATOM 62 HG23 THR A 4 -2.931 7.155 6.652 1.00 0.00 H ATOM 63 N ALA A 5 -3.493 7.605 2.421 1.00 0.00 N ATOM 64 CA ALA A 5 -4.658 7.239 1.554 1.00 0.00 C ATOM 65 C ALA A 5 -4.264 6.931 0.100 1.00 0.00 C ATOM 66 O ALA A 5 -4.378 5.813 -0.360 1.00 0.00 O ATOM 67 CB ALA A 5 -5.567 8.465 1.597 1.00 0.00 C ATOM 68 H ALA A 5 -3.126 8.514 2.396 1.00 0.00 H ATOM 69 HA ALA A 5 -5.180 6.397 1.978 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.451 8.284 0.985 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.029 9.331 1.210 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.871 8.657 2.626 1.00 0.00 H ATOM 73 N THR A 6 -3.860 7.929 -0.641 1.00 0.00 N ATOM 74 CA THR A 6 -3.524 7.712 -2.084 1.00 0.00 C ATOM 75 C THR A 6 -2.359 6.738 -2.278 1.00 0.00 C ATOM 76 O THR A 6 -2.451 5.800 -3.044 1.00 0.00 O ATOM 77 CB THR A 6 -3.145 9.099 -2.604 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.844 10.089 -1.860 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.519 9.208 -4.084 1.00 0.00 C ATOM 80 H THR A 6 -3.816 8.831 -0.260 1.00 0.00 H ATOM 81 HA THR A 6 -4.393 7.358 -2.614 1.00 0.00 H ATOM 82 HB THR A 6 -2.083 9.248 -2.494 1.00 0.00 H ATOM 83 HG1 THR A 6 -4.616 10.354 -2.367 1.00 0.00 H ATOM 84 HG21 THR A 6 -2.982 8.448 -4.652 1.00 0.00 H ATOM 85 HG22 THR A 6 -3.249 10.196 -4.456 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.592 9.057 -4.200 1.00 0.00 H ATOM 87 N CYS A 7 -1.260 6.952 -1.615 1.00 0.00 N ATOM 88 CA CYS A 7 -0.097 6.036 -1.798 1.00 0.00 C ATOM 89 C CYS A 7 -0.273 4.771 -0.955 1.00 0.00 C ATOM 90 O CYS A 7 0.510 3.846 -1.038 1.00 0.00 O ATOM 91 CB CYS A 7 1.113 6.835 -1.324 1.00 0.00 C ATOM 92 SG CYS A 7 1.443 8.186 -2.482 1.00 0.00 S ATOM 93 H CYS A 7 -1.191 7.722 -1.011 1.00 0.00 H ATOM 94 HA CYS A 7 0.017 5.780 -2.840 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.907 7.246 -0.352 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.974 6.188 -1.270 1.00 0.00 H ATOM 97 N ALA A 8 -1.290 4.725 -0.141 1.00 0.00 N ATOM 98 CA ALA A 8 -1.508 3.521 0.710 1.00 0.00 C ATOM 99 C ALA A 8 -1.818 2.294 -0.152 1.00 0.00 C ATOM 100 O ALA A 8 -1.238 1.243 0.025 1.00 0.00 O ATOM 101 CB ALA A 8 -2.712 3.870 1.583 1.00 0.00 C ATOM 102 H ALA A 8 -1.907 5.484 -0.087 1.00 0.00 H ATOM 103 HA ALA A 8 -0.647 3.338 1.331 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.939 3.032 2.242 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.574 4.076 0.948 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.483 4.751 2.183 1.00 0.00 H ATOM 107 N THR A 9 -2.734 2.419 -1.073 1.00 0.00 N ATOM 108 CA THR A 9 -3.093 1.254 -1.938 1.00 0.00 C ATOM 109 C THR A 9 -1.871 0.752 -2.713 1.00 0.00 C ATOM 110 O THR A 9 -1.690 -0.435 -2.900 1.00 0.00 O ATOM 111 CB THR A 9 -4.154 1.790 -2.901 1.00 0.00 C ATOM 112 OG1 THR A 9 -5.315 2.164 -2.170 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.516 0.705 -3.917 1.00 0.00 C ATOM 114 H THR A 9 -3.196 3.276 -1.193 1.00 0.00 H ATOM 115 HA THR A 9 -3.512 0.459 -1.340 1.00 0.00 H ATOM 116 HB THR A 9 -3.764 2.650 -3.423 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.063 2.291 -1.253 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.626 0.421 -4.479 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.272 1.087 -4.603 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.908 -0.167 -3.394 1.00 0.00 H ATOM 121 N GLN A 10 -1.038 1.642 -3.171 1.00 0.00 N ATOM 122 CA GLN A 10 0.167 1.207 -3.940 1.00 0.00 C ATOM 123 C GLN A 10 1.079 0.362 -3.049 1.00 0.00 C ATOM 124 O GLN A 10 1.351 -0.786 -3.339 1.00 0.00 O ATOM 125 CB GLN A 10 0.867 2.499 -4.359 1.00 0.00 C ATOM 126 CG GLN A 10 0.877 2.599 -5.886 1.00 0.00 C ATOM 127 CD GLN A 10 1.883 1.602 -6.458 1.00 0.00 C ATOM 128 OE1 GLN A 10 3.066 1.875 -6.508 1.00 0.00 O ATOM 129 NE2 GLN A 10 1.461 0.447 -6.896 1.00 0.00 N ATOM 130 H GLN A 10 -1.203 2.591 -3.010 1.00 0.00 H ATOM 131 HA GLN A 10 -0.125 0.643 -4.812 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.339 3.345 -3.943 1.00 0.00 H ATOM 133 HB3 GLN A 10 1.883 2.493 -3.993 1.00 0.00 H ATOM 134 HG2 GLN A 10 -0.110 2.376 -6.265 1.00 0.00 H ATOM 135 HG3 GLN A 10 1.159 3.599 -6.179 1.00 0.00 H ATOM 136 HE21 GLN A 10 0.503 0.227 -6.855 1.00 0.00 H ATOM 137 HE22 GLN A 10 2.103 -0.202 -7.266 1.00 0.00 H ATOM 138 N ARG A 11 1.527 0.906 -1.954 1.00 0.00 N ATOM 139 CA ARG A 11 2.387 0.107 -1.041 1.00 0.00 C ATOM 140 C ARG A 11 1.562 -1.072 -0.542 1.00 0.00 C ATOM 141 O ARG A 11 2.073 -2.127 -0.218 1.00 0.00 O ATOM 142 CB ARG A 11 2.747 1.048 0.109 1.00 0.00 C ATOM 143 CG ARG A 11 4.260 1.270 0.129 1.00 0.00 C ATOM 144 CD ARG A 11 4.750 1.311 1.578 1.00 0.00 C ATOM 145 NE ARG A 11 6.051 0.587 1.564 1.00 0.00 N ATOM 146 CZ ARG A 11 7.112 1.154 1.057 1.00 0.00 C ATOM 147 NH1 ARG A 11 7.042 2.364 0.569 1.00 0.00 N ATOM 148 NH2 ARG A 11 8.247 0.511 1.039 1.00 0.00 N ATOM 149 H ARG A 11 1.279 1.823 -1.723 1.00 0.00 H ATOM 150 HA ARG A 11 3.277 -0.232 -1.549 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.244 1.995 -0.028 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.436 0.608 1.046 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.748 0.461 -0.395 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.494 2.207 -0.355 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.889 2.334 1.899 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.051 0.804 2.226 1.00 0.00 H ATOM 157 HE ARG A 11 6.111 -0.320 1.933 1.00 0.00 H ATOM 158 HH11 ARG A 11 6.174 2.859 0.583 1.00 0.00 H ATOM 159 HH12 ARG A 11 7.857 2.795 0.184 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.303 -0.415 1.412 1.00 0.00 H ATOM 161 HH22 ARG A 11 9.062 0.943 0.653 1.00 0.00 H ATOM 162 N LEU A 12 0.274 -0.885 -0.500 1.00 0.00 N ATOM 163 CA LEU A 12 -0.642 -1.961 -0.047 1.00 0.00 C ATOM 164 C LEU A 12 -0.673 -3.062 -1.093 1.00 0.00 C ATOM 165 O LEU A 12 -0.443 -4.200 -0.800 1.00 0.00 O ATOM 166 CB LEU A 12 -1.978 -1.242 0.090 1.00 0.00 C ATOM 167 CG LEU A 12 -3.172 -2.196 0.019 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.392 -2.681 -1.416 1.00 0.00 C ATOM 169 CD2 LEU A 12 -2.934 -3.391 0.938 1.00 0.00 C ATOM 170 H LEU A 12 -0.096 -0.022 -0.780 1.00 0.00 H ATOM 171 HA LEU A 12 -0.324 -2.348 0.897 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.993 -0.739 1.041 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.057 -0.523 -0.701 1.00 0.00 H ATOM 174 HG LEU A 12 -4.053 -1.665 0.343 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.246 -3.358 -1.444 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.502 -3.205 -1.764 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.586 -1.826 -2.063 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.033 -3.918 0.624 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.787 -4.067 0.884 1.00 0.00 H ATOM 180 HD23 LEU A 12 -2.812 -3.043 1.964 1.00 0.00 H ATOM 181 N ALA A 13 -0.907 -2.731 -2.314 1.00 0.00 N ATOM 182 CA ALA A 13 -0.894 -3.768 -3.373 1.00 0.00 C ATOM 183 C ALA A 13 0.413 -4.543 -3.292 1.00 0.00 C ATOM 184 O ALA A 13 0.504 -5.696 -3.663 1.00 0.00 O ATOM 185 CB ALA A 13 -0.920 -2.968 -4.652 1.00 0.00 C ATOM 186 H ALA A 13 -1.061 -1.801 -2.546 1.00 0.00 H ATOM 187 HA ALA A 13 -1.752 -4.417 -3.306 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.913 -3.646 -5.505 1.00 0.00 H ATOM 189 HB2 ALA A 13 -0.043 -2.322 -4.695 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.823 -2.358 -4.681 1.00 0.00 H ATOM 191 N ASN A 14 1.420 -3.900 -2.780 1.00 0.00 N ATOM 192 CA ASN A 14 2.735 -4.544 -2.625 1.00 0.00 C ATOM 193 C ASN A 14 2.740 -5.231 -1.279 1.00 0.00 C ATOM 194 O ASN A 14 3.509 -6.136 -1.020 1.00 0.00 O ATOM 195 CB ASN A 14 3.743 -3.396 -2.663 1.00 0.00 C ATOM 196 CG ASN A 14 3.926 -2.923 -4.107 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.004 -3.025 -4.658 1.00 0.00 O ATOM 198 ND2 ASN A 14 2.911 -2.408 -4.747 1.00 0.00 N ATOM 199 H ASN A 14 1.301 -2.988 -2.464 1.00 0.00 H ATOM 200 HA ASN A 14 2.920 -5.243 -3.422 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.376 -2.577 -2.060 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.687 -3.734 -2.272 1.00 0.00 H ATOM 203 HD21 ASN A 14 2.038 -2.329 -4.300 1.00 0.00 H ATOM 204 HD22 ASN A 14 3.022 -2.099 -5.675 1.00 0.00 H ATOM 205 N PHE A 15 1.860 -4.810 -0.415 1.00 0.00 N ATOM 206 CA PHE A 15 1.795 -5.459 0.914 1.00 0.00 C ATOM 207 C PHE A 15 0.729 -6.546 0.841 1.00 0.00 C ATOM 208 O PHE A 15 0.811 -7.593 1.453 1.00 0.00 O ATOM 209 CB PHE A 15 1.440 -4.328 1.914 1.00 0.00 C ATOM 210 CG PHE A 15 0.225 -4.680 2.768 1.00 0.00 C ATOM 211 CD1 PHE A 15 0.137 -5.923 3.407 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.816 -3.753 2.911 1.00 0.00 C ATOM 213 CE1 PHE A 15 -0.988 -6.235 4.179 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.937 -4.065 3.681 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.025 -5.307 4.316 1.00 0.00 C ATOM 216 H PHE A 15 1.216 -4.091 -0.661 1.00 0.00 H ATOM 217 HA PHE A 15 2.747 -5.876 1.142 1.00 0.00 H ATOM 218 HB2 PHE A 15 2.285 -4.156 2.562 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.234 -3.424 1.361 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.934 -6.642 3.304 1.00 0.00 H ATOM 221 HD2 PHE A 15 -0.756 -2.796 2.432 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.057 -7.194 4.661 1.00 0.00 H ATOM 223 HE2 PHE A 15 -2.738 -3.345 3.779 1.00 0.00 H ATOM 224 HZ PHE A 15 -2.892 -5.550 4.911 1.00 0.00 H ATOM 225 N LEU A 16 -0.273 -6.250 0.094 1.00 0.00 N ATOM 226 CA LEU A 16 -1.422 -7.150 -0.091 1.00 0.00 C ATOM 227 C LEU A 16 -1.076 -8.292 -1.041 1.00 0.00 C ATOM 228 O LEU A 16 -1.736 -9.311 -1.065 1.00 0.00 O ATOM 229 CB LEU A 16 -2.446 -6.214 -0.713 1.00 0.00 C ATOM 230 CG LEU A 16 -3.843 -6.685 -0.374 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.115 -6.400 1.102 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.842 -5.925 -1.246 1.00 0.00 C ATOM 233 H LEU A 16 -0.280 -5.381 -0.360 1.00 0.00 H ATOM 234 HA LEU A 16 -1.782 -7.520 0.854 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.299 -5.221 -0.319 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.319 -6.190 -1.781 1.00 0.00 H ATOM 237 HG LEU A 16 -3.916 -7.742 -0.562 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.120 -6.736 1.358 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.032 -5.329 1.287 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.388 -6.932 1.715 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.755 -4.856 -1.052 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.854 -6.255 -1.012 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.630 -6.121 -2.297 1.00 0.00 H ATOM 244 N VAL A 17 -0.052 -8.133 -1.829 1.00 0.00 N ATOM 245 CA VAL A 17 0.310 -9.224 -2.773 1.00 0.00 C ATOM 246 C VAL A 17 0.369 -10.555 -2.022 1.00 0.00 C ATOM 247 O VAL A 17 0.212 -11.613 -2.599 1.00 0.00 O ATOM 248 CB VAL A 17 1.685 -8.875 -3.354 1.00 0.00 C ATOM 249 CG1 VAL A 17 1.509 -7.952 -4.560 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.554 -8.176 -2.307 1.00 0.00 C ATOM 251 H VAL A 17 0.464 -7.303 -1.802 1.00 0.00 H ATOM 252 HA VAL A 17 -0.417 -9.270 -3.563 1.00 0.00 H ATOM 253 HB VAL A 17 2.173 -9.784 -3.673 1.00 0.00 H ATOM 254 HG11 VAL A 17 2.486 -7.703 -4.974 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.004 -7.038 -4.248 1.00 0.00 H ATOM 256 HG13 VAL A 17 0.911 -8.456 -5.320 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.065 -7.257 -1.984 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.525 -7.937 -2.741 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.692 -8.835 -1.450 1.00 0.00 H ATOM 260 N ARG A 18 0.584 -10.511 -0.734 1.00 0.00 N ATOM 261 CA ARG A 18 0.643 -11.775 0.054 1.00 0.00 C ATOM 262 C ARG A 18 -0.530 -12.683 -0.329 1.00 0.00 C ATOM 263 O ARG A 18 -0.403 -13.891 -0.383 1.00 0.00 O ATOM 264 CB ARG A 18 0.528 -11.338 1.515 1.00 0.00 C ATOM 265 CG ARG A 18 1.759 -10.516 1.901 1.00 0.00 C ATOM 266 CD ARG A 18 1.787 -10.323 3.420 1.00 0.00 C ATOM 267 NE ARG A 18 1.722 -11.700 3.985 1.00 0.00 N ATOM 268 CZ ARG A 18 1.405 -11.880 5.239 1.00 0.00 C ATOM 269 NH1 ARG A 18 1.129 -10.857 6.003 1.00 0.00 N ATOM 270 NH2 ARG A 18 1.363 -13.089 5.732 1.00 0.00 N ATOM 271 H ARG A 18 0.702 -9.646 -0.286 1.00 0.00 H ATOM 272 HA ARG A 18 1.581 -12.280 -0.110 1.00 0.00 H ATOM 273 HB2 ARG A 18 -0.361 -10.737 1.642 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.467 -12.210 2.149 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.652 -11.036 1.587 1.00 0.00 H ATOM 276 HG3 ARG A 18 1.714 -9.552 1.420 1.00 0.00 H ATOM 277 HD2 ARG A 18 2.705 -9.835 3.718 1.00 0.00 H ATOM 278 HD3 ARG A 18 0.932 -9.750 3.743 1.00 0.00 H ATOM 279 HE ARG A 18 1.921 -12.472 3.414 1.00 0.00 H ATOM 280 HH11 ARG A 18 1.160 -9.930 5.628 1.00 0.00 H ATOM 281 HH12 ARG A 18 0.887 -11.000 6.961 1.00 0.00 H ATOM 282 HH21 ARG A 18 1.571 -13.874 5.149 1.00 0.00 H ATOM 283 HH22 ARG A 18 1.122 -13.229 6.693 1.00 0.00 H ATOM 284 N SER A 19 -1.672 -12.109 -0.596 1.00 0.00 N ATOM 285 CA SER A 19 -2.852 -12.935 -0.975 1.00 0.00 C ATOM 286 C SER A 19 -2.964 -13.029 -2.499 1.00 0.00 C ATOM 287 O SER A 19 -2.392 -13.908 -3.113 1.00 0.00 O ATOM 288 CB SER A 19 -4.056 -12.195 -0.393 1.00 0.00 C ATOM 289 OG SER A 19 -3.948 -10.809 -0.694 1.00 0.00 O ATOM 290 H SER A 19 -1.753 -11.137 -0.546 1.00 0.00 H ATOM 291 HA SER A 19 -2.778 -13.915 -0.539 1.00 0.00 H ATOM 292 HB2 SER A 19 -4.963 -12.582 -0.826 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.082 -12.340 0.679 1.00 0.00 H ATOM 294 HG SER A 19 -4.027 -10.320 0.129 1.00 0.00 H HETATM 295 N NH2 A 20 -3.683 -12.151 -3.142 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.760 -12.199 -4.118 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -4.145 -11.440 -2.649 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 2 ATOM 1 N LYS A 1 0.668 13.978 2.409 1.00 0.00 N ATOM 2 CA LYS A 1 0.527 12.779 3.284 1.00 0.00 C ATOM 3 C LYS A 1 -0.235 11.672 2.547 1.00 0.00 C ATOM 4 O LYS A 1 -1.059 10.987 3.117 1.00 0.00 O ATOM 5 CB LYS A 1 -0.270 13.261 4.495 1.00 0.00 C ATOM 6 CG LYS A 1 0.692 13.669 5.613 1.00 0.00 C ATOM 7 CD LYS A 1 0.660 15.188 5.786 1.00 0.00 C ATOM 8 CE LYS A 1 1.708 15.606 6.820 1.00 0.00 C ATOM 9 NZ LYS A 1 1.416 17.039 7.108 1.00 0.00 N ATOM 10 H1 LYS A 1 1.291 13.753 1.607 1.00 0.00 H ATOM 11 H2 LYS A 1 1.078 14.762 2.959 1.00 0.00 H ATOM 12 H3 LYS A 1 -0.267 14.259 2.050 1.00 0.00 H ATOM 13 HA LYS A 1 1.496 12.425 3.597 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.875 14.112 4.212 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.910 12.466 4.846 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.391 13.194 6.536 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.694 13.358 5.357 1.00 0.00 H ATOM 18 HD2 LYS A 1 0.877 15.663 4.840 1.00 0.00 H ATOM 19 HD3 LYS A 1 -0.320 15.493 6.126 1.00 0.00 H ATOM 20 HE2 LYS A 1 1.606 15.012 7.718 1.00 0.00 H ATOM 21 HE3 LYS A 1 2.701 15.506 6.411 1.00 0.00 H ATOM 22 HZ1 LYS A 1 2.031 17.643 6.526 1.00 0.00 H ATOM 23 HZ2 LYS A 1 1.591 17.232 8.116 1.00 0.00 H ATOM 24 HZ3 LYS A 1 0.422 17.242 6.882 1.00 0.00 H ATOM 25 N CYS A 2 0.037 11.495 1.283 1.00 0.00 N ATOM 26 CA CYS A 2 -0.671 10.435 0.509 1.00 0.00 C ATOM 27 C CYS A 2 -0.359 9.053 1.092 1.00 0.00 C ATOM 28 O CYS A 2 -1.111 8.113 0.924 1.00 0.00 O ATOM 29 CB CYS A 2 -0.124 10.555 -0.915 1.00 0.00 C ATOM 30 SG CYS A 2 1.605 10.018 -0.951 1.00 0.00 S ATOM 31 H CYS A 2 0.705 12.060 0.842 1.00 0.00 H ATOM 32 HA CYS A 2 -1.734 10.613 0.509 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.707 9.933 -1.578 1.00 0.00 H ATOM 34 HB3 CYS A 2 -0.188 11.583 -1.237 1.00 0.00 H ATOM 35 N ASN A 3 0.747 8.923 1.772 1.00 0.00 N ATOM 36 CA ASN A 3 1.112 7.601 2.363 1.00 0.00 C ATOM 37 C ASN A 3 -0.094 6.968 3.061 1.00 0.00 C ATOM 38 O ASN A 3 -0.234 5.762 3.108 1.00 0.00 O ATOM 39 CB ASN A 3 2.205 7.920 3.384 1.00 0.00 C ATOM 40 CG ASN A 3 3.139 6.718 3.529 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.177 6.661 2.901 1.00 0.00 O ATOM 42 ND2 ASN A 3 2.811 5.745 4.334 1.00 0.00 N ATOM 43 H ASN A 3 1.341 9.693 1.894 1.00 0.00 H ATOM 44 HA ASN A 3 1.503 6.938 1.610 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.771 8.778 3.050 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.753 8.138 4.340 1.00 0.00 H ATOM 47 HD21 ASN A 3 1.968 5.790 4.841 1.00 0.00 H ATOM 48 HD22 ASN A 3 3.406 4.968 4.433 1.00 0.00 H ATOM 49 N THR A 4 -0.957 7.770 3.617 1.00 0.00 N ATOM 50 CA THR A 4 -2.142 7.211 4.330 1.00 0.00 C ATOM 51 C THR A 4 -3.175 6.620 3.359 1.00 0.00 C ATOM 52 O THR A 4 -3.531 5.463 3.456 1.00 0.00 O ATOM 53 CB THR A 4 -2.749 8.396 5.085 1.00 0.00 C ATOM 54 OG1 THR A 4 -2.138 9.603 4.652 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.521 8.219 6.587 1.00 0.00 C ATOM 56 H THR A 4 -0.820 8.740 3.582 1.00 0.00 H ATOM 57 HA THR A 4 -1.827 6.460 5.037 1.00 0.00 H ATOM 58 HB THR A 4 -3.810 8.440 4.891 1.00 0.00 H ATOM 59 HG1 THR A 4 -2.413 10.305 5.245 1.00 0.00 H ATOM 60 HG21 THR A 4 -2.995 7.296 6.921 1.00 0.00 H ATOM 61 HG22 THR A 4 -2.954 9.064 7.123 1.00 0.00 H ATOM 62 HG23 THR A 4 -1.451 8.171 6.789 1.00 0.00 H ATOM 63 N ALA A 5 -3.699 7.412 2.458 1.00 0.00 N ATOM 64 CA ALA A 5 -4.749 6.884 1.530 1.00 0.00 C ATOM 65 C ALA A 5 -4.220 6.555 0.122 1.00 0.00 C ATOM 66 O ALA A 5 -4.190 5.411 -0.286 1.00 0.00 O ATOM 67 CB ALA A 5 -5.783 8.006 1.449 1.00 0.00 C ATOM 68 H ALA A 5 -3.432 8.354 2.414 1.00 0.00 H ATOM 69 HA ALA A 5 -5.211 6.011 1.959 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.595 7.706 0.786 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.311 8.908 1.059 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.182 8.206 2.444 1.00 0.00 H ATOM 73 N THR A 6 -3.864 7.554 -0.642 1.00 0.00 N ATOM 74 CA THR A 6 -3.408 7.308 -2.050 1.00 0.00 C ATOM 75 C THR A 6 -2.119 6.482 -2.124 1.00 0.00 C ATOM 76 O THR A 6 -2.048 5.503 -2.840 1.00 0.00 O ATOM 77 CB THR A 6 -3.174 8.703 -2.628 1.00 0.00 C ATOM 78 OG1 THR A 6 -4.407 9.410 -2.665 1.00 0.00 O ATOM 79 CG2 THR A 6 -2.611 8.582 -4.045 1.00 0.00 C ATOM 80 H THR A 6 -3.940 8.473 -0.309 1.00 0.00 H ATOM 81 HA THR A 6 -4.189 6.817 -2.608 1.00 0.00 H ATOM 82 HB THR A 6 -2.471 9.237 -2.009 1.00 0.00 H ATOM 83 HG1 THR A 6 -4.988 9.030 -2.001 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.667 8.039 -4.016 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.444 9.577 -4.457 1.00 0.00 H ATOM 86 HG23 THR A 6 -3.320 8.044 -4.674 1.00 0.00 H ATOM 87 N CYS A 7 -1.094 6.864 -1.417 1.00 0.00 N ATOM 88 CA CYS A 7 0.180 6.089 -1.494 1.00 0.00 C ATOM 89 C CYS A 7 0.078 4.806 -0.666 1.00 0.00 C ATOM 90 O CYS A 7 0.901 3.919 -0.777 1.00 0.00 O ATOM 91 CB CYS A 7 1.244 7.020 -0.919 1.00 0.00 C ATOM 92 SG CYS A 7 1.585 8.353 -2.094 1.00 0.00 S ATOM 93 H CYS A 7 -1.154 7.664 -0.854 1.00 0.00 H ATOM 94 HA CYS A 7 0.414 5.854 -2.521 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.887 7.441 0.003 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.150 6.460 -0.733 1.00 0.00 H ATOM 97 N ALA A 8 -0.923 4.701 0.161 1.00 0.00 N ATOM 98 CA ALA A 8 -1.075 3.476 0.995 1.00 0.00 C ATOM 99 C ALA A 8 -1.555 2.299 0.142 1.00 0.00 C ATOM 100 O ALA A 8 -1.333 1.153 0.471 1.00 0.00 O ATOM 101 CB ALA A 8 -2.126 3.843 2.038 1.00 0.00 C ATOM 102 H ALA A 8 -1.575 5.429 0.235 1.00 0.00 H ATOM 103 HA ALA A 8 -0.143 3.234 1.481 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.298 2.991 2.696 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.057 4.109 1.538 1.00 0.00 H ATOM 106 HB3 ALA A 8 -1.774 4.691 2.626 1.00 0.00 H ATOM 107 N THR A 9 -2.212 2.573 -0.954 1.00 0.00 N ATOM 108 CA THR A 9 -2.705 1.465 -1.823 1.00 0.00 C ATOM 109 C THR A 9 -1.548 0.903 -2.649 1.00 0.00 C ATOM 110 O THR A 9 -1.472 -0.281 -2.914 1.00 0.00 O ATOM 111 CB THR A 9 -3.750 2.109 -2.736 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.850 2.552 -1.954 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.230 1.085 -3.763 1.00 0.00 C ATOM 114 H THR A 9 -2.379 3.504 -1.204 1.00 0.00 H ATOM 115 HA THR A 9 -3.161 0.691 -1.229 1.00 0.00 H ATOM 116 HB THR A 9 -3.312 2.951 -3.251 1.00 0.00 H ATOM 117 HG1 THR A 9 -4.945 3.498 -2.083 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.384 0.746 -4.362 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.975 1.544 -4.414 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.674 0.233 -3.248 1.00 0.00 H ATOM 121 N GLN A 10 -0.647 1.751 -3.051 1.00 0.00 N ATOM 122 CA GLN A 10 0.519 1.287 -3.858 1.00 0.00 C ATOM 123 C GLN A 10 1.363 0.323 -3.018 1.00 0.00 C ATOM 124 O GLN A 10 1.561 -0.818 -3.382 1.00 0.00 O ATOM 125 CB GLN A 10 1.289 2.573 -4.202 1.00 0.00 C ATOM 126 CG GLN A 10 2.799 2.306 -4.229 1.00 0.00 C ATOM 127 CD GLN A 10 3.519 3.503 -4.853 1.00 0.00 C ATOM 128 OE1 GLN A 10 3.694 3.563 -6.054 1.00 0.00 O ATOM 129 NE2 GLN A 10 3.947 4.464 -4.081 1.00 0.00 N ATOM 130 H GLN A 10 -0.736 2.693 -2.815 1.00 0.00 H ATOM 131 HA GLN A 10 0.183 0.801 -4.760 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.974 2.928 -5.172 1.00 0.00 H ATOM 133 HB3 GLN A 10 1.075 3.327 -3.459 1.00 0.00 H ATOM 134 HG2 GLN A 10 3.152 2.159 -3.218 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.998 1.422 -4.814 1.00 0.00 H ATOM 136 HE21 GLN A 10 3.806 4.412 -3.109 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.412 5.237 -4.474 1.00 0.00 H ATOM 138 N ARG A 11 1.834 0.765 -1.887 1.00 0.00 N ATOM 139 CA ARG A 11 2.632 -0.144 -1.020 1.00 0.00 C ATOM 140 C ARG A 11 1.734 -1.306 -0.615 1.00 0.00 C ATOM 141 O ARG A 11 2.179 -2.406 -0.357 1.00 0.00 O ATOM 142 CB ARG A 11 3.024 0.696 0.198 1.00 0.00 C ATOM 143 CG ARG A 11 1.791 0.933 1.074 1.00 0.00 C ATOM 144 CD ARG A 11 2.200 1.697 2.338 1.00 0.00 C ATOM 145 NE ARG A 11 2.834 0.674 3.216 1.00 0.00 N ATOM 146 CZ ARG A 11 2.109 -0.272 3.751 1.00 0.00 C ATOM 147 NH1 ARG A 11 0.825 -0.326 3.524 1.00 0.00 N ATOM 148 NH2 ARG A 11 2.671 -1.166 4.519 1.00 0.00 N ATOM 149 H ARG A 11 1.644 1.681 -1.599 1.00 0.00 H ATOM 150 HA ARG A 11 3.510 -0.497 -1.537 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.777 0.172 0.769 1.00 0.00 H ATOM 152 HB3 ARG A 11 3.417 1.646 -0.131 1.00 0.00 H ATOM 153 HG2 ARG A 11 1.065 1.511 0.522 1.00 0.00 H ATOM 154 HG3 ARG A 11 1.360 -0.016 1.354 1.00 0.00 H ATOM 155 HD2 ARG A 11 2.908 2.477 2.090 1.00 0.00 H ATOM 156 HD3 ARG A 11 1.332 2.113 2.823 1.00 0.00 H ATOM 157 HE ARG A 11 3.797 0.711 3.391 1.00 0.00 H ATOM 158 HH11 ARG A 11 0.392 0.359 2.939 1.00 0.00 H ATOM 159 HH12 ARG A 11 0.274 -1.050 3.939 1.00 0.00 H ATOM 160 HH21 ARG A 11 3.655 -1.126 4.694 1.00 0.00 H ATOM 161 HH22 ARG A 11 2.119 -1.891 4.929 1.00 0.00 H ATOM 162 N LEU A 12 0.457 -1.046 -0.576 1.00 0.00 N ATOM 163 CA LEU A 12 -0.530 -2.094 -0.207 1.00 0.00 C ATOM 164 C LEU A 12 -0.614 -3.118 -1.325 1.00 0.00 C ATOM 165 O LEU A 12 -0.414 -4.283 -1.118 1.00 0.00 O ATOM 166 CB LEU A 12 -1.822 -1.309 -0.035 1.00 0.00 C ATOM 167 CG LEU A 12 -3.069 -2.192 -0.140 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.323 -2.602 -1.593 1.00 0.00 C ATOM 169 CD2 LEU A 12 -2.893 -3.436 0.724 1.00 0.00 C ATOM 170 H LEU A 12 0.140 -0.146 -0.801 1.00 0.00 H ATOM 171 HA LEU A 12 -0.249 -2.563 0.710 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.807 -0.846 0.936 1.00 0.00 H ATOM 173 HB3 LEU A 12 -1.861 -0.549 -0.794 1.00 0.00 H ATOM 174 HG LEU A 12 -3.915 -1.625 0.211 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.213 -3.229 -1.644 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.465 -3.159 -1.969 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.472 -1.710 -2.202 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.024 -3.997 0.381 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.782 -4.062 0.647 1.00 0.00 H ATOM 180 HD23 LEU A 12 -2.747 -3.140 1.763 1.00 0.00 H ATOM 181 N ALA A 13 -0.866 -2.696 -2.512 1.00 0.00 N ATOM 182 CA ALA A 13 -0.907 -3.656 -3.634 1.00 0.00 C ATOM 183 C ALA A 13 0.339 -4.533 -3.589 1.00 0.00 C ATOM 184 O ALA A 13 0.332 -5.673 -4.000 1.00 0.00 O ATOM 185 CB ALA A 13 -0.846 -2.772 -4.853 1.00 0.00 C ATOM 186 H ALA A 13 -1.005 -1.749 -2.674 1.00 0.00 H ATOM 187 HA ALA A 13 -1.811 -4.241 -3.628 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.871 -3.389 -5.751 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.077 -2.192 -4.836 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.700 -2.095 -4.854 1.00 0.00 H ATOM 191 N ASN A 14 1.402 -3.987 -3.070 1.00 0.00 N ATOM 192 CA ASN A 14 2.669 -4.734 -2.951 1.00 0.00 C ATOM 193 C ASN A 14 2.662 -5.443 -1.617 1.00 0.00 C ATOM 194 O ASN A 14 3.368 -6.407 -1.398 1.00 0.00 O ATOM 195 CB ASN A 14 3.767 -3.673 -3.002 1.00 0.00 C ATOM 196 CG ASN A 14 4.300 -3.559 -4.431 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.882 -4.491 -4.950 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.127 -2.448 -5.092 1.00 0.00 N ATOM 199 H ASN A 14 1.360 -3.081 -2.724 1.00 0.00 H ATOM 200 HA ASN A 14 2.779 -5.435 -3.763 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.361 -2.721 -2.692 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.572 -3.954 -2.340 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.655 -1.693 -4.670 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.466 -2.366 -6.013 1.00 0.00 H ATOM 205 N PHE A 15 1.843 -4.973 -0.716 1.00 0.00 N ATOM 206 CA PHE A 15 1.776 -5.636 0.606 1.00 0.00 C ATOM 207 C PHE A 15 0.683 -6.692 0.524 1.00 0.00 C ATOM 208 O PHE A 15 0.744 -7.755 1.106 1.00 0.00 O ATOM 209 CB PHE A 15 1.448 -4.513 1.627 1.00 0.00 C ATOM 210 CG PHE A 15 0.240 -4.865 2.494 1.00 0.00 C ATOM 211 CD1 PHE A 15 0.146 -6.121 3.107 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.791 -3.931 2.673 1.00 0.00 C ATOM 213 CE1 PHE A 15 -0.971 -6.440 3.885 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.906 -4.251 3.452 1.00 0.00 C ATOM 215 CZ PHE A 15 -1.998 -5.507 4.057 1.00 0.00 C ATOM 216 H PHE A 15 1.246 -4.204 -0.930 1.00 0.00 H ATOM 217 HA PHE A 15 2.721 -6.078 0.824 1.00 0.00 H ATOM 218 HB2 PHE A 15 2.304 -4.357 2.266 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.242 -3.600 1.089 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.935 -6.847 2.975 1.00 0.00 H ATOM 221 HD2 PHE A 15 -0.728 -2.961 2.219 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.040 -7.409 4.349 1.00 0.00 H ATOM 223 HE2 PHE A 15 -2.698 -3.527 3.577 1.00 0.00 H ATOM 224 HZ PHE A 15 -2.860 -5.757 4.658 1.00 0.00 H ATOM 225 N LEU A 16 -0.316 -6.352 -0.207 1.00 0.00 N ATOM 226 CA LEU A 16 -1.484 -7.219 -0.407 1.00 0.00 C ATOM 227 C LEU A 16 -1.143 -8.367 -1.359 1.00 0.00 C ATOM 228 O LEU A 16 -1.880 -9.325 -1.483 1.00 0.00 O ATOM 229 CB LEU A 16 -2.472 -6.246 -1.029 1.00 0.00 C ATOM 230 CG LEU A 16 -3.884 -6.721 -0.782 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.264 -6.394 0.662 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.820 -5.996 -1.748 1.00 0.00 C ATOM 233 H LEU A 16 -0.301 -5.473 -0.644 1.00 0.00 H ATOM 234 HA LEU A 16 -1.861 -7.587 0.533 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.340 -5.276 -0.578 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.293 -6.169 -2.087 1.00 0.00 H ATOM 237 HG LEU A 16 -3.933 -7.786 -0.941 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.282 -6.731 0.856 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.203 -5.317 0.819 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.579 -6.900 1.342 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.756 -4.921 -1.579 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.844 -6.329 -1.581 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.528 -6.220 -2.774 1.00 0.00 H ATOM 244 N VAL A 17 -0.030 -8.274 -2.028 1.00 0.00 N ATOM 245 CA VAL A 17 0.363 -9.357 -2.972 1.00 0.00 C ATOM 246 C VAL A 17 0.257 -10.720 -2.282 1.00 0.00 C ATOM 247 O VAL A 17 -0.231 -11.678 -2.846 1.00 0.00 O ATOM 248 CB VAL A 17 1.820 -9.067 -3.339 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.308 -10.103 -4.355 1.00 0.00 C ATOM 250 CG2 VAL A 17 1.923 -7.671 -3.950 1.00 0.00 C ATOM 251 H VAL A 17 0.544 -7.488 -1.909 1.00 0.00 H ATOM 252 HA VAL A 17 -0.252 -9.327 -3.855 1.00 0.00 H ATOM 253 HB VAL A 17 2.430 -9.120 -2.449 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.346 -9.896 -4.616 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.691 -10.051 -5.252 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.235 -11.100 -3.921 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.306 -7.620 -4.847 1.00 0.00 H ATOM 258 HG22 VAL A 17 2.961 -7.464 -4.212 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.576 -6.931 -3.228 1.00 0.00 H ATOM 260 N ARG A 18 0.717 -10.813 -1.062 1.00 0.00 N ATOM 261 CA ARG A 18 0.650 -12.112 -0.331 1.00 0.00 C ATOM 262 C ARG A 18 -0.791 -12.627 -0.286 1.00 0.00 C ATOM 263 O ARG A 18 -1.044 -13.807 -0.436 1.00 0.00 O ATOM 264 CB ARG A 18 1.149 -11.795 1.080 1.00 0.00 C ATOM 265 CG ARG A 18 1.845 -13.027 1.664 1.00 0.00 C ATOM 266 CD ARG A 18 3.163 -13.269 0.923 1.00 0.00 C ATOM 267 NE ARG A 18 3.410 -14.733 1.048 1.00 0.00 N ATOM 268 CZ ARG A 18 4.611 -15.214 0.866 1.00 0.00 C ATOM 269 NH1 ARG A 18 5.600 -14.414 0.569 1.00 0.00 N ATOM 270 NH2 ARG A 18 4.822 -16.496 0.980 1.00 0.00 N ATOM 271 H ARG A 18 1.110 -10.027 -0.629 1.00 0.00 H ATOM 272 HA ARG A 18 1.297 -12.840 -0.795 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.847 -10.973 1.037 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.312 -11.527 1.705 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.047 -12.862 2.713 1.00 0.00 H ATOM 276 HG3 ARG A 18 1.208 -13.890 1.551 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.066 -12.988 -0.117 1.00 0.00 H ATOM 278 HD3 ARG A 18 3.965 -12.720 1.390 1.00 0.00 H ATOM 279 HE ARG A 18 2.670 -15.337 1.268 1.00 0.00 H ATOM 280 HH11 ARG A 18 5.440 -13.432 0.479 1.00 0.00 H ATOM 281 HH12 ARG A 18 6.518 -14.785 0.432 1.00 0.00 H ATOM 282 HH21 ARG A 18 4.068 -17.110 1.206 1.00 0.00 H ATOM 283 HH22 ARG A 18 5.742 -16.865 0.841 1.00 0.00 H ATOM 284 N SER A 19 -1.740 -11.755 -0.076 1.00 0.00 N ATOM 285 CA SER A 19 -3.160 -12.198 -0.019 1.00 0.00 C ATOM 286 C SER A 19 -3.788 -12.151 -1.415 1.00 0.00 C ATOM 287 O SER A 19 -3.986 -13.173 -2.042 1.00 0.00 O ATOM 288 CB SER A 19 -3.849 -11.203 0.914 1.00 0.00 C ATOM 289 OG SER A 19 -3.110 -11.106 2.125 1.00 0.00 O ATOM 290 H SER A 19 -1.516 -10.810 0.044 1.00 0.00 H ATOM 291 HA SER A 19 -3.224 -13.191 0.390 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.889 -10.234 0.446 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.856 -11.542 1.121 1.00 0.00 H ATOM 294 HG SER A 19 -2.296 -10.634 1.937 1.00 0.00 H HETATM 295 N NH2 A 20 -4.113 -10.998 -1.930 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.515 -10.955 -2.822 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -3.953 -10.173 -1.425 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 3 ATOM 1 N LYS A 1 0.682 13.784 2.810 1.00 0.00 N ATOM 2 CA LYS A 1 -0.067 12.685 3.487 1.00 0.00 C ATOM 3 C LYS A 1 -0.519 11.644 2.461 1.00 0.00 C ATOM 4 O LYS A 1 -1.590 11.079 2.564 1.00 0.00 O ATOM 5 CB LYS A 1 -1.275 13.369 4.130 1.00 0.00 C ATOM 6 CG LYS A 1 -2.105 12.333 4.889 1.00 0.00 C ATOM 7 CD LYS A 1 -3.486 12.207 4.239 1.00 0.00 C ATOM 8 CE LYS A 1 -4.564 12.188 5.325 1.00 0.00 C ATOM 9 NZ LYS A 1 -5.857 12.218 4.587 1.00 0.00 N ATOM 10 H1 LYS A 1 0.715 14.616 3.432 1.00 0.00 H ATOM 11 H2 LYS A 1 0.201 14.034 1.921 1.00 0.00 H ATOM 12 H3 LYS A 1 1.650 13.470 2.602 1.00 0.00 H ATOM 13 HA LYS A 1 0.545 12.226 4.248 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.934 14.131 4.815 1.00 0.00 H ATOM 15 HB3 LYS A 1 -1.883 13.821 3.361 1.00 0.00 H ATOM 16 HG2 LYS A 1 -1.603 11.377 4.860 1.00 0.00 H ATOM 17 HG3 LYS A 1 -2.223 12.647 5.915 1.00 0.00 H ATOM 18 HD2 LYS A 1 -3.651 13.048 3.581 1.00 0.00 H ATOM 19 HD3 LYS A 1 -3.534 11.289 3.671 1.00 0.00 H ATOM 20 HE2 LYS A 1 -4.485 11.284 5.915 1.00 0.00 H ATOM 21 HE3 LYS A 1 -4.478 13.059 5.956 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -6.538 12.811 5.101 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -6.232 11.250 4.505 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -5.706 12.613 3.636 1.00 0.00 H ATOM 25 N CYS A 2 0.291 11.385 1.471 1.00 0.00 N ATOM 26 CA CYS A 2 -0.090 10.381 0.438 1.00 0.00 C ATOM 27 C CYS A 2 -0.048 8.968 1.026 1.00 0.00 C ATOM 28 O CYS A 2 -0.946 8.175 0.825 1.00 0.00 O ATOM 29 CB CYS A 2 0.959 10.530 -0.665 1.00 0.00 C ATOM 30 SG CYS A 2 0.515 9.478 -2.072 1.00 0.00 S ATOM 31 H CYS A 2 1.151 11.852 1.408 1.00 0.00 H ATOM 32 HA CYS A 2 -1.071 10.598 0.045 1.00 0.00 H ATOM 33 HB2 CYS A 2 0.999 11.561 -0.986 1.00 0.00 H ATOM 34 HB3 CYS A 2 1.927 10.235 -0.286 1.00 0.00 H ATOM 35 N ASN A 3 0.993 8.644 1.744 1.00 0.00 N ATOM 36 CA ASN A 3 1.100 7.277 2.336 1.00 0.00 C ATOM 37 C ASN A 3 -0.224 6.873 2.986 1.00 0.00 C ATOM 38 O ASN A 3 -0.554 5.707 3.073 1.00 0.00 O ATOM 39 CB ASN A 3 2.195 7.392 3.397 1.00 0.00 C ATOM 40 CG ASN A 3 3.562 7.437 2.717 1.00 0.00 C ATOM 41 OD1 ASN A 3 3.860 6.618 1.870 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.415 8.364 3.054 1.00 0.00 N ATOM 43 H ASN A 3 1.710 9.298 1.890 1.00 0.00 H ATOM 44 HA ASN A 3 1.390 6.557 1.590 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.046 8.295 3.971 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.150 6.537 4.055 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.175 9.028 3.740 1.00 0.00 H ATOM 48 HD22 ASN A 3 5.297 8.402 2.619 1.00 0.00 H ATOM 49 N THR A 4 -0.973 7.827 3.455 1.00 0.00 N ATOM 50 CA THR A 4 -2.268 7.501 4.114 1.00 0.00 C ATOM 51 C THR A 4 -3.316 7.022 3.100 1.00 0.00 C ATOM 52 O THR A 4 -3.860 5.942 3.225 1.00 0.00 O ATOM 53 CB THR A 4 -2.715 8.813 4.758 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.774 9.194 5.751 1.00 0.00 O ATOM 55 CG2 THR A 4 -4.090 8.626 5.399 1.00 0.00 C ATOM 56 H THR A 4 -0.681 8.759 3.384 1.00 0.00 H ATOM 57 HA THR A 4 -2.120 6.754 4.879 1.00 0.00 H ATOM 58 HB THR A 4 -2.775 9.582 4.004 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.432 8.396 6.159 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.811 8.333 4.635 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.408 9.562 5.858 1.00 0.00 H ATOM 62 HG23 THR A 4 -4.033 7.849 6.161 1.00 0.00 H ATOM 63 N ALA A 5 -3.640 7.829 2.123 1.00 0.00 N ATOM 64 CA ALA A 5 -4.691 7.420 1.143 1.00 0.00 C ATOM 65 C ALA A 5 -4.119 6.911 -0.190 1.00 0.00 C ATOM 66 O ALA A 5 -4.260 5.754 -0.534 1.00 0.00 O ATOM 67 CB ALA A 5 -5.510 8.687 0.904 1.00 0.00 C ATOM 68 H ALA A 5 -3.217 8.711 2.053 1.00 0.00 H ATOM 69 HA ALA A 5 -5.327 6.668 1.579 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.308 8.475 0.193 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.864 9.468 0.503 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.943 9.023 1.846 1.00 0.00 H ATOM 73 N THR A 6 -3.535 7.782 -0.970 1.00 0.00 N ATOM 74 CA THR A 6 -3.023 7.366 -2.315 1.00 0.00 C ATOM 75 C THR A 6 -1.795 6.454 -2.242 1.00 0.00 C ATOM 76 O THR A 6 -1.752 5.418 -2.876 1.00 0.00 O ATOM 77 CB THR A 6 -2.661 8.675 -3.015 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.846 9.410 -3.285 1.00 0.00 O ATOM 79 CG2 THR A 6 -1.939 8.366 -4.328 1.00 0.00 C ATOM 80 H THR A 6 -3.475 8.720 -0.694 1.00 0.00 H ATOM 81 HA THR A 6 -3.809 6.877 -2.869 1.00 0.00 H ATOM 82 HB THR A 6 -2.011 9.257 -2.380 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.862 10.173 -2.702 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.030 7.802 -4.119 1.00 0.00 H ATOM 85 HG22 THR A 6 -1.680 9.299 -4.829 1.00 0.00 H ATOM 86 HG23 THR A 6 -2.592 7.777 -4.972 1.00 0.00 H ATOM 87 N CYS A 7 -0.786 6.825 -1.509 1.00 0.00 N ATOM 88 CA CYS A 7 0.429 5.963 -1.453 1.00 0.00 C ATOM 89 C CYS A 7 0.196 4.765 -0.531 1.00 0.00 C ATOM 90 O CYS A 7 1.008 3.865 -0.449 1.00 0.00 O ATOM 91 CB CYS A 7 1.540 6.864 -0.912 1.00 0.00 C ATOM 92 SG CYS A 7 1.990 8.098 -2.163 1.00 0.00 S ATOM 93 H CYS A 7 -0.820 7.669 -1.013 1.00 0.00 H ATOM 94 HA CYS A 7 0.688 5.623 -2.444 1.00 0.00 H ATOM 95 HB2 CYS A 7 1.196 7.364 -0.026 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.405 6.265 -0.673 1.00 0.00 H ATOM 97 N ALA A 8 -0.911 4.741 0.158 1.00 0.00 N ATOM 98 CA ALA A 8 -1.199 3.595 1.069 1.00 0.00 C ATOM 99 C ALA A 8 -1.594 2.355 0.258 1.00 0.00 C ATOM 100 O ALA A 8 -1.057 1.281 0.445 1.00 0.00 O ATOM 101 CB ALA A 8 -2.369 4.066 1.932 1.00 0.00 C ATOM 102 H ALA A 8 -1.556 5.473 0.075 1.00 0.00 H ATOM 103 HA ALA A 8 -0.345 3.384 1.689 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.645 3.278 2.633 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.222 4.298 1.294 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.077 4.958 2.486 1.00 0.00 H ATOM 107 N THR A 9 -2.533 2.499 -0.638 1.00 0.00 N ATOM 108 CA THR A 9 -2.972 1.332 -1.460 1.00 0.00 C ATOM 109 C THR A 9 -1.824 0.842 -2.345 1.00 0.00 C ATOM 110 O THR A 9 -1.691 -0.336 -2.618 1.00 0.00 O ATOM 111 CB THR A 9 -4.118 1.862 -2.322 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.819 2.870 -1.605 1.00 0.00 O ATOM 113 CG2 THR A 9 -5.073 0.719 -2.666 1.00 0.00 C ATOM 114 H THR A 9 -2.951 3.374 -0.770 1.00 0.00 H ATOM 115 HA THR A 9 -3.329 0.538 -0.826 1.00 0.00 H ATOM 116 HB THR A 9 -3.721 2.281 -3.233 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.278 3.423 -2.242 1.00 0.00 H ATOM 118 HG21 THR A 9 -4.534 -0.053 -3.216 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.889 1.099 -3.280 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.478 0.294 -1.747 1.00 0.00 H ATOM 121 N GLN A 10 -1.000 1.741 -2.801 1.00 0.00 N ATOM 122 CA GLN A 10 0.139 1.343 -3.679 1.00 0.00 C ATOM 123 C GLN A 10 1.049 0.357 -2.937 1.00 0.00 C ATOM 124 O GLN A 10 1.250 -0.760 -3.372 1.00 0.00 O ATOM 125 CB GLN A 10 0.852 2.670 -4.008 1.00 0.00 C ATOM 126 CG GLN A 10 2.373 2.529 -3.875 1.00 0.00 C ATOM 127 CD GLN A 10 3.047 3.819 -4.344 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.467 4.588 -5.085 1.00 0.00 O ATOM 129 NE2 GLN A 10 4.259 4.092 -3.939 1.00 0.00 N ATOM 130 H GLN A 10 -1.133 2.679 -2.567 1.00 0.00 H ATOM 131 HA GLN A 10 -0.232 0.891 -4.587 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.612 2.958 -5.021 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.505 3.435 -3.330 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.626 2.347 -2.842 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.714 1.704 -4.482 1.00 0.00 H ATOM 136 HE21 GLN A 10 4.727 3.469 -3.340 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.700 4.920 -4.236 1.00 0.00 H ATOM 138 N ARG A 11 1.576 0.743 -1.808 1.00 0.00 N ATOM 139 CA ARG A 11 2.438 -0.201 -1.047 1.00 0.00 C ATOM 140 C ARG A 11 1.573 -1.383 -0.626 1.00 0.00 C ATOM 141 O ARG A 11 1.992 -2.521 -0.633 1.00 0.00 O ATOM 142 CB ARG A 11 2.927 0.581 0.172 1.00 0.00 C ATOM 143 CG ARG A 11 4.113 -0.150 0.802 1.00 0.00 C ATOM 144 CD ARG A 11 5.402 0.248 0.079 1.00 0.00 C ATOM 145 NE ARG A 11 6.495 -0.050 1.045 1.00 0.00 N ATOM 146 CZ ARG A 11 7.666 0.512 0.905 1.00 0.00 C ATOM 147 NH1 ARG A 11 7.884 1.340 -0.082 1.00 0.00 N ATOM 148 NH2 ARG A 11 8.621 0.242 1.753 1.00 0.00 N ATOM 149 H ARG A 11 1.389 1.639 -1.457 1.00 0.00 H ATOM 150 HA ARG A 11 3.274 -0.530 -1.647 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.235 1.571 -0.136 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.129 0.660 0.894 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.188 0.117 1.847 1.00 0.00 H ATOM 154 HG3 ARG A 11 3.968 -1.215 0.713 1.00 0.00 H ATOM 155 HD2 ARG A 11 5.521 -0.337 -0.822 1.00 0.00 H ATOM 156 HD3 ARG A 11 5.392 1.302 -0.155 1.00 0.00 H ATOM 157 HE ARG A 11 6.336 -0.670 1.787 1.00 0.00 H ATOM 158 HH11 ARG A 11 7.156 1.547 -0.733 1.00 0.00 H ATOM 159 HH12 ARG A 11 8.783 1.766 -0.186 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.455 -0.391 2.507 1.00 0.00 H ATOM 161 HH22 ARG A 11 9.519 0.671 1.647 1.00 0.00 H ATOM 162 N LEU A 12 0.346 -1.098 -0.297 1.00 0.00 N ATOM 163 CA LEU A 12 -0.619 -2.155 0.095 1.00 0.00 C ATOM 164 C LEU A 12 -0.734 -3.163 -1.043 1.00 0.00 C ATOM 165 O LEU A 12 -0.438 -4.314 -0.893 1.00 0.00 O ATOM 166 CB LEU A 12 -1.899 -1.354 0.279 1.00 0.00 C ATOM 167 CG LEU A 12 -3.133 -2.243 0.412 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.476 -2.899 -0.928 1.00 0.00 C ATOM 169 CD2 LEU A 12 -2.869 -3.309 1.466 1.00 0.00 C ATOM 170 H LEU A 12 0.043 -0.167 -0.335 1.00 0.00 H ATOM 171 HA LEU A 12 -0.329 -2.631 1.018 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.799 -0.763 1.172 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.015 -0.710 -0.570 1.00 0.00 H ATOM 174 HG LEU A 12 -3.965 -1.629 0.724 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.358 -3.528 -0.810 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.637 -3.510 -1.259 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.678 -2.127 -1.670 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.013 -3.913 1.166 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.747 -3.947 1.566 1.00 0.00 H ATOM 180 HD23 LEU A 12 -2.658 -2.831 2.422 1.00 0.00 H ATOM 181 N ALA A 13 -1.134 -2.731 -2.189 1.00 0.00 N ATOM 182 CA ALA A 13 -1.233 -3.665 -3.339 1.00 0.00 C ATOM 183 C ALA A 13 0.053 -4.476 -3.461 1.00 0.00 C ATOM 184 O ALA A 13 0.055 -5.607 -3.903 1.00 0.00 O ATOM 185 CB ALA A 13 -1.353 -2.748 -4.532 1.00 0.00 C ATOM 186 H ALA A 13 -1.356 -1.792 -2.304 1.00 0.00 H ATOM 187 HA ALA A 13 -2.096 -4.302 -3.259 1.00 0.00 H ATOM 188 HB1 ALA A 13 -1.433 -3.343 -5.442 1.00 0.00 H ATOM 189 HB2 ALA A 13 -0.471 -2.111 -4.591 1.00 0.00 H ATOM 190 HB3 ALA A 13 -2.243 -2.127 -4.426 1.00 0.00 H ATOM 191 N ASN A 14 1.141 -3.896 -3.053 1.00 0.00 N ATOM 192 CA ASN A 14 2.441 -4.587 -3.105 1.00 0.00 C ATOM 193 C ASN A 14 2.606 -5.336 -1.801 1.00 0.00 C ATOM 194 O ASN A 14 3.381 -6.264 -1.688 1.00 0.00 O ATOM 195 CB ASN A 14 3.485 -3.478 -3.228 1.00 0.00 C ATOM 196 CG ASN A 14 4.017 -3.425 -4.661 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.614 -4.370 -5.139 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.828 -2.347 -5.373 1.00 0.00 N ATOM 199 H ASN A 14 1.100 -3.000 -2.677 1.00 0.00 H ATOM 200 HA ASN A 14 2.492 -5.253 -3.950 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.034 -2.530 -2.976 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.303 -3.677 -2.550 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.348 -1.582 -4.984 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.167 -2.302 -6.296 1.00 0.00 H ATOM 205 N PHE A 15 1.864 -4.931 -0.805 1.00 0.00 N ATOM 206 CA PHE A 15 1.968 -5.623 0.499 1.00 0.00 C ATOM 207 C PHE A 15 0.912 -6.715 0.538 1.00 0.00 C ATOM 208 O PHE A 15 1.035 -7.732 1.191 1.00 0.00 O ATOM 209 CB PHE A 15 1.735 -4.524 1.558 1.00 0.00 C ATOM 210 CG PHE A 15 0.617 -4.898 2.514 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.700 -5.005 2.052 1.00 0.00 C ATOM 212 CD2 PHE A 15 0.901 -5.124 3.863 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.727 -5.341 2.936 1.00 0.00 C ATOM 214 CE2 PHE A 15 -0.129 -5.458 4.747 1.00 0.00 C ATOM 215 CZ PHE A 15 -1.445 -5.567 4.284 1.00 0.00 C ATOM 216 H PHE A 15 1.208 -4.184 -0.930 1.00 0.00 H ATOM 217 HA PHE A 15 2.946 -6.036 0.598 1.00 0.00 H ATOM 218 HB2 PHE A 15 2.643 -4.378 2.121 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.478 -3.603 1.059 1.00 0.00 H ATOM 220 HD1 PHE A 15 -0.925 -4.830 1.015 1.00 0.00 H ATOM 221 HD2 PHE A 15 1.916 -5.042 4.221 1.00 0.00 H ATOM 222 HE1 PHE A 15 -2.743 -5.416 2.571 1.00 0.00 H ATOM 223 HE2 PHE A 15 0.091 -5.629 5.784 1.00 0.00 H ATOM 224 HZ PHE A 15 -2.240 -5.826 4.968 1.00 0.00 H ATOM 225 N LEU A 16 -0.130 -6.463 -0.176 1.00 0.00 N ATOM 226 CA LEU A 16 -1.270 -7.380 -0.268 1.00 0.00 C ATOM 227 C LEU A 16 -0.982 -8.463 -1.304 1.00 0.00 C ATOM 228 O LEU A 16 -1.683 -9.449 -1.405 1.00 0.00 O ATOM 229 CB LEU A 16 -2.370 -6.438 -0.732 1.00 0.00 C ATOM 230 CG LEU A 16 -3.723 -7.009 -0.375 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.067 -6.598 1.056 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.761 -6.445 -1.342 1.00 0.00 C ATOM 233 H LEU A 16 -0.169 -5.620 -0.671 1.00 0.00 H ATOM 234 HA LEU A 16 -1.513 -7.802 0.692 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.245 -5.486 -0.244 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.303 -6.296 -1.797 1.00 0.00 H ATOM 237 HG LEU A 16 -3.686 -8.083 -0.451 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.042 -7.004 1.327 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.095 -5.511 1.126 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.310 -6.986 1.738 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.784 -5.358 -1.258 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.744 -6.848 -1.097 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.498 -6.725 -2.362 1.00 0.00 H ATOM 244 N VAL A 17 0.054 -8.282 -2.073 1.00 0.00 N ATOM 245 CA VAL A 17 0.399 -9.299 -3.103 1.00 0.00 C ATOM 246 C VAL A 17 0.409 -10.690 -2.471 1.00 0.00 C ATOM 247 O VAL A 17 0.052 -11.671 -3.094 1.00 0.00 O ATOM 248 CB VAL A 17 1.801 -8.926 -3.585 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.254 -9.917 -4.659 1.00 0.00 C ATOM 250 CG2 VAL A 17 1.781 -7.515 -4.169 1.00 0.00 C ATOM 251 H VAL A 17 0.605 -7.476 -1.972 1.00 0.00 H ATOM 252 HA VAL A 17 -0.299 -9.255 -3.922 1.00 0.00 H ATOM 253 HB VAL A 17 2.487 -8.963 -2.751 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.254 -9.650 -5.002 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.561 -9.884 -5.500 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.270 -10.924 -4.241 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.087 -7.479 -5.009 1.00 0.00 H ATOM 258 HG22 VAL A 17 2.781 -7.249 -4.513 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.461 -6.809 -3.403 1.00 0.00 H ATOM 260 N ARG A 18 0.814 -10.783 -1.233 1.00 0.00 N ATOM 261 CA ARG A 18 0.842 -12.111 -0.557 1.00 0.00 C ATOM 262 C ARG A 18 -0.565 -12.715 -0.527 1.00 0.00 C ATOM 263 O ARG A 18 -0.762 -13.871 -0.848 1.00 0.00 O ATOM 264 CB ARG A 18 1.334 -11.821 0.861 1.00 0.00 C ATOM 265 CG ARG A 18 2.570 -12.673 1.158 1.00 0.00 C ATOM 266 CD ARG A 18 3.198 -12.220 2.478 1.00 0.00 C ATOM 267 NE ARG A 18 3.054 -13.388 3.391 1.00 0.00 N ATOM 268 CZ ARG A 18 3.213 -13.238 4.677 1.00 0.00 C ATOM 269 NH1 ARG A 18 3.510 -12.065 5.169 1.00 0.00 N ATOM 270 NH2 ARG A 18 3.077 -14.262 5.476 1.00 0.00 N ATOM 271 H ARG A 18 1.095 -9.978 -0.747 1.00 0.00 H ATOM 272 HA ARG A 18 1.528 -12.776 -1.057 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.590 -10.774 0.945 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.555 -12.060 1.569 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.281 -13.710 1.234 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.288 -12.555 0.362 1.00 0.00 H ATOM 277 HD2 ARG A 18 4.240 -11.977 2.333 1.00 0.00 H ATOM 278 HD3 ARG A 18 2.662 -11.372 2.877 1.00 0.00 H ATOM 279 HE ARG A 18 2.838 -14.271 3.025 1.00 0.00 H ATOM 280 HH11 ARG A 18 3.617 -11.279 4.560 1.00 0.00 H ATOM 281 HH12 ARG A 18 3.631 -11.953 6.154 1.00 0.00 H ATOM 282 HH21 ARG A 18 2.853 -15.161 5.100 1.00 0.00 H ATOM 283 HH22 ARG A 18 3.195 -14.146 6.462 1.00 0.00 H ATOM 284 N SER A 19 -1.544 -11.941 -0.145 1.00 0.00 N ATOM 285 CA SER A 19 -2.936 -12.469 -0.097 1.00 0.00 C ATOM 286 C SER A 19 -3.613 -12.296 -1.459 1.00 0.00 C ATOM 287 O SER A 19 -4.293 -11.317 -1.698 1.00 0.00 O ATOM 288 CB SER A 19 -3.643 -11.626 0.965 1.00 0.00 C ATOM 289 OG SER A 19 -2.673 -11.020 1.807 1.00 0.00 O ATOM 290 H SER A 19 -1.363 -11.013 0.108 1.00 0.00 H ATOM 291 HA SER A 19 -2.933 -13.504 0.195 1.00 0.00 H ATOM 292 HB2 SER A 19 -4.228 -10.858 0.486 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.298 -12.261 1.548 1.00 0.00 H ATOM 294 HG SER A 19 -2.917 -11.200 2.718 1.00 0.00 H HETATM 295 N NH2 A 20 -3.453 -13.215 -2.373 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.879 -13.114 -3.249 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -2.904 -14.006 -2.182 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 4 ATOM 1 N LYS A 1 1.821 13.539 2.867 1.00 0.00 N ATOM 2 CA LYS A 1 1.694 12.147 3.392 1.00 0.00 C ATOM 3 C LYS A 1 0.633 11.381 2.598 1.00 0.00 C ATOM 4 O LYS A 1 -0.445 11.106 3.089 1.00 0.00 O ATOM 5 CB LYS A 1 1.263 12.306 4.852 1.00 0.00 C ATOM 6 CG LYS A 1 1.062 10.927 5.483 1.00 0.00 C ATOM 7 CD LYS A 1 1.346 11.006 6.983 1.00 0.00 C ATOM 8 CE LYS A 1 1.257 9.607 7.594 1.00 0.00 C ATOM 9 NZ LYS A 1 0.120 9.676 8.552 1.00 0.00 N ATOM 10 H1 LYS A 1 1.001 13.761 2.268 1.00 0.00 H ATOM 11 H2 LYS A 1 2.694 13.616 2.304 1.00 0.00 H ATOM 12 H3 LYS A 1 1.860 14.210 3.661 1.00 0.00 H ATOM 13 HA LYS A 1 2.642 11.637 3.341 1.00 0.00 H ATOM 14 HB2 LYS A 1 2.028 12.843 5.395 1.00 0.00 H ATOM 15 HB3 LYS A 1 0.336 12.858 4.898 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.044 10.603 5.325 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.740 10.220 5.028 1.00 0.00 H ATOM 18 HD2 LYS A 1 2.338 11.406 7.141 1.00 0.00 H ATOM 19 HD3 LYS A 1 0.619 11.650 7.454 1.00 0.00 H ATOM 20 HE2 LYS A 1 1.059 8.874 6.823 1.00 0.00 H ATOM 21 HE3 LYS A 1 2.169 9.365 8.118 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -0.777 9.664 8.027 1.00 0.00 H ATOM 23 HZ2 LYS A 1 0.188 10.555 9.106 1.00 0.00 H ATOM 24 HZ3 LYS A 1 0.154 8.859 9.194 1.00 0.00 H ATOM 25 N CYS A 2 0.928 11.034 1.374 1.00 0.00 N ATOM 26 CA CYS A 2 -0.066 10.283 0.552 1.00 0.00 C ATOM 27 C CYS A 2 -0.138 8.825 1.024 1.00 0.00 C ATOM 28 O CYS A 2 -1.120 8.141 0.810 1.00 0.00 O ATOM 29 CB CYS A 2 0.436 10.380 -0.892 1.00 0.00 C ATOM 30 SG CYS A 2 2.038 9.556 -1.057 1.00 0.00 S ATOM 31 H CYS A 2 1.801 11.265 0.995 1.00 0.00 H ATOM 32 HA CYS A 2 -1.038 10.746 0.633 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.276 9.909 -1.551 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.538 11.422 -1.165 1.00 0.00 H ATOM 35 N ASN A 3 0.896 8.350 1.668 1.00 0.00 N ATOM 36 CA ASN A 3 0.894 6.939 2.162 1.00 0.00 C ATOM 37 C ASN A 3 -0.443 6.615 2.828 1.00 0.00 C ATOM 38 O ASN A 3 -0.873 5.479 2.856 1.00 0.00 O ATOM 39 CB ASN A 3 2.029 6.882 3.187 1.00 0.00 C ATOM 40 CG ASN A 3 3.349 6.597 2.469 1.00 0.00 C ATOM 41 OD1 ASN A 3 3.563 5.510 1.973 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.252 7.537 2.392 1.00 0.00 N ATOM 43 H ASN A 3 1.674 8.923 1.831 1.00 0.00 H ATOM 44 HA ASN A 3 1.091 6.248 1.360 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.095 7.828 3.703 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.831 6.094 3.899 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.078 8.418 2.794 1.00 0.00 H ATOM 48 HD22 ASN A 3 5.104 7.363 1.932 1.00 0.00 H ATOM 49 N THR A 4 -1.095 7.597 3.378 1.00 0.00 N ATOM 50 CA THR A 4 -2.396 7.337 4.052 1.00 0.00 C ATOM 51 C THR A 4 -3.505 7.021 3.041 1.00 0.00 C ATOM 52 O THR A 4 -4.120 5.973 3.094 1.00 0.00 O ATOM 53 CB THR A 4 -2.715 8.635 4.791 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.770 8.827 5.834 1.00 0.00 O ATOM 55 CG2 THR A 4 -4.123 8.554 5.381 1.00 0.00 C ATOM 56 H THR A 4 -0.728 8.505 3.353 1.00 0.00 H ATOM 57 HA THR A 4 -2.296 6.533 4.762 1.00 0.00 H ATOM 58 HB THR A 4 -2.664 9.463 4.101 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.718 8.011 6.338 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.846 8.407 4.579 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.350 9.480 5.908 1.00 0.00 H ATOM 62 HG23 THR A 4 -4.178 7.717 6.077 1.00 0.00 H ATOM 63 N ALA A 5 -3.795 7.928 2.145 1.00 0.00 N ATOM 64 CA ALA A 5 -4.896 7.680 1.167 1.00 0.00 C ATOM 65 C ALA A 5 -4.384 7.269 -0.223 1.00 0.00 C ATOM 66 O ALA A 5 -4.594 6.159 -0.669 1.00 0.00 O ATOM 67 CB ALA A 5 -5.642 9.011 1.082 1.00 0.00 C ATOM 68 H ALA A 5 -3.310 8.780 2.134 1.00 0.00 H ATOM 69 HA ALA A 5 -5.563 6.924 1.549 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.472 8.919 0.381 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.961 9.789 0.737 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.026 9.276 2.067 1.00 0.00 H ATOM 73 N THR A 6 -3.763 8.176 -0.928 1.00 0.00 N ATOM 74 CA THR A 6 -3.294 7.868 -2.316 1.00 0.00 C ATOM 75 C THR A 6 -2.191 6.801 -2.350 1.00 0.00 C ATOM 76 O THR A 6 -2.267 5.855 -3.108 1.00 0.00 O ATOM 77 CB THR A 6 -2.764 9.202 -2.846 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.823 10.149 -2.880 1.00 0.00 O ATOM 79 CG2 THR A 6 -2.203 9.010 -4.255 1.00 0.00 C ATOM 80 H THR A 6 -3.643 9.078 -0.563 1.00 0.00 H ATOM 81 HA THR A 6 -4.127 7.554 -2.922 1.00 0.00 H ATOM 82 HB THR A 6 -1.980 9.562 -2.195 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.533 10.901 -3.402 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.390 8.284 -4.227 1.00 0.00 H ATOM 85 HG22 THR A 6 -1.826 9.962 -4.630 1.00 0.00 H ATOM 86 HG23 THR A 6 -2.992 8.647 -4.914 1.00 0.00 H ATOM 87 N CYS A 7 -1.160 6.946 -1.567 1.00 0.00 N ATOM 88 CA CYS A 7 -0.058 5.935 -1.605 1.00 0.00 C ATOM 89 C CYS A 7 -0.366 4.735 -0.700 1.00 0.00 C ATOM 90 O CYS A 7 0.357 3.759 -0.688 1.00 0.00 O ATOM 91 CB CYS A 7 1.172 6.680 -1.090 1.00 0.00 C ATOM 92 SG CYS A 7 1.653 7.973 -2.255 1.00 0.00 S ATOM 93 H CYS A 7 -1.098 7.722 -0.973 1.00 0.00 H ATOM 94 HA CYS A 7 0.114 5.606 -2.617 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.937 7.134 -0.147 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.990 5.987 -0.963 1.00 0.00 H ATOM 97 N ALA A 8 -1.424 4.796 0.061 1.00 0.00 N ATOM 98 CA ALA A 8 -1.756 3.654 0.967 1.00 0.00 C ATOM 99 C ALA A 8 -2.074 2.390 0.160 1.00 0.00 C ATOM 100 O ALA A 8 -1.671 1.299 0.512 1.00 0.00 O ATOM 101 CB ALA A 8 -2.988 4.110 1.744 1.00 0.00 C ATOM 102 H ALA A 8 -1.995 5.591 0.044 1.00 0.00 H ATOM 103 HA ALA A 8 -0.942 3.466 1.649 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.295 3.324 2.433 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.800 4.320 1.048 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.750 5.013 2.306 1.00 0.00 H ATOM 107 N THR A 9 -2.792 2.527 -0.918 1.00 0.00 N ATOM 108 CA THR A 9 -3.139 1.337 -1.747 1.00 0.00 C ATOM 109 C THR A 9 -1.901 0.851 -2.501 1.00 0.00 C ATOM 110 O THR A 9 -1.726 -0.326 -2.748 1.00 0.00 O ATOM 111 CB THR A 9 -4.204 1.833 -2.724 1.00 0.00 C ATOM 112 OG1 THR A 9 -3.767 3.046 -3.322 1.00 0.00 O ATOM 113 CG2 THR A 9 -5.515 2.076 -1.976 1.00 0.00 C ATOM 114 H THR A 9 -3.105 3.417 -1.185 1.00 0.00 H ATOM 115 HA THR A 9 -3.542 0.550 -1.129 1.00 0.00 H ATOM 116 HB THR A 9 -4.364 1.092 -3.492 1.00 0.00 H ATOM 117 HG1 THR A 9 -3.224 2.823 -4.081 1.00 0.00 H ATOM 118 HG21 THR A 9 -5.850 1.146 -1.518 1.00 0.00 H ATOM 119 HG22 THR A 9 -6.273 2.430 -2.675 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.358 2.826 -1.201 1.00 0.00 H ATOM 121 N GLN A 10 -1.046 1.761 -2.871 1.00 0.00 N ATOM 122 CA GLN A 10 0.190 1.386 -3.619 1.00 0.00 C ATOM 123 C GLN A 10 1.035 0.420 -2.783 1.00 0.00 C ATOM 124 O GLN A 10 1.317 -0.687 -3.198 1.00 0.00 O ATOM 125 CB GLN A 10 0.910 2.724 -3.858 1.00 0.00 C ATOM 126 CG GLN A 10 2.428 2.559 -3.722 1.00 0.00 C ATOM 127 CD GLN A 10 3.136 3.607 -4.581 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.788 3.808 -5.727 1.00 0.00 O ATOM 129 NE2 GLN A 10 4.125 4.288 -4.072 1.00 0.00 N ATOM 130 H GLN A 10 -1.220 2.697 -2.655 1.00 0.00 H ATOM 131 HA GLN A 10 -0.068 0.933 -4.564 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.679 3.080 -4.850 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.565 3.446 -3.131 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.708 2.689 -2.686 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.713 1.571 -4.052 1.00 0.00 H ATOM 136 HE21 GLN A 10 4.407 4.126 -3.143 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.587 4.965 -4.616 1.00 0.00 H ATOM 138 N ARG A 11 1.428 0.814 -1.604 1.00 0.00 N ATOM 139 CA ARG A 11 2.232 -0.113 -0.760 1.00 0.00 C ATOM 140 C ARG A 11 1.356 -1.313 -0.427 1.00 0.00 C ATOM 141 O ARG A 11 1.801 -2.438 -0.384 1.00 0.00 O ATOM 142 CB ARG A 11 2.589 0.679 0.499 1.00 0.00 C ATOM 143 CG ARG A 11 4.065 0.455 0.838 1.00 0.00 C ATOM 144 CD ARG A 11 4.620 1.688 1.555 1.00 0.00 C ATOM 145 NE ARG A 11 5.997 1.861 1.013 1.00 0.00 N ATOM 146 CZ ARG A 11 6.176 2.383 -0.170 1.00 0.00 C ATOM 147 NH1 ARG A 11 5.147 2.754 -0.887 1.00 0.00 N ATOM 148 NH2 ARG A 11 7.385 2.534 -0.639 1.00 0.00 N ATOM 149 H ARG A 11 1.181 1.704 -1.271 1.00 0.00 H ATOM 150 HA ARG A 11 3.126 -0.423 -1.279 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.412 1.730 0.325 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.979 0.341 1.323 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.162 -0.408 1.478 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.623 0.292 -0.073 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.013 2.555 1.334 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.659 1.516 2.620 1.00 0.00 H ATOM 157 HE ARG A 11 6.770 1.584 1.547 1.00 0.00 H ATOM 158 HH11 ARG A 11 4.220 2.640 -0.530 1.00 0.00 H ATOM 159 HH12 ARG A 11 5.287 3.153 -1.793 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.172 2.251 -0.090 1.00 0.00 H ATOM 161 HH22 ARG A 11 7.525 2.932 -1.545 1.00 0.00 H ATOM 162 N LEU A 12 0.095 -1.056 -0.230 1.00 0.00 N ATOM 163 CA LEU A 12 -0.885 -2.134 0.065 1.00 0.00 C ATOM 164 C LEU A 12 -0.873 -3.148 -1.074 1.00 0.00 C ATOM 165 O LEU A 12 -0.578 -4.296 -0.892 1.00 0.00 O ATOM 166 CB LEU A 12 -2.193 -1.360 0.119 1.00 0.00 C ATOM 167 CG LEU A 12 -3.414 -2.273 0.140 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.619 -2.932 -1.227 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.222 -3.338 1.212 1.00 0.00 C ATOM 170 H LEU A 12 -0.221 -0.133 -0.304 1.00 0.00 H ATOM 171 HA LEU A 12 -0.680 -2.604 1.013 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.193 -0.760 1.013 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.244 -0.722 -0.742 1.00 0.00 H ATOM 174 HG LEU A 12 -4.283 -1.678 0.376 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.495 -3.579 -1.191 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.740 -3.525 -1.481 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.768 -2.162 -1.984 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.331 -3.924 0.987 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.092 -3.995 1.232 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.106 -2.859 2.184 1.00 0.00 H ATOM 181 N ALA A 13 -1.161 -2.725 -2.256 1.00 0.00 N ATOM 182 CA ALA A 13 -1.132 -3.660 -3.407 1.00 0.00 C ATOM 183 C ALA A 13 0.174 -4.446 -3.401 1.00 0.00 C ATOM 184 O ALA A 13 0.244 -5.578 -3.831 1.00 0.00 O ATOM 185 CB ALA A 13 -1.153 -2.743 -4.606 1.00 0.00 C ATOM 186 H ALA A 13 -1.377 -1.790 -2.397 1.00 0.00 H ATOM 187 HA ALA A 13 -1.988 -4.313 -3.410 1.00 0.00 H ATOM 188 HB1 ALA A 13 -1.134 -3.338 -5.519 1.00 0.00 H ATOM 189 HB2 ALA A 13 -0.281 -2.090 -4.580 1.00 0.00 H ATOM 190 HB3 ALA A 13 -2.060 -2.138 -4.586 1.00 0.00 H ATOM 191 N ASN A 14 1.202 -3.836 -2.893 1.00 0.00 N ATOM 192 CA ASN A 14 2.516 -4.492 -2.813 1.00 0.00 C ATOM 193 C ASN A 14 2.578 -5.225 -1.491 1.00 0.00 C ATOM 194 O ASN A 14 3.368 -6.129 -1.293 1.00 0.00 O ATOM 195 CB ASN A 14 3.532 -3.353 -2.863 1.00 0.00 C ATOM 196 CG ASN A 14 3.973 -3.125 -4.313 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.924 -3.726 -4.772 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.316 -2.278 -5.055 1.00 0.00 N ATOM 199 H ASN A 14 1.102 -2.941 -2.532 1.00 0.00 H ATOM 200 HA ASN A 14 2.661 -5.166 -3.641 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.079 -2.449 -2.479 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.390 -3.608 -2.264 1.00 0.00 H ATOM 203 HD21 ASN A 14 2.545 -1.791 -4.682 1.00 0.00 H ATOM 204 HD22 ASN A 14 3.590 -2.127 -5.989 1.00 0.00 H ATOM 205 N PHE A 15 1.730 -4.838 -0.574 1.00 0.00 N ATOM 206 CA PHE A 15 1.725 -5.518 0.742 1.00 0.00 C ATOM 207 C PHE A 15 0.711 -6.650 0.679 1.00 0.00 C ATOM 208 O PHE A 15 0.818 -7.671 1.330 1.00 0.00 O ATOM 209 CB PHE A 15 1.335 -4.423 1.760 1.00 0.00 C ATOM 210 CG PHE A 15 0.143 -4.842 2.598 1.00 0.00 C ATOM 211 CD1 PHE A 15 -1.115 -5.000 2.005 1.00 0.00 C ATOM 212 CD2 PHE A 15 0.296 -5.064 3.969 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.214 -5.379 2.776 1.00 0.00 C ATOM 214 CE2 PHE A 15 -0.805 -5.443 4.742 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.062 -5.602 4.146 1.00 0.00 C ATOM 216 H PHE A 15 1.067 -4.115 -0.771 1.00 0.00 H ATOM 217 HA PHE A 15 2.703 -5.889 0.948 1.00 0.00 H ATOM 218 HB2 PHE A 15 2.174 -4.230 2.412 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.089 -3.518 1.226 1.00 0.00 H ATOM 220 HD1 PHE A 15 -1.239 -4.826 0.951 1.00 0.00 H ATOM 221 HD2 PHE A 15 1.263 -4.943 4.429 1.00 0.00 H ATOM 222 HE1 PHE A 15 -3.183 -5.493 2.308 1.00 0.00 H ATOM 223 HE2 PHE A 15 -0.686 -5.610 5.797 1.00 0.00 H ATOM 224 HZ PHE A 15 -2.911 -5.897 4.745 1.00 0.00 H ATOM 225 N LEU A 16 -0.274 -6.427 -0.119 1.00 0.00 N ATOM 226 CA LEU A 16 -1.370 -7.381 -0.322 1.00 0.00 C ATOM 227 C LEU A 16 -0.926 -8.472 -1.295 1.00 0.00 C ATOM 228 O LEU A 16 -1.578 -9.485 -1.456 1.00 0.00 O ATOM 229 CB LEU A 16 -2.432 -6.481 -0.933 1.00 0.00 C ATOM 230 CG LEU A 16 -3.801 -7.096 -0.756 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.390 -6.606 0.565 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.687 -6.654 -1.917 1.00 0.00 C ATOM 233 H LEU A 16 -0.300 -5.578 -0.605 1.00 0.00 H ATOM 234 HA LEU A 16 -1.713 -7.796 0.612 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.407 -5.525 -0.434 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.230 -6.335 -1.980 1.00 0.00 H ATOM 237 HG LEU A 16 -3.713 -8.172 -0.744 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.379 -7.042 0.706 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.472 -5.519 0.546 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.740 -6.907 1.387 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.767 -5.567 -1.921 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.680 -7.090 -1.804 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.249 -6.989 -2.857 1.00 0.00 H ATOM 244 N VAL A 17 0.185 -8.265 -1.946 1.00 0.00 N ATOM 245 CA VAL A 17 0.686 -9.282 -2.912 1.00 0.00 C ATOM 246 C VAL A 17 0.686 -10.669 -2.266 1.00 0.00 C ATOM 247 O VAL A 17 0.245 -11.638 -2.851 1.00 0.00 O ATOM 248 CB VAL A 17 2.117 -8.858 -3.238 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.747 -9.871 -4.195 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.101 -7.478 -3.893 1.00 0.00 C ATOM 251 H VAL A 17 0.687 -7.434 -1.799 1.00 0.00 H ATOM 252 HA VAL A 17 0.086 -9.277 -3.807 1.00 0.00 H ATOM 253 HB VAL A 17 2.695 -8.818 -2.325 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.768 -9.567 -4.426 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.164 -9.914 -5.115 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.759 -10.855 -3.727 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.515 -7.518 -4.812 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.121 -7.174 -4.126 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.655 -6.756 -3.209 1.00 0.00 H ATOM 260 N ARG A 18 1.182 -10.770 -1.062 1.00 0.00 N ATOM 261 CA ARG A 18 1.212 -12.096 -0.379 1.00 0.00 C ATOM 262 C ARG A 18 -0.160 -12.768 -0.471 1.00 0.00 C ATOM 263 O ARG A 18 -0.265 -13.972 -0.596 1.00 0.00 O ATOM 264 CB ARG A 18 1.560 -11.786 1.077 1.00 0.00 C ATOM 265 CG ARG A 18 2.585 -12.803 1.588 1.00 0.00 C ATOM 266 CD ARG A 18 3.994 -12.346 1.206 1.00 0.00 C ATOM 267 NE ARG A 18 4.744 -12.303 2.493 1.00 0.00 N ATOM 268 CZ ARG A 18 6.049 -12.291 2.492 1.00 0.00 C ATOM 269 NH1 ARG A 18 6.705 -12.317 1.362 1.00 0.00 N ATOM 270 NH2 ARG A 18 6.701 -12.253 3.622 1.00 0.00 N ATOM 271 H ARG A 18 1.535 -9.976 -0.608 1.00 0.00 H ATOM 272 HA ARG A 18 1.971 -12.726 -0.814 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.977 -10.790 1.143 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.668 -11.845 1.681 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.509 -12.880 2.662 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.389 -13.766 1.143 1.00 0.00 H ATOM 277 HD2 ARG A 18 4.447 -13.056 0.528 1.00 0.00 H ATOM 278 HD3 ARG A 18 3.966 -11.364 0.763 1.00 0.00 H ATOM 279 HE ARG A 18 4.255 -12.285 3.343 1.00 0.00 H ATOM 280 HH11 ARG A 18 6.207 -12.348 0.495 1.00 0.00 H ATOM 281 HH12 ARG A 18 7.704 -12.307 1.365 1.00 0.00 H ATOM 282 HH21 ARG A 18 6.200 -12.235 4.487 1.00 0.00 H ATOM 283 HH22 ARG A 18 7.701 -12.244 3.622 1.00 0.00 H ATOM 284 N SER A 19 -1.211 -11.998 -0.413 1.00 0.00 N ATOM 285 CA SER A 19 -2.574 -12.591 -0.498 1.00 0.00 C ATOM 286 C SER A 19 -3.111 -12.473 -1.926 1.00 0.00 C ATOM 287 O SER A 19 -2.830 -11.518 -2.622 1.00 0.00 O ATOM 288 CB SER A 19 -3.427 -11.767 0.467 1.00 0.00 C ATOM 289 OG SER A 19 -2.787 -10.525 0.718 1.00 0.00 O ATOM 290 H SER A 19 -1.105 -11.032 -0.313 1.00 0.00 H ATOM 291 HA SER A 19 -2.554 -13.619 -0.184 1.00 0.00 H ATOM 292 HB2 SER A 19 -4.395 -11.586 0.029 1.00 0.00 H ATOM 293 HB3 SER A 19 -3.550 -12.314 1.393 1.00 0.00 H ATOM 294 HG SER A 19 -3.385 -9.982 1.237 1.00 0.00 H HETATM 295 N NH2 A 20 -3.879 -13.416 -2.397 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.226 -13.354 -3.312 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -4.107 -14.188 -1.838 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 5 ATOM 1 N LYS A 1 2.419 12.520 2.299 1.00 0.00 N ATOM 2 CA LYS A 1 1.039 12.523 2.864 1.00 0.00 C ATOM 3 C LYS A 1 0.184 11.457 2.173 1.00 0.00 C ATOM 4 O LYS A 1 -0.729 10.904 2.755 1.00 0.00 O ATOM 5 CB LYS A 1 0.496 13.922 2.574 1.00 0.00 C ATOM 6 CG LYS A 1 0.686 14.812 3.805 1.00 0.00 C ATOM 7 CD LYS A 1 -0.661 15.023 4.499 1.00 0.00 C ATOM 8 CE LYS A 1 -1.598 15.800 3.572 1.00 0.00 C ATOM 9 NZ LYS A 1 -2.867 15.941 4.339 1.00 0.00 N ATOM 10 H1 LYS A 1 2.728 11.538 2.148 1.00 0.00 H ATOM 11 H2 LYS A 1 3.066 12.989 2.964 1.00 0.00 H ATOM 12 H3 LYS A 1 2.424 13.026 1.393 1.00 0.00 H ATOM 13 HA LYS A 1 1.066 12.353 3.929 1.00 0.00 H ATOM 14 HB2 LYS A 1 1.030 14.346 1.735 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.555 13.859 2.336 1.00 0.00 H ATOM 16 HG2 LYS A 1 1.374 14.336 4.489 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.084 15.767 3.500 1.00 0.00 H ATOM 18 HD2 LYS A 1 -1.099 14.063 4.733 1.00 0.00 H ATOM 19 HD3 LYS A 1 -0.512 15.583 5.409 1.00 0.00 H ATOM 20 HE2 LYS A 1 -1.181 16.773 3.349 1.00 0.00 H ATOM 21 HE3 LYS A 1 -1.773 15.247 2.664 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -2.655 15.987 5.356 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -3.479 15.120 4.149 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -3.354 16.811 4.048 1.00 0.00 H ATOM 25 N CYS A 2 0.475 11.166 0.934 1.00 0.00 N ATOM 26 CA CYS A 2 -0.317 10.137 0.201 1.00 0.00 C ATOM 27 C CYS A 2 -0.208 8.781 0.909 1.00 0.00 C ATOM 28 O CYS A 2 -1.054 7.922 0.756 1.00 0.00 O ATOM 29 CB CYS A 2 0.310 10.069 -1.192 1.00 0.00 C ATOM 30 SG CYS A 2 1.985 9.395 -1.078 1.00 0.00 S ATOM 31 H CYS A 2 1.214 11.625 0.486 1.00 0.00 H ATOM 32 HA CYS A 2 -1.349 10.439 0.127 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.290 9.433 -1.826 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.349 11.062 -1.616 1.00 0.00 H ATOM 35 N ASN A 3 0.829 8.580 1.675 1.00 0.00 N ATOM 36 CA ASN A 3 0.999 7.278 2.386 1.00 0.00 C ATOM 37 C ASN A 3 -0.321 6.836 3.021 1.00 0.00 C ATOM 38 O ASN A 3 -0.655 5.668 3.032 1.00 0.00 O ATOM 39 CB ASN A 3 2.037 7.560 3.473 1.00 0.00 C ATOM 40 CG ASN A 3 2.413 6.252 4.170 1.00 0.00 C ATOM 41 OD1 ASN A 3 1.874 5.926 5.208 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.324 5.483 3.639 1.00 0.00 N ATOM 43 H ASN A 3 1.502 9.286 1.779 1.00 0.00 H ATOM 44 HA ASN A 3 1.370 6.520 1.717 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.917 7.998 3.025 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.622 8.244 4.198 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.761 5.748 2.798 1.00 0.00 H ATOM 48 HD22 ASN A 3 3.573 4.640 4.081 1.00 0.00 H ATOM 49 N THR A 4 -1.066 7.756 3.560 1.00 0.00 N ATOM 50 CA THR A 4 -2.355 7.389 4.208 1.00 0.00 C ATOM 51 C THR A 4 -3.425 6.996 3.180 1.00 0.00 C ATOM 52 O THR A 4 -4.017 5.938 3.269 1.00 0.00 O ATOM 53 CB THR A 4 -2.784 8.645 4.968 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.643 9.252 5.556 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.782 8.262 6.061 1.00 0.00 C ATOM 56 H THR A 4 -0.772 8.692 3.548 1.00 0.00 H ATOM 57 HA THR A 4 -2.199 6.584 4.907 1.00 0.00 H ATOM 58 HB THR A 4 -3.252 9.338 4.286 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.018 8.558 5.777 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.656 7.795 5.608 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.089 9.156 6.603 1.00 0.00 H ATOM 62 HG23 THR A 4 -3.314 7.561 6.752 1.00 0.00 H ATOM 63 N ALA A 5 -3.720 7.856 2.240 1.00 0.00 N ATOM 64 CA ALA A 5 -4.799 7.532 1.254 1.00 0.00 C ATOM 65 C ALA A 5 -4.264 7.048 -0.107 1.00 0.00 C ATOM 66 O ALA A 5 -4.454 5.910 -0.485 1.00 0.00 O ATOM 67 CB ALA A 5 -5.559 8.845 1.081 1.00 0.00 C ATOM 68 H ALA A 5 -3.264 8.722 2.203 1.00 0.00 H ATOM 69 HA ALA A 5 -5.463 6.792 1.668 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.374 8.703 0.371 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.881 9.611 0.706 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.966 9.159 2.042 1.00 0.00 H ATOM 73 N THR A 6 -3.653 7.918 -0.870 1.00 0.00 N ATOM 74 CA THR A 6 -3.176 7.516 -2.233 1.00 0.00 C ATOM 75 C THR A 6 -2.059 6.466 -2.182 1.00 0.00 C ATOM 76 O THR A 6 -2.127 5.454 -2.849 1.00 0.00 O ATOM 77 CB THR A 6 -2.653 8.808 -2.870 1.00 0.00 C ATOM 78 OG1 THR A 6 -2.993 9.919 -2.048 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.276 8.978 -4.259 1.00 0.00 C ATOM 80 H THR A 6 -3.548 8.844 -0.567 1.00 0.00 H ATOM 81 HA THR A 6 -4.002 7.141 -2.815 1.00 0.00 H ATOM 82 HB THR A 6 -1.581 8.749 -2.969 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.671 10.429 -2.498 1.00 0.00 H ATOM 84 HG21 THR A 6 -3.006 8.128 -4.886 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.905 9.896 -4.714 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.361 9.031 -4.167 1.00 0.00 H ATOM 87 N CYS A 7 -1.026 6.697 -1.423 1.00 0.00 N ATOM 88 CA CYS A 7 0.086 5.701 -1.377 1.00 0.00 C ATOM 89 C CYS A 7 -0.270 4.527 -0.458 1.00 0.00 C ATOM 90 O CYS A 7 0.436 3.541 -0.400 1.00 0.00 O ATOM 91 CB CYS A 7 1.286 6.468 -0.830 1.00 0.00 C ATOM 92 SG CYS A 7 1.878 7.641 -2.074 1.00 0.00 S ATOM 93 H CYS A 7 -0.970 7.522 -0.901 1.00 0.00 H ATOM 94 HA CYS A 7 0.306 5.342 -2.370 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.992 7.007 0.052 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.078 5.775 -0.584 1.00 0.00 H ATOM 97 N ALA A 8 -1.359 4.622 0.252 1.00 0.00 N ATOM 98 CA ALA A 8 -1.752 3.503 1.157 1.00 0.00 C ATOM 99 C ALA A 8 -2.137 2.274 0.331 1.00 0.00 C ATOM 100 O ALA A 8 -1.898 1.148 0.724 1.00 0.00 O ATOM 101 CB ALA A 8 -2.960 4.024 1.932 1.00 0.00 C ATOM 102 H ALA A 8 -1.919 5.423 0.190 1.00 0.00 H ATOM 103 HA ALA A 8 -0.949 3.267 1.838 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.309 3.255 2.622 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.759 4.275 1.234 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.676 4.914 2.494 1.00 0.00 H ATOM 107 N THR A 9 -2.724 2.483 -0.817 1.00 0.00 N ATOM 108 CA THR A 9 -3.117 1.332 -1.676 1.00 0.00 C ATOM 109 C THR A 9 -1.896 0.836 -2.450 1.00 0.00 C ATOM 110 O THR A 9 -1.701 -0.344 -2.651 1.00 0.00 O ATOM 111 CB THR A 9 -4.166 1.895 -2.637 1.00 0.00 C ATOM 112 OG1 THR A 9 -5.314 2.294 -1.900 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.558 0.824 -3.656 1.00 0.00 C ATOM 114 H THR A 9 -2.899 3.398 -1.115 1.00 0.00 H ATOM 115 HA THR A 9 -3.544 0.541 -1.082 1.00 0.00 H ATOM 116 HB THR A 9 -3.757 2.749 -3.156 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.613 3.137 -2.250 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.677 0.519 -4.221 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.305 1.228 -4.339 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.972 -0.040 -3.135 1.00 0.00 H ATOM 121 N GLN A 10 -1.067 1.741 -2.873 1.00 0.00 N ATOM 122 CA GLN A 10 0.155 1.344 -3.628 1.00 0.00 C ATOM 123 C GLN A 10 1.030 0.460 -2.738 1.00 0.00 C ATOM 124 O GLN A 10 1.325 -0.673 -3.069 1.00 0.00 O ATOM 125 CB GLN A 10 0.847 2.670 -3.974 1.00 0.00 C ATOM 126 CG GLN A 10 2.368 2.487 -4.016 1.00 0.00 C ATOM 127 CD GLN A 10 2.956 3.352 -5.132 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.427 3.397 -6.224 1.00 0.00 O ATOM 129 NE2 GLN A 10 4.039 4.045 -4.902 1.00 0.00 N ATOM 130 H GLN A 10 -1.245 2.683 -2.687 1.00 0.00 H ATOM 131 HA GLN A 10 -0.114 0.817 -4.530 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.502 3.009 -4.941 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.597 3.409 -3.228 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.787 2.785 -3.065 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.600 1.450 -4.204 1.00 0.00 H ATOM 136 HE21 GLN A 10 4.468 4.007 -4.017 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.423 4.604 -5.616 1.00 0.00 H ATOM 138 N ARG A 11 1.424 0.952 -1.597 1.00 0.00 N ATOM 139 CA ARG A 11 2.246 0.117 -0.683 1.00 0.00 C ATOM 140 C ARG A 11 1.418 -1.101 -0.292 1.00 0.00 C ATOM 141 O ARG A 11 1.932 -2.162 0.004 1.00 0.00 O ATOM 142 CB ARG A 11 2.526 1.001 0.532 1.00 0.00 C ATOM 143 CG ARG A 11 4.035 1.059 0.783 1.00 0.00 C ATOM 144 CD ARG A 11 4.713 1.843 -0.344 1.00 0.00 C ATOM 145 NE ARG A 11 6.144 1.938 0.057 1.00 0.00 N ATOM 146 CZ ARG A 11 6.926 0.896 -0.040 1.00 0.00 C ATOM 147 NH1 ARG A 11 6.454 -0.238 -0.487 1.00 0.00 N ATOM 148 NH2 ARG A 11 8.179 0.987 0.310 1.00 0.00 N ATOM 149 H ARG A 11 1.155 1.856 -1.332 1.00 0.00 H ATOM 150 HA ARG A 11 3.168 -0.180 -1.159 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.153 1.998 0.347 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.035 0.588 1.401 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.224 1.549 1.728 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.434 0.057 0.813 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.616 1.309 -1.281 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.284 2.830 -0.427 1.00 0.00 H ATOM 157 HE ARG A 11 6.501 2.787 0.396 1.00 0.00 H ATOM 158 HH11 ARG A 11 5.493 -0.312 -0.754 1.00 0.00 H ATOM 159 HH12 ARG A 11 7.055 -1.033 -0.564 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.541 1.854 0.653 1.00 0.00 H ATOM 161 HH22 ARG A 11 8.778 0.189 0.237 1.00 0.00 H ATOM 162 N LEU A 12 0.125 -0.939 -0.307 1.00 0.00 N ATOM 163 CA LEU A 12 -0.789 -2.056 0.044 1.00 0.00 C ATOM 164 C LEU A 12 -0.763 -3.090 -1.069 1.00 0.00 C ATOM 165 O LEU A 12 -0.554 -4.247 -0.833 1.00 0.00 O ATOM 166 CB LEU A 12 -2.140 -1.371 0.186 1.00 0.00 C ATOM 167 CG LEU A 12 -3.320 -2.313 -0.081 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.459 -2.619 -1.575 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.132 -3.612 0.692 1.00 0.00 C ATOM 170 H LEU A 12 -0.249 -0.070 -0.559 1.00 0.00 H ATOM 171 HA LEU A 12 -0.492 -2.496 0.973 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.222 -0.995 1.191 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.178 -0.553 -0.506 1.00 0.00 H ATOM 174 HG LEU A 12 -4.223 -1.826 0.253 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.304 -3.289 -1.732 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.547 -3.095 -1.935 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.625 -1.691 -2.123 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.208 -4.095 0.373 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.974 -4.276 0.497 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.079 -3.396 1.759 1.00 0.00 H ATOM 181 N ALA A 13 -0.923 -2.682 -2.282 1.00 0.00 N ATOM 182 CA ALA A 13 -0.849 -3.655 -3.400 1.00 0.00 C ATOM 183 C ALA A 13 0.466 -4.416 -3.302 1.00 0.00 C ATOM 184 O ALA A 13 0.593 -5.542 -3.737 1.00 0.00 O ATOM 185 CB ALA A 13 -0.831 -2.784 -4.630 1.00 0.00 C ATOM 186 H ALA A 13 -1.061 -1.739 -2.465 1.00 0.00 H ATOM 187 HA ALA A 13 -1.697 -4.319 -3.408 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.777 -3.412 -5.519 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.037 -2.126 -4.597 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.740 -2.184 -4.664 1.00 0.00 H ATOM 191 N ASN A 14 1.435 -3.792 -2.702 1.00 0.00 N ATOM 192 CA ASN A 14 2.750 -4.425 -2.518 1.00 0.00 C ATOM 193 C ASN A 14 2.691 -5.198 -1.220 1.00 0.00 C ATOM 194 O ASN A 14 3.467 -6.099 -0.969 1.00 0.00 O ATOM 195 CB ASN A 14 3.745 -3.269 -2.429 1.00 0.00 C ATOM 196 CG ASN A 14 4.052 -2.752 -3.836 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.192 -2.740 -4.255 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.075 -2.322 -4.587 1.00 0.00 N ATOM 199 H ASN A 14 1.285 -2.904 -2.335 1.00 0.00 H ATOM 200 HA ASN A 14 2.988 -5.071 -3.347 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.318 -2.473 -1.836 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.655 -3.614 -1.967 1.00 0.00 H ATOM 203 HD21 ASN A 14 2.152 -2.331 -4.247 1.00 0.00 H ATOM 204 HD22 ASN A 14 3.265 -1.988 -5.493 1.00 0.00 H ATOM 205 N PHE A 15 1.748 -4.855 -0.388 1.00 0.00 N ATOM 206 CA PHE A 15 1.617 -5.590 0.887 1.00 0.00 C ATOM 207 C PHE A 15 0.598 -6.703 0.666 1.00 0.00 C ATOM 208 O PHE A 15 0.649 -7.770 1.246 1.00 0.00 O ATOM 209 CB PHE A 15 1.152 -4.544 1.932 1.00 0.00 C ATOM 210 CG PHE A 15 -0.097 -5.004 2.676 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.155 -6.283 3.245 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.200 -4.147 2.784 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.312 -6.698 3.914 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.352 -4.562 3.452 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.412 -5.839 4.017 1.00 0.00 C ATOM 216 H PHE A 15 1.098 -4.139 -0.629 1.00 0.00 H ATOM 217 HA PHE A 15 2.568 -5.989 1.157 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.945 -4.381 2.644 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.938 -3.614 1.425 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.691 -6.949 3.166 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.161 -3.163 2.358 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.356 -7.682 4.345 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.200 -3.894 3.524 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.304 -6.162 4.532 1.00 0.00 H ATOM 225 N LEU A 16 -0.334 -6.404 -0.168 1.00 0.00 N ATOM 226 CA LEU A 16 -1.431 -7.324 -0.503 1.00 0.00 C ATOM 227 C LEU A 16 -0.979 -8.368 -1.526 1.00 0.00 C ATOM 228 O LEU A 16 -1.597 -9.403 -1.682 1.00 0.00 O ATOM 229 CB LEU A 16 -2.447 -6.364 -1.107 1.00 0.00 C ATOM 230 CG LEU A 16 -3.842 -6.941 -1.007 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.426 -6.585 0.359 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.698 -6.330 -2.115 1.00 0.00 C ATOM 233 H LEU A 16 -0.324 -5.517 -0.586 1.00 0.00 H ATOM 234 HA LEU A 16 -1.837 -7.789 0.379 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.411 -5.432 -0.564 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.203 -6.178 -2.139 1.00 0.00 H ATOM 237 HG LEU A 16 -3.799 -8.012 -1.120 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.432 -6.996 0.443 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.467 -5.501 0.466 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.796 -7.004 1.144 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.733 -5.247 -1.992 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.709 -6.734 -2.059 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.264 -6.572 -3.085 1.00 0.00 H ATOM 244 N VAL A 17 0.088 -8.108 -2.227 1.00 0.00 N ATOM 245 CA VAL A 17 0.554 -9.099 -3.239 1.00 0.00 C ATOM 246 C VAL A 17 0.646 -10.491 -2.609 1.00 0.00 C ATOM 247 O VAL A 17 0.475 -11.495 -3.272 1.00 0.00 O ATOM 248 CB VAL A 17 1.937 -8.634 -3.705 1.00 0.00 C ATOM 249 CG1 VAL A 17 1.779 -7.564 -4.786 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.726 -8.054 -2.533 1.00 0.00 C ATOM 251 H VAL A 17 0.573 -7.268 -2.096 1.00 0.00 H ATOM 252 HA VAL A 17 -0.124 -9.106 -4.072 1.00 0.00 H ATOM 253 HB VAL A 17 2.474 -9.478 -4.118 1.00 0.00 H ATOM 254 HG11 VAL A 17 2.763 -7.233 -5.117 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.229 -6.715 -4.380 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.232 -7.980 -5.632 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.187 -7.203 -2.117 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.706 -7.728 -2.880 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.849 -8.817 -1.764 1.00 0.00 H ATOM 260 N ARG A 18 0.917 -10.560 -1.333 1.00 0.00 N ATOM 261 CA ARG A 18 1.023 -11.886 -0.660 1.00 0.00 C ATOM 262 C ARG A 18 -0.330 -12.600 -0.677 1.00 0.00 C ATOM 263 O ARG A 18 -0.421 -13.773 -0.980 1.00 0.00 O ATOM 264 CB ARG A 18 1.443 -11.569 0.774 1.00 0.00 C ATOM 265 CG ARG A 18 2.932 -11.227 0.805 1.00 0.00 C ATOM 266 CD ARG A 18 3.547 -11.748 2.104 1.00 0.00 C ATOM 267 NE ARG A 18 3.310 -10.668 3.101 1.00 0.00 N ATOM 268 CZ ARG A 18 3.931 -9.524 2.990 1.00 0.00 C ATOM 269 NH1 ARG A 18 4.761 -9.320 2.002 1.00 0.00 N ATOM 270 NH2 ARG A 18 3.723 -8.583 3.869 1.00 0.00 N ATOM 271 H ARG A 18 1.053 -9.738 -0.816 1.00 0.00 H ATOM 272 HA ARG A 18 1.775 -12.493 -1.139 1.00 0.00 H ATOM 273 HB2 ARG A 18 0.871 -10.728 1.139 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.259 -12.429 1.401 1.00 0.00 H ATOM 275 HG2 ARG A 18 3.425 -11.690 -0.040 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.058 -10.156 0.752 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.056 -12.661 2.411 1.00 0.00 H ATOM 278 HD3 ARG A 18 4.606 -11.911 1.980 1.00 0.00 H ATOM 279 HE ARG A 18 2.687 -10.815 3.842 1.00 0.00 H ATOM 280 HH11 ARG A 18 4.921 -10.039 1.326 1.00 0.00 H ATOM 281 HH12 ARG A 18 5.232 -8.443 1.920 1.00 0.00 H ATOM 282 HH21 ARG A 18 3.087 -8.737 4.625 1.00 0.00 H ATOM 283 HH22 ARG A 18 4.199 -7.706 3.785 1.00 0.00 H ATOM 284 N SER A 19 -1.383 -11.902 -0.350 1.00 0.00 N ATOM 285 CA SER A 19 -2.729 -12.541 -0.346 1.00 0.00 C ATOM 286 C SER A 19 -3.313 -12.557 -1.761 1.00 0.00 C ATOM 287 O SER A 19 -3.606 -13.604 -2.304 1.00 0.00 O ATOM 288 CB SER A 19 -3.580 -11.666 0.573 1.00 0.00 C ATOM 289 OG SER A 19 -3.956 -10.483 -0.121 1.00 0.00 O ATOM 290 H SER A 19 -1.289 -10.958 -0.108 1.00 0.00 H ATOM 291 HA SER A 19 -2.669 -13.540 0.049 1.00 0.00 H ATOM 292 HB2 SER A 19 -4.467 -12.203 0.865 1.00 0.00 H ATOM 293 HB3 SER A 19 -3.009 -11.412 1.456 1.00 0.00 H ATOM 294 HG SER A 19 -4.851 -10.256 0.145 1.00 0.00 H HETATM 295 N NH2 A 20 -3.498 -11.426 -2.386 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.874 -11.422 -3.291 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -3.262 -10.581 -1.949 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 6 ATOM 1 N LYS A 1 1.623 13.512 2.536 1.00 0.00 N ATOM 2 CA LYS A 1 1.230 12.312 3.328 1.00 0.00 C ATOM 3 C LYS A 1 0.289 11.421 2.512 1.00 0.00 C ATOM 4 O LYS A 1 -0.803 11.100 2.940 1.00 0.00 O ATOM 5 CB LYS A 1 0.508 12.867 4.557 1.00 0.00 C ATOM 6 CG LYS A 1 1.534 13.450 5.532 1.00 0.00 C ATOM 7 CD LYS A 1 1.726 12.488 6.706 1.00 0.00 C ATOM 8 CE LYS A 1 0.633 12.731 7.749 1.00 0.00 C ATOM 9 NZ LYS A 1 1.036 11.918 8.930 1.00 0.00 N ATOM 10 H1 LYS A 1 1.772 13.240 1.544 1.00 0.00 H ATOM 11 H2 LYS A 1 2.504 13.910 2.924 1.00 0.00 H ATOM 12 H3 LYS A 1 0.868 14.225 2.589 1.00 0.00 H ATOM 13 HA LYS A 1 2.104 11.758 3.633 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.179 13.642 4.250 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.036 12.072 5.043 1.00 0.00 H ATOM 16 HG2 LYS A 1 2.476 13.591 5.023 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.177 14.398 5.904 1.00 0.00 H ATOM 18 HD2 LYS A 1 1.664 11.468 6.348 1.00 0.00 H ATOM 19 HD3 LYS A 1 2.693 12.653 7.155 1.00 0.00 H ATOM 20 HE2 LYS A 1 0.591 13.780 8.007 1.00 0.00 H ATOM 21 HE3 LYS A 1 -0.323 12.395 7.377 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.707 11.180 8.634 1.00 0.00 H ATOM 23 HZ2 LYS A 1 0.192 11.472 9.346 1.00 0.00 H ATOM 24 HZ3 LYS A 1 1.488 12.532 9.636 1.00 0.00 H ATOM 25 N CYS A 2 0.704 11.013 1.345 1.00 0.00 N ATOM 26 CA CYS A 2 -0.168 10.139 0.512 1.00 0.00 C ATOM 27 C CYS A 2 -0.105 8.698 1.030 1.00 0.00 C ATOM 28 O CYS A 2 -1.010 7.913 0.823 1.00 0.00 O ATOM 29 CB CYS A 2 0.402 10.236 -0.905 1.00 0.00 C ATOM 30 SG CYS A 2 2.043 9.475 -0.958 1.00 0.00 S ATOM 31 H CYS A 2 1.590 11.279 1.018 1.00 0.00 H ATOM 32 HA CYS A 2 -1.184 10.499 0.525 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.254 9.724 -1.594 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.478 11.276 -1.188 1.00 0.00 H ATOM 35 N ASN A 3 0.954 8.350 1.710 1.00 0.00 N ATOM 36 CA ASN A 3 1.077 6.965 2.251 1.00 0.00 C ATOM 37 C ASN A 3 -0.237 6.547 2.909 1.00 0.00 C ATOM 38 O ASN A 3 -0.648 5.406 2.837 1.00 0.00 O ATOM 39 CB ASN A 3 2.189 7.052 3.297 1.00 0.00 C ATOM 40 CG ASN A 3 2.239 5.751 4.103 1.00 0.00 C ATOM 41 OD1 ASN A 3 2.739 5.728 5.210 1.00 0.00 O ATOM 42 ND2 ASN A 3 1.741 4.659 3.589 1.00 0.00 N ATOM 43 H ASN A 3 1.668 9.002 1.870 1.00 0.00 H ATOM 44 HA ASN A 3 1.353 6.268 1.479 1.00 0.00 H ATOM 45 HB2 ASN A 3 3.138 7.206 2.799 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.994 7.879 3.963 1.00 0.00 H ATOM 47 HD21 ASN A 3 1.338 4.678 2.692 1.00 0.00 H ATOM 48 HD22 ASN A 3 1.770 3.819 4.101 1.00 0.00 H ATOM 49 N THR A 4 -0.890 7.466 3.559 1.00 0.00 N ATOM 50 CA THR A 4 -2.173 7.137 4.237 1.00 0.00 C ATOM 51 C THR A 4 -3.310 6.920 3.227 1.00 0.00 C ATOM 52 O THR A 4 -3.964 5.897 3.234 1.00 0.00 O ATOM 53 CB THR A 4 -2.475 8.349 5.124 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.323 9.178 5.206 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.863 7.874 6.524 1.00 0.00 C ATOM 56 H THR A 4 -0.533 8.376 3.608 1.00 0.00 H ATOM 57 HA THR A 4 -2.054 6.262 4.854 1.00 0.00 H ATOM 58 HB THR A 4 -3.293 8.910 4.700 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.489 9.849 5.874 1.00 0.00 H ATOM 60 HG21 THR A 4 -3.748 7.241 6.461 1.00 0.00 H ATOM 61 HG22 THR A 4 -3.078 8.737 7.154 1.00 0.00 H ATOM 62 HG23 THR A 4 -2.040 7.305 6.956 1.00 0.00 H ATOM 63 N ALA A 5 -3.586 7.891 2.394 1.00 0.00 N ATOM 64 CA ALA A 5 -4.723 7.739 1.433 1.00 0.00 C ATOM 65 C ALA A 5 -4.282 7.344 0.012 1.00 0.00 C ATOM 66 O ALA A 5 -4.579 6.265 -0.459 1.00 0.00 O ATOM 67 CB ALA A 5 -5.389 9.113 1.409 1.00 0.00 C ATOM 68 H ALA A 5 -3.074 8.726 2.424 1.00 0.00 H ATOM 69 HA ALA A 5 -5.426 7.015 1.810 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.238 9.094 0.726 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.670 9.860 1.073 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.735 9.367 2.411 1.00 0.00 H ATOM 73 N THR A 6 -3.630 8.230 -0.698 1.00 0.00 N ATOM 74 CA THR A 6 -3.241 7.922 -2.114 1.00 0.00 C ATOM 75 C THR A 6 -2.171 6.827 -2.215 1.00 0.00 C ATOM 76 O THR A 6 -2.321 5.879 -2.960 1.00 0.00 O ATOM 77 CB THR A 6 -2.697 9.239 -2.672 1.00 0.00 C ATOM 78 OG1 THR A 6 -2.805 10.260 -1.688 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.497 9.637 -3.914 1.00 0.00 C ATOM 80 H THR A 6 -3.438 9.114 -0.319 1.00 0.00 H ATOM 81 HA THR A 6 -4.113 7.632 -2.677 1.00 0.00 H ATOM 82 HB THR A 6 -1.661 9.113 -2.946 1.00 0.00 H ATOM 83 HG1 THR A 6 -1.926 10.611 -1.527 1.00 0.00 H ATOM 84 HG21 THR A 6 -3.406 8.858 -4.671 1.00 0.00 H ATOM 85 HG22 THR A 6 -3.109 10.575 -4.311 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.546 9.762 -3.646 1.00 0.00 H ATOM 87 N CYS A 7 -1.090 6.949 -1.502 1.00 0.00 N ATOM 88 CA CYS A 7 -0.023 5.907 -1.604 1.00 0.00 C ATOM 89 C CYS A 7 -0.400 4.666 -0.787 1.00 0.00 C ATOM 90 O CYS A 7 0.277 3.659 -0.826 1.00 0.00 O ATOM 91 CB CYS A 7 1.231 6.568 -1.037 1.00 0.00 C ATOM 92 SG CYS A 7 1.800 7.868 -2.160 1.00 0.00 S ATOM 93 H CYS A 7 -0.968 7.724 -0.916 1.00 0.00 H ATOM 94 HA CYS A 7 0.139 5.639 -2.636 1.00 0.00 H ATOM 95 HB2 CYS A 7 1.002 7.005 -0.083 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.008 5.828 -0.919 1.00 0.00 H ATOM 97 N ALA A 8 -1.473 4.731 -0.046 1.00 0.00 N ATOM 98 CA ALA A 8 -1.887 3.552 0.769 1.00 0.00 C ATOM 99 C ALA A 8 -2.140 2.341 -0.133 1.00 0.00 C ATOM 100 O ALA A 8 -1.751 1.232 0.177 1.00 0.00 O ATOM 101 CB ALA A 8 -3.181 3.988 1.458 1.00 0.00 C ATOM 102 H ALA A 8 -2.006 5.552 -0.028 1.00 0.00 H ATOM 103 HA ALA A 8 -1.136 3.323 1.510 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.554 3.174 2.080 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.927 4.240 0.705 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.985 4.861 2.081 1.00 0.00 H ATOM 107 N THR A 9 -2.784 2.543 -1.250 1.00 0.00 N ATOM 108 CA THR A 9 -3.058 1.404 -2.174 1.00 0.00 C ATOM 109 C THR A 9 -1.744 0.889 -2.765 1.00 0.00 C ATOM 110 O THR A 9 -1.577 -0.288 -3.016 1.00 0.00 O ATOM 111 CB THR A 9 -3.946 1.992 -3.274 1.00 0.00 C ATOM 112 OG1 THR A 9 -5.083 2.606 -2.682 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.400 0.880 -4.220 1.00 0.00 C ATOM 114 H THR A 9 -3.085 3.447 -1.484 1.00 0.00 H ATOM 115 HA THR A 9 -3.579 0.614 -1.659 1.00 0.00 H ATOM 116 HB THR A 9 -3.390 2.729 -3.832 1.00 0.00 H ATOM 117 HG1 THR A 9 -4.997 3.557 -2.790 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.528 0.409 -4.674 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.032 1.302 -5.001 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.965 0.134 -3.660 1.00 0.00 H ATOM 121 N GLN A 10 -0.813 1.771 -2.984 1.00 0.00 N ATOM 122 CA GLN A 10 0.501 1.355 -3.558 1.00 0.00 C ATOM 123 C GLN A 10 1.188 0.371 -2.614 1.00 0.00 C ATOM 124 O GLN A 10 1.470 -0.756 -2.973 1.00 0.00 O ATOM 125 CB GLN A 10 1.312 2.645 -3.663 1.00 0.00 C ATOM 126 CG GLN A 10 1.022 3.324 -5.003 1.00 0.00 C ATOM 127 CD GLN A 10 -0.441 3.769 -5.043 1.00 0.00 C ATOM 128 OE1 GLN A 10 -1.057 3.964 -4.014 1.00 0.00 O ATOM 129 NE2 GLN A 10 -1.026 3.942 -6.195 1.00 0.00 N ATOM 130 H GLN A 10 -0.981 2.709 -2.767 1.00 0.00 H ATOM 131 HA GLN A 10 0.368 0.917 -4.534 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.038 3.310 -2.855 1.00 0.00 H ATOM 133 HB3 GLN A 10 2.364 2.415 -3.600 1.00 0.00 H ATOM 134 HG2 GLN A 10 1.664 4.186 -5.114 1.00 0.00 H ATOM 135 HG3 GLN A 10 1.207 2.628 -5.807 1.00 0.00 H ATOM 136 HE21 GLN A 10 -0.525 3.785 -7.029 1.00 0.00 H ATOM 137 HE22 GLN A 10 -1.967 4.230 -6.231 1.00 0.00 H ATOM 138 N ARG A 11 1.434 0.776 -1.396 1.00 0.00 N ATOM 139 CA ARG A 11 2.071 -0.155 -0.428 1.00 0.00 C ATOM 140 C ARG A 11 1.142 -1.348 -0.254 1.00 0.00 C ATOM 141 O ARG A 11 1.564 -2.477 -0.145 1.00 0.00 O ATOM 142 CB ARG A 11 2.193 0.639 0.875 1.00 0.00 C ATOM 143 CG ARG A 11 3.444 0.194 1.635 1.00 0.00 C ATOM 144 CD ARG A 11 3.132 -1.071 2.436 1.00 0.00 C ATOM 145 NE ARG A 11 3.717 -0.831 3.784 1.00 0.00 N ATOM 146 CZ ARG A 11 3.453 -1.651 4.768 1.00 0.00 C ATOM 147 NH1 ARG A 11 2.666 -2.675 4.573 1.00 0.00 N ATOM 148 NH2 ARG A 11 3.974 -1.446 5.946 1.00 0.00 N ATOM 149 H ARG A 11 1.179 1.679 -1.119 1.00 0.00 H ATOM 150 HA ARG A 11 3.044 -0.469 -0.775 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.265 1.693 0.648 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.321 0.461 1.486 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.239 -0.009 0.931 1.00 0.00 H ATOM 154 HG3 ARG A 11 3.753 0.978 2.311 1.00 0.00 H ATOM 155 HD2 ARG A 11 2.062 -1.215 2.506 1.00 0.00 H ATOM 156 HD3 ARG A 11 3.599 -1.929 1.978 1.00 0.00 H ATOM 157 HE ARG A 11 4.304 -0.060 3.934 1.00 0.00 H ATOM 158 HH11 ARG A 11 2.262 -2.835 3.672 1.00 0.00 H ATOM 159 HH12 ARG A 11 2.464 -3.300 5.327 1.00 0.00 H ATOM 160 HH21 ARG A 11 4.576 -0.662 6.097 1.00 0.00 H ATOM 161 HH22 ARG A 11 3.773 -2.074 6.698 1.00 0.00 H ATOM 162 N LEU A 12 -0.132 -1.081 -0.264 1.00 0.00 N ATOM 163 CA LEU A 12 -1.154 -2.155 -0.140 1.00 0.00 C ATOM 164 C LEU A 12 -0.973 -3.149 -1.282 1.00 0.00 C ATOM 165 O LEU A 12 -0.712 -4.302 -1.074 1.00 0.00 O ATOM 166 CB LEU A 12 -2.454 -1.377 -0.266 1.00 0.00 C ATOM 167 CG LEU A 12 -3.663 -2.287 -0.476 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.658 -2.877 -1.889 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.638 -3.408 0.558 1.00 0.00 C ATOM 170 H LEU A 12 -0.428 -0.155 -0.381 1.00 0.00 H ATOM 171 HA LEU A 12 -1.093 -2.642 0.820 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.598 -0.815 0.639 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.368 -0.705 -1.098 1.00 0.00 H ATOM 174 HG LEU A 12 -4.558 -1.698 -0.348 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.527 -3.522 -2.017 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.749 -3.460 -2.037 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.694 -2.070 -2.621 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.722 -3.988 0.444 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.500 -4.059 0.410 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.674 -2.980 1.560 1.00 0.00 H ATOM 181 N ALA A 13 -1.072 -2.708 -2.487 1.00 0.00 N ATOM 182 CA ALA A 13 -0.865 -3.628 -3.633 1.00 0.00 C ATOM 183 C ALA A 13 0.446 -4.377 -3.447 1.00 0.00 C ATOM 184 O ALA A 13 0.624 -5.486 -3.905 1.00 0.00 O ATOM 185 CB ALA A 13 -0.738 -2.698 -4.814 1.00 0.00 C ATOM 186 H ALA A 13 -1.255 -1.768 -2.647 1.00 0.00 H ATOM 187 HA ALA A 13 -1.697 -4.301 -3.760 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.581 -3.281 -5.721 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.109 -2.029 -4.661 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.651 -2.110 -4.914 1.00 0.00 H ATOM 191 N ASN A 14 1.352 -3.760 -2.756 1.00 0.00 N ATOM 192 CA ASN A 14 2.659 -4.372 -2.482 1.00 0.00 C ATOM 193 C ASN A 14 2.527 -5.175 -1.207 1.00 0.00 C ATOM 194 O ASN A 14 3.305 -6.061 -0.918 1.00 0.00 O ATOM 195 CB ASN A 14 3.604 -3.189 -2.290 1.00 0.00 C ATOM 196 CG ASN A 14 3.821 -2.484 -3.629 1.00 0.00 C ATOM 197 OD1 ASN A 14 3.522 -3.030 -4.674 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.330 -1.282 -3.645 1.00 0.00 N ATOM 199 H ASN A 14 1.158 -2.885 -2.381 1.00 0.00 H ATOM 200 HA ASN A 14 2.981 -4.988 -3.305 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.169 -2.496 -1.584 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.546 -3.541 -1.913 1.00 0.00 H ATOM 203 HD21 ASN A 14 4.570 -0.840 -2.798 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.473 -0.820 -4.502 1.00 0.00 H ATOM 205 N PHE A 15 1.523 -4.860 -0.438 1.00 0.00 N ATOM 206 CA PHE A 15 1.309 -5.598 0.827 1.00 0.00 C ATOM 207 C PHE A 15 0.323 -6.726 0.561 1.00 0.00 C ATOM 208 O PHE A 15 0.269 -7.729 1.242 1.00 0.00 O ATOM 209 CB PHE A 15 0.763 -4.545 1.815 1.00 0.00 C ATOM 210 CG PHE A 15 -0.555 -4.974 2.433 1.00 0.00 C ATOM 211 CD1 PHE A 15 -1.697 -5.136 1.635 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.635 -5.191 3.809 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.909 -5.513 2.214 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.849 -5.571 4.388 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.988 -5.732 3.592 1.00 0.00 C ATOM 216 H PHE A 15 0.881 -4.149 -0.718 1.00 0.00 H ATOM 217 HA PHE A 15 2.243 -5.981 1.167 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.486 -4.397 2.603 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.619 -3.612 1.292 1.00 0.00 H ATOM 220 HD1 PHE A 15 -1.644 -4.971 0.575 1.00 0.00 H ATOM 221 HD2 PHE A 15 0.242 -5.069 4.424 1.00 0.00 H ATOM 222 HE1 PHE A 15 -3.787 -5.630 1.592 1.00 0.00 H ATOM 223 HE2 PHE A 15 -1.908 -5.734 5.449 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.926 -6.025 4.040 1.00 0.00 H ATOM 225 N LEU A 16 -0.474 -6.507 -0.428 1.00 0.00 N ATOM 226 CA LEU A 16 -1.521 -7.451 -0.829 1.00 0.00 C ATOM 227 C LEU A 16 -0.967 -8.477 -1.815 1.00 0.00 C ATOM 228 O LEU A 16 -1.560 -9.511 -2.052 1.00 0.00 O ATOM 229 CB LEU A 16 -2.510 -6.511 -1.500 1.00 0.00 C ATOM 230 CG LEU A 16 -3.888 -7.129 -1.541 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.619 -6.779 -0.245 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.643 -6.549 -2.734 1.00 0.00 C ATOM 233 H LEU A 16 -0.397 -5.665 -0.921 1.00 0.00 H ATOM 234 HA LEU A 16 -1.973 -7.924 0.027 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.552 -5.593 -0.940 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.181 -6.294 -2.503 1.00 0.00 H ATOM 237 HG LEU A 16 -3.802 -8.199 -1.638 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.616 -7.219 -0.260 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.701 -5.696 -0.155 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.061 -7.173 0.605 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.724 -5.468 -2.623 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.641 -6.984 -2.779 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.104 -6.780 -3.653 1.00 0.00 H ATOM 244 N VAL A 17 0.165 -8.198 -2.401 1.00 0.00 N ATOM 245 CA VAL A 17 0.743 -9.161 -3.374 1.00 0.00 C ATOM 246 C VAL A 17 0.772 -10.564 -2.766 1.00 0.00 C ATOM 247 O VAL A 17 0.501 -11.547 -3.428 1.00 0.00 O ATOM 248 CB VAL A 17 2.167 -8.681 -3.666 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.118 -7.452 -4.570 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.884 -8.329 -2.360 1.00 0.00 C ATOM 251 H VAL A 17 0.626 -7.356 -2.203 1.00 0.00 H ATOM 252 HA VAL A 17 0.163 -9.151 -4.278 1.00 0.00 H ATOM 253 HB VAL A 17 2.709 -9.470 -4.170 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.133 -7.112 -4.777 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.563 -6.657 -4.073 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.624 -7.709 -5.507 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.339 -7.536 -1.848 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.896 -7.989 -2.581 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.929 -9.211 -1.721 1.00 0.00 H ATOM 260 N ARG A 18 1.102 -10.663 -1.507 1.00 0.00 N ATOM 261 CA ARG A 18 1.154 -12.000 -0.850 1.00 0.00 C ATOM 262 C ARG A 18 -0.262 -12.554 -0.659 1.00 0.00 C ATOM 263 O ARG A 18 -0.488 -13.745 -0.742 1.00 0.00 O ATOM 264 CB ARG A 18 1.824 -11.752 0.502 1.00 0.00 C ATOM 265 CG ARG A 18 1.686 -12.997 1.381 1.00 0.00 C ATOM 266 CD ARG A 18 2.097 -12.660 2.817 1.00 0.00 C ATOM 267 NE ARG A 18 2.091 -13.964 3.537 1.00 0.00 N ATOM 268 CZ ARG A 18 3.022 -14.850 3.296 1.00 0.00 C ATOM 269 NH1 ARG A 18 3.959 -14.596 2.424 1.00 0.00 N ATOM 270 NH2 ARG A 18 3.014 -15.991 3.931 1.00 0.00 N ATOM 271 H ARG A 18 1.319 -9.855 -0.993 1.00 0.00 H ATOM 272 HA ARG A 18 1.749 -12.684 -1.435 1.00 0.00 H ATOM 273 HB2 ARG A 18 2.871 -11.533 0.348 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.349 -10.913 0.990 1.00 0.00 H ATOM 275 HG2 ARG A 18 0.661 -13.334 1.367 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.327 -13.779 0.999 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.086 -12.224 2.832 1.00 0.00 H ATOM 278 HD3 ARG A 18 1.382 -11.987 3.265 1.00 0.00 H ATOM 279 HE ARG A 18 1.388 -14.159 4.192 1.00 0.00 H ATOM 280 HH11 ARG A 18 3.967 -13.722 1.937 1.00 0.00 H ATOM 281 HH12 ARG A 18 4.669 -15.275 2.242 1.00 0.00 H ATOM 282 HH21 ARG A 18 2.297 -16.187 4.600 1.00 0.00 H ATOM 283 HH22 ARG A 18 3.728 -16.669 3.748 1.00 0.00 H ATOM 284 N SER A 19 -1.217 -11.701 -0.403 1.00 0.00 N ATOM 285 CA SER A 19 -2.614 -12.187 -0.207 1.00 0.00 C ATOM 286 C SER A 19 -2.681 -13.130 0.997 1.00 0.00 C ATOM 287 O SER A 19 -1.713 -13.785 1.329 1.00 0.00 O ATOM 288 CB SER A 19 -2.955 -12.933 -1.497 1.00 0.00 C ATOM 289 OG SER A 19 -2.907 -14.333 -1.258 1.00 0.00 O ATOM 290 H SER A 19 -1.017 -10.744 -0.339 1.00 0.00 H ATOM 291 HA SER A 19 -3.287 -11.354 -0.072 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.946 -12.662 -1.819 1.00 0.00 H ATOM 293 HB3 SER A 19 -2.244 -12.663 -2.265 1.00 0.00 H ATOM 294 HG SER A 19 -2.023 -14.553 -0.952 1.00 0.00 H HETATM 295 N NH2 A 20 -3.794 -13.229 1.670 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.848 -13.831 2.442 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -4.577 -12.702 1.403 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 7 ATOM 1 N LYS A 1 1.708 11.810 4.205 1.00 0.00 N ATOM 2 CA LYS A 1 0.661 12.481 3.380 1.00 0.00 C ATOM 3 C LYS A 1 0.044 11.484 2.396 1.00 0.00 C ATOM 4 O LYS A 1 -1.049 10.991 2.597 1.00 0.00 O ATOM 5 CB LYS A 1 1.401 13.589 2.628 1.00 0.00 C ATOM 6 CG LYS A 1 1.354 14.882 3.446 1.00 0.00 C ATOM 7 CD LYS A 1 2.498 15.802 3.011 1.00 0.00 C ATOM 8 CE LYS A 1 2.763 16.844 4.103 1.00 0.00 C ATOM 9 NZ LYS A 1 2.012 18.054 3.668 1.00 0.00 N ATOM 10 H1 LYS A 1 2.308 12.530 4.655 1.00 0.00 H ATOM 11 H2 LYS A 1 2.291 11.202 3.594 1.00 0.00 H ATOM 12 H3 LYS A 1 1.253 11.231 4.938 1.00 0.00 H ATOM 13 HA LYS A 1 -0.100 12.909 4.012 1.00 0.00 H ATOM 14 HB2 LYS A 1 2.429 13.295 2.478 1.00 0.00 H ATOM 15 HB3 LYS A 1 0.929 13.753 1.671 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.408 15.380 3.279 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.459 14.651 4.495 1.00 0.00 H ATOM 18 HD2 LYS A 1 3.390 15.214 2.851 1.00 0.00 H ATOM 19 HD3 LYS A 1 2.228 16.305 2.095 1.00 0.00 H ATOM 20 HE2 LYS A 1 2.394 16.491 5.056 1.00 0.00 H ATOM 21 HE3 LYS A 1 3.817 17.066 4.163 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.011 17.811 3.531 1.00 0.00 H ATOM 23 HZ2 LYS A 1 2.412 18.406 2.772 1.00 0.00 H ATOM 24 HZ3 LYS A 1 2.092 18.791 4.395 1.00 0.00 H ATOM 25 N CYS A 2 0.735 11.184 1.330 1.00 0.00 N ATOM 26 CA CYS A 2 0.190 10.221 0.330 1.00 0.00 C ATOM 27 C CYS A 2 0.122 8.814 0.928 1.00 0.00 C ATOM 28 O CYS A 2 -0.818 8.076 0.704 1.00 0.00 O ATOM 29 CB CYS A 2 1.184 10.257 -0.831 1.00 0.00 C ATOM 30 SG CYS A 2 0.620 9.151 -2.149 1.00 0.00 S ATOM 31 H CYS A 2 1.614 11.595 1.185 1.00 0.00 H ATOM 32 HA CYS A 2 -0.783 10.535 -0.008 1.00 0.00 H ATOM 33 HB2 CYS A 2 1.253 11.265 -1.214 1.00 0.00 H ATOM 34 HB3 CYS A 2 2.156 9.937 -0.484 1.00 0.00 H ATOM 35 N ASN A 3 1.118 8.433 1.682 1.00 0.00 N ATOM 36 CA ASN A 3 1.126 7.068 2.289 1.00 0.00 C ATOM 37 C ASN A 3 -0.234 6.737 2.905 1.00 0.00 C ATOM 38 O ASN A 3 -0.628 5.591 2.978 1.00 0.00 O ATOM 39 CB ASN A 3 2.196 7.136 3.382 1.00 0.00 C ATOM 40 CG ASN A 3 3.191 5.988 3.197 1.00 0.00 C ATOM 41 OD1 ASN A 3 2.803 4.875 2.904 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.466 6.216 3.358 1.00 0.00 N ATOM 43 H ASN A 3 1.869 9.042 1.841 1.00 0.00 H ATOM 44 HA ASN A 3 1.401 6.325 1.560 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.717 8.080 3.315 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.727 7.050 4.349 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.779 7.118 3.594 1.00 0.00 H ATOM 48 HD22 ASN A 3 5.114 5.483 3.242 1.00 0.00 H ATOM 49 N THR A 4 -0.942 7.725 3.373 1.00 0.00 N ATOM 50 CA THR A 4 -2.264 7.452 4.008 1.00 0.00 C ATOM 51 C THR A 4 -3.332 7.048 2.980 1.00 0.00 C ATOM 52 O THR A 4 -3.910 5.983 3.069 1.00 0.00 O ATOM 53 CB THR A 4 -2.656 8.770 4.686 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.553 9.666 4.664 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.066 8.497 6.133 1.00 0.00 C ATOM 56 H THR A 4 -0.600 8.642 3.323 1.00 0.00 H ATOM 57 HA THR A 4 -2.161 6.683 4.756 1.00 0.00 H ATOM 58 HB THR A 4 -3.488 9.211 4.160 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.818 10.450 4.178 1.00 0.00 H ATOM 60 HG21 THR A 4 -3.916 7.815 6.148 1.00 0.00 H ATOM 61 HG22 THR A 4 -3.345 9.434 6.615 1.00 0.00 H ATOM 62 HG23 THR A 4 -2.230 8.048 6.669 1.00 0.00 H ATOM 63 N ALA A 5 -3.634 7.899 2.032 1.00 0.00 N ATOM 64 CA ALA A 5 -4.705 7.555 1.044 1.00 0.00 C ATOM 65 C ALA A 5 -4.154 7.095 -0.315 1.00 0.00 C ATOM 66 O ALA A 5 -4.298 5.951 -0.700 1.00 0.00 O ATOM 67 CB ALA A 5 -5.498 8.850 0.876 1.00 0.00 C ATOM 68 H ALA A 5 -3.186 8.768 1.989 1.00 0.00 H ATOM 69 HA ALA A 5 -5.352 6.796 1.452 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.309 8.691 0.165 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.839 9.635 0.505 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.913 9.150 1.838 1.00 0.00 H ATOM 73 N THR A 6 -3.571 7.993 -1.064 1.00 0.00 N ATOM 74 CA THR A 6 -3.065 7.631 -2.428 1.00 0.00 C ATOM 75 C THR A 6 -1.970 6.561 -2.386 1.00 0.00 C ATOM 76 O THR A 6 -2.032 5.580 -3.100 1.00 0.00 O ATOM 77 CB THR A 6 -2.506 8.937 -2.994 1.00 0.00 C ATOM 78 OG1 THR A 6 -2.186 9.816 -1.926 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.553 9.590 -3.898 1.00 0.00 C ATOM 80 H THR A 6 -3.501 8.918 -0.751 1.00 0.00 H ATOM 81 HA THR A 6 -3.883 7.296 -3.046 1.00 0.00 H ATOM 82 HB THR A 6 -1.619 8.728 -3.570 1.00 0.00 H ATOM 83 HG1 THR A 6 -2.058 10.693 -2.292 1.00 0.00 H ATOM 84 HG21 THR A 6 -3.798 8.915 -4.718 1.00 0.00 H ATOM 85 HG22 THR A 6 -3.155 10.521 -4.302 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.453 9.800 -3.320 1.00 0.00 H ATOM 87 N CYS A 7 -0.962 6.739 -1.584 1.00 0.00 N ATOM 88 CA CYS A 7 0.129 5.723 -1.545 1.00 0.00 C ATOM 89 C CYS A 7 -0.275 4.534 -0.668 1.00 0.00 C ATOM 90 O CYS A 7 0.354 3.495 -0.689 1.00 0.00 O ATOM 91 CB CYS A 7 1.333 6.454 -0.955 1.00 0.00 C ATOM 92 SG CYS A 7 1.972 7.646 -2.161 1.00 0.00 S ATOM 93 H CYS A 7 -0.913 7.538 -1.021 1.00 0.00 H ATOM 94 HA CYS A 7 0.359 5.387 -2.543 1.00 0.00 H ATOM 95 HB2 CYS A 7 1.033 6.974 -0.066 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.106 5.739 -0.712 1.00 0.00 H ATOM 97 N ALA A 8 -1.328 4.670 0.091 1.00 0.00 N ATOM 98 CA ALA A 8 -1.769 3.534 0.950 1.00 0.00 C ATOM 99 C ALA A 8 -2.078 2.320 0.071 1.00 0.00 C ATOM 100 O ALA A 8 -1.609 1.226 0.313 1.00 0.00 O ATOM 101 CB ALA A 8 -3.037 4.029 1.646 1.00 0.00 C ATOM 102 H ALA A 8 -1.832 5.509 0.089 1.00 0.00 H ATOM 103 HA ALA A 8 -1.013 3.293 1.680 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.423 3.246 2.298 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.788 4.281 0.897 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.805 4.914 2.239 1.00 0.00 H ATOM 107 N THR A 9 -2.861 2.514 -0.954 1.00 0.00 N ATOM 108 CA THR A 9 -3.204 1.384 -1.864 1.00 0.00 C ATOM 109 C THR A 9 -1.954 0.916 -2.616 1.00 0.00 C ATOM 110 O THR A 9 -1.793 -0.252 -2.912 1.00 0.00 O ATOM 111 CB THR A 9 -4.229 1.959 -2.845 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.533 0.982 -3.832 1.00 0.00 O ATOM 113 CG2 THR A 9 -3.658 3.207 -3.522 1.00 0.00 C ATOM 114 H THR A 9 -3.222 3.408 -1.127 1.00 0.00 H ATOM 115 HA THR A 9 -3.642 0.571 -1.309 1.00 0.00 H ATOM 116 HB THR A 9 -5.129 2.224 -2.311 1.00 0.00 H ATOM 117 HG1 THR A 9 -3.786 0.927 -4.433 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.424 3.957 -2.766 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.392 3.611 -4.219 1.00 0.00 H ATOM 120 HG23 THR A 9 -2.750 2.943 -4.064 1.00 0.00 H ATOM 121 N GLN A 10 -1.070 1.823 -2.934 1.00 0.00 N ATOM 122 CA GLN A 10 0.169 1.439 -3.675 1.00 0.00 C ATOM 123 C GLN A 10 0.995 0.460 -2.842 1.00 0.00 C ATOM 124 O GLN A 10 1.263 -0.649 -3.260 1.00 0.00 O ATOM 125 CB GLN A 10 0.933 2.748 -3.878 1.00 0.00 C ATOM 126 CG GLN A 10 1.082 3.028 -5.374 1.00 0.00 C ATOM 127 CD GLN A 10 1.621 1.780 -6.076 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.538 1.145 -5.594 1.00 0.00 O ATOM 129 NE2 GLN A 10 1.086 1.399 -7.204 1.00 0.00 N ATOM 130 H GLN A 10 -1.225 2.756 -2.686 1.00 0.00 H ATOM 131 HA GLN A 10 -0.082 1.003 -4.629 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.390 3.557 -3.412 1.00 0.00 H ATOM 133 HB3 GLN A 10 1.912 2.666 -3.431 1.00 0.00 H ATOM 134 HG2 GLN A 10 0.120 3.290 -5.789 1.00 0.00 H ATOM 135 HG3 GLN A 10 1.772 3.845 -5.520 1.00 0.00 H ATOM 136 HE21 GLN A 10 0.342 1.914 -7.592 1.00 0.00 H ATOM 137 HE22 GLN A 10 1.426 0.598 -7.663 1.00 0.00 H ATOM 138 N ARG A 11 1.382 0.848 -1.660 1.00 0.00 N ATOM 139 CA ARG A 11 2.166 -0.082 -0.802 1.00 0.00 C ATOM 140 C ARG A 11 1.267 -1.260 -0.445 1.00 0.00 C ATOM 141 O ARG A 11 1.706 -2.383 -0.319 1.00 0.00 O ATOM 142 CB ARG A 11 2.544 0.724 0.444 1.00 0.00 C ATOM 143 CG ARG A 11 1.279 1.273 1.111 1.00 0.00 C ATOM 144 CD ARG A 11 0.816 0.307 2.202 1.00 0.00 C ATOM 145 NE ARG A 11 1.174 0.976 3.486 1.00 0.00 N ATOM 146 CZ ARG A 11 0.695 0.531 4.617 1.00 0.00 C ATOM 147 NH1 ARG A 11 -0.099 -0.505 4.632 1.00 0.00 N ATOM 148 NH2 ARG A 11 1.012 1.124 5.735 1.00 0.00 N ATOM 149 H ARG A 11 1.141 1.738 -1.333 1.00 0.00 H ATOM 150 HA ARG A 11 3.053 -0.420 -1.317 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.069 0.085 1.138 1.00 0.00 H ATOM 152 HB3 ARG A 11 3.182 1.546 0.159 1.00 0.00 H ATOM 153 HG2 ARG A 11 1.495 2.237 1.549 1.00 0.00 H ATOM 154 HG3 ARG A 11 0.499 1.381 0.373 1.00 0.00 H ATOM 155 HD2 ARG A 11 -0.254 0.155 2.141 1.00 0.00 H ATOM 156 HD3 ARG A 11 1.335 -0.635 2.119 1.00 0.00 H ATOM 157 HE ARG A 11 1.772 1.754 3.480 1.00 0.00 H ATOM 158 HH11 ARG A 11 -0.344 -0.962 3.777 1.00 0.00 H ATOM 159 HH12 ARG A 11 -0.464 -0.842 5.499 1.00 0.00 H ATOM 160 HH21 ARG A 11 1.621 1.917 5.726 1.00 0.00 H ATOM 161 HH22 ARG A 11 0.645 0.785 6.602 1.00 0.00 H ATOM 162 N LEU A 12 -0.002 -0.991 -0.319 1.00 0.00 N ATOM 163 CA LEU A 12 -0.996 -2.052 -0.008 1.00 0.00 C ATOM 164 C LEU A 12 -0.989 -3.072 -1.142 1.00 0.00 C ATOM 165 O LEU A 12 -0.719 -4.226 -0.947 1.00 0.00 O ATOM 166 CB LEU A 12 -2.295 -1.260 0.056 1.00 0.00 C ATOM 167 CG LEU A 12 -3.538 -2.150 -0.016 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.719 -2.712 -1.427 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.403 -3.288 0.986 1.00 0.00 C ATOM 170 H LEU A 12 -0.312 -0.072 -0.457 1.00 0.00 H ATOM 171 HA LEU A 12 -0.786 -2.518 0.941 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.314 -0.717 0.986 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.309 -0.567 -0.762 1.00 0.00 H ATOM 174 HG LEU A 12 -4.403 -1.554 0.236 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.608 -3.342 -1.457 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.845 -3.305 -1.697 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.833 -1.890 -2.134 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.518 -3.879 0.749 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.287 -3.923 0.936 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.307 -2.878 1.991 1.00 0.00 H ATOM 181 N ALA A 13 -1.234 -2.652 -2.334 1.00 0.00 N ATOM 182 CA ALA A 13 -1.187 -3.600 -3.474 1.00 0.00 C ATOM 183 C ALA A 13 0.131 -4.361 -3.437 1.00 0.00 C ATOM 184 O ALA A 13 0.237 -5.486 -3.884 1.00 0.00 O ATOM 185 CB ALA A 13 -1.208 -2.700 -4.685 1.00 0.00 C ATOM 186 H ALA A 13 -1.419 -1.713 -2.492 1.00 0.00 H ATOM 187 HA ALA A 13 -2.034 -4.265 -3.474 1.00 0.00 H ATOM 188 HB1 ALA A 13 -1.176 -3.307 -5.590 1.00 0.00 H ATOM 189 HB2 ALA A 13 -0.342 -2.038 -4.661 1.00 0.00 H ATOM 190 HB3 ALA A 13 -2.121 -2.104 -4.680 1.00 0.00 H ATOM 191 N ASN A 14 1.129 -3.738 -2.884 1.00 0.00 N ATOM 192 CA ASN A 14 2.455 -4.366 -2.763 1.00 0.00 C ATOM 193 C ASN A 14 2.476 -5.127 -1.454 1.00 0.00 C ATOM 194 O ASN A 14 3.270 -6.023 -1.242 1.00 0.00 O ATOM 195 CB ASN A 14 3.444 -3.201 -2.738 1.00 0.00 C ATOM 196 CG ASN A 14 3.770 -2.772 -4.171 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.400 -3.503 -4.909 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.364 -1.608 -4.598 1.00 0.00 N ATOM 199 H ASN A 14 0.994 -2.852 -2.510 1.00 0.00 H ATOM 200 HA ASN A 14 2.654 -5.016 -3.598 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.008 -2.371 -2.204 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.350 -3.509 -2.242 1.00 0.00 H ATOM 203 HD21 ASN A 14 2.854 -1.015 -4.000 1.00 0.00 H ATOM 204 HD22 ASN A 14 3.569 -1.325 -5.518 1.00 0.00 H ATOM 205 N PHE A 15 1.584 -4.770 -0.568 1.00 0.00 N ATOM 206 CA PHE A 15 1.528 -5.472 0.735 1.00 0.00 C ATOM 207 C PHE A 15 0.530 -6.612 0.613 1.00 0.00 C ATOM 208 O PHE A 15 0.587 -7.617 1.291 1.00 0.00 O ATOM 209 CB PHE A 15 1.082 -4.395 1.750 1.00 0.00 C ATOM 210 CG PHE A 15 -0.158 -4.817 2.522 1.00 0.00 C ATOM 211 CD1 PHE A 15 -1.379 -5.010 1.860 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.084 -4.999 3.904 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.516 -5.384 2.578 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.223 -5.374 4.623 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.440 -5.566 3.962 1.00 0.00 C ATOM 216 H PHE A 15 0.923 -4.053 -0.783 1.00 0.00 H ATOM 217 HA PHE A 15 2.498 -5.839 0.979 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.885 -4.217 2.449 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.870 -3.479 1.220 1.00 0.00 H ATOM 220 HD1 PHE A 15 -1.446 -4.871 0.798 1.00 0.00 H ATOM 221 HD2 PHE A 15 0.852 -4.854 4.414 1.00 0.00 H ATOM 222 HE1 PHE A 15 -3.455 -5.527 2.061 1.00 0.00 H ATOM 223 HE2 PHE A 15 -1.163 -5.511 5.687 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.319 -5.854 4.518 1.00 0.00 H ATOM 225 N LEU A 16 -0.388 -6.411 -0.267 1.00 0.00 N ATOM 226 CA LEU A 16 -1.457 -7.376 -0.535 1.00 0.00 C ATOM 227 C LEU A 16 -0.963 -8.430 -1.524 1.00 0.00 C ATOM 228 O LEU A 16 -1.594 -9.445 -1.740 1.00 0.00 O ATOM 229 CB LEU A 16 -2.506 -6.467 -1.153 1.00 0.00 C ATOM 230 CG LEU A 16 -3.862 -7.125 -1.118 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.593 -6.661 0.142 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.634 -6.694 -2.362 1.00 0.00 C ATOM 233 H LEU A 16 -0.383 -5.573 -0.771 1.00 0.00 H ATOM 234 HA LEU A 16 -1.827 -7.822 0.374 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.546 -5.549 -0.590 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.237 -6.242 -2.171 1.00 0.00 H ATOM 237 HG LEU A 16 -3.744 -8.196 -1.104 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.577 -7.127 0.184 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.706 -5.577 0.119 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.018 -6.947 1.023 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.744 -5.610 -2.364 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.620 -7.159 -2.358 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.090 -7.005 -3.254 1.00 0.00 H ATOM 244 N VAL A 17 0.168 -8.185 -2.126 1.00 0.00 N ATOM 245 CA VAL A 17 0.718 -9.161 -3.106 1.00 0.00 C ATOM 246 C VAL A 17 0.724 -10.569 -2.506 1.00 0.00 C ATOM 247 O VAL A 17 0.276 -11.516 -3.121 1.00 0.00 O ATOM 248 CB VAL A 17 2.150 -8.693 -3.368 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.824 -9.631 -4.373 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.116 -7.277 -3.937 1.00 0.00 C ATOM 251 H VAL A 17 0.652 -7.354 -1.935 1.00 0.00 H ATOM 252 HA VAL A 17 0.151 -9.136 -4.019 1.00 0.00 H ATOM 253 HB VAL A 17 2.706 -8.699 -2.441 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.844 -9.294 -4.557 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.265 -9.624 -5.309 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.843 -10.643 -3.969 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.553 -7.273 -4.870 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.134 -6.936 -4.126 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.637 -6.609 -3.221 1.00 0.00 H ATOM 260 N ARG A 18 1.226 -10.714 -1.310 1.00 0.00 N ATOM 261 CA ARG A 18 1.256 -12.064 -0.679 1.00 0.00 C ATOM 262 C ARG A 18 -0.171 -12.581 -0.478 1.00 0.00 C ATOM 263 O ARG A 18 -0.515 -13.664 -0.906 1.00 0.00 O ATOM 264 CB ARG A 18 1.947 -11.860 0.668 1.00 0.00 C ATOM 265 CG ARG A 18 3.282 -12.608 0.674 1.00 0.00 C ATOM 266 CD ARG A 18 4.396 -11.665 0.217 1.00 0.00 C ATOM 267 NE ARG A 18 5.629 -12.500 0.208 1.00 0.00 N ATOM 268 CZ ARG A 18 6.806 -11.934 0.236 1.00 0.00 C ATOM 269 NH1 ARG A 18 6.909 -10.633 0.280 1.00 0.00 N ATOM 270 NH2 ARG A 18 7.882 -12.672 0.224 1.00 0.00 N ATOM 271 H ARG A 18 1.583 -9.934 -0.828 1.00 0.00 H ATOM 272 HA ARG A 18 1.824 -12.751 -1.286 1.00 0.00 H ATOM 273 HB2 ARG A 18 2.124 -10.806 0.826 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.319 -12.243 1.458 1.00 0.00 H ATOM 275 HG2 ARG A 18 3.493 -12.961 1.672 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.226 -13.449 -0.001 1.00 0.00 H ATOM 277 HD2 ARG A 18 4.186 -11.290 -0.776 1.00 0.00 H ATOM 278 HD3 ARG A 18 4.505 -10.849 0.913 1.00 0.00 H ATOM 279 HE ARG A 18 5.557 -13.477 0.181 1.00 0.00 H ATOM 280 HH11 ARG A 18 6.088 -10.065 0.292 1.00 0.00 H ATOM 281 HH12 ARG A 18 7.812 -10.205 0.299 1.00 0.00 H ATOM 282 HH21 ARG A 18 7.804 -13.669 0.194 1.00 0.00 H ATOM 283 HH22 ARG A 18 8.784 -12.241 0.244 1.00 0.00 H ATOM 284 N SER A 19 -1.003 -11.811 0.166 1.00 0.00 N ATOM 285 CA SER A 19 -2.409 -12.256 0.391 1.00 0.00 C ATOM 286 C SER A 19 -3.141 -12.385 -0.948 1.00 0.00 C ATOM 287 O SER A 19 -3.847 -13.345 -1.184 1.00 0.00 O ATOM 288 CB SER A 19 -3.040 -11.158 1.245 1.00 0.00 C ATOM 289 OG SER A 19 -4.399 -10.988 0.863 1.00 0.00 O ATOM 290 H SER A 19 -0.708 -10.938 0.502 1.00 0.00 H ATOM 291 HA SER A 19 -2.426 -13.193 0.923 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.995 -11.436 2.284 1.00 0.00 H ATOM 293 HB3 SER A 19 -2.495 -10.233 1.099 1.00 0.00 H ATOM 294 HG SER A 19 -4.833 -10.459 1.535 1.00 0.00 H HETATM 295 N NH2 A 20 -3.000 -11.445 -1.845 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.464 -11.517 -2.706 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -2.431 -10.671 -1.658 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 8 ATOM 1 N LYS A 1 2.497 12.530 2.666 1.00 0.00 N ATOM 2 CA LYS A 1 1.110 12.612 3.212 1.00 0.00 C ATOM 3 C LYS A 1 0.205 11.599 2.507 1.00 0.00 C ATOM 4 O LYS A 1 -0.654 10.991 3.115 1.00 0.00 O ATOM 5 CB LYS A 1 0.650 14.040 2.912 1.00 0.00 C ATOM 6 CG LYS A 1 -0.796 14.216 3.374 1.00 0.00 C ATOM 7 CD LYS A 1 -1.165 15.700 3.346 1.00 0.00 C ATOM 8 CE LYS A 1 -2.257 15.939 2.301 1.00 0.00 C ATOM 9 NZ LYS A 1 -1.628 15.580 0.999 1.00 0.00 N ATOM 10 H1 LYS A 1 2.807 11.538 2.654 1.00 0.00 H ATOM 11 H2 LYS A 1 3.139 13.087 3.267 1.00 0.00 H ATOM 12 H3 LYS A 1 2.512 12.908 1.698 1.00 0.00 H ATOM 13 HA LYS A 1 1.113 12.442 4.276 1.00 0.00 H ATOM 14 HB2 LYS A 1 1.284 14.740 3.436 1.00 0.00 H ATOM 15 HB3 LYS A 1 0.712 14.223 1.850 1.00 0.00 H ATOM 16 HG2 LYS A 1 -1.454 13.668 2.714 1.00 0.00 H ATOM 17 HG3 LYS A 1 -0.902 13.839 4.380 1.00 0.00 H ATOM 18 HD2 LYS A 1 -1.525 15.998 4.320 1.00 0.00 H ATOM 19 HD3 LYS A 1 -0.292 16.282 3.092 1.00 0.00 H ATOM 20 HE2 LYS A 1 -3.110 15.304 2.497 1.00 0.00 H ATOM 21 HE3 LYS A 1 -2.550 16.977 2.294 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -0.661 15.962 0.964 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -2.190 15.982 0.220 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -1.592 14.547 0.904 1.00 0.00 H ATOM 25 N CYS A 2 0.389 11.412 1.230 1.00 0.00 N ATOM 26 CA CYS A 2 -0.461 10.439 0.486 1.00 0.00 C ATOM 27 C CYS A 2 -0.301 9.036 1.077 1.00 0.00 C ATOM 28 O CYS A 2 -1.161 8.189 0.932 1.00 0.00 O ATOM 29 CB CYS A 2 0.060 10.475 -0.951 1.00 0.00 C ATOM 30 SG CYS A 2 1.740 9.801 -1.004 1.00 0.00 S ATOM 31 H CYS A 2 1.089 11.913 0.759 1.00 0.00 H ATOM 32 HA CYS A 2 -1.494 10.744 0.511 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.585 9.881 -1.582 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.070 11.495 -1.306 1.00 0.00 H ATOM 35 N ASN A 3 0.799 8.781 1.733 1.00 0.00 N ATOM 36 CA ASN A 3 1.029 7.429 2.324 1.00 0.00 C ATOM 37 C ASN A 3 -0.228 6.931 3.041 1.00 0.00 C ATOM 38 O ASN A 3 -0.491 5.746 3.096 1.00 0.00 O ATOM 39 CB ASN A 3 2.164 7.634 3.329 1.00 0.00 C ATOM 40 CG ASN A 3 3.509 7.553 2.602 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.309 8.463 2.678 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.791 6.493 1.895 1.00 0.00 N ATOM 43 H ASN A 3 1.481 9.477 1.829 1.00 0.00 H ATOM 44 HA ASN A 3 1.336 6.726 1.569 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.063 8.605 3.793 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.119 6.865 4.085 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.142 5.756 1.835 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.652 6.433 1.425 1.00 0.00 H ATOM 49 N THR A 4 -0.996 7.818 3.603 1.00 0.00 N ATOM 50 CA THR A 4 -2.221 7.381 4.329 1.00 0.00 C ATOM 51 C THR A 4 -3.315 6.896 3.367 1.00 0.00 C ATOM 52 O THR A 4 -3.772 5.773 3.456 1.00 0.00 O ATOM 53 CB THR A 4 -2.694 8.625 5.085 1.00 0.00 C ATOM 54 OG1 THR A 4 -2.082 9.780 4.528 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.309 8.501 6.560 1.00 0.00 C ATOM 56 H THR A 4 -0.762 8.769 3.561 1.00 0.00 H ATOM 57 HA THR A 4 -1.977 6.604 5.035 1.00 0.00 H ATOM 58 HB THR A 4 -3.767 8.709 5.003 1.00 0.00 H ATOM 59 HG1 THR A 4 -2.744 10.248 4.014 1.00 0.00 H ATOM 60 HG21 THR A 4 -2.781 7.616 6.986 1.00 0.00 H ATOM 61 HG22 THR A 4 -2.645 9.386 7.099 1.00 0.00 H ATOM 62 HG23 THR A 4 -1.226 8.413 6.647 1.00 0.00 H ATOM 63 N ALA A 5 -3.772 7.738 2.477 1.00 0.00 N ATOM 64 CA ALA A 5 -4.874 7.316 1.553 1.00 0.00 C ATOM 65 C ALA A 5 -4.383 6.952 0.142 1.00 0.00 C ATOM 66 O ALA A 5 -4.454 5.813 -0.274 1.00 0.00 O ATOM 67 CB ALA A 5 -5.799 8.531 1.485 1.00 0.00 C ATOM 68 H ALA A 5 -3.418 8.651 2.435 1.00 0.00 H ATOM 69 HA ALA A 5 -5.413 6.487 1.980 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.640 8.312 0.827 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.247 9.387 1.096 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.171 8.762 2.483 1.00 0.00 H ATOM 73 N THR A 6 -3.944 7.923 -0.615 1.00 0.00 N ATOM 74 CA THR A 6 -3.514 7.654 -2.025 1.00 0.00 C ATOM 75 C THR A 6 -2.325 6.692 -2.114 1.00 0.00 C ATOM 76 O THR A 6 -2.359 5.728 -2.852 1.00 0.00 O ATOM 77 CB THR A 6 -3.124 9.025 -2.578 1.00 0.00 C ATOM 78 OG1 THR A 6 -2.688 9.858 -1.511 1.00 0.00 O ATOM 79 CG2 THR A 6 -4.331 9.665 -3.266 1.00 0.00 C ATOM 80 H THR A 6 -3.938 8.841 -0.272 1.00 0.00 H ATOM 81 HA THR A 6 -4.345 7.267 -2.595 1.00 0.00 H ATOM 82 HB THR A 6 -2.325 8.911 -3.295 1.00 0.00 H ATOM 83 HG1 THR A 6 -2.801 10.772 -1.781 1.00 0.00 H ATOM 84 HG21 THR A 6 -4.664 9.027 -4.084 1.00 0.00 H ATOM 85 HG22 THR A 6 -4.050 10.642 -3.659 1.00 0.00 H ATOM 86 HG23 THR A 6 -5.140 9.783 -2.545 1.00 0.00 H ATOM 87 N CYS A 7 -1.270 6.944 -1.395 1.00 0.00 N ATOM 88 CA CYS A 7 -0.089 6.038 -1.483 1.00 0.00 C ATOM 89 C CYS A 7 -0.324 4.763 -0.665 1.00 0.00 C ATOM 90 O CYS A 7 0.465 3.839 -0.702 1.00 0.00 O ATOM 91 CB CYS A 7 1.074 6.848 -0.915 1.00 0.00 C ATOM 92 SG CYS A 7 1.567 8.117 -2.109 1.00 0.00 S ATOM 93 H CYS A 7 -1.246 7.734 -0.815 1.00 0.00 H ATOM 94 HA CYS A 7 0.111 5.786 -2.512 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.766 7.321 -0.002 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.910 6.193 -0.719 1.00 0.00 H ATOM 97 N ALA A 8 -1.403 4.700 0.065 1.00 0.00 N ATOM 98 CA ALA A 8 -1.685 3.478 0.874 1.00 0.00 C ATOM 99 C ALA A 8 -2.034 2.306 -0.049 1.00 0.00 C ATOM 100 O ALA A 8 -1.866 1.155 0.301 1.00 0.00 O ATOM 101 CB ALA A 8 -2.884 3.848 1.746 1.00 0.00 C ATOM 102 H ALA A 8 -2.031 5.452 0.078 1.00 0.00 H ATOM 103 HA ALA A 8 -0.839 3.232 1.496 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.154 2.998 2.373 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.729 4.112 1.110 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.626 4.698 2.378 1.00 0.00 H ATOM 107 N THR A 9 -2.514 2.595 -1.226 1.00 0.00 N ATOM 108 CA THR A 9 -2.871 1.507 -2.183 1.00 0.00 C ATOM 109 C THR A 9 -1.600 0.944 -2.822 1.00 0.00 C ATOM 110 O THR A 9 -1.501 -0.228 -3.122 1.00 0.00 O ATOM 111 CB THR A 9 -3.750 2.183 -3.236 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.969 2.600 -2.635 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.048 1.197 -4.367 1.00 0.00 C ATOM 114 H THR A 9 -2.634 3.531 -1.487 1.00 0.00 H ATOM 115 HA THR A 9 -3.424 0.729 -1.682 1.00 0.00 H ATOM 116 HB THR A 9 -3.235 3.041 -3.638 1.00 0.00 H ATOM 117 HG1 THR A 9 -4.754 3.195 -1.914 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.113 0.878 -4.827 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.675 1.681 -5.116 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.569 0.328 -3.965 1.00 0.00 H ATOM 121 N GLN A 10 -0.629 1.781 -3.029 1.00 0.00 N ATOM 122 CA GLN A 10 0.647 1.314 -3.643 1.00 0.00 C ATOM 123 C GLN A 10 1.309 0.289 -2.719 1.00 0.00 C ATOM 124 O GLN A 10 1.537 -0.843 -3.098 1.00 0.00 O ATOM 125 CB GLN A 10 1.498 2.587 -3.790 1.00 0.00 C ATOM 126 CG GLN A 10 2.979 2.277 -3.549 1.00 0.00 C ATOM 127 CD GLN A 10 3.836 3.450 -4.029 1.00 0.00 C ATOM 128 OE1 GLN A 10 4.775 3.266 -4.777 1.00 0.00 O ATOM 129 NE2 GLN A 10 3.549 4.658 -3.627 1.00 0.00 N ATOM 130 H GLN A 10 -0.738 2.715 -2.772 1.00 0.00 H ATOM 131 HA GLN A 10 0.461 0.877 -4.611 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.376 2.984 -4.787 1.00 0.00 H ATOM 133 HB3 GLN A 10 1.168 3.321 -3.070 1.00 0.00 H ATOM 134 HG2 GLN A 10 3.144 2.118 -2.492 1.00 0.00 H ATOM 135 HG3 GLN A 10 3.255 1.385 -4.093 1.00 0.00 H ATOM 136 HE21 GLN A 10 2.788 4.805 -3.019 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.094 5.419 -3.930 1.00 0.00 H ATOM 138 N ARG A 11 1.591 0.664 -1.502 1.00 0.00 N ATOM 139 CA ARG A 11 2.202 -0.314 -0.567 1.00 0.00 C ATOM 140 C ARG A 11 1.229 -1.474 -0.413 1.00 0.00 C ATOM 141 O ARG A 11 1.606 -2.604 -0.168 1.00 0.00 O ATOM 142 CB ARG A 11 2.379 0.435 0.756 1.00 0.00 C ATOM 143 CG ARG A 11 2.814 -0.549 1.843 1.00 0.00 C ATOM 144 CD ARG A 11 4.272 -0.284 2.218 1.00 0.00 C ATOM 145 NE ARG A 11 5.070 -0.914 1.129 1.00 0.00 N ATOM 146 CZ ARG A 11 5.299 -2.201 1.139 1.00 0.00 C ATOM 147 NH1 ARG A 11 4.815 -2.950 2.093 1.00 0.00 N ATOM 148 NH2 ARG A 11 6.008 -2.741 0.186 1.00 0.00 N ATOM 149 H ARG A 11 1.380 1.571 -1.202 1.00 0.00 H ATOM 150 HA ARG A 11 3.155 -0.658 -0.940 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.135 1.197 0.636 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.445 0.894 1.038 1.00 0.00 H ATOM 153 HG2 ARG A 11 2.187 -0.420 2.715 1.00 0.00 H ATOM 154 HG3 ARG A 11 2.716 -1.560 1.477 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.461 0.781 2.257 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.509 -0.742 3.164 1.00 0.00 H ATOM 157 HE ARG A 11 5.429 -0.360 0.405 1.00 0.00 H ATOM 158 HH11 ARG A 11 4.267 -2.543 2.822 1.00 0.00 H ATOM 159 HH12 ARG A 11 4.998 -3.933 2.095 1.00 0.00 H ATOM 160 HH21 ARG A 11 6.376 -2.172 -0.548 1.00 0.00 H ATOM 161 HH22 ARG A 11 6.186 -3.725 0.192 1.00 0.00 H ATOM 162 N LEU A 12 -0.033 -1.190 -0.584 1.00 0.00 N ATOM 163 CA LEU A 12 -1.067 -2.250 -0.484 1.00 0.00 C ATOM 164 C LEU A 12 -0.873 -3.224 -1.630 1.00 0.00 C ATOM 165 O LEU A 12 -0.722 -4.398 -1.429 1.00 0.00 O ATOM 166 CB LEU A 12 -2.384 -1.486 -0.568 1.00 0.00 C ATOM 167 CG LEU A 12 -3.539 -2.359 -1.073 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.419 -2.606 -2.578 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.548 -3.696 -0.330 1.00 0.00 C ATOM 170 H LEU A 12 -0.300 -0.271 -0.799 1.00 0.00 H ATOM 171 HA LEU A 12 -0.985 -2.754 0.455 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.630 -1.125 0.415 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.255 -0.652 -1.231 1.00 0.00 H ATOM 174 HG LEU A 12 -4.464 -1.837 -0.885 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.250 -3.228 -2.912 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.478 -3.114 -2.789 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.444 -1.653 -3.106 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.605 -4.215 -0.503 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.372 -4.310 -0.695 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.674 -3.518 0.738 1.00 0.00 H ATOM 181 N ALA A 13 -0.814 -2.748 -2.824 1.00 0.00 N ATOM 182 CA ALA A 13 -0.560 -3.661 -3.957 1.00 0.00 C ATOM 183 C ALA A 13 0.680 -4.487 -3.649 1.00 0.00 C ATOM 184 O ALA A 13 0.839 -5.599 -4.107 1.00 0.00 O ATOM 185 CB ALA A 13 -0.262 -2.728 -5.105 1.00 0.00 C ATOM 186 H ALA A 13 -0.900 -1.794 -2.975 1.00 0.00 H ATOM 187 HA ALA A 13 -1.415 -4.280 -4.173 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.057 -3.310 -6.003 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.608 -2.118 -4.862 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.121 -2.081 -5.280 1.00 0.00 H ATOM 191 N ASN A 14 1.547 -3.932 -2.852 1.00 0.00 N ATOM 192 CA ASN A 14 2.783 -4.628 -2.453 1.00 0.00 C ATOM 193 C ASN A 14 2.483 -5.415 -1.197 1.00 0.00 C ATOM 194 O ASN A 14 3.168 -6.357 -0.851 1.00 0.00 O ATOM 195 CB ASN A 14 3.800 -3.520 -2.174 1.00 0.00 C ATOM 196 CG ASN A 14 4.503 -3.134 -3.477 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.513 -3.710 -3.830 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.010 -2.174 -4.210 1.00 0.00 N ATOM 199 H ASN A 14 1.365 -3.051 -2.482 1.00 0.00 H ATOM 200 HA ASN A 14 3.132 -5.273 -3.241 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.290 -2.658 -1.769 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.532 -3.872 -1.464 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.193 -1.708 -3.923 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.456 -1.919 -5.050 1.00 0.00 H ATOM 205 N PHE A 15 1.438 -5.038 -0.515 1.00 0.00 N ATOM 206 CA PHE A 15 1.079 -5.781 0.714 1.00 0.00 C ATOM 207 C PHE A 15 0.104 -6.870 0.305 1.00 0.00 C ATOM 208 O PHE A 15 0.105 -7.980 0.796 1.00 0.00 O ATOM 209 CB PHE A 15 0.444 -4.740 1.673 1.00 0.00 C ATOM 210 CG PHE A 15 -0.939 -5.176 2.158 1.00 0.00 C ATOM 211 CD1 PHE A 15 -1.138 -6.466 2.670 1.00 0.00 C ATOM 212 CD2 PHE A 15 -2.023 -4.286 2.090 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.409 -6.861 3.101 1.00 0.00 C ATOM 214 CE2 PHE A 15 -3.289 -4.682 2.523 1.00 0.00 C ATOM 215 CZ PHE A 15 -3.485 -5.971 3.027 1.00 0.00 C ATOM 216 H PHE A 15 0.869 -4.288 -0.840 1.00 0.00 H ATOM 217 HA PHE A 15 1.962 -6.197 1.142 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.090 -4.613 2.528 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.358 -3.796 1.157 1.00 0.00 H ATOM 220 HD1 PHE A 15 -0.312 -7.159 2.723 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.883 -3.293 1.711 1.00 0.00 H ATOM 222 HE1 PHE A 15 -2.558 -7.853 3.490 1.00 0.00 H ATOM 223 HE2 PHE A 15 -4.118 -3.992 2.459 1.00 0.00 H ATOM 224 HZ PHE A 15 -4.465 -6.279 3.362 1.00 0.00 H ATOM 225 N LEU A 16 -0.719 -6.507 -0.608 1.00 0.00 N ATOM 226 CA LEU A 16 -1.747 -7.401 -1.147 1.00 0.00 C ATOM 227 C LEU A 16 -1.089 -8.516 -1.959 1.00 0.00 C ATOM 228 O LEU A 16 -1.701 -9.520 -2.267 1.00 0.00 O ATOM 229 CB LEU A 16 -2.542 -6.447 -2.028 1.00 0.00 C ATOM 230 CG LEU A 16 -3.920 -7.009 -2.288 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.830 -6.624 -1.123 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.450 -6.407 -3.589 1.00 0.00 C ATOM 233 H LEU A 16 -0.657 -5.592 -0.958 1.00 0.00 H ATOM 234 HA LEU A 16 -2.368 -7.798 -0.364 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.638 -5.498 -1.519 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.027 -6.293 -2.961 1.00 0.00 H ATOM 237 HG LEU A 16 -3.862 -8.082 -2.370 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.830 -7.022 -1.295 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.881 -5.538 -1.045 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.430 -7.036 -0.197 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.502 -5.322 -3.493 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.445 -6.802 -3.794 1.00 0.00 H ATOM 243 HD23 LEU A 16 -3.781 -6.667 -4.409 1.00 0.00 H ATOM 244 N VAL A 17 0.158 -8.348 -2.296 1.00 0.00 N ATOM 245 CA VAL A 17 0.861 -9.403 -3.080 1.00 0.00 C ATOM 246 C VAL A 17 0.733 -10.751 -2.368 1.00 0.00 C ATOM 247 O VAL A 17 0.119 -11.674 -2.869 1.00 0.00 O ATOM 248 CB VAL A 17 2.326 -8.968 -3.126 1.00 0.00 C ATOM 249 CG1 VAL A 17 3.117 -9.932 -4.011 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.417 -7.556 -3.704 1.00 0.00 C ATOM 251 H VAL A 17 0.632 -7.530 -2.033 1.00 0.00 H ATOM 252 HA VAL A 17 0.461 -9.454 -4.075 1.00 0.00 H ATOM 253 HB VAL A 17 2.737 -8.977 -2.126 1.00 0.00 H ATOM 254 HG11 VAL A 17 4.161 -9.622 -4.044 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.704 -9.922 -5.020 1.00 0.00 H ATOM 256 HG13 VAL A 17 3.050 -10.940 -3.601 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.003 -7.548 -4.712 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.461 -7.243 -3.738 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.852 -6.868 -3.075 1.00 0.00 H ATOM 260 N ARG A 18 1.306 -10.870 -1.201 1.00 0.00 N ATOM 261 CA ARG A 18 1.218 -12.156 -0.449 1.00 0.00 C ATOM 262 C ARG A 18 -0.240 -12.616 -0.364 1.00 0.00 C ATOM 263 O ARG A 18 -0.579 -13.711 -0.762 1.00 0.00 O ATOM 264 CB ARG A 18 1.762 -11.836 0.945 1.00 0.00 C ATOM 265 CG ARG A 18 2.970 -12.729 1.240 1.00 0.00 C ATOM 266 CD ARG A 18 2.486 -14.113 1.677 1.00 0.00 C ATOM 267 NE ARG A 18 3.477 -14.569 2.691 1.00 0.00 N ATOM 268 CZ ARG A 18 3.427 -14.111 3.914 1.00 0.00 C ATOM 269 NH1 ARG A 18 2.517 -13.235 4.249 1.00 0.00 N ATOM 270 NH2 ARG A 18 4.288 -14.524 4.802 1.00 0.00 N ATOM 271 H ARG A 18 1.794 -10.112 -0.816 1.00 0.00 H ATOM 272 HA ARG A 18 1.826 -12.911 -0.920 1.00 0.00 H ATOM 273 HB2 ARG A 18 2.062 -10.800 0.985 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.994 -12.019 1.681 1.00 0.00 H ATOM 275 HG2 ARG A 18 3.576 -12.821 0.351 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.557 -12.289 2.032 1.00 0.00 H ATOM 277 HD2 ARG A 18 1.500 -14.042 2.115 1.00 0.00 H ATOM 278 HD3 ARG A 18 2.478 -14.790 0.836 1.00 0.00 H ATOM 279 HE ARG A 18 4.168 -15.220 2.442 1.00 0.00 H ATOM 280 HH11 ARG A 18 1.858 -12.912 3.569 1.00 0.00 H ATOM 281 HH12 ARG A 18 2.480 -12.887 5.185 1.00 0.00 H ATOM 282 HH21 ARG A 18 4.987 -15.193 4.548 1.00 0.00 H ATOM 283 HH22 ARG A 18 4.248 -14.175 5.737 1.00 0.00 H ATOM 284 N SER A 19 -1.105 -11.784 0.151 1.00 0.00 N ATOM 285 CA SER A 19 -2.539 -12.172 0.260 1.00 0.00 C ATOM 286 C SER A 19 -3.430 -10.927 0.200 1.00 0.00 C ATOM 287 O SER A 19 -3.118 -9.909 0.783 1.00 0.00 O ATOM 288 CB SER A 19 -2.664 -12.855 1.620 1.00 0.00 C ATOM 289 OG SER A 19 -1.412 -13.428 1.974 1.00 0.00 O ATOM 290 H SER A 19 -0.812 -10.906 0.463 1.00 0.00 H ATOM 291 HA SER A 19 -2.800 -12.860 -0.526 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.946 -12.131 2.365 1.00 0.00 H ATOM 293 HB3 SER A 19 -3.422 -13.626 1.565 1.00 0.00 H ATOM 294 HG SER A 19 -1.284 -14.215 1.440 1.00 0.00 H HETATM 295 N NH2 A 20 -4.538 -10.969 -0.488 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -5.116 -10.179 -0.533 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -4.791 -11.790 -0.958 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 9 ATOM 1 N LYS A 1 1.492 12.880 3.196 1.00 0.00 N ATOM 2 CA LYS A 1 0.008 12.893 3.341 1.00 0.00 C ATOM 3 C LYS A 1 -0.624 11.858 2.406 1.00 0.00 C ATOM 4 O LYS A 1 -1.647 11.275 2.707 1.00 0.00 O ATOM 5 CB LYS A 1 -0.417 14.305 2.938 1.00 0.00 C ATOM 6 CG LYS A 1 0.014 15.300 4.017 1.00 0.00 C ATOM 7 CD LYS A 1 -0.414 16.712 3.608 1.00 0.00 C ATOM 8 CE LYS A 1 -0.749 17.529 4.859 1.00 0.00 C ATOM 9 NZ LYS A 1 0.548 18.120 5.292 1.00 0.00 N ATOM 10 H1 LYS A 1 1.751 13.216 2.248 1.00 0.00 H ATOM 11 H2 LYS A 1 1.845 11.910 3.330 1.00 0.00 H ATOM 12 H3 LYS A 1 1.916 13.506 3.910 1.00 0.00 H ATOM 13 HA LYS A 1 -0.275 12.701 4.364 1.00 0.00 H ATOM 14 HB2 LYS A 1 0.051 14.567 1.999 1.00 0.00 H ATOM 15 HB3 LYS A 1 -1.491 14.340 2.826 1.00 0.00 H ATOM 16 HG2 LYS A 1 -0.456 15.038 4.955 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.087 15.269 4.128 1.00 0.00 H ATOM 18 HD2 LYS A 1 0.394 17.189 3.071 1.00 0.00 H ATOM 19 HD3 LYS A 1 -1.285 16.656 2.974 1.00 0.00 H ATOM 20 HE2 LYS A 1 -1.459 18.309 4.618 1.00 0.00 H ATOM 21 HE3 LYS A 1 -1.140 16.888 5.634 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.080 17.420 5.846 1.00 0.00 H ATOM 23 HZ2 LYS A 1 0.366 18.961 5.877 1.00 0.00 H ATOM 24 HZ3 LYS A 1 1.101 18.390 4.456 1.00 0.00 H ATOM 25 N CYS A 2 -0.022 11.629 1.272 1.00 0.00 N ATOM 26 CA CYS A 2 -0.584 10.637 0.309 1.00 0.00 C ATOM 27 C CYS A 2 -0.372 9.210 0.824 1.00 0.00 C ATOM 28 O CYS A 2 -1.269 8.391 0.805 1.00 0.00 O ATOM 29 CB CYS A 2 0.205 10.857 -0.984 1.00 0.00 C ATOM 30 SG CYS A 2 -0.479 9.817 -2.299 1.00 0.00 S ATOM 31 H CYS A 2 0.800 12.113 1.049 1.00 0.00 H ATOM 32 HA CYS A 2 -1.633 10.826 0.138 1.00 0.00 H ATOM 33 HB2 CYS A 2 0.136 11.895 -1.275 1.00 0.00 H ATOM 34 HB3 CYS A 2 1.241 10.597 -0.821 1.00 0.00 H ATOM 35 N ASN A 3 0.816 8.907 1.268 1.00 0.00 N ATOM 36 CA ASN A 3 1.110 7.528 1.768 1.00 0.00 C ATOM 37 C ASN A 3 -0.005 7.026 2.689 1.00 0.00 C ATOM 38 O ASN A 3 -0.223 5.839 2.819 1.00 0.00 O ATOM 39 CB ASN A 3 2.417 7.664 2.549 1.00 0.00 C ATOM 40 CG ASN A 3 2.729 6.340 3.250 1.00 0.00 C ATOM 41 OD1 ASN A 3 2.050 5.355 3.042 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.736 6.276 4.077 1.00 0.00 N ATOM 43 H ASN A 3 1.527 9.582 1.260 1.00 0.00 H ATOM 44 HA ASN A 3 1.250 6.847 0.945 1.00 0.00 H ATOM 45 HB2 ASN A 3 3.219 7.912 1.868 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.316 8.445 3.287 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.285 7.075 4.244 1.00 0.00 H ATOM 48 HD22 ASN A 3 3.943 5.428 4.533 1.00 0.00 H ATOM 49 N THR A 4 -0.694 7.913 3.346 1.00 0.00 N ATOM 50 CA THR A 4 -1.769 7.469 4.275 1.00 0.00 C ATOM 51 C THR A 4 -2.975 6.889 3.522 1.00 0.00 C ATOM 52 O THR A 4 -3.361 5.759 3.743 1.00 0.00 O ATOM 53 CB THR A 4 -2.176 8.734 5.033 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.154 9.713 4.903 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.382 8.401 6.511 1.00 0.00 C ATOM 56 H THR A 4 -0.493 8.866 3.244 1.00 0.00 H ATOM 57 HA THR A 4 -1.381 6.742 4.970 1.00 0.00 H ATOM 58 HB THR A 4 -3.097 9.119 4.624 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.512 10.557 5.189 1.00 0.00 H ATOM 60 HG21 THR A 4 -3.167 7.651 6.609 1.00 0.00 H ATOM 61 HG22 THR A 4 -2.672 9.303 7.050 1.00 0.00 H ATOM 62 HG23 THR A 4 -1.454 8.011 6.929 1.00 0.00 H ATOM 63 N ALA A 5 -3.598 7.656 2.666 1.00 0.00 N ATOM 64 CA ALA A 5 -4.803 7.132 1.953 1.00 0.00 C ATOM 65 C ALA A 5 -4.512 6.689 0.508 1.00 0.00 C ATOM 66 O ALA A 5 -4.598 5.521 0.181 1.00 0.00 O ATOM 67 CB ALA A 5 -5.787 8.301 1.953 1.00 0.00 C ATOM 68 H ALA A 5 -3.297 8.576 2.518 1.00 0.00 H ATOM 69 HA ALA A 5 -5.231 6.312 2.507 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.705 8.004 1.447 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.344 9.150 1.432 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.015 8.585 2.980 1.00 0.00 H ATOM 73 N THR A 6 -4.235 7.619 -0.367 1.00 0.00 N ATOM 74 CA THR A 6 -4.014 7.250 -1.809 1.00 0.00 C ATOM 75 C THR A 6 -2.698 6.496 -2.056 1.00 0.00 C ATOM 76 O THR A 6 -2.694 5.463 -2.698 1.00 0.00 O ATOM 77 CB THR A 6 -4.036 8.571 -2.600 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.320 8.399 -3.814 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.396 9.705 -1.796 1.00 0.00 C ATOM 80 H THR A 6 -4.222 8.554 -0.086 1.00 0.00 H ATOM 81 HA THR A 6 -4.837 6.638 -2.144 1.00 0.00 H ATOM 82 HB THR A 6 -5.060 8.832 -2.824 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.858 8.751 -4.528 1.00 0.00 H ATOM 84 HG21 THR A 6 -3.946 9.847 -0.866 1.00 0.00 H ATOM 85 HG22 THR A 6 -3.425 10.626 -2.379 1.00 0.00 H ATOM 86 HG23 THR A 6 -2.360 9.451 -1.570 1.00 0.00 H ATOM 87 N CYS A 7 -1.581 6.983 -1.589 1.00 0.00 N ATOM 88 CA CYS A 7 -0.304 6.251 -1.858 1.00 0.00 C ATOM 89 C CYS A 7 -0.234 4.969 -1.021 1.00 0.00 C ATOM 90 O CYS A 7 0.577 4.100 -1.272 1.00 0.00 O ATOM 91 CB CYS A 7 0.818 7.212 -1.465 1.00 0.00 C ATOM 92 SG CYS A 7 0.992 8.499 -2.726 1.00 0.00 S ATOM 93 H CYS A 7 -1.576 7.821 -1.084 1.00 0.00 H ATOM 94 HA CYS A 7 -0.229 6.011 -2.907 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.584 7.666 -0.525 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.746 6.665 -1.380 1.00 0.00 H ATOM 97 N ALA A 8 -1.076 4.842 -0.033 1.00 0.00 N ATOM 98 CA ALA A 8 -1.051 3.611 0.809 1.00 0.00 C ATOM 99 C ALA A 8 -1.417 2.388 -0.039 1.00 0.00 C ATOM 100 O ALA A 8 -1.073 1.270 0.285 1.00 0.00 O ATOM 101 CB ALA A 8 -2.106 3.850 1.891 1.00 0.00 C ATOM 102 H ALA A 8 -1.724 5.552 0.153 1.00 0.00 H ATOM 103 HA ALA A 8 -0.081 3.482 1.262 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.149 2.986 2.554 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.080 3.998 1.424 1.00 0.00 H ATOM 106 HB3 ALA A 8 -1.842 4.737 2.467 1.00 0.00 H ATOM 107 N THR A 9 -2.112 2.598 -1.123 1.00 0.00 N ATOM 108 CA THR A 9 -2.506 1.455 -1.998 1.00 0.00 C ATOM 109 C THR A 9 -1.275 0.867 -2.697 1.00 0.00 C ATOM 110 O THR A 9 -1.187 -0.319 -2.935 1.00 0.00 O ATOM 111 CB THR A 9 -3.466 2.061 -3.024 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.590 2.611 -2.351 1.00 0.00 O ATOM 113 CG2 THR A 9 -3.929 0.975 -3.997 1.00 0.00 C ATOM 114 H THR A 9 -2.380 3.510 -1.363 1.00 0.00 H ATOM 115 HA THR A 9 -3.012 0.697 -1.424 1.00 0.00 H ATOM 116 HB THR A 9 -2.959 2.838 -3.574 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.297 1.964 -2.376 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.065 0.556 -4.513 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.613 1.408 -4.727 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.440 0.186 -3.445 1.00 0.00 H ATOM 121 N GLN A 10 -0.325 1.692 -3.032 1.00 0.00 N ATOM 122 CA GLN A 10 0.899 1.182 -3.722 1.00 0.00 C ATOM 123 C GLN A 10 1.641 0.207 -2.810 1.00 0.00 C ATOM 124 O GLN A 10 1.835 -0.945 -3.146 1.00 0.00 O ATOM 125 CB GLN A 10 1.751 2.422 -3.996 1.00 0.00 C ATOM 126 CG GLN A 10 1.960 2.580 -5.502 1.00 0.00 C ATOM 127 CD GLN A 10 3.119 1.687 -5.954 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.942 0.506 -6.170 1.00 0.00 O ATOM 129 NE2 GLN A 10 4.305 2.208 -6.108 1.00 0.00 N ATOM 130 H GLN A 10 -0.419 2.643 -2.831 1.00 0.00 H ATOM 131 HA GLN A 10 0.636 0.700 -4.650 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.247 3.296 -3.608 1.00 0.00 H ATOM 133 HB3 GLN A 10 2.709 2.315 -3.510 1.00 0.00 H ATOM 134 HG2 GLN A 10 1.058 2.291 -6.023 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.192 3.609 -5.729 1.00 0.00 H ATOM 136 HE21 GLN A 10 4.448 3.166 -5.935 1.00 0.00 H ATOM 137 HE22 GLN A 10 5.056 1.641 -6.400 1.00 0.00 H ATOM 138 N ARG A 11 2.033 0.644 -1.648 1.00 0.00 N ATOM 139 CA ARG A 11 2.728 -0.281 -0.716 1.00 0.00 C ATOM 140 C ARG A 11 1.766 -1.414 -0.379 1.00 0.00 C ATOM 141 O ARG A 11 2.158 -2.524 -0.082 1.00 0.00 O ATOM 142 CB ARG A 11 3.043 0.553 0.526 1.00 0.00 C ATOM 143 CG ARG A 11 4.375 0.094 1.123 1.00 0.00 C ATOM 144 CD ARG A 11 5.164 1.312 1.605 1.00 0.00 C ATOM 145 NE ARG A 11 6.581 0.859 1.648 1.00 0.00 N ATOM 146 CZ ARG A 11 7.456 1.509 2.370 1.00 0.00 C ATOM 147 NH1 ARG A 11 7.091 2.562 3.053 1.00 0.00 N ATOM 148 NH2 ARG A 11 8.696 1.106 2.407 1.00 0.00 N ATOM 149 H ARG A 11 1.849 1.569 -1.381 1.00 0.00 H ATOM 150 HA ARG A 11 3.634 -0.664 -1.158 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.111 1.595 0.250 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.259 0.424 1.257 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.186 -0.568 1.956 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.946 -0.429 0.371 1.00 0.00 H ATOM 155 HD2 ARG A 11 5.048 2.132 0.910 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.839 1.606 2.591 1.00 0.00 H ATOM 157 HE ARG A 11 6.860 0.072 1.134 1.00 0.00 H ATOM 158 HH11 ARG A 11 6.142 2.873 3.026 1.00 0.00 H ATOM 159 HH12 ARG A 11 7.764 3.056 3.604 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.977 0.302 1.882 1.00 0.00 H ATOM 161 HH22 ARG A 11 9.367 1.602 2.958 1.00 0.00 H ATOM 162 N LEU A 12 0.497 -1.122 -0.442 1.00 0.00 N ATOM 163 CA LEU A 12 -0.538 -2.146 -0.150 1.00 0.00 C ATOM 164 C LEU A 12 -0.566 -3.166 -1.273 1.00 0.00 C ATOM 165 O LEU A 12 -0.500 -4.343 -1.047 1.00 0.00 O ATOM 166 CB LEU A 12 -1.825 -1.333 -0.064 1.00 0.00 C ATOM 167 CG LEU A 12 -3.074 -2.163 -0.388 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.171 -2.447 -1.889 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.041 -3.479 0.383 1.00 0.00 C ATOM 170 H LEU A 12 0.222 -0.216 -0.694 1.00 0.00 H ATOM 171 HA LEU A 12 -0.333 -2.623 0.788 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.916 -0.950 0.938 1.00 0.00 H ATOM 173 HB3 LEU A 12 -1.756 -0.515 -0.756 1.00 0.00 H ATOM 174 HG LEU A 12 -3.941 -1.596 -0.089 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.065 -3.037 -2.091 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.290 -3.002 -2.212 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.227 -1.505 -2.435 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.153 -4.044 0.101 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.931 -4.062 0.147 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.015 -3.273 1.453 1.00 0.00 H ATOM 181 N ALA A 13 -0.613 -2.727 -2.483 1.00 0.00 N ATOM 182 CA ALA A 13 -0.587 -3.685 -3.611 1.00 0.00 C ATOM 183 C ALA A 13 0.633 -4.575 -3.461 1.00 0.00 C ATOM 184 O ALA A 13 0.673 -5.697 -3.923 1.00 0.00 O ATOM 185 CB ALA A 13 -0.417 -2.810 -4.824 1.00 0.00 C ATOM 186 H ALA A 13 -0.632 -1.771 -2.658 1.00 0.00 H ATOM 187 HA ALA A 13 -1.498 -4.258 -3.670 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.386 -3.431 -5.719 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.513 -2.248 -4.740 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.255 -2.116 -4.893 1.00 0.00 H ATOM 191 N ASN A 14 1.624 -4.061 -2.793 1.00 0.00 N ATOM 192 CA ASN A 14 2.861 -4.819 -2.551 1.00 0.00 C ATOM 193 C ASN A 14 2.668 -5.592 -1.267 1.00 0.00 C ATOM 194 O ASN A 14 3.329 -6.578 -1.008 1.00 0.00 O ATOM 195 CB ASN A 14 3.952 -3.759 -2.397 1.00 0.00 C ATOM 196 CG ASN A 14 4.061 -2.945 -3.687 1.00 0.00 C ATOM 197 OD1 ASN A 14 3.869 -3.468 -4.767 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.363 -1.677 -3.620 1.00 0.00 N ATOM 199 H ASN A 14 1.538 -3.170 -2.412 1.00 0.00 H ATOM 200 HA ASN A 14 3.079 -5.476 -3.376 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.702 -3.102 -1.577 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.894 -4.241 -2.197 1.00 0.00 H ATOM 203 HD21 ASN A 14 4.518 -1.255 -2.745 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.437 -1.146 -4.446 1.00 0.00 H ATOM 205 N PHE A 15 1.739 -5.154 -0.461 1.00 0.00 N ATOM 206 CA PHE A 15 1.485 -5.883 0.804 1.00 0.00 C ATOM 207 C PHE A 15 0.386 -6.894 0.529 1.00 0.00 C ATOM 208 O PHE A 15 0.340 -7.985 1.059 1.00 0.00 O ATOM 209 CB PHE A 15 1.065 -4.803 1.836 1.00 0.00 C ATOM 210 CG PHE A 15 -0.267 -5.137 2.503 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.500 -6.413 3.037 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.274 -4.163 2.580 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.727 -6.708 3.637 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.498 -4.459 3.183 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.728 -5.732 3.711 1.00 0.00 C ATOM 216 H PHE A 15 1.185 -4.364 -0.713 1.00 0.00 H ATOM 217 HA PHE A 15 2.381 -6.368 1.112 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.826 -4.729 2.595 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.979 -3.851 1.331 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.268 -7.169 2.981 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.106 -3.182 2.179 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.905 -7.689 4.038 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.268 -3.703 3.231 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.674 -5.962 4.176 1.00 0.00 H ATOM 225 N LEU A 16 -0.497 -6.484 -0.306 1.00 0.00 N ATOM 226 CA LEU A 16 -1.654 -7.298 -0.701 1.00 0.00 C ATOM 227 C LEU A 16 -1.211 -8.425 -1.630 1.00 0.00 C ATOM 228 O LEU A 16 -1.945 -9.359 -1.891 1.00 0.00 O ATOM 229 CB LEU A 16 -2.500 -6.268 -1.433 1.00 0.00 C ATOM 230 CG LEU A 16 -3.940 -6.717 -1.486 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.627 -6.315 -0.182 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.615 -6.026 -2.669 1.00 0.00 C ATOM 233 H LEU A 16 -0.400 -5.589 -0.691 1.00 0.00 H ATOM 234 HA LEU A 16 -2.182 -7.677 0.158 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.443 -5.329 -0.905 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.124 -6.133 -2.432 1.00 0.00 H ATOM 237 HG LEU A 16 -3.979 -7.787 -1.608 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.669 -6.634 -0.207 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.581 -5.232 -0.065 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.121 -6.792 0.658 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.566 -4.945 -2.536 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.658 -6.337 -2.725 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.104 -6.302 -3.591 1.00 0.00 H ATOM 244 N VAL A 17 -0.012 -8.344 -2.130 1.00 0.00 N ATOM 245 CA VAL A 17 0.486 -9.409 -3.044 1.00 0.00 C ATOM 246 C VAL A 17 0.251 -10.788 -2.424 1.00 0.00 C ATOM 247 O VAL A 17 -0.402 -11.636 -2.999 1.00 0.00 O ATOM 248 CB VAL A 17 1.984 -9.143 -3.190 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.591 -10.169 -4.147 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.201 -7.738 -3.747 1.00 0.00 C ATOM 251 H VAL A 17 0.561 -7.580 -1.906 1.00 0.00 H ATOM 252 HA VAL A 17 0.004 -9.333 -4.002 1.00 0.00 H ATOM 253 HB VAL A 17 2.461 -9.228 -2.223 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.659 -9.981 -4.252 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.110 -10.086 -5.122 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.437 -11.172 -3.750 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.721 -7.655 -4.722 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.269 -7.549 -3.851 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.767 -7.006 -3.066 1.00 0.00 H ATOM 260 N ARG A 18 0.778 -11.018 -1.251 1.00 0.00 N ATOM 261 CA ARG A 18 0.584 -12.343 -0.594 1.00 0.00 C ATOM 262 C ARG A 18 -0.902 -12.583 -0.314 1.00 0.00 C ATOM 263 O ARG A 18 -1.344 -13.706 -0.178 1.00 0.00 O ATOM 264 CB ARG A 18 1.366 -12.252 0.717 1.00 0.00 C ATOM 265 CG ARG A 18 0.868 -11.052 1.525 1.00 0.00 C ATOM 266 CD ARG A 18 0.981 -11.360 3.020 1.00 0.00 C ATOM 267 NE ARG A 18 1.453 -10.092 3.641 1.00 0.00 N ATOM 268 CZ ARG A 18 1.469 -9.965 4.941 1.00 0.00 C ATOM 269 NH1 ARG A 18 1.063 -10.945 5.703 1.00 0.00 N ATOM 270 NH2 ARG A 18 1.891 -8.855 5.480 1.00 0.00 N ATOM 271 H ARG A 18 1.302 -10.321 -0.804 1.00 0.00 H ATOM 272 HA ARG A 18 0.987 -13.134 -1.208 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.218 -13.157 1.288 1.00 0.00 H ATOM 274 HB3 ARG A 18 2.416 -12.128 0.503 1.00 0.00 H ATOM 275 HG2 ARG A 18 1.469 -10.185 1.289 1.00 0.00 H ATOM 276 HG3 ARG A 18 -0.164 -10.853 1.278 1.00 0.00 H ATOM 277 HD2 ARG A 18 0.017 -11.644 3.418 1.00 0.00 H ATOM 278 HD3 ARG A 18 1.703 -12.144 3.187 1.00 0.00 H ATOM 279 HE ARG A 18 1.754 -9.352 3.073 1.00 0.00 H ATOM 280 HH11 ARG A 18 0.739 -11.797 5.294 1.00 0.00 H ATOM 281 HH12 ARG A 18 1.078 -10.843 6.697 1.00 0.00 H ATOM 282 HH21 ARG A 18 2.199 -8.101 4.899 1.00 0.00 H ATOM 283 HH22 ARG A 18 1.905 -8.756 6.476 1.00 0.00 H ATOM 284 N SER A 19 -1.673 -11.535 -0.228 1.00 0.00 N ATOM 285 CA SER A 19 -3.128 -11.701 0.044 1.00 0.00 C ATOM 286 C SER A 19 -3.890 -11.925 -1.266 1.00 0.00 C ATOM 287 O SER A 19 -3.313 -12.304 -2.265 1.00 0.00 O ATOM 288 CB SER A 19 -3.560 -10.391 0.699 1.00 0.00 C ATOM 289 OG SER A 19 -3.544 -10.544 2.112 1.00 0.00 O ATOM 290 H SER A 19 -1.297 -10.639 -0.340 1.00 0.00 H ATOM 291 HA SER A 19 -3.291 -12.523 0.720 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.879 -9.605 0.420 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.557 -10.133 0.367 1.00 0.00 H ATOM 294 HG SER A 19 -4.367 -10.193 2.458 1.00 0.00 H HETATM 295 N NH2 A 20 -5.174 -11.699 -1.303 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -5.671 -11.836 -2.136 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -5.641 -11.393 -0.498 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 10 ATOM 1 N LYS A 1 0.540 13.134 3.474 1.00 0.00 N ATOM 2 CA LYS A 1 0.804 11.699 3.780 1.00 0.00 C ATOM 3 C LYS A 1 0.150 10.808 2.720 1.00 0.00 C ATOM 4 O LYS A 1 -0.731 10.025 3.012 1.00 0.00 O ATOM 5 CB LYS A 1 0.169 11.460 5.149 1.00 0.00 C ATOM 6 CG LYS A 1 1.192 10.809 6.081 1.00 0.00 C ATOM 7 CD LYS A 1 1.373 11.676 7.328 1.00 0.00 C ATOM 8 CE LYS A 1 2.589 11.188 8.118 1.00 0.00 C ATOM 9 NZ LYS A 1 2.353 11.658 9.512 1.00 0.00 N ATOM 10 H1 LYS A 1 -0.305 13.449 3.989 1.00 0.00 H ATOM 11 H2 LYS A 1 0.386 13.247 2.452 1.00 0.00 H ATOM 12 H3 LYS A 1 1.356 13.708 3.768 1.00 0.00 H ATOM 13 HA LYS A 1 1.865 11.511 3.828 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.149 12.405 5.568 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.686 10.808 5.043 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.841 9.828 6.371 1.00 0.00 H ATOM 17 HG3 LYS A 1 2.137 10.716 5.569 1.00 0.00 H ATOM 18 HD2 LYS A 1 1.525 12.705 7.032 1.00 0.00 H ATOM 19 HD3 LYS A 1 0.492 11.606 7.948 1.00 0.00 H ATOM 20 HE2 LYS A 1 2.648 10.108 8.086 1.00 0.00 H ATOM 21 HE3 LYS A 1 3.493 11.629 7.728 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.913 12.599 9.491 1.00 0.00 H ATOM 23 HZ2 LYS A 1 3.260 11.708 10.020 1.00 0.00 H ATOM 24 HZ3 LYS A 1 1.718 10.993 9.999 1.00 0.00 H ATOM 25 N CYS A 2 0.574 10.924 1.492 1.00 0.00 N ATOM 26 CA CYS A 2 -0.023 10.087 0.414 1.00 0.00 C ATOM 27 C CYS A 2 -0.075 8.621 0.847 1.00 0.00 C ATOM 28 O CYS A 2 -1.084 7.958 0.707 1.00 0.00 O ATOM 29 CB CYS A 2 0.913 10.251 -0.785 1.00 0.00 C ATOM 30 SG CYS A 2 0.152 9.507 -2.251 1.00 0.00 S ATOM 31 H CYS A 2 1.286 11.565 1.279 1.00 0.00 H ATOM 32 HA CYS A 2 -1.010 10.443 0.162 1.00 0.00 H ATOM 33 HB2 CYS A 2 1.087 11.303 -0.965 1.00 0.00 H ATOM 34 HB3 CYS A 2 1.852 9.761 -0.579 1.00 0.00 H ATOM 35 N ASN A 3 1.007 8.107 1.363 1.00 0.00 N ATOM 36 CA ASN A 3 1.023 6.678 1.792 1.00 0.00 C ATOM 37 C ASN A 3 -0.236 6.354 2.594 1.00 0.00 C ATOM 38 O ASN A 3 -0.709 5.235 2.601 1.00 0.00 O ATOM 39 CB ASN A 3 2.267 6.546 2.672 1.00 0.00 C ATOM 40 CG ASN A 3 2.775 5.104 2.633 1.00 0.00 C ATOM 41 OD1 ASN A 3 1.995 4.175 2.564 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.059 4.877 2.676 1.00 0.00 N ATOM 43 H ASN A 3 1.813 8.657 1.460 1.00 0.00 H ATOM 44 HA ASN A 3 1.106 6.027 0.938 1.00 0.00 H ATOM 45 HB2 ASN A 3 3.038 7.209 2.307 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.018 6.810 3.689 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.689 5.632 2.733 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.395 3.953 2.649 1.00 0.00 H ATOM 49 N THR A 4 -0.777 7.319 3.276 1.00 0.00 N ATOM 50 CA THR A 4 -2.001 7.064 4.085 1.00 0.00 C ATOM 51 C THR A 4 -3.229 6.851 3.192 1.00 0.00 C ATOM 52 O THR A 4 -3.894 5.838 3.271 1.00 0.00 O ATOM 53 CB THR A 4 -2.177 8.321 4.938 1.00 0.00 C ATOM 54 OG1 THR A 4 -0.977 8.577 5.656 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.329 8.116 5.922 1.00 0.00 C ATOM 56 H THR A 4 -0.376 8.214 3.262 1.00 0.00 H ATOM 57 HA THR A 4 -1.852 6.209 4.726 1.00 0.00 H ATOM 58 HB THR A 4 -2.400 9.161 4.299 1.00 0.00 H ATOM 59 HG1 THR A 4 -0.707 7.761 6.081 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.249 7.921 5.370 1.00 0.00 H ATOM 61 HG22 THR A 4 -3.453 9.013 6.529 1.00 0.00 H ATOM 62 HG23 THR A 4 -3.108 7.267 6.569 1.00 0.00 H ATOM 63 N ALA A 5 -3.560 7.813 2.373 1.00 0.00 N ATOM 64 CA ALA A 5 -4.776 7.673 1.516 1.00 0.00 C ATOM 65 C ALA A 5 -4.449 7.274 0.067 1.00 0.00 C ATOM 66 O ALA A 5 -4.793 6.198 -0.379 1.00 0.00 O ATOM 67 CB ALA A 5 -5.427 9.056 1.546 1.00 0.00 C ATOM 68 H ALA A 5 -3.031 8.637 2.343 1.00 0.00 H ATOM 69 HA ALA A 5 -5.450 6.954 1.950 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.332 9.045 0.939 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.731 9.794 1.147 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.682 9.316 2.573 1.00 0.00 H ATOM 73 N THR A 6 -3.841 8.154 -0.687 1.00 0.00 N ATOM 74 CA THR A 6 -3.560 7.846 -2.127 1.00 0.00 C ATOM 75 C THR A 6 -2.455 6.797 -2.313 1.00 0.00 C ATOM 76 O THR A 6 -2.626 5.843 -3.047 1.00 0.00 O ATOM 77 CB THR A 6 -3.123 9.179 -2.742 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.061 10.177 -1.731 1.00 0.00 O ATOM 79 CG2 THR A 6 -4.129 9.599 -3.814 1.00 0.00 C ATOM 80 H THR A 6 -3.611 9.035 -0.322 1.00 0.00 H ATOM 81 HA THR A 6 -4.463 7.514 -2.612 1.00 0.00 H ATOM 82 HB THR A 6 -2.151 9.064 -3.195 1.00 0.00 H ATOM 83 HG1 THR A 6 -2.674 10.966 -2.119 1.00 0.00 H ATOM 84 HG21 THR A 6 -4.171 8.837 -4.592 1.00 0.00 H ATOM 85 HG22 THR A 6 -3.819 10.548 -4.252 1.00 0.00 H ATOM 86 HG23 THR A 6 -5.115 9.713 -3.363 1.00 0.00 H ATOM 87 N CYS A 7 -1.323 6.962 -1.691 1.00 0.00 N ATOM 88 CA CYS A 7 -0.229 5.962 -1.889 1.00 0.00 C ATOM 89 C CYS A 7 -0.434 4.750 -0.979 1.00 0.00 C ATOM 90 O CYS A 7 0.274 3.766 -1.076 1.00 0.00 O ATOM 91 CB CYS A 7 1.067 6.694 -1.536 1.00 0.00 C ATOM 92 SG CYS A 7 1.394 7.993 -2.759 1.00 0.00 S ATOM 93 H CYS A 7 -1.183 7.741 -1.113 1.00 0.00 H ATOM 94 HA CYS A 7 -0.199 5.649 -2.921 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.975 7.134 -0.561 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.886 5.991 -1.536 1.00 0.00 H ATOM 97 N ALA A 8 -1.399 4.802 -0.102 1.00 0.00 N ATOM 98 CA ALA A 8 -1.641 3.639 0.800 1.00 0.00 C ATOM 99 C ALA A 8 -1.900 2.381 -0.032 1.00 0.00 C ATOM 100 O ALA A 8 -1.484 1.295 0.318 1.00 0.00 O ATOM 101 CB ALA A 8 -2.880 4.015 1.611 1.00 0.00 C ATOM 102 H ALA A 8 -1.965 5.598 -0.040 1.00 0.00 H ATOM 103 HA ALA A 8 -0.799 3.489 1.457 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.123 3.206 2.300 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.720 4.181 0.936 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.683 4.926 2.176 1.00 0.00 H ATOM 107 N THR A 9 -2.579 2.524 -1.138 1.00 0.00 N ATOM 108 CA THR A 9 -2.863 1.344 -2.007 1.00 0.00 C ATOM 109 C THR A 9 -1.572 0.870 -2.680 1.00 0.00 C ATOM 110 O THR A 9 -1.375 -0.303 -2.925 1.00 0.00 O ATOM 111 CB THR A 9 -3.856 1.852 -3.054 1.00 0.00 C ATOM 112 OG1 THR A 9 -3.396 3.090 -3.577 1.00 0.00 O ATOM 113 CG2 THR A 9 -5.228 2.048 -2.407 1.00 0.00 C ATOM 114 H THR A 9 -2.898 3.412 -1.405 1.00 0.00 H ATOM 115 HA THR A 9 -3.308 0.548 -1.432 1.00 0.00 H ATOM 116 HB THR A 9 -3.938 1.130 -3.852 1.00 0.00 H ATOM 117 HG1 THR A 9 -3.823 3.797 -3.087 1.00 0.00 H ATOM 118 HG21 THR A 9 -5.580 1.098 -2.005 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.934 2.410 -3.154 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.149 2.776 -1.600 1.00 0.00 H ATOM 121 N GLN A 10 -0.692 1.778 -2.985 1.00 0.00 N ATOM 122 CA GLN A 10 0.589 1.391 -3.648 1.00 0.00 C ATOM 123 C GLN A 10 1.374 0.437 -2.749 1.00 0.00 C ATOM 124 O GLN A 10 1.671 -0.677 -3.126 1.00 0.00 O ATOM 125 CB GLN A 10 1.350 2.703 -3.842 1.00 0.00 C ATOM 126 CG GLN A 10 1.671 2.894 -5.326 1.00 0.00 C ATOM 127 CD GLN A 10 3.052 2.311 -5.632 1.00 0.00 C ATOM 128 OE1 GLN A 10 4.013 3.039 -5.776 1.00 0.00 O ATOM 129 NE2 GLN A 10 3.190 1.017 -5.739 1.00 0.00 N ATOM 130 H GLN A 10 -0.876 2.715 -2.777 1.00 0.00 H ATOM 131 HA GLN A 10 0.394 0.929 -4.603 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.743 3.527 -3.496 1.00 0.00 H ATOM 133 HB3 GLN A 10 2.271 2.672 -3.278 1.00 0.00 H ATOM 134 HG2 GLN A 10 0.924 2.390 -5.922 1.00 0.00 H ATOM 135 HG3 GLN A 10 1.669 3.948 -5.561 1.00 0.00 H ATOM 136 HE21 GLN A 10 2.411 0.429 -5.622 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.075 0.635 -5.937 1.00 0.00 H ATOM 138 N ARG A 11 1.689 0.852 -1.554 1.00 0.00 N ATOM 139 CA ARG A 11 2.426 -0.060 -0.640 1.00 0.00 C ATOM 140 C ARG A 11 1.520 -1.244 -0.322 1.00 0.00 C ATOM 141 O ARG A 11 1.966 -2.340 -0.045 1.00 0.00 O ATOM 142 CB ARG A 11 2.708 0.760 0.620 1.00 0.00 C ATOM 143 CG ARG A 11 3.295 -0.151 1.699 1.00 0.00 C ATOM 144 CD ARG A 11 4.589 -0.788 1.185 1.00 0.00 C ATOM 145 NE ARG A 11 5.215 -1.410 2.385 1.00 0.00 N ATOM 146 CZ ARG A 11 6.477 -1.754 2.365 1.00 0.00 C ATOM 147 NH1 ARG A 11 7.193 -1.562 1.290 1.00 0.00 N ATOM 148 NH2 ARG A 11 7.021 -2.288 3.424 1.00 0.00 N ATOM 149 H ARG A 11 1.424 1.746 -1.256 1.00 0.00 H ATOM 150 HA ARG A 11 3.348 -0.393 -1.089 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.414 1.544 0.385 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.789 1.197 0.980 1.00 0.00 H ATOM 153 HG2 ARG A 11 3.507 0.430 2.585 1.00 0.00 H ATOM 154 HG3 ARG A 11 2.586 -0.928 1.940 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.365 -1.542 0.440 1.00 0.00 H ATOM 156 HD3 ARG A 11 5.244 -0.036 0.776 1.00 0.00 H ATOM 157 HE ARG A 11 4.681 -1.562 3.192 1.00 0.00 H ATOM 158 HH11 ARG A 11 6.779 -1.152 0.478 1.00 0.00 H ATOM 159 HH12 ARG A 11 8.159 -1.824 1.281 1.00 0.00 H ATOM 160 HH21 ARG A 11 6.473 -2.438 4.247 1.00 0.00 H ATOM 161 HH22 ARG A 11 7.987 -2.550 3.412 1.00 0.00 H ATOM 162 N LEU A 12 0.239 -1.015 -0.375 1.00 0.00 N ATOM 163 CA LEU A 12 -0.739 -2.098 -0.097 1.00 0.00 C ATOM 164 C LEU A 12 -0.730 -3.083 -1.251 1.00 0.00 C ATOM 165 O LEU A 12 -0.606 -4.261 -1.058 1.00 0.00 O ATOM 166 CB LEU A 12 -2.062 -1.355 0.039 1.00 0.00 C ATOM 167 CG LEU A 12 -3.275 -2.219 -0.333 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.363 -2.419 -1.847 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.187 -3.575 0.364 1.00 0.00 C ATOM 170 H LEU A 12 -0.084 -0.119 -0.610 1.00 0.00 H ATOM 171 HA LEU A 12 -0.488 -2.591 0.820 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.166 -1.040 1.064 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.032 -0.495 -0.598 1.00 0.00 H ATOM 174 HG LEU A 12 -4.165 -1.705 -0.005 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.231 -3.035 -2.083 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.459 -2.915 -2.202 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.461 -1.450 -2.337 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.276 -4.086 0.053 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.052 -4.180 0.093 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.170 -3.429 1.444 1.00 0.00 H ATOM 181 N ALA A 13 -0.813 -2.616 -2.449 1.00 0.00 N ATOM 182 CA ALA A 13 -0.755 -3.544 -3.600 1.00 0.00 C ATOM 183 C ALA A 13 0.515 -4.374 -3.491 1.00 0.00 C ATOM 184 O ALA A 13 0.606 -5.480 -3.981 1.00 0.00 O ATOM 185 CB ALA A 13 -0.656 -2.632 -4.796 1.00 0.00 C ATOM 186 H ALA A 13 -0.881 -1.657 -2.597 1.00 0.00 H ATOM 187 HA ALA A 13 -1.633 -4.164 -3.658 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.607 -3.230 -5.706 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.243 -2.021 -4.714 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.532 -1.985 -4.833 1.00 0.00 H ATOM 191 N ASN A 14 1.489 -3.830 -2.822 1.00 0.00 N ATOM 192 CA ASN A 14 2.765 -4.536 -2.621 1.00 0.00 C ATOM 193 C ASN A 14 2.624 -5.357 -1.358 1.00 0.00 C ATOM 194 O ASN A 14 3.332 -6.318 -1.136 1.00 0.00 O ATOM 195 CB ASN A 14 3.813 -3.437 -2.452 1.00 0.00 C ATOM 196 CG ASN A 14 4.162 -2.851 -3.821 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.723 -3.528 -4.659 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.850 -1.613 -4.086 1.00 0.00 N ATOM 199 H ASN A 14 1.367 -2.956 -2.417 1.00 0.00 H ATOM 200 HA ASN A 14 2.998 -5.161 -3.468 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.416 -2.656 -1.817 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.702 -3.850 -2.003 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.394 -1.065 -3.408 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.071 -1.227 -4.964 1.00 0.00 H ATOM 205 N PHE A 15 1.680 -4.991 -0.534 1.00 0.00 N ATOM 206 CA PHE A 15 1.471 -5.771 0.707 1.00 0.00 C ATOM 207 C PHE A 15 0.419 -6.825 0.399 1.00 0.00 C ATOM 208 O PHE A 15 0.423 -7.931 0.901 1.00 0.00 O ATOM 209 CB PHE A 15 1.003 -4.747 1.771 1.00 0.00 C ATOM 210 CG PHE A 15 -0.306 -5.170 2.432 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.464 -6.469 2.935 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.366 -4.258 2.534 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.670 -6.850 3.530 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.570 -4.638 3.130 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.725 -5.936 3.629 1.00 0.00 C ATOM 216 H PHE A 15 1.083 -4.224 -0.759 1.00 0.00 H ATOM 217 HA PHE A 15 2.393 -6.221 0.996 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.765 -4.657 2.531 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.865 -3.786 1.297 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.346 -7.179 2.859 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.257 -3.259 2.158 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.789 -7.851 3.907 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.383 -3.928 3.200 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.656 -6.231 4.090 1.00 0.00 H ATOM 225 N LEU A 16 -0.479 -6.437 -0.432 1.00 0.00 N ATOM 226 CA LEU A 16 -1.594 -7.293 -0.855 1.00 0.00 C ATOM 227 C LEU A 16 -1.102 -8.359 -1.833 1.00 0.00 C ATOM 228 O LEU A 16 -1.793 -9.313 -2.130 1.00 0.00 O ATOM 229 CB LEU A 16 -2.499 -6.282 -1.540 1.00 0.00 C ATOM 230 CG LEU A 16 -3.911 -6.812 -1.608 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.626 -6.460 -0.305 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.620 -6.156 -2.792 1.00 0.00 C ATOM 233 H LEU A 16 -0.424 -5.527 -0.790 1.00 0.00 H ATOM 234 HA LEU A 16 -2.095 -7.734 -0.010 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.493 -5.363 -0.972 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.137 -6.082 -2.533 1.00 0.00 H ATOM 237 HG LEU A 16 -3.887 -7.882 -1.736 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.648 -6.836 -0.338 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.642 -5.377 -0.180 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.099 -6.915 0.534 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.635 -5.075 -2.653 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.642 -6.528 -2.856 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.089 -6.396 -3.713 1.00 0.00 H ATOM 244 N VAL A 17 0.091 -8.203 -2.332 1.00 0.00 N ATOM 245 CA VAL A 17 0.632 -9.207 -3.287 1.00 0.00 C ATOM 246 C VAL A 17 0.462 -10.616 -2.716 1.00 0.00 C ATOM 247 O VAL A 17 -0.070 -11.499 -3.358 1.00 0.00 O ATOM 248 CB VAL A 17 2.117 -8.868 -3.428 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.767 -9.820 -4.434 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.268 -7.430 -3.921 1.00 0.00 C ATOM 251 H VAL A 17 0.630 -7.424 -2.078 1.00 0.00 H ATOM 252 HA VAL A 17 0.142 -9.118 -4.241 1.00 0.00 H ATOM 253 HB VAL A 17 2.602 -8.975 -2.470 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.825 -9.577 -4.533 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.278 -9.715 -5.403 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.662 -10.847 -4.084 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.778 -7.324 -4.889 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.326 -7.189 -4.021 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.807 -6.750 -3.205 1.00 0.00 H ATOM 260 N ARG A 18 0.914 -10.830 -1.510 1.00 0.00 N ATOM 261 CA ARG A 18 0.787 -12.173 -0.886 1.00 0.00 C ATOM 262 C ARG A 18 -0.594 -12.329 -0.244 1.00 0.00 C ATOM 263 O ARG A 18 -1.241 -13.350 -0.375 1.00 0.00 O ATOM 264 CB ARG A 18 1.884 -12.202 0.176 1.00 0.00 C ATOM 265 CG ARG A 18 2.246 -13.649 0.507 1.00 0.00 C ATOM 266 CD ARG A 18 2.532 -13.762 2.004 1.00 0.00 C ATOM 267 NE ARG A 18 3.121 -15.119 2.186 1.00 0.00 N ATOM 268 CZ ARG A 18 4.382 -15.331 1.918 1.00 0.00 C ATOM 269 NH1 ARG A 18 5.134 -14.360 1.470 1.00 0.00 N ATOM 270 NH2 ARG A 18 4.892 -16.519 2.096 1.00 0.00 N ATOM 271 H ARG A 18 1.340 -10.103 -1.011 1.00 0.00 H ATOM 272 HA ARG A 18 0.958 -12.947 -1.615 1.00 0.00 H ATOM 273 HB2 ARG A 18 2.758 -11.688 -0.196 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.532 -11.710 1.071 1.00 0.00 H ATOM 275 HG2 ARG A 18 1.422 -14.295 0.244 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.126 -13.937 -0.049 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.235 -12.998 2.310 1.00 0.00 H ATOM 278 HD3 ARG A 18 1.616 -13.676 2.564 1.00 0.00 H ATOM 279 HE ARG A 18 2.561 -15.853 2.516 1.00 0.00 H ATOM 280 HH11 ARG A 18 4.747 -13.451 1.330 1.00 0.00 H ATOM 281 HH12 ARG A 18 6.098 -14.530 1.267 1.00 0.00 H ATOM 282 HH21 ARG A 18 4.318 -17.264 2.435 1.00 0.00 H ATOM 283 HH22 ARG A 18 5.859 -16.683 1.894 1.00 0.00 H ATOM 284 N SER A 19 -1.051 -11.322 0.450 1.00 0.00 N ATOM 285 CA SER A 19 -2.390 -11.408 1.102 1.00 0.00 C ATOM 286 C SER A 19 -3.497 -11.377 0.045 1.00 0.00 C ATOM 287 O SER A 19 -3.744 -10.359 -0.571 1.00 0.00 O ATOM 288 CB SER A 19 -2.472 -10.173 1.999 1.00 0.00 C ATOM 289 OG SER A 19 -1.157 -9.768 2.360 1.00 0.00 O ATOM 290 H SER A 19 -0.514 -10.508 0.543 1.00 0.00 H ATOM 291 HA SER A 19 -2.462 -12.303 1.700 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.958 -9.372 1.471 1.00 0.00 H ATOM 293 HB3 SER A 19 -3.043 -10.413 2.888 1.00 0.00 H ATOM 294 HG SER A 19 -0.675 -10.546 2.649 1.00 0.00 H HETATM 295 N NH2 A 20 -4.184 -12.460 -0.191 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.896 -12.452 -0.865 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -3.989 -13.283 0.305 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 11 ATOM 1 N LYS A 1 1.370 13.578 2.216 1.00 0.00 N ATOM 2 CA LYS A 1 0.557 12.715 3.123 1.00 0.00 C ATOM 3 C LYS A 1 -0.147 11.619 2.321 1.00 0.00 C ATOM 4 O LYS A 1 -1.172 11.104 2.723 1.00 0.00 O ATOM 5 CB LYS A 1 -0.469 13.656 3.755 1.00 0.00 C ATOM 6 CG LYS A 1 -0.086 13.925 5.211 1.00 0.00 C ATOM 7 CD LYS A 1 0.506 15.331 5.330 1.00 0.00 C ATOM 8 CE LYS A 1 2.026 15.234 5.486 1.00 0.00 C ATOM 9 NZ LYS A 1 2.248 14.994 6.939 1.00 0.00 N ATOM 10 H1 LYS A 1 2.351 13.233 2.197 1.00 0.00 H ATOM 11 H2 LYS A 1 1.353 14.557 2.563 1.00 0.00 H ATOM 12 H3 LYS A 1 0.974 13.541 1.256 1.00 0.00 H ATOM 13 HA LYS A 1 1.179 12.281 3.889 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.490 14.587 3.207 1.00 0.00 H ATOM 15 HB3 LYS A 1 -1.446 13.198 3.721 1.00 0.00 H ATOM 16 HG2 LYS A 1 -0.964 13.851 5.835 1.00 0.00 H ATOM 17 HG3 LYS A 1 0.647 13.201 5.531 1.00 0.00 H ATOM 18 HD2 LYS A 1 0.270 15.896 4.440 1.00 0.00 H ATOM 19 HD3 LYS A 1 0.087 15.826 6.193 1.00 0.00 H ATOM 20 HE2 LYS A 1 2.411 14.409 4.902 1.00 0.00 H ATOM 21 HE3 LYS A 1 2.495 16.159 5.188 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.738 14.135 7.231 1.00 0.00 H ATOM 23 HZ2 LYS A 1 1.897 15.809 7.483 1.00 0.00 H ATOM 24 HZ3 LYS A 1 3.264 14.868 7.117 1.00 0.00 H ATOM 25 N CYS A 2 0.394 11.259 1.189 1.00 0.00 N ATOM 26 CA CYS A 2 -0.248 10.195 0.364 1.00 0.00 C ATOM 27 C CYS A 2 -0.136 8.843 1.073 1.00 0.00 C ATOM 28 O CYS A 2 -0.953 7.964 0.887 1.00 0.00 O ATOM 29 CB CYS A 2 0.537 10.184 -0.951 1.00 0.00 C ATOM 30 SG CYS A 2 2.186 9.490 -0.675 1.00 0.00 S ATOM 31 H CYS A 2 1.221 11.686 0.882 1.00 0.00 H ATOM 32 HA CYS A 2 -1.281 10.438 0.174 1.00 0.00 H ATOM 33 HB2 CYS A 2 0.013 9.581 -1.675 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.629 11.193 -1.324 1.00 0.00 H ATOM 35 N ASN A 3 0.875 8.670 1.883 1.00 0.00 N ATOM 36 CA ASN A 3 1.046 7.374 2.604 1.00 0.00 C ATOM 37 C ASN A 3 -0.286 6.914 3.196 1.00 0.00 C ATOM 38 O ASN A 3 -0.576 5.736 3.262 1.00 0.00 O ATOM 39 CB ASN A 3 2.048 7.676 3.718 1.00 0.00 C ATOM 40 CG ASN A 3 3.230 6.710 3.617 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.357 7.126 3.434 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.021 5.427 3.729 1.00 0.00 N ATOM 43 H ASN A 3 1.524 9.392 2.014 1.00 0.00 H ATOM 44 HA ASN A 3 1.449 6.619 1.948 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.402 8.692 3.618 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.568 7.555 4.677 1.00 0.00 H ATOM 47 HD21 ASN A 3 2.108 5.090 3.879 1.00 0.00 H ATOM 48 HD22 ASN A 3 3.775 4.799 3.664 1.00 0.00 H ATOM 49 N THR A 4 -1.094 7.835 3.639 1.00 0.00 N ATOM 50 CA THR A 4 -2.403 7.452 4.241 1.00 0.00 C ATOM 51 C THR A 4 -3.395 6.949 3.181 1.00 0.00 C ATOM 52 O THR A 4 -3.897 5.846 3.271 1.00 0.00 O ATOM 53 CB THR A 4 -2.920 8.739 4.889 1.00 0.00 C ATOM 54 OG1 THR A 4 -2.207 8.980 6.096 1.00 0.00 O ATOM 55 CG2 THR A 4 -4.412 8.598 5.199 1.00 0.00 C ATOM 56 H THR A 4 -0.838 8.779 3.585 1.00 0.00 H ATOM 57 HA THR A 4 -2.256 6.701 4.999 1.00 0.00 H ATOM 58 HB THR A 4 -2.775 9.566 4.214 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.275 8.822 5.925 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.960 8.414 4.275 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.776 9.516 5.660 1.00 0.00 H ATOM 62 HG23 THR A 4 -4.564 7.763 5.883 1.00 0.00 H ATOM 63 N ALA A 5 -3.720 7.756 2.205 1.00 0.00 N ATOM 64 CA ALA A 5 -4.722 7.315 1.183 1.00 0.00 C ATOM 65 C ALA A 5 -4.086 6.867 -0.145 1.00 0.00 C ATOM 66 O ALA A 5 -4.154 5.713 -0.516 1.00 0.00 O ATOM 67 CB ALA A 5 -5.601 8.544 0.954 1.00 0.00 C ATOM 68 H ALA A 5 -3.335 8.656 2.160 1.00 0.00 H ATOM 69 HA ALA A 5 -5.327 6.520 1.584 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.368 8.311 0.215 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.987 9.368 0.591 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.077 8.831 1.892 1.00 0.00 H ATOM 73 N THR A 6 -3.528 7.785 -0.890 1.00 0.00 N ATOM 74 CA THR A 6 -2.957 7.433 -2.231 1.00 0.00 C ATOM 75 C THR A 6 -1.783 6.447 -2.142 1.00 0.00 C ATOM 76 O THR A 6 -1.763 5.446 -2.830 1.00 0.00 O ATOM 77 CB THR A 6 -2.488 8.766 -2.812 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.595 9.652 -2.907 1.00 0.00 O ATOM 79 CG2 THR A 6 -1.893 8.537 -4.204 1.00 0.00 C ATOM 80 H THR A 6 -3.528 8.719 -0.593 1.00 0.00 H ATOM 81 HA THR A 6 -3.728 7.023 -2.861 1.00 0.00 H ATOM 82 HB THR A 6 -1.736 9.195 -2.169 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.268 10.502 -3.212 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.045 7.856 -4.130 1.00 0.00 H ATOM 85 HG22 THR A 6 -1.559 9.488 -4.618 1.00 0.00 H ATOM 86 HG23 THR A 6 -2.651 8.104 -4.857 1.00 0.00 H ATOM 87 N CYS A 7 -0.799 6.716 -1.332 1.00 0.00 N ATOM 88 CA CYS A 7 0.359 5.775 -1.258 1.00 0.00 C ATOM 89 C CYS A 7 -0.010 4.534 -0.445 1.00 0.00 C ATOM 90 O CYS A 7 0.677 3.532 -0.479 1.00 0.00 O ATOM 91 CB CYS A 7 1.475 6.558 -0.571 1.00 0.00 C ATOM 92 SG CYS A 7 2.176 7.763 -1.723 1.00 0.00 S ATOM 93 H CYS A 7 -0.810 7.533 -0.791 1.00 0.00 H ATOM 94 HA CYS A 7 0.671 5.491 -2.250 1.00 0.00 H ATOM 95 HB2 CYS A 7 1.072 7.073 0.279 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.248 5.876 -0.247 1.00 0.00 H ATOM 97 N ALA A 8 -1.092 4.584 0.281 1.00 0.00 N ATOM 98 CA ALA A 8 -1.497 3.399 1.085 1.00 0.00 C ATOM 99 C ALA A 8 -1.813 2.223 0.158 1.00 0.00 C ATOM 100 O ALA A 8 -1.262 1.149 0.293 1.00 0.00 O ATOM 101 CB ALA A 8 -2.747 3.841 1.842 1.00 0.00 C ATOM 102 H ALA A 8 -1.638 5.398 0.293 1.00 0.00 H ATOM 103 HA ALA A 8 -0.718 3.131 1.782 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.108 3.019 2.460 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.521 4.127 1.130 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.505 4.693 2.477 1.00 0.00 H ATOM 107 N THR A 9 -2.687 2.422 -0.792 1.00 0.00 N ATOM 108 CA THR A 9 -3.031 1.320 -1.736 1.00 0.00 C ATOM 109 C THR A 9 -1.779 0.873 -2.496 1.00 0.00 C ATOM 110 O THR A 9 -1.612 -0.285 -2.822 1.00 0.00 O ATOM 111 CB THR A 9 -4.056 1.926 -2.697 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.534 0.915 -3.574 1.00 0.00 O ATOM 113 CG2 THR A 9 -3.403 3.043 -3.511 1.00 0.00 C ATOM 114 H THR A 9 -3.114 3.300 -0.886 1.00 0.00 H ATOM 115 HA THR A 9 -3.471 0.490 -1.205 1.00 0.00 H ATOM 116 HB THR A 9 -4.882 2.332 -2.133 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.348 1.231 -3.973 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.038 3.818 -2.837 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.136 3.472 -4.194 1.00 0.00 H ATOM 120 HG23 THR A 9 -2.569 2.637 -4.083 1.00 0.00 H ATOM 121 N GLN A 10 -0.893 1.785 -2.780 1.00 0.00 N ATOM 122 CA GLN A 10 0.350 1.413 -3.519 1.00 0.00 C ATOM 123 C GLN A 10 1.172 0.431 -2.687 1.00 0.00 C ATOM 124 O GLN A 10 1.437 -0.677 -3.105 1.00 0.00 O ATOM 125 CB GLN A 10 1.109 2.726 -3.715 1.00 0.00 C ATOM 126 CG GLN A 10 1.269 3.005 -5.212 1.00 0.00 C ATOM 127 CD GLN A 10 2.224 1.977 -5.824 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.430 0.917 -5.267 1.00 0.00 O ATOM 129 NE2 GLN A 10 2.816 2.246 -6.954 1.00 0.00 N ATOM 130 H GLN A 10 -1.047 2.710 -2.506 1.00 0.00 H ATOM 131 HA GLN A 10 0.107 0.978 -4.476 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.556 3.533 -3.255 1.00 0.00 H ATOM 133 HB3 GLN A 10 2.084 2.651 -3.259 1.00 0.00 H ATOM 134 HG2 GLN A 10 0.305 2.935 -5.695 1.00 0.00 H ATOM 135 HG3 GLN A 10 1.674 3.996 -5.353 1.00 0.00 H ATOM 136 HE21 GLN A 10 2.647 3.104 -7.405 1.00 0.00 H ATOM 137 HE22 GLN A 10 3.430 1.589 -7.355 1.00 0.00 H ATOM 138 N ARG A 11 1.551 0.811 -1.498 1.00 0.00 N ATOM 139 CA ARG A 11 2.322 -0.128 -0.643 1.00 0.00 C ATOM 140 C ARG A 11 1.428 -1.325 -0.337 1.00 0.00 C ATOM 141 O ARG A 11 1.882 -2.431 -0.124 1.00 0.00 O ATOM 142 CB ARG A 11 2.643 0.652 0.632 1.00 0.00 C ATOM 143 CG ARG A 11 3.920 0.093 1.263 1.00 0.00 C ATOM 144 CD ARG A 11 3.863 0.282 2.779 1.00 0.00 C ATOM 145 NE ARG A 11 5.005 1.181 3.099 1.00 0.00 N ATOM 146 CZ ARG A 11 5.343 1.398 4.344 1.00 0.00 C ATOM 147 NH1 ARG A 11 4.684 0.819 5.312 1.00 0.00 N ATOM 148 NH2 ARG A 11 6.340 2.192 4.619 1.00 0.00 N ATOM 149 H ARG A 11 1.309 1.700 -1.164 1.00 0.00 H ATOM 150 HA ARG A 11 3.228 -0.442 -1.135 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.788 1.695 0.389 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.826 0.554 1.331 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.005 -0.959 1.033 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.777 0.620 0.869 1.00 0.00 H ATOM 155 HD2 ARG A 11 2.927 0.743 3.066 1.00 0.00 H ATOM 156 HD3 ARG A 11 3.985 -0.665 3.282 1.00 0.00 H ATOM 157 HE ARG A 11 5.504 1.615 2.375 1.00 0.00 H ATOM 158 HH11 ARG A 11 3.920 0.209 5.105 1.00 0.00 H ATOM 159 HH12 ARG A 11 4.945 0.987 6.262 1.00 0.00 H ATOM 160 HH21 ARG A 11 6.845 2.635 3.878 1.00 0.00 H ATOM 161 HH22 ARG A 11 6.599 2.360 5.570 1.00 0.00 H ATOM 162 N LEU A 12 0.145 -1.094 -0.334 1.00 0.00 N ATOM 163 CA LEU A 12 -0.825 -2.185 -0.066 1.00 0.00 C ATOM 164 C LEU A 12 -0.843 -3.132 -1.253 1.00 0.00 C ATOM 165 O LEU A 12 -0.690 -4.315 -1.102 1.00 0.00 O ATOM 166 CB LEU A 12 -2.146 -1.448 0.120 1.00 0.00 C ATOM 167 CG LEU A 12 -3.366 -2.310 -0.226 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.504 -2.479 -1.742 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.244 -3.681 0.435 1.00 0.00 C ATOM 170 H LEU A 12 -0.184 -0.189 -0.521 1.00 0.00 H ATOM 171 HA LEU A 12 -0.555 -2.707 0.830 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.219 -1.145 1.152 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.138 -0.579 -0.507 1.00 0.00 H ATOM 174 HG LEU A 12 -4.247 -1.812 0.145 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.377 -3.094 -1.962 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.611 -2.963 -2.137 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.623 -1.501 -2.208 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.342 -4.178 0.078 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.115 -4.285 0.183 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.187 -3.560 1.517 1.00 0.00 H ATOM 181 N ALA A 13 -0.970 -2.630 -2.432 1.00 0.00 N ATOM 182 CA ALA A 13 -0.934 -3.521 -3.612 1.00 0.00 C ATOM 183 C ALA A 13 0.342 -4.343 -3.562 1.00 0.00 C ATOM 184 O ALA A 13 0.427 -5.431 -4.092 1.00 0.00 O ATOM 185 CB ALA A 13 -0.867 -2.572 -4.781 1.00 0.00 C ATOM 186 H ALA A 13 -1.057 -1.670 -2.547 1.00 0.00 H ATOM 187 HA ALA A 13 -1.810 -4.145 -3.670 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.836 -3.141 -5.710 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.031 -1.959 -4.701 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.747 -1.929 -4.778 1.00 0.00 H ATOM 191 N ASN A 14 1.327 -3.818 -2.896 1.00 0.00 N ATOM 192 CA ASN A 14 2.610 -4.521 -2.747 1.00 0.00 C ATOM 193 C ASN A 14 2.504 -5.384 -1.510 1.00 0.00 C ATOM 194 O ASN A 14 3.222 -6.348 -1.336 1.00 0.00 O ATOM 195 CB ASN A 14 3.654 -3.421 -2.561 1.00 0.00 C ATOM 196 CG ASN A 14 3.922 -2.735 -3.903 1.00 0.00 C ATOM 197 OD1 ASN A 14 3.627 -3.281 -4.947 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.472 -1.552 -3.918 1.00 0.00 N ATOM 199 H ASN A 14 1.210 -2.956 -2.457 1.00 0.00 H ATOM 200 HA ASN A 14 2.829 -5.115 -3.619 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.288 -2.693 -1.852 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.570 -3.852 -2.192 1.00 0.00 H ATOM 203 HD21 ASN A 14 4.709 -1.111 -3.071 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.646 -1.103 -4.776 1.00 0.00 H ATOM 205 N PHE A 15 1.583 -5.046 -0.650 1.00 0.00 N ATOM 206 CA PHE A 15 1.409 -5.866 0.573 1.00 0.00 C ATOM 207 C PHE A 15 0.350 -6.909 0.268 1.00 0.00 C ATOM 208 O PHE A 15 0.378 -8.034 0.725 1.00 0.00 O ATOM 209 CB PHE A 15 0.975 -4.878 1.686 1.00 0.00 C ATOM 210 CG PHE A 15 -0.315 -5.324 2.372 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.456 -6.641 2.834 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.370 -4.418 2.536 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.645 -7.042 3.452 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.556 -4.820 3.152 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.696 -6.133 3.611 1.00 0.00 C ATOM 216 H PHE A 15 0.978 -4.276 -0.833 1.00 0.00 H ATOM 217 HA PHE A 15 2.339 -6.324 0.819 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.760 -4.813 2.425 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.822 -3.902 1.250 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.352 -7.347 2.711 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.271 -3.406 2.189 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.753 -8.055 3.798 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.366 -4.113 3.269 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.613 -6.445 4.088 1.00 0.00 H ATOM 225 N LEU A 16 -0.582 -6.493 -0.510 1.00 0.00 N ATOM 226 CA LEU A 16 -1.707 -7.340 -0.920 1.00 0.00 C ATOM 227 C LEU A 16 -1.233 -8.392 -1.917 1.00 0.00 C ATOM 228 O LEU A 16 -1.915 -9.358 -2.194 1.00 0.00 O ATOM 229 CB LEU A 16 -2.632 -6.322 -1.569 1.00 0.00 C ATOM 230 CG LEU A 16 -4.046 -6.849 -1.598 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.713 -6.538 -0.258 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.802 -6.154 -2.730 1.00 0.00 C ATOM 233 H LEU A 16 -0.543 -5.571 -0.838 1.00 0.00 H ATOM 234 HA LEU A 16 -2.187 -7.794 -0.068 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.605 -5.408 -0.995 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.298 -6.115 -2.572 1.00 0.00 H ATOM 237 HG LEU A 16 -4.031 -7.914 -1.762 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.736 -6.914 -0.265 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.723 -5.460 -0.098 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.156 -7.019 0.546 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.811 -5.078 -2.555 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.827 -6.524 -2.764 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.309 -6.363 -3.679 1.00 0.00 H ATOM 244 N VAL A 17 -0.059 -8.212 -2.455 1.00 0.00 N ATOM 245 CA VAL A 17 0.469 -9.204 -3.430 1.00 0.00 C ATOM 246 C VAL A 17 0.340 -10.612 -2.848 1.00 0.00 C ATOM 247 O VAL A 17 -0.390 -11.442 -3.354 1.00 0.00 O ATOM 248 CB VAL A 17 1.941 -8.841 -3.618 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.576 -9.788 -4.638 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.049 -7.404 -4.126 1.00 0.00 C ATOM 251 H VAL A 17 0.475 -7.427 -2.213 1.00 0.00 H ATOM 252 HA VAL A 17 -0.055 -9.125 -4.366 1.00 0.00 H ATOM 253 HB VAL A 17 2.458 -8.930 -2.674 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.626 -9.528 -4.771 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.056 -9.697 -5.592 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.499 -10.814 -4.279 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.528 -7.315 -5.079 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.099 -7.144 -4.261 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.597 -6.727 -3.401 1.00 0.00 H ATOM 260 N ARG A 18 1.039 -10.883 -1.781 1.00 0.00 N ATOM 261 CA ARG A 18 0.955 -12.232 -1.153 1.00 0.00 C ATOM 262 C ARG A 18 -0.455 -12.466 -0.606 1.00 0.00 C ATOM 263 O ARG A 18 -0.873 -13.587 -0.394 1.00 0.00 O ATOM 264 CB ARG A 18 1.976 -12.201 -0.013 1.00 0.00 C ATOM 265 CG ARG A 18 1.590 -11.111 0.989 1.00 0.00 C ATOM 266 CD ARG A 18 2.771 -10.827 1.921 1.00 0.00 C ATOM 267 NE ARG A 18 3.554 -9.758 1.240 1.00 0.00 N ATOM 268 CZ ARG A 18 4.444 -9.072 1.906 1.00 0.00 C ATOM 269 NH1 ARG A 18 4.638 -9.304 3.177 1.00 0.00 N ATOM 270 NH2 ARG A 18 5.140 -8.149 1.301 1.00 0.00 N ATOM 271 H ARG A 18 1.617 -10.195 -1.387 1.00 0.00 H ATOM 272 HA ARG A 18 1.218 -12.999 -1.865 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.987 -13.161 0.486 1.00 0.00 H ATOM 274 HB3 ARG A 18 2.957 -11.992 -0.412 1.00 0.00 H ATOM 275 HG2 ARG A 18 1.327 -10.209 0.455 1.00 0.00 H ATOM 276 HG3 ARG A 18 0.744 -11.441 1.573 1.00 0.00 H ATOM 277 HD2 ARG A 18 2.414 -10.482 2.882 1.00 0.00 H ATOM 278 HD3 ARG A 18 3.378 -11.712 2.039 1.00 0.00 H ATOM 279 HE ARG A 18 3.405 -9.574 0.289 1.00 0.00 H ATOM 280 HH11 ARG A 18 4.103 -10.009 3.644 1.00 0.00 H ATOM 281 HH12 ARG A 18 5.321 -8.777 3.682 1.00 0.00 H ATOM 282 HH21 ARG A 18 4.991 -7.967 0.329 1.00 0.00 H ATOM 283 HH22 ARG A 18 5.823 -7.623 1.810 1.00 0.00 H ATOM 284 N SER A 19 -1.192 -11.412 -0.377 1.00 0.00 N ATOM 285 CA SER A 19 -2.576 -11.568 0.154 1.00 0.00 C ATOM 286 C SER A 19 -2.593 -12.575 1.306 1.00 0.00 C ATOM 287 O SER A 19 -1.559 -13.004 1.776 1.00 0.00 O ATOM 288 CB SER A 19 -3.396 -12.086 -1.026 1.00 0.00 C ATOM 289 OG SER A 19 -4.003 -10.987 -1.693 1.00 0.00 O ATOM 290 H SER A 19 -0.834 -10.518 -0.557 1.00 0.00 H ATOM 291 HA SER A 19 -2.962 -10.614 0.482 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.750 -12.605 -1.714 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.156 -12.765 -0.665 1.00 0.00 H ATOM 294 HG SER A 19 -3.618 -10.922 -2.570 1.00 0.00 H HETATM 295 N NH2 A 20 -3.741 -12.973 1.786 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.765 -13.617 2.525 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -4.575 -12.627 1.409 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 12 ATOM 1 N LYS A 1 -0.060 13.167 3.589 1.00 0.00 N ATOM 2 CA LYS A 1 0.723 11.900 3.513 1.00 0.00 C ATOM 3 C LYS A 1 0.105 10.959 2.476 1.00 0.00 C ATOM 4 O LYS A 1 -0.931 10.366 2.703 1.00 0.00 O ATOM 5 CB LYS A 1 0.628 11.294 4.912 1.00 0.00 C ATOM 6 CG LYS A 1 1.898 11.626 5.698 1.00 0.00 C ATOM 7 CD LYS A 1 2.337 10.400 6.502 1.00 0.00 C ATOM 8 CE LYS A 1 3.043 10.853 7.781 1.00 0.00 C ATOM 9 NZ LYS A 1 4.471 10.477 7.587 1.00 0.00 N ATOM 10 H1 LYS A 1 -1.046 12.981 3.316 1.00 0.00 H ATOM 11 H2 LYS A 1 0.353 13.869 2.941 1.00 0.00 H ATOM 12 H3 LYS A 1 -0.034 13.533 4.561 1.00 0.00 H ATOM 13 HA LYS A 1 1.754 12.106 3.268 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.231 11.705 5.424 1.00 0.00 H ATOM 15 HB3 LYS A 1 0.525 10.222 4.836 1.00 0.00 H ATOM 16 HG2 LYS A 1 2.684 11.908 5.011 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.700 12.445 6.374 1.00 0.00 H ATOM 18 HD2 LYS A 1 1.470 9.808 6.757 1.00 0.00 H ATOM 19 HD3 LYS A 1 3.017 9.806 5.909 1.00 0.00 H ATOM 20 HE2 LYS A 1 2.946 11.923 7.903 1.00 0.00 H ATOM 21 HE3 LYS A 1 2.638 10.337 8.637 1.00 0.00 H ATOM 22 HZ1 LYS A 1 4.913 10.301 8.511 1.00 0.00 H ATOM 23 HZ2 LYS A 1 4.971 11.252 7.104 1.00 0.00 H ATOM 24 HZ3 LYS A 1 4.528 9.615 7.009 1.00 0.00 H ATOM 25 N CYS A 2 0.728 10.817 1.338 1.00 0.00 N ATOM 26 CA CYS A 2 0.168 9.917 0.289 1.00 0.00 C ATOM 27 C CYS A 2 0.106 8.479 0.802 1.00 0.00 C ATOM 28 O CYS A 2 -0.901 7.810 0.685 1.00 0.00 O ATOM 29 CB CYS A 2 1.142 10.014 -0.887 1.00 0.00 C ATOM 30 SG CYS A 2 0.408 9.223 -2.343 1.00 0.00 S ATOM 31 H CYS A 2 1.562 11.307 1.172 1.00 0.00 H ATOM 32 HA CYS A 2 -0.809 10.253 -0.014 1.00 0.00 H ATOM 33 HB2 CYS A 2 1.344 11.052 -1.104 1.00 0.00 H ATOM 34 HB3 CYS A 2 2.064 9.511 -0.633 1.00 0.00 H ATOM 35 N ASN A 3 1.182 7.990 1.355 1.00 0.00 N ATOM 36 CA ASN A 3 1.192 6.586 1.859 1.00 0.00 C ATOM 37 C ASN A 3 -0.081 6.302 2.654 1.00 0.00 C ATOM 38 O ASN A 3 -0.602 5.204 2.645 1.00 0.00 O ATOM 39 CB ASN A 3 2.417 6.507 2.768 1.00 0.00 C ATOM 40 CG ASN A 3 2.605 5.067 3.247 1.00 0.00 C ATOM 41 OD1 ASN A 3 1.987 4.157 2.731 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.438 4.822 4.219 1.00 0.00 N ATOM 43 H ASN A 3 1.989 8.542 1.428 1.00 0.00 H ATOM 44 HA ASN A 3 1.292 5.891 1.042 1.00 0.00 H ATOM 45 HB2 ASN A 3 3.293 6.822 2.220 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.273 7.152 3.622 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.937 5.561 4.636 1.00 0.00 H ATOM 48 HD22 ASN A 3 3.567 3.898 4.535 1.00 0.00 H ATOM 49 N THR A 4 -0.578 7.280 3.350 1.00 0.00 N ATOM 50 CA THR A 4 -1.810 7.072 4.158 1.00 0.00 C ATOM 51 C THR A 4 -3.047 6.920 3.266 1.00 0.00 C ATOM 52 O THR A 4 -3.764 5.944 3.350 1.00 0.00 O ATOM 53 CB THR A 4 -1.928 8.327 5.020 1.00 0.00 C ATOM 54 OG1 THR A 4 -0.749 8.477 5.801 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.142 8.203 5.942 1.00 0.00 C ATOM 56 H THR A 4 -0.136 8.156 3.348 1.00 0.00 H ATOM 57 HA THR A 4 -1.698 6.207 4.792 1.00 0.00 H ATOM 58 HB THR A 4 -2.050 9.191 4.384 1.00 0.00 H ATOM 59 HG1 THR A 4 -0.647 7.688 6.339 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.045 8.090 5.342 1.00 0.00 H ATOM 61 HG22 THR A 4 -3.225 9.099 6.557 1.00 0.00 H ATOM 62 HG23 THR A 4 -3.023 7.331 6.586 1.00 0.00 H ATOM 63 N ALA A 5 -3.331 7.895 2.441 1.00 0.00 N ATOM 64 CA ALA A 5 -4.555 7.810 1.589 1.00 0.00 C ATOM 65 C ALA A 5 -4.264 7.368 0.144 1.00 0.00 C ATOM 66 O ALA A 5 -4.672 6.306 -0.280 1.00 0.00 O ATOM 67 CB ALA A 5 -5.123 9.229 1.597 1.00 0.00 C ATOM 68 H ALA A 5 -2.762 8.691 2.407 1.00 0.00 H ATOM 69 HA ALA A 5 -5.272 7.142 2.040 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.029 9.262 0.992 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.386 9.918 1.184 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.359 9.521 2.620 1.00 0.00 H ATOM 73 N THR A 6 -3.616 8.199 -0.629 1.00 0.00 N ATOM 74 CA THR A 6 -3.366 7.850 -2.064 1.00 0.00 C ATOM 75 C THR A 6 -2.332 6.729 -2.238 1.00 0.00 C ATOM 76 O THR A 6 -2.571 5.772 -2.949 1.00 0.00 O ATOM 77 CB THR A 6 -2.850 9.144 -2.692 1.00 0.00 C ATOM 78 OG1 THR A 6 -2.195 9.921 -1.698 1.00 0.00 O ATOM 79 CG2 THR A 6 -4.025 9.934 -3.269 1.00 0.00 C ATOM 80 H THR A 6 -3.333 9.070 -0.283 1.00 0.00 H ATOM 81 HA THR A 6 -4.291 7.570 -2.540 1.00 0.00 H ATOM 82 HB THR A 6 -2.155 8.911 -3.483 1.00 0.00 H ATOM 83 HG1 THR A 6 -2.332 10.848 -1.908 1.00 0.00 H ATOM 84 HG21 THR A 6 -4.527 9.336 -4.030 1.00 0.00 H ATOM 85 HG22 THR A 6 -3.658 10.857 -3.717 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.729 10.173 -2.472 1.00 0.00 H ATOM 87 N CYS A 7 -1.188 6.835 -1.628 1.00 0.00 N ATOM 88 CA CYS A 7 -0.165 5.763 -1.810 1.00 0.00 C ATOM 89 C CYS A 7 -0.462 4.578 -0.887 1.00 0.00 C ATOM 90 O CYS A 7 0.176 3.546 -0.963 1.00 0.00 O ATOM 91 CB CYS A 7 1.177 6.411 -1.464 1.00 0.00 C ATOM 92 SG CYS A 7 1.608 7.640 -2.726 1.00 0.00 S ATOM 93 H CYS A 7 -0.996 7.614 -1.068 1.00 0.00 H ATOM 94 HA CYS A 7 -0.153 5.435 -2.838 1.00 0.00 H ATOM 95 HB2 CYS A 7 1.109 6.890 -0.506 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.944 5.650 -1.429 1.00 0.00 H ATOM 97 N ALA A 8 -1.431 4.710 -0.023 1.00 0.00 N ATOM 98 CA ALA A 8 -1.770 3.580 0.889 1.00 0.00 C ATOM 99 C ALA A 8 -2.182 2.357 0.065 1.00 0.00 C ATOM 100 O ALA A 8 -2.021 1.228 0.485 1.00 0.00 O ATOM 101 CB ALA A 8 -2.944 4.082 1.729 1.00 0.00 C ATOM 102 H ALA A 8 -1.941 5.546 0.019 1.00 0.00 H ATOM 103 HA ALA A 8 -0.932 3.343 1.526 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.251 3.303 2.427 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.779 4.333 1.074 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.640 4.969 2.286 1.00 0.00 H ATOM 107 N THR A 9 -2.705 2.576 -1.111 1.00 0.00 N ATOM 108 CA THR A 9 -3.122 1.434 -1.973 1.00 0.00 C ATOM 109 C THR A 9 -1.901 0.889 -2.714 1.00 0.00 C ATOM 110 O THR A 9 -1.747 -0.299 -2.906 1.00 0.00 O ATOM 111 CB THR A 9 -4.126 2.030 -2.961 1.00 0.00 C ATOM 112 OG1 THR A 9 -5.020 2.889 -2.265 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.914 0.907 -3.636 1.00 0.00 C ATOM 114 H THR A 9 -2.818 3.494 -1.430 1.00 0.00 H ATOM 115 HA THR A 9 -3.589 0.662 -1.384 1.00 0.00 H ATOM 116 HB THR A 9 -3.598 2.596 -3.713 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.450 2.376 -1.579 1.00 0.00 H ATOM 118 HG21 THR A 9 -4.227 0.251 -4.171 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.628 1.335 -4.339 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.449 0.333 -2.880 1.00 0.00 H ATOM 121 N GLN A 10 -1.025 1.760 -3.116 1.00 0.00 N ATOM 122 CA GLN A 10 0.201 1.311 -3.833 1.00 0.00 C ATOM 123 C GLN A 10 1.033 0.441 -2.890 1.00 0.00 C ATOM 124 O GLN A 10 1.310 -0.708 -3.171 1.00 0.00 O ATOM 125 CB GLN A 10 0.934 2.610 -4.202 1.00 0.00 C ATOM 126 CG GLN A 10 2.448 2.377 -4.231 1.00 0.00 C ATOM 127 CD GLN A 10 3.093 3.321 -5.248 1.00 0.00 C ATOM 128 OE1 GLN A 10 3.979 2.930 -5.981 1.00 0.00 O ATOM 129 NE2 GLN A 10 2.681 4.557 -5.324 1.00 0.00 N ATOM 130 H GLN A 10 -1.171 2.707 -2.937 1.00 0.00 H ATOM 131 HA GLN A 10 -0.059 0.762 -4.724 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.605 2.940 -5.176 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.706 3.369 -3.471 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.858 2.569 -3.249 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.651 1.355 -4.512 1.00 0.00 H ATOM 136 HE21 GLN A 10 1.963 4.873 -4.731 1.00 0.00 H ATOM 137 HE22 GLN A 10 3.090 5.171 -5.975 1.00 0.00 H ATOM 138 N ARG A 11 1.404 0.970 -1.756 1.00 0.00 N ATOM 139 CA ARG A 11 2.181 0.155 -0.788 1.00 0.00 C ATOM 140 C ARG A 11 1.340 -1.066 -0.432 1.00 0.00 C ATOM 141 O ARG A 11 1.842 -2.124 -0.111 1.00 0.00 O ATOM 142 CB ARG A 11 2.377 1.057 0.430 1.00 0.00 C ATOM 143 CG ARG A 11 3.846 1.029 0.860 1.00 0.00 C ATOM 144 CD ARG A 11 3.974 0.286 2.192 1.00 0.00 C ATOM 145 NE ARG A 11 2.982 0.936 3.092 1.00 0.00 N ATOM 146 CZ ARG A 11 2.601 0.339 4.191 1.00 0.00 C ATOM 147 NH1 ARG A 11 3.094 -0.829 4.509 1.00 0.00 N ATOM 148 NH2 ARG A 11 1.729 0.912 4.974 1.00 0.00 N ATOM 149 H ARG A 11 1.149 1.889 -1.534 1.00 0.00 H ATOM 150 HA ARG A 11 3.132 -0.137 -1.205 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.096 2.069 0.177 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.760 0.705 1.244 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.432 0.523 0.105 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.207 2.040 0.977 1.00 0.00 H ATOM 155 HD2 ARG A 11 3.738 -0.762 2.061 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.970 0.401 2.593 1.00 0.00 H ATOM 157 HE ARG A 11 2.613 1.814 2.860 1.00 0.00 H ATOM 158 HH11 ARG A 11 3.763 -1.269 3.911 1.00 0.00 H ATOM 159 HH12 ARG A 11 2.799 -1.283 5.350 1.00 0.00 H ATOM 160 HH21 ARG A 11 1.353 1.806 4.734 1.00 0.00 H ATOM 161 HH22 ARG A 11 1.438 0.456 5.816 1.00 0.00 H ATOM 162 N LEU A 12 0.049 -0.908 -0.515 1.00 0.00 N ATOM 163 CA LEU A 12 -0.876 -2.030 -0.214 1.00 0.00 C ATOM 164 C LEU A 12 -0.758 -3.067 -1.314 1.00 0.00 C ATOM 165 O LEU A 12 -0.534 -4.221 -1.059 1.00 0.00 O ATOM 166 CB LEU A 12 -2.246 -1.360 -0.173 1.00 0.00 C ATOM 167 CG LEU A 12 -3.390 -2.332 -0.483 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.417 -2.702 -1.968 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.229 -3.596 0.353 1.00 0.00 C ATOM 170 H LEU A 12 -0.317 -0.042 -0.792 1.00 0.00 H ATOM 171 HA LEU A 12 -0.637 -2.460 0.738 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.394 -0.960 0.814 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.257 -0.562 -0.889 1.00 0.00 H ATOM 174 HG LEU A 12 -4.320 -1.852 -0.230 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.239 -3.392 -2.156 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.475 -3.177 -2.242 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.556 -1.801 -2.565 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.277 -4.071 0.115 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.043 -4.285 0.131 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.251 -3.337 1.412 1.00 0.00 H ATOM 181 N ALA A 13 -0.854 -2.670 -2.537 1.00 0.00 N ATOM 182 CA ALA A 13 -0.687 -3.648 -3.636 1.00 0.00 C ATOM 183 C ALA A 13 0.633 -4.380 -3.447 1.00 0.00 C ATOM 184 O ALA A 13 0.820 -5.492 -3.893 1.00 0.00 O ATOM 185 CB ALA A 13 -0.605 -2.790 -4.873 1.00 0.00 C ATOM 186 H ALA A 13 -1.005 -1.730 -2.737 1.00 0.00 H ATOM 187 HA ALA A 13 -1.518 -4.329 -3.693 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.480 -3.426 -5.749 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.246 -2.114 -4.791 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.522 -2.209 -4.974 1.00 0.00 H ATOM 191 N ASN A 14 1.540 -3.747 -2.759 1.00 0.00 N ATOM 192 CA ASN A 14 2.851 -4.354 -2.482 1.00 0.00 C ATOM 193 C ASN A 14 2.715 -5.140 -1.197 1.00 0.00 C ATOM 194 O ASN A 14 3.476 -6.042 -0.912 1.00 0.00 O ATOM 195 CB ASN A 14 3.812 -3.178 -2.301 1.00 0.00 C ATOM 196 CG ASN A 14 4.709 -3.053 -3.534 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.854 -3.462 -3.510 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.236 -2.503 -4.617 1.00 0.00 N ATOM 199 H ASN A 14 1.340 -2.870 -2.389 1.00 0.00 H ATOM 200 HA ASN A 14 3.168 -4.982 -3.296 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.245 -2.266 -2.175 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.425 -3.344 -1.428 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.309 -2.173 -4.636 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.807 -2.418 -5.414 1.00 0.00 H ATOM 205 N PHE A 15 1.721 -4.800 -0.415 1.00 0.00 N ATOM 206 CA PHE A 15 1.516 -5.539 0.854 1.00 0.00 C ATOM 207 C PHE A 15 0.515 -6.656 0.590 1.00 0.00 C ATOM 208 O PHE A 15 0.551 -7.727 1.164 1.00 0.00 O ATOM 209 CB PHE A 15 0.989 -4.489 1.868 1.00 0.00 C ATOM 210 CG PHE A 15 -0.311 -4.935 2.529 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.421 -6.213 3.096 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.410 -4.066 2.567 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.622 -6.613 3.692 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.608 -4.467 3.163 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.716 -5.742 3.725 1.00 0.00 C ATOM 216 H PHE A 15 1.089 -4.077 -0.691 1.00 0.00 H ATOM 217 HA PHE A 15 2.450 -5.935 1.180 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.735 -4.333 2.630 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.819 -3.556 1.347 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.419 -6.889 3.071 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.336 -3.085 2.141 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.705 -7.597 4.119 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.450 -3.790 3.183 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.642 -6.054 4.186 1.00 0.00 H ATOM 225 N LEU A 16 -0.382 -6.359 -0.277 1.00 0.00 N ATOM 226 CA LEU A 16 -1.460 -7.285 -0.662 1.00 0.00 C ATOM 227 C LEU A 16 -0.918 -8.368 -1.586 1.00 0.00 C ATOM 228 O LEU A 16 -1.554 -9.373 -1.832 1.00 0.00 O ATOM 229 CB LEU A 16 -2.411 -6.349 -1.390 1.00 0.00 C ATOM 230 CG LEU A 16 -3.804 -6.934 -1.407 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.490 -6.611 -0.081 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.580 -6.302 -2.563 1.00 0.00 C ATOM 233 H LEU A 16 -0.354 -5.474 -0.692 1.00 0.00 H ATOM 234 HA LEU A 16 -1.939 -7.708 0.205 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.432 -5.400 -0.877 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.068 -6.195 -2.399 1.00 0.00 H ATOM 237 HG LEU A 16 -3.743 -8.002 -1.539 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.497 -7.028 -0.081 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.545 -5.530 0.046 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.918 -7.044 0.740 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.631 -5.223 -2.420 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.589 -6.713 -2.591 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.073 -6.520 -3.503 1.00 0.00 H ATOM 244 N VAL A 17 0.259 -8.165 -2.103 1.00 0.00 N ATOM 245 CA VAL A 17 0.857 -9.176 -3.017 1.00 0.00 C ATOM 246 C VAL A 17 0.754 -10.573 -2.399 1.00 0.00 C ATOM 247 O VAL A 17 0.472 -11.543 -3.076 1.00 0.00 O ATOM 248 CB VAL A 17 2.324 -8.771 -3.161 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.424 -7.496 -3.992 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.926 -8.523 -1.773 1.00 0.00 C ATOM 251 H VAL A 17 0.744 -7.342 -1.893 1.00 0.00 H ATOM 252 HA VAL A 17 0.371 -9.146 -3.977 1.00 0.00 H ATOM 253 HB VAL A 17 2.868 -9.564 -3.653 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.471 -7.209 -4.093 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.875 -6.695 -3.497 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.998 -7.671 -4.980 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.376 -7.724 -1.276 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.972 -8.234 -1.876 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.858 -9.434 -1.179 1.00 0.00 H ATOM 260 N ARG A 18 0.981 -10.685 -1.119 1.00 0.00 N ATOM 261 CA ARG A 18 0.894 -12.020 -0.463 1.00 0.00 C ATOM 262 C ARG A 18 -0.572 -12.397 -0.228 1.00 0.00 C ATOM 263 O ARG A 18 -0.939 -13.555 -0.266 1.00 0.00 O ATOM 264 CB ARG A 18 1.625 -11.855 0.872 1.00 0.00 C ATOM 265 CG ARG A 18 3.058 -11.381 0.618 1.00 0.00 C ATOM 266 CD ARG A 18 4.043 -12.461 1.074 1.00 0.00 C ATOM 267 NE ARG A 18 5.389 -11.863 0.862 1.00 0.00 N ATOM 268 CZ ARG A 18 6.435 -12.368 1.463 1.00 0.00 C ATOM 269 NH1 ARG A 18 6.309 -13.411 2.236 1.00 0.00 N ATOM 270 NH2 ARG A 18 7.609 -11.829 1.286 1.00 0.00 N ATOM 271 H ARG A 18 1.205 -9.893 -0.589 1.00 0.00 H ATOM 272 HA ARG A 18 1.386 -12.767 -1.062 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.106 -11.126 1.477 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.649 -12.803 1.389 1.00 0.00 H ATOM 275 HG2 ARG A 18 3.192 -11.192 -0.438 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.240 -10.474 1.172 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.889 -12.689 2.120 1.00 0.00 H ATOM 278 HD3 ARG A 18 3.934 -13.350 0.472 1.00 0.00 H ATOM 279 HE ARG A 18 5.491 -11.086 0.274 1.00 0.00 H ATOM 280 HH11 ARG A 18 5.412 -13.830 2.371 1.00 0.00 H ATOM 281 HH12 ARG A 18 7.113 -13.793 2.693 1.00 0.00 H ATOM 282 HH21 ARG A 18 7.710 -11.031 0.691 1.00 0.00 H ATOM 283 HH22 ARG A 18 8.410 -12.211 1.746 1.00 0.00 H ATOM 284 N SER A 19 -1.411 -11.427 0.015 1.00 0.00 N ATOM 285 CA SER A 19 -2.852 -11.727 0.252 1.00 0.00 C ATOM 286 C SER A 19 -3.458 -12.414 -0.975 1.00 0.00 C ATOM 287 O SER A 19 -3.233 -12.002 -2.096 1.00 0.00 O ATOM 288 CB SER A 19 -3.505 -10.364 0.481 1.00 0.00 C ATOM 289 OG SER A 19 -3.704 -10.167 1.875 1.00 0.00 O ATOM 290 H SER A 19 -1.091 -10.502 0.042 1.00 0.00 H ATOM 291 HA SER A 19 -2.970 -12.344 1.127 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.864 -9.586 0.102 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.455 -10.329 -0.037 1.00 0.00 H ATOM 294 HG SER A 19 -4.592 -10.457 2.093 1.00 0.00 H HETATM 295 N NH2 A 20 -4.227 -13.456 -0.808 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.623 -13.903 -1.585 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -4.411 -13.790 0.095 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 13 ATOM 1 N LYS A 1 0.526 14.085 1.748 1.00 0.00 N ATOM 2 CA LYS A 1 -0.061 13.041 2.640 1.00 0.00 C ATOM 3 C LYS A 1 -0.444 11.800 1.826 1.00 0.00 C ATOM 4 O LYS A 1 -1.464 11.184 2.061 1.00 0.00 O ATOM 5 CB LYS A 1 -1.309 13.690 3.242 1.00 0.00 C ATOM 6 CG LYS A 1 -0.916 14.537 4.455 1.00 0.00 C ATOM 7 CD LYS A 1 -2.181 15.085 5.117 1.00 0.00 C ATOM 8 CE LYS A 1 -1.838 15.629 6.506 1.00 0.00 C ATOM 9 NZ LYS A 1 -2.043 17.100 6.405 1.00 0.00 N ATOM 10 H1 LYS A 1 0.014 14.095 0.843 1.00 0.00 H ATOM 11 H2 LYS A 1 1.529 13.869 1.578 1.00 0.00 H ATOM 12 H3 LYS A 1 0.443 15.015 2.202 1.00 0.00 H ATOM 13 HA LYS A 1 0.632 12.780 3.422 1.00 0.00 H ATOM 14 HB2 LYS A 1 -1.781 14.319 2.501 1.00 0.00 H ATOM 15 HB3 LYS A 1 -1.998 12.921 3.554 1.00 0.00 H ATOM 16 HG2 LYS A 1 -0.373 13.927 5.161 1.00 0.00 H ATOM 17 HG3 LYS A 1 -0.294 15.359 4.135 1.00 0.00 H ATOM 18 HD2 LYS A 1 -2.591 15.880 4.511 1.00 0.00 H ATOM 19 HD3 LYS A 1 -2.908 14.294 5.213 1.00 0.00 H ATOM 20 HE2 LYS A 1 -2.501 15.205 7.249 1.00 0.00 H ATOM 21 HE3 LYS A 1 -0.810 15.414 6.752 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -1.717 17.432 5.477 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -1.502 17.577 7.156 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -3.053 17.319 6.515 1.00 0.00 H ATOM 25 N CYS A 2 0.364 11.431 0.868 1.00 0.00 N ATOM 26 CA CYS A 2 0.042 10.231 0.044 1.00 0.00 C ATOM 27 C CYS A 2 0.125 8.964 0.897 1.00 0.00 C ATOM 28 O CYS A 2 -0.763 8.134 0.880 1.00 0.00 O ATOM 29 CB CYS A 2 1.104 10.197 -1.056 1.00 0.00 C ATOM 30 SG CYS A 2 0.730 8.853 -2.214 1.00 0.00 S ATOM 31 H CYS A 2 1.182 11.941 0.692 1.00 0.00 H ATOM 32 HA CYS A 2 -0.939 10.327 -0.395 1.00 0.00 H ATOM 33 HB2 CYS A 2 1.107 11.137 -1.585 1.00 0.00 H ATOM 34 HB3 CYS A 2 2.075 10.028 -0.613 1.00 0.00 H ATOM 35 N ASN A 3 1.190 8.803 1.634 1.00 0.00 N ATOM 36 CA ASN A 3 1.338 7.583 2.482 1.00 0.00 C ATOM 37 C ASN A 3 0.034 7.294 3.226 1.00 0.00 C ATOM 38 O ASN A 3 -0.300 6.156 3.491 1.00 0.00 O ATOM 39 CB ASN A 3 2.452 7.925 3.471 1.00 0.00 C ATOM 40 CG ASN A 3 2.706 6.725 4.385 1.00 0.00 C ATOM 41 OD1 ASN A 3 2.107 6.610 5.436 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.577 5.820 4.029 1.00 0.00 N ATOM 43 H ASN A 3 1.897 9.483 1.626 1.00 0.00 H ATOM 44 HA ASN A 3 1.628 6.735 1.886 1.00 0.00 H ATOM 45 HB2 ASN A 3 3.356 8.164 2.927 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.156 8.774 4.068 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.062 5.915 3.176 1.00 0.00 H ATOM 48 HD22 ASN A 3 3.746 5.046 4.610 1.00 0.00 H ATOM 49 N THR A 4 -0.695 8.313 3.580 1.00 0.00 N ATOM 50 CA THR A 4 -1.966 8.092 4.322 1.00 0.00 C ATOM 51 C THR A 4 -3.062 7.502 3.424 1.00 0.00 C ATOM 52 O THR A 4 -3.574 6.432 3.684 1.00 0.00 O ATOM 53 CB THR A 4 -2.372 9.485 4.805 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.380 9.988 5.687 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.714 9.405 5.533 1.00 0.00 C ATOM 56 H THR A 4 -0.401 9.224 3.367 1.00 0.00 H ATOM 57 HA THR A 4 -1.795 7.452 5.172 1.00 0.00 H ATOM 58 HB THR A 4 -2.467 10.145 3.957 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.239 10.914 5.479 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.475 9.022 4.853 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.001 10.399 5.876 1.00 0.00 H ATOM 62 HG23 THR A 4 -3.624 8.737 6.390 1.00 0.00 H ATOM 63 N ALA A 5 -3.456 8.202 2.390 1.00 0.00 N ATOM 64 CA ALA A 5 -4.553 7.681 1.515 1.00 0.00 C ATOM 65 C ALA A 5 -4.046 7.089 0.190 1.00 0.00 C ATOM 66 O ALA A 5 -4.159 5.905 -0.058 1.00 0.00 O ATOM 67 CB ALA A 5 -5.438 8.896 1.244 1.00 0.00 C ATOM 68 H ALA A 5 -3.055 9.077 2.206 1.00 0.00 H ATOM 69 HA ALA A 5 -5.127 6.940 2.051 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.272 8.604 0.606 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.853 9.668 0.745 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.821 9.284 2.187 1.00 0.00 H ATOM 73 N THR A 6 -3.551 7.921 -0.688 1.00 0.00 N ATOM 74 CA THR A 6 -3.103 7.437 -2.032 1.00 0.00 C ATOM 75 C THR A 6 -1.991 6.383 -1.954 1.00 0.00 C ATOM 76 O THR A 6 -2.086 5.336 -2.564 1.00 0.00 O ATOM 77 CB THR A 6 -2.591 8.692 -2.741 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.634 9.653 -2.806 1.00 0.00 O ATOM 79 CG2 THR A 6 -2.135 8.333 -4.155 1.00 0.00 C ATOM 80 H THR A 6 -3.516 8.879 -0.481 1.00 0.00 H ATOM 81 HA THR A 6 -3.945 7.042 -2.579 1.00 0.00 H ATOM 82 HB THR A 6 -1.760 9.102 -2.191 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.637 10.145 -1.981 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.334 7.595 -4.103 1.00 0.00 H ATOM 85 HG22 THR A 6 -1.771 9.229 -4.658 1.00 0.00 H ATOM 86 HG23 THR A 6 -2.974 7.919 -4.714 1.00 0.00 H ATOM 87 N CYS A 7 -0.934 6.641 -1.240 1.00 0.00 N ATOM 88 CA CYS A 7 0.169 5.635 -1.175 1.00 0.00 C ATOM 89 C CYS A 7 -0.234 4.448 -0.294 1.00 0.00 C ATOM 90 O CYS A 7 0.460 3.453 -0.228 1.00 0.00 O ATOM 91 CB CYS A 7 1.359 6.379 -0.575 1.00 0.00 C ATOM 92 SG CYS A 7 2.122 7.439 -1.830 1.00 0.00 S ATOM 93 H CYS A 7 -0.855 7.495 -0.762 1.00 0.00 H ATOM 94 HA CYS A 7 0.416 5.293 -2.168 1.00 0.00 H ATOM 95 HB2 CYS A 7 1.018 6.984 0.243 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.085 5.665 -0.216 1.00 0.00 H ATOM 97 N ALA A 8 -1.350 4.537 0.378 1.00 0.00 N ATOM 98 CA ALA A 8 -1.787 3.403 1.244 1.00 0.00 C ATOM 99 C ALA A 8 -2.110 2.185 0.375 1.00 0.00 C ATOM 100 O ALA A 8 -1.863 1.055 0.749 1.00 0.00 O ATOM 101 CB ALA A 8 -3.042 3.904 1.957 1.00 0.00 C ATOM 102 H ALA A 8 -1.900 5.344 0.310 1.00 0.00 H ATOM 103 HA ALA A 8 -1.022 3.161 1.965 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.423 3.123 2.614 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.802 4.160 1.219 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.797 4.787 2.547 1.00 0.00 H ATOM 107 N THR A 9 -2.652 2.412 -0.789 1.00 0.00 N ATOM 108 CA THR A 9 -2.984 1.281 -1.700 1.00 0.00 C ATOM 109 C THR A 9 -1.706 0.804 -2.390 1.00 0.00 C ATOM 110 O THR A 9 -1.532 -0.364 -2.679 1.00 0.00 O ATOM 111 CB THR A 9 -3.961 1.863 -2.720 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.865 2.739 -2.065 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.738 0.728 -3.387 1.00 0.00 C ATOM 114 H THR A 9 -2.830 3.332 -1.072 1.00 0.00 H ATOM 115 HA THR A 9 -3.448 0.477 -1.153 1.00 0.00 H ATOM 116 HB THR A 9 -3.412 2.408 -3.474 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.565 2.962 -2.683 1.00 0.00 H ATOM 118 HG21 THR A 9 -4.042 0.058 -3.892 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.435 1.143 -4.115 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.292 0.172 -2.630 1.00 0.00 H ATOM 121 N GLN A 10 -0.815 1.716 -2.653 1.00 0.00 N ATOM 122 CA GLN A 10 0.465 1.354 -3.323 1.00 0.00 C ATOM 123 C GLN A 10 1.233 0.353 -2.451 1.00 0.00 C ATOM 124 O GLN A 10 1.526 -0.749 -2.871 1.00 0.00 O ATOM 125 CB GLN A 10 1.213 2.687 -3.460 1.00 0.00 C ATOM 126 CG GLN A 10 2.723 2.474 -3.324 1.00 0.00 C ATOM 127 CD GLN A 10 3.440 3.820 -3.440 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.822 4.861 -3.338 1.00 0.00 O ATOM 129 NE2 GLN A 10 4.728 3.843 -3.650 1.00 0.00 N ATOM 130 H GLN A 10 -0.989 2.645 -2.404 1.00 0.00 H ATOM 131 HA GLN A 10 0.272 0.934 -4.299 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.000 3.119 -4.427 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.879 3.364 -2.687 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.935 2.034 -2.361 1.00 0.00 H ATOM 135 HG3 GLN A 10 3.067 1.814 -4.107 1.00 0.00 H ATOM 136 HE21 GLN A 10 5.226 2.999 -3.732 1.00 0.00 H ATOM 137 HE22 GLN A 10 5.198 4.704 -3.726 1.00 0.00 H ATOM 138 N ARG A 11 1.539 0.714 -1.234 1.00 0.00 N ATOM 139 CA ARG A 11 2.258 -0.244 -0.346 1.00 0.00 C ATOM 140 C ARG A 11 1.358 -1.461 -0.161 1.00 0.00 C ATOM 141 O ARG A 11 1.802 -2.588 -0.116 1.00 0.00 O ATOM 142 CB ARG A 11 2.456 0.499 0.979 1.00 0.00 C ATOM 143 CG ARG A 11 3.936 0.850 1.153 1.00 0.00 C ATOM 144 CD ARG A 11 4.063 2.142 1.964 1.00 0.00 C ATOM 145 NE ARG A 11 5.320 1.986 2.748 1.00 0.00 N ATOM 146 CZ ARG A 11 5.338 1.237 3.819 1.00 0.00 C ATOM 147 NH1 ARG A 11 4.259 0.607 4.198 1.00 0.00 N ATOM 148 NH2 ARG A 11 6.438 1.117 4.512 1.00 0.00 N ATOM 149 H ARG A 11 1.276 1.599 -0.901 1.00 0.00 H ATOM 150 HA ARG A 11 3.207 -0.525 -0.773 1.00 0.00 H ATOM 151 HB2 ARG A 11 1.867 1.405 0.976 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.141 -0.132 1.796 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.438 0.047 1.673 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.388 0.991 0.184 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.134 2.994 1.302 1.00 0.00 H ATOM 156 HD3 ARG A 11 3.222 2.252 2.632 1.00 0.00 H ATOM 157 HE ARG A 11 6.135 2.450 2.465 1.00 0.00 H ATOM 158 HH11 ARG A 11 3.415 0.697 3.670 1.00 0.00 H ATOM 159 HH12 ARG A 11 4.276 0.034 5.018 1.00 0.00 H ATOM 160 HH21 ARG A 11 7.267 1.598 4.224 1.00 0.00 H ATOM 161 HH22 ARG A 11 6.453 0.543 5.330 1.00 0.00 H ATOM 162 N LEU A 12 0.082 -1.210 -0.090 1.00 0.00 N ATOM 163 CA LEU A 12 -0.921 -2.297 0.056 1.00 0.00 C ATOM 164 C LEU A 12 -0.817 -3.231 -1.144 1.00 0.00 C ATOM 165 O LEU A 12 -0.537 -4.390 -1.012 1.00 0.00 O ATOM 166 CB LEU A 12 -2.225 -1.517 0.061 1.00 0.00 C ATOM 167 CG LEU A 12 -3.452 -2.414 -0.084 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.542 -2.986 -1.502 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.367 -3.543 0.931 1.00 0.00 C ATOM 170 H LEU A 12 -0.227 -0.282 -0.157 1.00 0.00 H ATOM 171 HA LEU A 12 -0.790 -2.829 0.984 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.295 -0.988 0.994 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.202 -0.816 -0.749 1.00 0.00 H ATOM 174 HG LEU A 12 -4.334 -1.822 0.110 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.424 -3.622 -1.583 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.649 -3.575 -1.714 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.617 -2.169 -2.220 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.464 -4.126 0.752 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.241 -4.187 0.833 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.336 -3.126 1.938 1.00 0.00 H ATOM 181 N ALA A 13 -1.014 -2.733 -2.315 1.00 0.00 N ATOM 182 CA ALA A 13 -0.893 -3.596 -3.519 1.00 0.00 C ATOM 183 C ALA A 13 0.410 -4.385 -3.462 1.00 0.00 C ATOM 184 O ALA A 13 0.524 -5.473 -3.987 1.00 0.00 O ATOM 185 CB ALA A 13 -0.819 -2.606 -4.653 1.00 0.00 C ATOM 186 H ALA A 13 -1.227 -1.789 -2.415 1.00 0.00 H ATOM 187 HA ALA A 13 -1.746 -4.243 -3.631 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.727 -3.141 -5.598 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.048 -1.960 -4.516 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.725 -1.999 -4.666 1.00 0.00 H ATOM 191 N ASN A 14 1.386 -3.832 -2.804 1.00 0.00 N ATOM 192 CA ASN A 14 2.688 -4.504 -2.661 1.00 0.00 C ATOM 193 C ASN A 14 2.620 -5.358 -1.417 1.00 0.00 C ATOM 194 O ASN A 14 3.374 -6.293 -1.237 1.00 0.00 O ATOM 195 CB ASN A 14 3.707 -3.375 -2.494 1.00 0.00 C ATOM 196 CG ASN A 14 4.438 -3.143 -3.818 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.080 -3.712 -4.830 1.00 0.00 O ATOM 198 ND2 ASN A 14 5.456 -2.327 -3.853 1.00 0.00 N ATOM 199 H ASN A 14 1.251 -2.977 -2.369 1.00 0.00 H ATOM 200 HA ASN A 14 2.916 -5.094 -3.532 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.195 -2.469 -2.201 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.423 -3.647 -1.732 1.00 0.00 H ATOM 203 HD21 ASN A 14 5.745 -1.866 -3.032 1.00 0.00 H ATOM 204 HD22 ASN A 14 5.932 -2.172 -4.701 1.00 0.00 H ATOM 205 N PHE A 15 1.697 -5.037 -0.551 1.00 0.00 N ATOM 206 CA PHE A 15 1.559 -5.832 0.692 1.00 0.00 C ATOM 207 C PHE A 15 0.508 -6.910 0.460 1.00 0.00 C ATOM 208 O PHE A 15 0.491 -7.957 1.075 1.00 0.00 O ATOM 209 CB PHE A 15 1.140 -4.814 1.774 1.00 0.00 C ATOM 210 CG PHE A 15 -0.137 -5.238 2.476 1.00 0.00 C ATOM 211 CD1 PHE A 15 -1.345 -5.300 1.768 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.111 -5.560 3.835 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.518 -5.688 2.418 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.288 -5.945 4.484 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.492 -6.010 3.776 1.00 0.00 C ATOM 216 H PHE A 15 1.065 -4.284 -0.738 1.00 0.00 H ATOM 217 HA PHE A 15 2.501 -6.268 0.934 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.931 -4.731 2.504 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.986 -3.851 1.311 1.00 0.00 H ATOM 220 HD1 PHE A 15 -1.373 -5.052 0.722 1.00 0.00 H ATOM 221 HD2 PHE A 15 0.817 -5.512 4.381 1.00 0.00 H ATOM 222 HE1 PHE A 15 -3.447 -5.727 1.865 1.00 0.00 H ATOM 223 HE2 PHE A 15 -1.266 -6.188 5.529 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.400 -6.310 4.279 1.00 0.00 H ATOM 225 N LEU A 16 -0.375 -6.607 -0.428 1.00 0.00 N ATOM 226 CA LEU A 16 -1.483 -7.501 -0.779 1.00 0.00 C ATOM 227 C LEU A 16 -1.017 -8.525 -1.807 1.00 0.00 C ATOM 228 O LEU A 16 -1.683 -9.506 -2.080 1.00 0.00 O ATOM 229 CB LEU A 16 -2.479 -6.521 -1.375 1.00 0.00 C ATOM 230 CG LEU A 16 -3.872 -7.100 -1.312 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.477 -6.776 0.053 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.713 -6.467 -2.420 1.00 0.00 C ATOM 233 H LEU A 16 -0.313 -5.742 -0.879 1.00 0.00 H ATOM 234 HA LEU A 16 -1.897 -7.977 0.094 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.451 -5.603 -0.808 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.218 -6.308 -2.397 1.00 0.00 H ATOM 237 HG LEU A 16 -3.821 -8.167 -1.447 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.484 -7.189 0.112 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.520 -5.695 0.185 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.859 -7.213 0.838 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.753 -5.387 -2.275 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.723 -6.875 -2.388 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.263 -6.686 -3.388 1.00 0.00 H ATOM 244 N VAL A 17 0.128 -8.300 -2.379 1.00 0.00 N ATOM 245 CA VAL A 17 0.655 -9.250 -3.393 1.00 0.00 C ATOM 246 C VAL A 17 0.565 -10.685 -2.868 1.00 0.00 C ATOM 247 O VAL A 17 0.168 -11.590 -3.574 1.00 0.00 O ATOM 248 CB VAL A 17 2.118 -8.855 -3.587 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.189 -7.506 -4.296 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.808 -8.749 -2.222 1.00 0.00 C ATOM 251 H VAL A 17 0.638 -7.495 -2.145 1.00 0.00 H ATOM 252 HA VAL A 17 0.118 -9.144 -4.318 1.00 0.00 H ATOM 253 HB VAL A 17 2.615 -9.602 -4.187 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.232 -7.223 -4.435 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.685 -6.751 -3.692 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.700 -7.579 -5.268 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.306 -7.993 -1.618 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.851 -8.467 -2.363 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.758 -9.712 -1.713 1.00 0.00 H ATOM 260 N ARG A 18 0.928 -10.900 -1.632 1.00 0.00 N ATOM 261 CA ARG A 18 0.858 -12.279 -1.069 1.00 0.00 C ATOM 262 C ARG A 18 -0.581 -12.799 -1.121 1.00 0.00 C ATOM 263 O ARG A 18 -0.820 -13.970 -1.342 1.00 0.00 O ATOM 264 CB ARG A 18 1.328 -12.145 0.380 1.00 0.00 C ATOM 265 CG ARG A 18 0.421 -11.162 1.123 1.00 0.00 C ATOM 266 CD ARG A 18 0.831 -11.104 2.597 1.00 0.00 C ATOM 267 NE ARG A 18 2.182 -10.476 2.594 1.00 0.00 N ATOM 268 CZ ARG A 18 2.843 -10.337 3.711 1.00 0.00 C ATOM 269 NH1 ARG A 18 2.330 -10.753 4.836 1.00 0.00 N ATOM 270 NH2 ARG A 18 4.026 -9.785 3.698 1.00 0.00 N ATOM 271 H ARG A 18 1.244 -10.156 -1.075 1.00 0.00 H ATOM 272 HA ARG A 18 1.518 -12.940 -1.610 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.286 -13.110 0.864 1.00 0.00 H ATOM 274 HB3 ARG A 18 2.344 -11.776 0.398 1.00 0.00 H ATOM 275 HG2 ARG A 18 0.518 -10.181 0.683 1.00 0.00 H ATOM 276 HG3 ARG A 18 -0.604 -11.490 1.049 1.00 0.00 H ATOM 277 HD2 ARG A 18 0.133 -10.498 3.157 1.00 0.00 H ATOM 278 HD3 ARG A 18 0.887 -12.098 3.012 1.00 0.00 H ATOM 279 HE ARG A 18 2.573 -10.166 1.751 1.00 0.00 H ATOM 280 HH11 ARG A 18 1.425 -11.180 4.848 1.00 0.00 H ATOM 281 HH12 ARG A 18 2.842 -10.646 5.688 1.00 0.00 H ATOM 282 HH21 ARG A 18 4.421 -9.468 2.837 1.00 0.00 H ATOM 283 HH22 ARG A 18 4.535 -9.675 4.553 1.00 0.00 H ATOM 284 N SER A 19 -1.542 -11.938 -0.924 1.00 0.00 N ATOM 285 CA SER A 19 -2.965 -12.385 -0.965 1.00 0.00 C ATOM 286 C SER A 19 -3.191 -13.535 0.020 1.00 0.00 C ATOM 287 O SER A 19 -2.252 -14.141 0.499 1.00 0.00 O ATOM 288 CB SER A 19 -3.188 -12.852 -2.405 1.00 0.00 C ATOM 289 OG SER A 19 -3.740 -14.163 -2.399 1.00 0.00 O ATOM 290 H SER A 19 -1.329 -10.998 -0.749 1.00 0.00 H ATOM 291 HA SER A 19 -3.624 -11.562 -0.741 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.871 -12.183 -2.901 1.00 0.00 H ATOM 293 HB3 SER A 19 -2.243 -12.851 -2.932 1.00 0.00 H ATOM 294 HG SER A 19 -4.605 -14.118 -1.988 1.00 0.00 H HETATM 295 N NH2 A 20 -4.411 -13.864 0.348 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.569 -14.598 0.979 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -5.170 -13.377 -0.036 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 14 ATOM 1 N LYS A 1 1.602 12.931 2.900 1.00 0.00 N ATOM 2 CA LYS A 1 0.491 12.185 3.558 1.00 0.00 C ATOM 3 C LYS A 1 -0.166 11.222 2.565 1.00 0.00 C ATOM 4 O LYS A 1 -1.024 10.441 2.921 1.00 0.00 O ATOM 5 CB LYS A 1 -0.503 13.262 3.994 1.00 0.00 C ATOM 6 CG LYS A 1 -0.990 14.034 2.766 1.00 0.00 C ATOM 7 CD LYS A 1 -2.514 14.160 2.812 1.00 0.00 C ATOM 8 CE LYS A 1 -2.999 14.942 1.587 1.00 0.00 C ATOM 9 NZ LYS A 1 -3.951 14.025 0.899 1.00 0.00 N ATOM 10 H1 LYS A 1 2.316 12.257 2.555 1.00 0.00 H ATOM 11 H2 LYS A 1 2.040 13.579 3.587 1.00 0.00 H ATOM 12 H3 LYS A 1 1.227 13.476 2.099 1.00 0.00 H ATOM 13 HA LYS A 1 0.855 11.649 4.420 1.00 0.00 H ATOM 14 HB2 LYS A 1 -1.346 12.796 4.485 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.020 13.944 4.678 1.00 0.00 H ATOM 16 HG2 LYS A 1 -0.547 15.020 2.762 1.00 0.00 H ATOM 17 HG3 LYS A 1 -0.701 13.505 1.870 1.00 0.00 H ATOM 18 HD2 LYS A 1 -2.957 13.175 2.809 1.00 0.00 H ATOM 19 HD3 LYS A 1 -2.807 14.685 3.709 1.00 0.00 H ATOM 20 HE2 LYS A 1 -3.503 15.848 1.895 1.00 0.00 H ATOM 21 HE3 LYS A 1 -2.171 15.173 0.935 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -3.426 13.391 0.265 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -4.632 14.584 0.347 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -4.459 13.457 1.607 1.00 0.00 H ATOM 25 N CYS A 2 0.228 11.277 1.322 1.00 0.00 N ATOM 26 CA CYS A 2 -0.377 10.364 0.310 1.00 0.00 C ATOM 27 C CYS A 2 -0.253 8.910 0.760 1.00 0.00 C ATOM 28 O CYS A 2 -1.203 8.153 0.719 1.00 0.00 O ATOM 29 CB CYS A 2 0.429 10.591 -0.970 1.00 0.00 C ATOM 30 SG CYS A 2 -0.380 9.741 -2.350 1.00 0.00 S ATOM 31 H CYS A 2 0.921 11.916 1.055 1.00 0.00 H ATOM 32 HA CYS A 2 -1.412 10.621 0.142 1.00 0.00 H ATOM 33 HB2 CYS A 2 0.481 11.650 -1.180 1.00 0.00 H ATOM 34 HB3 CYS A 2 1.427 10.200 -0.841 1.00 0.00 H ATOM 35 N ASN A 3 0.915 8.505 1.182 1.00 0.00 N ATOM 36 CA ASN A 3 1.099 7.093 1.621 1.00 0.00 C ATOM 37 C ASN A 3 -0.056 6.673 2.528 1.00 0.00 C ATOM 38 O ASN A 3 -0.410 5.514 2.605 1.00 0.00 O ATOM 39 CB ASN A 3 2.418 7.084 2.395 1.00 0.00 C ATOM 40 CG ASN A 3 3.563 6.704 1.453 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.074 7.538 0.733 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.988 5.471 1.430 1.00 0.00 N ATOM 43 H ASN A 3 1.671 9.128 1.200 1.00 0.00 H ATOM 44 HA ASN A 3 1.168 6.437 0.768 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.600 8.066 2.806 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.360 6.364 3.196 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.574 4.796 2.014 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.726 5.218 0.826 1.00 0.00 H ATOM 49 N THR A 4 -0.638 7.608 3.220 1.00 0.00 N ATOM 50 CA THR A 4 -1.763 7.270 4.134 1.00 0.00 C ATOM 51 C THR A 4 -3.028 6.894 3.352 1.00 0.00 C ATOM 52 O THR A 4 -3.572 5.820 3.521 1.00 0.00 O ATOM 53 CB THR A 4 -2.002 8.546 4.943 1.00 0.00 C ATOM 54 OG1 THR A 4 -0.758 9.189 5.190 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.667 8.194 6.274 1.00 0.00 C ATOM 56 H THR A 4 -0.328 8.536 3.146 1.00 0.00 H ATOM 57 HA THR A 4 -1.479 6.470 4.796 1.00 0.00 H ATOM 58 HB THR A 4 -2.646 9.211 4.388 1.00 0.00 H ATOM 59 HG1 THR A 4 -0.792 10.062 4.793 1.00 0.00 H ATOM 60 HG21 THR A 4 -3.621 7.702 6.085 1.00 0.00 H ATOM 61 HG22 THR A 4 -2.836 9.105 6.848 1.00 0.00 H ATOM 62 HG23 THR A 4 -2.019 7.524 6.839 1.00 0.00 H ATOM 63 N ALA A 5 -3.526 7.779 2.527 1.00 0.00 N ATOM 64 CA ALA A 5 -4.783 7.468 1.780 1.00 0.00 C ATOM 65 C ALA A 5 -4.533 7.044 0.322 1.00 0.00 C ATOM 66 O ALA A 5 -4.784 5.917 -0.057 1.00 0.00 O ATOM 67 CB ALA A 5 -5.583 8.769 1.815 1.00 0.00 C ATOM 68 H ALA A 5 -3.095 8.652 2.423 1.00 0.00 H ATOM 69 HA ALA A 5 -5.336 6.699 2.294 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.526 8.630 1.287 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.010 9.561 1.333 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.784 9.045 2.850 1.00 0.00 H ATOM 73 N THR A 6 -4.099 7.956 -0.511 1.00 0.00 N ATOM 74 CA THR A 6 -3.904 7.624 -1.959 1.00 0.00 C ATOM 75 C THR A 6 -2.702 6.704 -2.205 1.00 0.00 C ATOM 76 O THR A 6 -2.816 5.702 -2.881 1.00 0.00 O ATOM 77 CB THR A 6 -3.682 8.974 -2.639 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.284 9.933 -1.668 1.00 0.00 O ATOM 79 CG2 THR A 6 -4.981 9.430 -3.306 1.00 0.00 C ATOM 80 H THR A 6 -3.946 8.871 -0.195 1.00 0.00 H ATOM 81 HA THR A 6 -4.798 7.170 -2.355 1.00 0.00 H ATOM 82 HB THR A 6 -2.912 8.878 -3.388 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.220 10.786 -2.103 1.00 0.00 H ATOM 84 HG21 THR A 6 -5.285 8.694 -4.051 1.00 0.00 H ATOM 85 HG22 THR A 6 -4.822 10.393 -3.791 1.00 0.00 H ATOM 86 HG23 THR A 6 -5.762 9.528 -2.552 1.00 0.00 H ATOM 87 N CYS A 7 -1.552 7.031 -1.691 1.00 0.00 N ATOM 88 CA CYS A 7 -0.369 6.158 -1.942 1.00 0.00 C ATOM 89 C CYS A 7 -0.392 4.952 -0.998 1.00 0.00 C ATOM 90 O CYS A 7 0.410 4.047 -1.113 1.00 0.00 O ATOM 91 CB CYS A 7 0.854 7.038 -1.684 1.00 0.00 C ATOM 92 SG CYS A 7 0.953 8.339 -2.944 1.00 0.00 S ATOM 93 H CYS A 7 -1.462 7.846 -1.156 1.00 0.00 H ATOM 94 HA CYS A 7 -0.368 5.825 -2.967 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.773 7.486 -0.713 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.748 6.433 -1.726 1.00 0.00 H ATOM 97 N ALA A 8 -1.311 4.927 -0.073 1.00 0.00 N ATOM 98 CA ALA A 8 -1.391 3.774 0.869 1.00 0.00 C ATOM 99 C ALA A 8 -1.758 2.499 0.105 1.00 0.00 C ATOM 100 O ALA A 8 -1.483 1.399 0.540 1.00 0.00 O ATOM 101 CB ALA A 8 -2.497 4.144 1.857 1.00 0.00 C ATOM 102 H ALA A 8 -1.955 5.664 -0.002 1.00 0.00 H ATOM 103 HA ALA A 8 -0.456 3.647 1.392 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.617 3.342 2.586 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.433 4.288 1.318 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.230 5.066 2.373 1.00 0.00 H ATOM 107 N THR A 9 -2.376 2.643 -1.038 1.00 0.00 N ATOM 108 CA THR A 9 -2.760 1.448 -1.841 1.00 0.00 C ATOM 109 C THR A 9 -1.529 0.905 -2.569 1.00 0.00 C ATOM 110 O THR A 9 -1.369 -0.283 -2.755 1.00 0.00 O ATOM 111 CB THR A 9 -3.795 1.963 -2.844 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.764 2.746 -2.159 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.481 0.781 -3.528 1.00 0.00 C ATOM 114 H THR A 9 -2.581 3.540 -1.369 1.00 0.00 H ATOM 115 HA THR A 9 -3.198 0.691 -1.212 1.00 0.00 H ATOM 116 HB THR A 9 -3.303 2.570 -3.589 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.432 2.151 -1.810 1.00 0.00 H ATOM 118 HG21 THR A 9 -3.737 0.182 -4.053 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.217 1.151 -4.242 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.979 0.166 -2.779 1.00 0.00 H ATOM 121 N GLN A 10 -0.656 1.779 -2.974 1.00 0.00 N ATOM 122 CA GLN A 10 0.580 1.338 -3.686 1.00 0.00 C ATOM 123 C GLN A 10 1.401 0.432 -2.761 1.00 0.00 C ATOM 124 O GLN A 10 1.669 -0.710 -3.077 1.00 0.00 O ATOM 125 CB GLN A 10 1.316 2.647 -4.018 1.00 0.00 C ATOM 126 CG GLN A 10 2.832 2.460 -3.911 1.00 0.00 C ATOM 127 CD GLN A 10 3.528 3.808 -4.108 1.00 0.00 C ATOM 128 OE1 GLN A 10 4.062 4.081 -5.165 1.00 0.00 O ATOM 129 NE2 GLN A 10 3.542 4.669 -3.127 1.00 0.00 N ATOM 130 H GLN A 10 -0.810 2.728 -2.802 1.00 0.00 H ATOM 131 HA GLN A 10 0.325 0.813 -4.592 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.066 2.950 -5.024 1.00 0.00 H ATOM 133 HB3 GLN A 10 1.003 3.416 -3.327 1.00 0.00 H ATOM 134 HG2 GLN A 10 3.076 2.071 -2.934 1.00 0.00 H ATOM 135 HG3 GLN A 10 3.167 1.770 -4.671 1.00 0.00 H ATOM 136 HE21 GLN A 10 3.108 4.447 -2.272 1.00 0.00 H ATOM 137 HE22 GLN A 10 3.987 5.539 -3.244 1.00 0.00 H ATOM 138 N ARG A 11 1.776 0.922 -1.612 1.00 0.00 N ATOM 139 CA ARG A 11 2.546 0.067 -0.668 1.00 0.00 C ATOM 140 C ARG A 11 1.671 -1.124 -0.299 1.00 0.00 C ATOM 141 O ARG A 11 2.142 -2.200 0.015 1.00 0.00 O ATOM 142 CB ARG A 11 2.809 0.950 0.552 1.00 0.00 C ATOM 143 CG ARG A 11 3.958 1.913 0.247 1.00 0.00 C ATOM 144 CD ARG A 11 5.293 1.233 0.563 1.00 0.00 C ATOM 145 NE ARG A 11 5.656 1.714 1.925 1.00 0.00 N ATOM 146 CZ ARG A 11 6.892 1.638 2.340 1.00 0.00 C ATOM 147 NH1 ARG A 11 7.815 1.138 1.564 1.00 0.00 N ATOM 148 NH2 ARG A 11 7.205 2.063 3.533 1.00 0.00 N ATOM 149 H ARG A 11 1.532 1.835 -1.361 1.00 0.00 H ATOM 150 HA ARG A 11 3.474 -0.257 -1.112 1.00 0.00 H ATOM 151 HB2 ARG A 11 1.918 1.514 0.787 1.00 0.00 H ATOM 152 HB3 ARG A 11 3.075 0.330 1.395 1.00 0.00 H ATOM 153 HG2 ARG A 11 3.930 2.186 -0.798 1.00 0.00 H ATOM 154 HG3 ARG A 11 3.854 2.800 0.854 1.00 0.00 H ATOM 155 HD2 ARG A 11 5.176 0.159 0.559 1.00 0.00 H ATOM 156 HD3 ARG A 11 6.045 1.535 -0.148 1.00 0.00 H ATOM 157 HE ARG A 11 4.966 2.089 2.512 1.00 0.00 H ATOM 158 HH11 ARG A 11 7.580 0.811 0.649 1.00 0.00 H ATOM 159 HH12 ARG A 11 8.762 1.083 1.885 1.00 0.00 H ATOM 160 HH21 ARG A 11 6.499 2.445 4.130 1.00 0.00 H ATOM 161 HH22 ARG A 11 8.150 2.007 3.853 1.00 0.00 H ATOM 162 N LEU A 12 0.383 -0.923 -0.355 1.00 0.00 N ATOM 163 CA LEU A 12 -0.576 -2.008 -0.034 1.00 0.00 C ATOM 164 C LEU A 12 -0.562 -3.035 -1.153 1.00 0.00 C ATOM 165 O LEU A 12 -0.385 -4.200 -0.925 1.00 0.00 O ATOM 166 CB LEU A 12 -1.904 -1.272 0.077 1.00 0.00 C ATOM 167 CG LEU A 12 -3.113 -2.175 -0.194 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.231 -2.506 -1.685 1.00 0.00 C ATOM 169 CD2 LEU A 12 -2.987 -3.462 0.610 1.00 0.00 C ATOM 170 H LEU A 12 0.045 -0.043 -0.623 1.00 0.00 H ATOM 171 HA LEU A 12 -0.320 -2.465 0.900 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.987 -0.876 1.075 1.00 0.00 H ATOM 173 HB3 LEU A 12 -1.901 -0.463 -0.627 1.00 0.00 H ATOM 174 HG LEU A 12 -4.003 -1.648 0.112 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.097 -3.148 -1.848 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.330 -3.022 -2.016 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.350 -1.584 -2.254 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.075 -3.984 0.320 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.849 -4.100 0.413 1.00 0.00 H ATOM 180 HD23 LEU A 12 -2.946 -3.224 1.673 1.00 0.00 H ATOM 181 N ALA A 13 -0.695 -2.617 -2.364 1.00 0.00 N ATOM 182 CA ALA A 13 -0.634 -3.585 -3.482 1.00 0.00 C ATOM 183 C ALA A 13 0.633 -4.418 -3.349 1.00 0.00 C ATOM 184 O ALA A 13 0.708 -5.545 -3.791 1.00 0.00 O ATOM 185 CB ALA A 13 -0.528 -2.713 -4.707 1.00 0.00 C ATOM 186 H ALA A 13 -0.810 -1.670 -2.545 1.00 0.00 H ATOM 187 HA ALA A 13 -1.516 -4.203 -3.524 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.477 -3.340 -5.597 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.372 -2.102 -4.642 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.403 -2.066 -4.770 1.00 0.00 H ATOM 191 N ASN A 14 1.624 -3.854 -2.721 1.00 0.00 N ATOM 192 CA ASN A 14 2.895 -4.565 -2.508 1.00 0.00 C ATOM 193 C ASN A 14 2.776 -5.322 -1.205 1.00 0.00 C ATOM 194 O ASN A 14 3.476 -6.280 -0.954 1.00 0.00 O ATOM 195 CB ASN A 14 3.960 -3.472 -2.416 1.00 0.00 C ATOM 196 CG ASN A 14 4.510 -3.179 -3.812 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.706 -3.080 -3.998 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.681 -3.035 -4.808 1.00 0.00 N ATOM 199 H ASN A 14 1.517 -2.960 -2.353 1.00 0.00 H ATOM 200 HA ASN A 14 3.105 -5.232 -3.328 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.519 -2.575 -2.006 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.763 -3.804 -1.777 1.00 0.00 H ATOM 203 HD21 ASN A 14 2.711 -3.115 -4.655 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.024 -2.847 -5.711 1.00 0.00 H ATOM 205 N PHE A 15 1.860 -4.902 -0.377 1.00 0.00 N ATOM 206 CA PHE A 15 1.674 -5.616 0.906 1.00 0.00 C ATOM 207 C PHE A 15 0.606 -6.674 0.680 1.00 0.00 C ATOM 208 O PHE A 15 0.609 -7.751 1.244 1.00 0.00 O ATOM 209 CB PHE A 15 1.241 -4.540 1.933 1.00 0.00 C ATOM 210 CG PHE A 15 -0.045 -4.931 2.656 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.183 -6.204 3.226 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.103 -4.015 2.745 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.370 -6.556 3.876 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.287 -4.368 3.394 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.423 -5.639 3.959 1.00 0.00 C ATOM 216 H PHE A 15 1.267 -4.135 -0.623 1.00 0.00 H ATOM 217 HA PHE A 15 2.597 -6.063 1.195 1.00 0.00 H ATOM 218 HB2 PHE A 15 2.027 -4.411 2.661 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.085 -3.604 1.416 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.628 -6.915 3.162 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.008 -3.037 2.316 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.475 -7.536 4.305 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.100 -3.657 3.452 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.338 -5.912 4.462 1.00 0.00 H ATOM 225 N LEU A 16 -0.310 -6.324 -0.149 1.00 0.00 N ATOM 226 CA LEU A 16 -1.439 -7.194 -0.491 1.00 0.00 C ATOM 227 C LEU A 16 -0.988 -8.301 -1.439 1.00 0.00 C ATOM 228 O LEU A 16 -1.697 -9.257 -1.680 1.00 0.00 O ATOM 229 CB LEU A 16 -2.373 -6.214 -1.182 1.00 0.00 C ATOM 230 CG LEU A 16 -3.793 -6.718 -1.093 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.331 -6.421 0.305 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.635 -5.996 -2.143 1.00 0.00 C ATOM 233 H LEU A 16 -0.256 -5.437 -0.562 1.00 0.00 H ATOM 234 HA LEU A 16 -1.906 -7.597 0.392 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.306 -5.257 -0.688 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.088 -6.099 -2.212 1.00 0.00 H ATOM 237 HG LEU A 16 -3.804 -7.781 -1.271 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.357 -6.780 0.384 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.308 -5.346 0.483 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.712 -6.925 1.048 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.611 -4.923 -1.954 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.664 -6.350 -2.090 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.232 -6.199 -3.135 1.00 0.00 H ATOM 244 N VAL A 17 0.193 -8.179 -1.972 1.00 0.00 N ATOM 245 CA VAL A 17 0.697 -9.227 -2.899 1.00 0.00 C ATOM 246 C VAL A 17 0.515 -10.605 -2.261 1.00 0.00 C ATOM 247 O VAL A 17 0.324 -11.596 -2.938 1.00 0.00 O ATOM 248 CB VAL A 17 2.182 -8.920 -3.092 1.00 0.00 C ATOM 249 CG1 VAL A 17 2.794 -9.937 -4.057 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.340 -7.514 -3.666 1.00 0.00 C ATOM 251 H VAL A 17 0.746 -7.399 -1.761 1.00 0.00 H ATOM 252 HA VAL A 17 0.182 -9.171 -3.845 1.00 0.00 H ATOM 253 HB VAL A 17 2.688 -8.982 -2.138 1.00 0.00 H ATOM 254 HG11 VAL A 17 3.853 -9.717 -4.194 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.284 -9.879 -5.019 1.00 0.00 H ATOM 256 HG13 VAL A 17 2.682 -10.941 -3.647 1.00 0.00 H ATOM 257 HG21 VAL A 17 1.829 -7.454 -4.627 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.399 -7.294 -3.804 1.00 0.00 H ATOM 259 HG23 VAL A 17 1.906 -6.789 -2.978 1.00 0.00 H ATOM 260 N ARG A 18 0.566 -10.670 -0.957 1.00 0.00 N ATOM 261 CA ARG A 18 0.390 -11.979 -0.268 1.00 0.00 C ATOM 262 C ARG A 18 -0.850 -12.693 -0.807 1.00 0.00 C ATOM 263 O ARG A 18 -0.800 -13.847 -1.185 1.00 0.00 O ATOM 264 CB ARG A 18 0.206 -11.624 1.208 1.00 0.00 C ATOM 265 CG ARG A 18 1.362 -12.204 2.022 1.00 0.00 C ATOM 266 CD ARG A 18 1.553 -11.377 3.295 1.00 0.00 C ATOM 267 NE ARG A 18 1.229 -12.308 4.409 1.00 0.00 N ATOM 268 CZ ARG A 18 1.387 -11.930 5.648 1.00 0.00 C ATOM 269 NH1 ARG A 18 1.825 -10.729 5.918 1.00 0.00 N ATOM 270 NH2 ARG A 18 1.106 -12.753 6.621 1.00 0.00 N ATOM 271 H ARG A 18 0.720 -9.855 -0.433 1.00 0.00 H ATOM 272 HA ARG A 18 1.267 -12.595 -0.393 1.00 0.00 H ATOM 273 HB2 ARG A 18 0.187 -10.550 1.320 1.00 0.00 H ATOM 274 HB3 ARG A 18 -0.726 -12.039 1.564 1.00 0.00 H ATOM 275 HG2 ARG A 18 1.140 -13.227 2.287 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.269 -12.173 1.436 1.00 0.00 H ATOM 277 HD2 ARG A 18 2.577 -11.035 3.371 1.00 0.00 H ATOM 278 HD3 ARG A 18 0.873 -10.539 3.304 1.00 0.00 H ATOM 279 HE ARG A 18 0.897 -13.209 4.212 1.00 0.00 H ATOM 280 HH11 ARG A 18 2.041 -10.096 5.175 1.00 0.00 H ATOM 281 HH12 ARG A 18 1.946 -10.443 6.868 1.00 0.00 H ATOM 282 HH21 ARG A 18 0.770 -13.672 6.415 1.00 0.00 H ATOM 283 HH22 ARG A 18 1.225 -12.464 7.571 1.00 0.00 H ATOM 284 N SER A 19 -1.964 -12.014 -0.847 1.00 0.00 N ATOM 285 CA SER A 19 -3.210 -12.649 -1.364 1.00 0.00 C ATOM 286 C SER A 19 -3.542 -13.907 -0.557 1.00 0.00 C ATOM 287 O SER A 19 -4.329 -14.730 -0.979 1.00 0.00 O ATOM 288 CB SER A 19 -2.899 -13.010 -2.816 1.00 0.00 C ATOM 289 OG SER A 19 -3.609 -12.133 -3.681 1.00 0.00 O ATOM 290 H SER A 19 -1.980 -11.083 -0.539 1.00 0.00 H ATOM 291 HA SER A 19 -4.031 -11.950 -1.327 1.00 0.00 H ATOM 292 HB2 SER A 19 -1.842 -12.906 -2.996 1.00 0.00 H ATOM 293 HB3 SER A 19 -3.193 -14.034 -3.003 1.00 0.00 H ATOM 294 HG SER A 19 -4.548 -12.268 -3.533 1.00 0.00 H HETATM 295 N NH2 A 20 -2.969 -14.092 0.602 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.176 -14.893 1.127 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -2.334 -13.430 0.945 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 15 ATOM 1 N LYS A 1 1.915 11.905 3.627 1.00 0.00 N ATOM 2 CA LYS A 1 0.790 12.564 2.904 1.00 0.00 C ATOM 3 C LYS A 1 0.012 11.531 2.084 1.00 0.00 C ATOM 4 O LYS A 1 -1.085 11.141 2.440 1.00 0.00 O ATOM 5 CB LYS A 1 1.457 13.589 1.985 1.00 0.00 C ATOM 6 CG LYS A 1 1.488 14.953 2.678 1.00 0.00 C ATOM 7 CD LYS A 1 2.940 15.407 2.849 1.00 0.00 C ATOM 8 CE LYS A 1 2.969 16.800 3.482 1.00 0.00 C ATOM 9 NZ LYS A 1 2.087 17.632 2.616 1.00 0.00 N ATOM 10 H1 LYS A 1 2.482 11.352 2.955 1.00 0.00 H ATOM 11 H2 LYS A 1 1.532 11.274 4.361 1.00 0.00 H ATOM 12 H3 LYS A 1 2.515 12.628 4.071 1.00 0.00 H ATOM 13 HA LYS A 1 0.136 13.065 3.601 1.00 0.00 H ATOM 14 HB2 LYS A 1 2.466 13.272 1.766 1.00 0.00 H ATOM 15 HB3 LYS A 1 0.895 13.667 1.066 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.953 15.675 2.076 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.021 14.875 3.647 1.00 0.00 H ATOM 18 HD2 LYS A 1 3.462 14.708 3.487 1.00 0.00 H ATOM 19 HD3 LYS A 1 3.421 15.443 1.883 1.00 0.00 H ATOM 20 HE2 LYS A 1 2.580 16.762 4.490 1.00 0.00 H ATOM 21 HE3 LYS A 1 3.972 17.196 3.476 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.092 17.421 2.829 1.00 0.00 H ATOM 23 HZ2 LYS A 1 2.282 17.418 1.616 1.00 0.00 H ATOM 24 HZ3 LYS A 1 2.272 18.639 2.798 1.00 0.00 H ATOM 25 N CYS A 2 0.567 11.081 0.991 1.00 0.00 N ATOM 26 CA CYS A 2 -0.146 10.073 0.154 1.00 0.00 C ATOM 27 C CYS A 2 -0.058 8.692 0.812 1.00 0.00 C ATOM 28 O CYS A 2 -0.940 7.867 0.669 1.00 0.00 O ATOM 29 CB CYS A 2 0.578 10.089 -1.200 1.00 0.00 C ATOM 30 SG CYS A 2 2.137 9.170 -1.096 1.00 0.00 S ATOM 31 H CYS A 2 1.450 11.407 0.720 1.00 0.00 H ATOM 32 HA CYS A 2 -1.177 10.359 0.022 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.051 9.634 -1.947 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.784 11.112 -1.482 1.00 0.00 H ATOM 35 N ASN A 3 1.000 8.436 1.535 1.00 0.00 N ATOM 36 CA ASN A 3 1.151 7.111 2.206 1.00 0.00 C ATOM 37 C ASN A 3 -0.157 6.714 2.885 1.00 0.00 C ATOM 38 O ASN A 3 -0.535 5.560 2.909 1.00 0.00 O ATOM 39 CB ASN A 3 2.246 7.328 3.248 1.00 0.00 C ATOM 40 CG ASN A 3 3.464 6.477 2.889 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.111 5.926 3.757 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.804 6.343 1.636 1.00 0.00 N ATOM 43 H ASN A 3 1.697 9.116 1.638 1.00 0.00 H ATOM 44 HA ASN A 3 1.460 6.354 1.505 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.524 8.371 3.265 1.00 0.00 H ATOM 46 HB3 ASN A 3 1.879 7.037 4.222 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.276 6.787 0.934 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.585 5.795 1.395 1.00 0.00 H ATOM 49 N THR A 4 -0.842 7.666 3.447 1.00 0.00 N ATOM 50 CA THR A 4 -2.120 7.359 4.142 1.00 0.00 C ATOM 51 C THR A 4 -3.244 7.007 3.157 1.00 0.00 C ATOM 52 O THR A 4 -3.842 5.954 3.243 1.00 0.00 O ATOM 53 CB THR A 4 -2.467 8.643 4.895 1.00 0.00 C ATOM 54 OG1 THR A 4 -2.442 9.738 3.991 1.00 0.00 O ATOM 55 CG2 THR A 4 -1.445 8.876 6.009 1.00 0.00 C ATOM 56 H THR A 4 -0.510 8.587 3.420 1.00 0.00 H ATOM 57 HA THR A 4 -1.978 6.556 4.847 1.00 0.00 H ATOM 58 HB THR A 4 -3.451 8.553 5.327 1.00 0.00 H ATOM 59 HG1 THR A 4 -3.338 10.074 3.908 1.00 0.00 H ATOM 60 HG21 THR A 4 -1.463 8.034 6.701 1.00 0.00 H ATOM 61 HG22 THR A 4 -1.694 9.792 6.545 1.00 0.00 H ATOM 62 HG23 THR A 4 -0.449 8.968 5.576 1.00 0.00 H ATOM 63 N ALA A 5 -3.572 7.896 2.252 1.00 0.00 N ATOM 64 CA ALA A 5 -4.703 7.610 1.315 1.00 0.00 C ATOM 65 C ALA A 5 -4.247 7.144 -0.079 1.00 0.00 C ATOM 66 O ALA A 5 -4.464 6.011 -0.462 1.00 0.00 O ATOM 67 CB ALA A 5 -5.447 8.940 1.204 1.00 0.00 C ATOM 68 H ALA A 5 -3.108 8.759 2.217 1.00 0.00 H ATOM 69 HA ALA A 5 -5.361 6.875 1.748 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.298 8.826 0.533 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.774 9.702 0.810 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.801 9.242 2.190 1.00 0.00 H ATOM 73 N THR A 6 -3.670 8.019 -0.860 1.00 0.00 N ATOM 74 CA THR A 6 -3.266 7.629 -2.249 1.00 0.00 C ATOM 75 C THR A 6 -2.206 6.525 -2.263 1.00 0.00 C ATOM 76 O THR A 6 -2.354 5.529 -2.944 1.00 0.00 O ATOM 77 CB THR A 6 -2.703 8.908 -2.867 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.632 9.968 -2.687 1.00 0.00 O ATOM 79 CG2 THR A 6 -2.458 8.689 -4.361 1.00 0.00 C ATOM 80 H THR A 6 -3.540 8.941 -0.552 1.00 0.00 H ATOM 81 HA THR A 6 -4.133 7.315 -2.809 1.00 0.00 H ATOM 82 HB THR A 6 -1.774 9.160 -2.387 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.316 10.519 -1.967 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.745 7.876 -4.497 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.056 9.602 -4.801 1.00 0.00 H ATOM 86 HG23 THR A 6 -3.398 8.433 -4.850 1.00 0.00 H ATOM 87 N CYS A 7 -1.137 6.686 -1.539 1.00 0.00 N ATOM 88 CA CYS A 7 -0.083 5.633 -1.552 1.00 0.00 C ATOM 89 C CYS A 7 -0.499 4.449 -0.672 1.00 0.00 C ATOM 90 O CYS A 7 0.113 3.400 -0.699 1.00 0.00 O ATOM 91 CB CYS A 7 1.167 6.311 -0.996 1.00 0.00 C ATOM 92 SG CYS A 7 1.801 7.508 -2.196 1.00 0.00 S ATOM 93 H CYS A 7 -1.020 7.497 -1.002 1.00 0.00 H ATOM 94 HA CYS A 7 0.101 5.300 -2.561 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.916 6.822 -0.089 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.924 5.567 -0.795 1.00 0.00 H ATOM 97 N ALA A 8 -1.539 4.605 0.103 1.00 0.00 N ATOM 98 CA ALA A 8 -1.992 3.479 0.972 1.00 0.00 C ATOM 99 C ALA A 8 -2.259 2.239 0.117 1.00 0.00 C ATOM 100 O ALA A 8 -1.973 1.125 0.512 1.00 0.00 O ATOM 101 CB ALA A 8 -3.285 3.966 1.625 1.00 0.00 C ATOM 102 H ALA A 8 -2.025 5.455 0.109 1.00 0.00 H ATOM 103 HA ALA A 8 -1.254 3.265 1.729 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.677 3.188 2.280 1.00 0.00 H ATOM 105 HB2 ALA A 8 -4.019 4.194 0.852 1.00 0.00 H ATOM 106 HB3 ALA A 8 -3.082 4.864 2.209 1.00 0.00 H ATOM 107 N THR A 9 -2.795 2.425 -1.059 1.00 0.00 N ATOM 108 CA THR A 9 -3.068 1.264 -1.950 1.00 0.00 C ATOM 109 C THR A 9 -1.760 0.808 -2.596 1.00 0.00 C ATOM 110 O THR A 9 -1.546 -0.360 -2.842 1.00 0.00 O ATOM 111 CB THR A 9 -4.047 1.790 -3.006 1.00 0.00 C ATOM 112 OG1 THR A 9 -5.365 1.766 -2.477 1.00 0.00 O ATOM 113 CG2 THR A 9 -3.985 0.912 -4.259 1.00 0.00 C ATOM 114 H THR A 9 -3.004 3.333 -1.360 1.00 0.00 H ATOM 115 HA THR A 9 -3.520 0.460 -1.393 1.00 0.00 H ATOM 116 HB THR A 9 -3.781 2.803 -3.268 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.610 0.846 -2.340 1.00 0.00 H ATOM 118 HG21 THR A 9 -2.974 0.930 -4.666 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.683 1.292 -5.005 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.253 -0.112 -3.999 1.00 0.00 H ATOM 121 N GLN A 10 -0.888 1.735 -2.869 1.00 0.00 N ATOM 122 CA GLN A 10 0.418 1.377 -3.498 1.00 0.00 C ATOM 123 C GLN A 10 1.202 0.468 -2.549 1.00 0.00 C ATOM 124 O GLN A 10 1.534 -0.653 -2.879 1.00 0.00 O ATOM 125 CB GLN A 10 1.128 2.725 -3.710 1.00 0.00 C ATOM 126 CG GLN A 10 2.643 2.570 -3.524 1.00 0.00 C ATOM 127 CD GLN A 10 3.357 3.813 -4.058 1.00 0.00 C ATOM 128 OE1 GLN A 10 4.110 4.448 -3.346 1.00 0.00 O ATOM 129 NE2 GLN A 10 3.154 4.187 -5.291 1.00 0.00 N ATOM 130 H GLN A 10 -1.090 2.666 -2.656 1.00 0.00 H ATOM 131 HA GLN A 10 0.258 0.888 -4.446 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.927 3.078 -4.710 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.753 3.442 -2.995 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.862 2.452 -2.472 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.985 1.699 -4.062 1.00 0.00 H ATOM 136 HE21 GLN A 10 2.545 3.670 -5.866 1.00 0.00 H ATOM 137 HE22 GLN A 10 3.610 4.985 -5.643 1.00 0.00 H ATOM 138 N ARG A 11 1.474 0.931 -1.360 1.00 0.00 N ATOM 139 CA ARG A 11 2.203 0.079 -0.385 1.00 0.00 C ATOM 140 C ARG A 11 1.352 -1.154 -0.112 1.00 0.00 C ATOM 141 O ARG A 11 1.839 -2.220 0.208 1.00 0.00 O ATOM 142 CB ARG A 11 2.338 0.940 0.870 1.00 0.00 C ATOM 143 CG ARG A 11 3.476 0.407 1.739 1.00 0.00 C ATOM 144 CD ARG A 11 2.898 -0.174 3.031 1.00 0.00 C ATOM 145 NE ARG A 11 3.183 -1.633 2.954 1.00 0.00 N ATOM 146 CZ ARG A 11 4.381 -2.081 3.223 1.00 0.00 C ATOM 147 NH1 ARG A 11 5.332 -1.253 3.561 1.00 0.00 N ATOM 148 NH2 ARG A 11 4.628 -3.360 3.151 1.00 0.00 N ATOM 149 H ARG A 11 1.178 1.827 -1.104 1.00 0.00 H ATOM 150 HA ARG A 11 3.175 -0.196 -0.764 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.549 1.962 0.585 1.00 0.00 H ATOM 152 HB3 ARG A 11 1.415 0.907 1.430 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.008 -0.366 1.201 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.154 1.211 1.980 1.00 0.00 H ATOM 155 HD2 ARG A 11 3.384 0.266 3.891 1.00 0.00 H ATOM 156 HD3 ARG A 11 1.832 -0.008 3.073 1.00 0.00 H ATOM 157 HE ARG A 11 2.472 -2.257 2.699 1.00 0.00 H ATOM 158 HH11 ARG A 11 5.148 -0.272 3.615 1.00 0.00 H ATOM 159 HH12 ARG A 11 6.247 -1.601 3.768 1.00 0.00 H ATOM 160 HH21 ARG A 11 3.903 -3.997 2.890 1.00 0.00 H ATOM 161 HH22 ARG A 11 5.544 -3.704 3.358 1.00 0.00 H ATOM 162 N LEU A 12 0.067 -0.993 -0.251 1.00 0.00 N ATOM 163 CA LEU A 12 -0.873 -2.118 -0.024 1.00 0.00 C ATOM 164 C LEU A 12 -0.767 -3.100 -1.179 1.00 0.00 C ATOM 165 O LEU A 12 -0.549 -4.262 -0.984 1.00 0.00 O ATOM 166 CB LEU A 12 -2.224 -1.418 0.042 1.00 0.00 C ATOM 167 CG LEU A 12 -3.394 -2.348 -0.290 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.432 -2.658 -1.788 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.264 -3.641 0.511 1.00 0.00 C ATOM 170 H LEU A 12 -0.283 -0.118 -0.518 1.00 0.00 H ATOM 171 HA LEU A 12 -0.655 -2.603 0.903 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.357 -1.039 1.040 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.213 -0.602 -0.652 1.00 0.00 H ATOM 174 HG LEU A 12 -4.311 -1.850 -0.019 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.271 -3.320 -2.001 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.502 -3.144 -2.083 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.550 -1.731 -2.349 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.326 -4.134 0.256 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.098 -4.302 0.273 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.275 -3.412 1.577 1.00 0.00 H ATOM 181 N ALA A 13 -0.878 -2.642 -2.376 1.00 0.00 N ATOM 182 CA ALA A 13 -0.733 -3.560 -3.527 1.00 0.00 C ATOM 183 C ALA A 13 0.553 -4.362 -3.375 1.00 0.00 C ATOM 184 O ALA A 13 0.671 -5.475 -3.840 1.00 0.00 O ATOM 185 CB ALA A 13 -0.603 -2.632 -4.707 1.00 0.00 C ATOM 186 H ALA A 13 -1.034 -1.697 -2.523 1.00 0.00 H ATOM 187 HA ALA A 13 -1.593 -4.202 -3.637 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.489 -3.217 -5.619 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.271 -1.994 -4.574 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.496 -2.012 -4.782 1.00 0.00 H ATOM 191 N ASN A 14 1.509 -3.796 -2.697 1.00 0.00 N ATOM 192 CA ASN A 14 2.788 -4.488 -2.469 1.00 0.00 C ATOM 193 C ASN A 14 2.635 -5.305 -1.206 1.00 0.00 C ATOM 194 O ASN A 14 3.353 -6.255 -0.965 1.00 0.00 O ATOM 195 CB ASN A 14 3.822 -3.377 -2.284 1.00 0.00 C ATOM 196 CG ASN A 14 4.504 -3.084 -3.622 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.337 -3.818 -4.576 1.00 0.00 O ATOM 198 ND2 ASN A 14 5.268 -2.032 -3.734 1.00 0.00 N ATOM 199 H ASN A 14 1.372 -2.917 -2.305 1.00 0.00 H ATOM 200 HA ASN A 14 3.044 -5.113 -3.309 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.328 -2.485 -1.927 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.564 -3.690 -1.566 1.00 0.00 H ATOM 203 HD21 ASN A 14 5.402 -1.438 -2.961 1.00 0.00 H ATOM 204 HD22 ASN A 14 5.709 -1.836 -4.590 1.00 0.00 H ATOM 205 N PHE A 15 1.677 -4.944 -0.401 1.00 0.00 N ATOM 206 CA PHE A 15 1.453 -5.715 0.843 1.00 0.00 C ATOM 207 C PHE A 15 0.407 -6.780 0.538 1.00 0.00 C ATOM 208 O PHE A 15 0.415 -7.881 1.051 1.00 0.00 O ATOM 209 CB PHE A 15 0.972 -4.685 1.899 1.00 0.00 C ATOM 210 CG PHE A 15 -0.327 -5.121 2.570 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.469 -6.421 3.072 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.396 -4.219 2.679 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.667 -6.815 3.673 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.592 -4.614 3.279 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.731 -5.912 3.778 1.00 0.00 C ATOM 216 H PHE A 15 1.075 -4.185 -0.642 1.00 0.00 H ATOM 217 HA PHE A 15 2.373 -6.160 1.145 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.736 -4.576 2.653 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.818 -3.730 1.415 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.349 -7.121 2.994 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.298 -3.220 2.304 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.773 -7.817 4.052 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.412 -3.911 3.353 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.656 -6.217 4.242 1.00 0.00 H ATOM 225 N LEU A 16 -0.500 -6.404 -0.293 1.00 0.00 N ATOM 226 CA LEU A 16 -1.615 -7.271 -0.702 1.00 0.00 C ATOM 227 C LEU A 16 -1.157 -8.308 -1.727 1.00 0.00 C ATOM 228 O LEU A 16 -1.772 -9.341 -1.895 1.00 0.00 O ATOM 229 CB LEU A 16 -2.571 -6.260 -1.324 1.00 0.00 C ATOM 230 CG LEU A 16 -3.999 -6.721 -1.129 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.334 -6.667 0.362 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.929 -5.787 -1.906 1.00 0.00 C ATOM 233 H LEU A 16 -0.454 -5.495 -0.657 1.00 0.00 H ATOM 234 HA LEU A 16 -2.075 -7.741 0.151 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.434 -5.308 -0.840 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.360 -6.155 -2.374 1.00 0.00 H ATOM 237 HG LEU A 16 -4.101 -7.730 -1.490 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.361 -6.997 0.516 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.223 -5.644 0.723 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.656 -7.321 0.911 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.816 -4.769 -1.534 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.962 -6.109 -1.773 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.673 -5.817 -2.965 1.00 0.00 H ATOM 244 N VAL A 17 -0.086 -8.041 -2.420 1.00 0.00 N ATOM 245 CA VAL A 17 0.391 -9.022 -3.437 1.00 0.00 C ATOM 246 C VAL A 17 0.479 -10.423 -2.825 1.00 0.00 C ATOM 247 O VAL A 17 0.062 -11.399 -3.419 1.00 0.00 O ATOM 248 CB VAL A 17 1.782 -8.559 -3.886 1.00 0.00 C ATOM 249 CG1 VAL A 17 1.646 -7.515 -4.996 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.554 -7.957 -2.707 1.00 0.00 C ATOM 251 H VAL A 17 0.392 -7.201 -2.278 1.00 0.00 H ATOM 252 HA VAL A 17 -0.278 -9.018 -4.275 1.00 0.00 H ATOM 253 HB VAL A 17 2.327 -9.410 -4.270 1.00 0.00 H ATOM 254 HG11 VAL A 17 2.637 -7.189 -5.312 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.084 -6.659 -4.623 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.120 -7.953 -5.845 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.006 -7.101 -2.313 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.539 -7.634 -3.044 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.667 -8.708 -1.925 1.00 0.00 H ATOM 260 N ARG A 18 1.024 -10.534 -1.643 1.00 0.00 N ATOM 261 CA ARG A 18 1.143 -11.873 -0.997 1.00 0.00 C ATOM 262 C ARG A 18 -0.244 -12.422 -0.657 1.00 0.00 C ATOM 263 O ARG A 18 -0.632 -13.480 -1.112 1.00 0.00 O ATOM 264 CB ARG A 18 1.953 -11.624 0.276 1.00 0.00 C ATOM 265 CG ARG A 18 3.270 -10.937 -0.088 1.00 0.00 C ATOM 266 CD ARG A 18 4.440 -11.757 0.456 1.00 0.00 C ATOM 267 NE ARG A 18 5.448 -10.746 0.886 1.00 0.00 N ATOM 268 CZ ARG A 18 6.401 -11.080 1.715 1.00 0.00 C ATOM 269 NH1 ARG A 18 6.478 -12.304 2.168 1.00 0.00 N ATOM 270 NH2 ARG A 18 7.277 -10.191 2.091 1.00 0.00 N ATOM 271 H ARG A 18 1.358 -9.736 -1.182 1.00 0.00 H ATOM 272 HA ARG A 18 1.673 -12.557 -1.642 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.388 -10.990 0.944 1.00 0.00 H ATOM 274 HB3 ARG A 18 2.162 -12.565 0.763 1.00 0.00 H ATOM 275 HG2 ARG A 18 3.351 -10.862 -1.162 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.293 -9.949 0.346 1.00 0.00 H ATOM 277 HD2 ARG A 18 4.121 -12.356 1.297 1.00 0.00 H ATOM 278 HD3 ARG A 18 4.854 -12.385 -0.318 1.00 0.00 H ATOM 279 HE ARG A 18 5.396 -9.830 0.546 1.00 0.00 H ATOM 280 HH11 ARG A 18 5.809 -12.989 1.880 1.00 0.00 H ATOM 281 HH12 ARG A 18 7.210 -12.555 2.802 1.00 0.00 H ATOM 282 HH21 ARG A 18 7.220 -9.254 1.743 1.00 0.00 H ATOM 283 HH22 ARG A 18 8.005 -10.443 2.729 1.00 0.00 H ATOM 284 N SER A 19 -0.994 -11.710 0.135 1.00 0.00 N ATOM 285 CA SER A 19 -2.357 -12.187 0.503 1.00 0.00 C ATOM 286 C SER A 19 -3.323 -11.987 -0.668 1.00 0.00 C ATOM 287 O SER A 19 -4.199 -11.147 -0.616 1.00 0.00 O ATOM 288 CB SER A 19 -2.769 -11.317 1.690 1.00 0.00 C ATOM 289 OG SER A 19 -2.328 -9.985 1.468 1.00 0.00 O ATOM 290 H SER A 19 -0.662 -10.859 0.489 1.00 0.00 H ATOM 291 HA SER A 19 -2.329 -13.224 0.798 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.841 -11.325 1.789 1.00 0.00 H ATOM 293 HB3 SER A 19 -2.323 -11.712 2.594 1.00 0.00 H ATOM 294 HG SER A 19 -2.826 -9.406 2.048 1.00 0.00 H HETATM 295 N NH2 A 20 -3.199 -12.730 -1.732 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.811 -12.612 -2.488 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -2.491 -13.409 -1.777 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 16 ATOM 1 N LYS A 1 1.859 13.290 2.250 1.00 0.00 N ATOM 2 CA LYS A 1 0.887 12.538 3.095 1.00 0.00 C ATOM 3 C LYS A 1 0.114 11.530 2.241 1.00 0.00 C ATOM 4 O LYS A 1 -0.907 11.009 2.647 1.00 0.00 O ATOM 5 CB LYS A 1 -0.056 13.603 3.657 1.00 0.00 C ATOM 6 CG LYS A 1 -0.841 14.247 2.511 1.00 0.00 C ATOM 7 CD LYS A 1 -2.341 14.132 2.794 1.00 0.00 C ATOM 8 CE LYS A 1 -2.892 15.501 3.199 1.00 0.00 C ATOM 9 NZ LYS A 1 -3.950 15.802 2.195 1.00 0.00 N ATOM 10 H1 LYS A 1 1.359 13.727 1.450 1.00 0.00 H ATOM 11 H2 LYS A 1 2.583 12.635 1.890 1.00 0.00 H ATOM 12 H3 LYS A 1 2.314 14.031 2.819 1.00 0.00 H ATOM 13 HA LYS A 1 1.398 12.037 3.901 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.743 13.146 4.353 1.00 0.00 H ATOM 15 HB3 LYS A 1 0.520 14.362 4.165 1.00 0.00 H ATOM 16 HG2 LYS A 1 -0.568 15.289 2.429 1.00 0.00 H ATOM 17 HG3 LYS A 1 -0.612 13.739 1.587 1.00 0.00 H ATOM 18 HD2 LYS A 1 -2.848 13.787 1.905 1.00 0.00 H ATOM 19 HD3 LYS A 1 -2.503 13.428 3.597 1.00 0.00 H ATOM 20 HE2 LYS A 1 -3.314 15.456 4.193 1.00 0.00 H ATOM 21 HE3 LYS A 1 -2.115 16.247 3.152 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -3.508 16.118 1.309 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -4.571 16.552 2.561 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -4.509 14.945 2.013 1.00 0.00 H ATOM 25 N CYS A 2 0.594 11.250 1.060 1.00 0.00 N ATOM 26 CA CYS A 2 -0.109 10.276 0.174 1.00 0.00 C ATOM 27 C CYS A 2 -0.023 8.865 0.763 1.00 0.00 C ATOM 28 O CYS A 2 -0.939 8.076 0.650 1.00 0.00 O ATOM 29 CB CYS A 2 0.648 10.348 -1.154 1.00 0.00 C ATOM 30 SG CYS A 2 -0.070 9.170 -2.329 1.00 0.00 S ATOM 31 H CYS A 2 1.418 11.681 0.755 1.00 0.00 H ATOM 32 HA CYS A 2 -1.137 10.566 0.031 1.00 0.00 H ATOM 33 HB2 CYS A 2 0.571 11.347 -1.558 1.00 0.00 H ATOM 34 HB3 CYS A 2 1.687 10.105 -0.992 1.00 0.00 H ATOM 35 N ASN A 3 1.081 8.538 1.379 1.00 0.00 N ATOM 36 CA ASN A 3 1.249 7.176 1.967 1.00 0.00 C ATOM 37 C ASN A 3 0.004 6.753 2.757 1.00 0.00 C ATOM 38 O ASN A 3 -0.334 5.588 2.816 1.00 0.00 O ATOM 39 CB ASN A 3 2.450 7.308 2.904 1.00 0.00 C ATOM 40 CG ASN A 3 3.699 6.758 2.211 1.00 0.00 C ATOM 41 OD1 ASN A 3 3.607 5.876 1.380 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.871 7.242 2.521 1.00 0.00 N ATOM 43 H ASN A 3 1.809 9.191 1.449 1.00 0.00 H ATOM 44 HA ASN A 3 1.469 6.454 1.199 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.602 8.349 3.148 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.264 6.750 3.807 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.944 7.955 3.195 1.00 0.00 H ATOM 48 HD22 ASN A 3 5.677 6.892 2.081 1.00 0.00 H ATOM 49 N THR A 4 -0.658 7.678 3.390 1.00 0.00 N ATOM 50 CA THR A 4 -1.855 7.311 4.202 1.00 0.00 C ATOM 51 C THR A 4 -3.061 6.910 3.334 1.00 0.00 C ATOM 52 O THR A 4 -3.572 5.813 3.447 1.00 0.00 O ATOM 53 CB THR A 4 -2.184 8.570 5.008 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.084 9.469 4.954 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.463 8.192 6.463 1.00 0.00 C ATOM 56 H THR A 4 -0.359 8.610 3.352 1.00 0.00 H ATOM 57 HA THR A 4 -1.608 6.510 4.880 1.00 0.00 H ATOM 58 HB THR A 4 -3.058 9.046 4.591 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.432 10.363 4.939 1.00 0.00 H ATOM 60 HG21 THR A 4 -3.308 7.505 6.505 1.00 0.00 H ATOM 61 HG22 THR A 4 -2.697 9.091 7.034 1.00 0.00 H ATOM 62 HG23 THR A 4 -1.583 7.710 6.889 1.00 0.00 H ATOM 63 N ALA A 5 -3.549 7.793 2.501 1.00 0.00 N ATOM 64 CA ALA A 5 -4.753 7.446 1.681 1.00 0.00 C ATOM 65 C ALA A 5 -4.411 7.078 0.230 1.00 0.00 C ATOM 66 O ALA A 5 -4.579 5.951 -0.191 1.00 0.00 O ATOM 67 CB ALA A 5 -5.615 8.708 1.710 1.00 0.00 C ATOM 68 H ALA A 5 -3.149 8.686 2.439 1.00 0.00 H ATOM 69 HA ALA A 5 -5.293 6.637 2.145 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.523 8.542 1.131 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.057 9.540 1.280 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.880 8.944 2.741 1.00 0.00 H ATOM 73 N THR A 6 -3.988 8.036 -0.550 1.00 0.00 N ATOM 74 CA THR A 6 -3.694 7.767 -1.992 1.00 0.00 C ATOM 75 C THR A 6 -2.613 6.695 -2.175 1.00 0.00 C ATOM 76 O THR A 6 -2.785 5.762 -2.934 1.00 0.00 O ATOM 77 CB THR A 6 -3.220 9.109 -2.549 1.00 0.00 C ATOM 78 OG1 THR A 6 -4.333 9.983 -2.681 1.00 0.00 O ATOM 79 CG2 THR A 6 -2.570 8.897 -3.916 1.00 0.00 C ATOM 80 H THR A 6 -3.899 8.946 -0.198 1.00 0.00 H ATOM 81 HA THR A 6 -4.597 7.467 -2.501 1.00 0.00 H ATOM 82 HB THR A 6 -2.500 9.545 -1.876 1.00 0.00 H ATOM 83 HG1 THR A 6 -4.825 9.721 -3.464 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.717 8.227 -3.813 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.233 9.855 -4.311 1.00 0.00 H ATOM 86 HG23 THR A 6 -3.296 8.458 -4.600 1.00 0.00 H ATOM 87 N CYS A 7 -1.501 6.816 -1.509 1.00 0.00 N ATOM 88 CA CYS A 7 -0.430 5.792 -1.685 1.00 0.00 C ATOM 89 C CYS A 7 -0.709 4.573 -0.800 1.00 0.00 C ATOM 90 O CYS A 7 -0.036 3.564 -0.892 1.00 0.00 O ATOM 91 CB CYS A 7 0.863 6.491 -1.266 1.00 0.00 C ATOM 92 SG CYS A 7 1.326 7.720 -2.513 1.00 0.00 S ATOM 93 H CYS A 7 -1.365 7.576 -0.905 1.00 0.00 H ATOM 94 HA CYS A 7 -0.365 5.495 -2.721 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.711 6.981 -0.324 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.652 5.760 -1.170 1.00 0.00 H ATOM 97 N ALA A 8 -1.701 4.653 0.046 1.00 0.00 N ATOM 98 CA ALA A 8 -2.024 3.491 0.926 1.00 0.00 C ATOM 99 C ALA A 8 -2.260 2.242 0.072 1.00 0.00 C ATOM 100 O ALA A 8 -1.984 1.133 0.484 1.00 0.00 O ATOM 101 CB ALA A 8 -3.306 3.890 1.657 1.00 0.00 C ATOM 102 H ALA A 8 -2.234 5.472 0.100 1.00 0.00 H ATOM 103 HA ALA A 8 -1.230 3.319 1.636 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.609 3.085 2.326 1.00 0.00 H ATOM 105 HB2 ALA A 8 -4.097 4.075 0.930 1.00 0.00 H ATOM 106 HB3 ALA A 8 -3.127 4.795 2.237 1.00 0.00 H ATOM 107 N THR A 9 -2.761 2.420 -1.119 1.00 0.00 N ATOM 108 CA THR A 9 -3.007 1.251 -2.012 1.00 0.00 C ATOM 109 C THR A 9 -1.678 0.766 -2.589 1.00 0.00 C ATOM 110 O THR A 9 -1.463 -0.408 -2.801 1.00 0.00 O ATOM 111 CB THR A 9 -3.912 1.788 -3.122 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.797 2.759 -2.582 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.717 0.639 -3.727 1.00 0.00 C ATOM 114 H THR A 9 -2.966 3.324 -1.432 1.00 0.00 H ATOM 115 HA THR A 9 -3.505 0.462 -1.475 1.00 0.00 H ATOM 116 HB THR A 9 -3.306 2.241 -3.892 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.587 2.305 -2.284 1.00 0.00 H ATOM 118 HG21 THR A 9 -4.036 -0.103 -4.143 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.361 1.023 -4.518 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.329 0.176 -2.953 1.00 0.00 H ATOM 121 N GLN A 10 -0.785 1.677 -2.835 1.00 0.00 N ATOM 122 CA GLN A 10 0.546 1.299 -3.394 1.00 0.00 C ATOM 123 C GLN A 10 1.263 0.375 -2.406 1.00 0.00 C ATOM 124 O GLN A 10 1.591 -0.752 -2.722 1.00 0.00 O ATOM 125 CB GLN A 10 1.285 2.636 -3.563 1.00 0.00 C ATOM 126 CG GLN A 10 2.783 2.464 -3.294 1.00 0.00 C ATOM 127 CD GLN A 10 3.565 3.533 -4.057 1.00 0.00 C ATOM 128 OE1 GLN A 10 3.963 4.532 -3.491 1.00 0.00 O ATOM 129 NE2 GLN A 10 3.806 3.365 -5.328 1.00 0.00 N ATOM 130 H GLN A 10 -0.991 2.611 -2.647 1.00 0.00 H ATOM 131 HA GLN A 10 0.431 0.812 -4.350 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.143 2.995 -4.572 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.879 3.356 -2.869 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.968 2.566 -2.234 1.00 0.00 H ATOM 135 HG3 GLN A 10 3.098 1.486 -3.623 1.00 0.00 H ATOM 136 HE21 GLN A 10 3.483 2.555 -5.786 1.00 0.00 H ATOM 137 HE22 GLN A 10 4.307 4.048 -5.828 1.00 0.00 H ATOM 138 N ARG A 11 1.482 0.827 -1.203 1.00 0.00 N ATOM 139 CA ARG A 11 2.146 -0.049 -0.204 1.00 0.00 C ATOM 140 C ARG A 11 1.267 -1.281 -0.010 1.00 0.00 C ATOM 141 O ARG A 11 1.730 -2.359 0.308 1.00 0.00 O ATOM 142 CB ARG A 11 2.218 0.780 1.079 1.00 0.00 C ATOM 143 CG ARG A 11 3.079 2.022 0.834 1.00 0.00 C ATOM 144 CD ARG A 11 4.365 1.926 1.657 1.00 0.00 C ATOM 145 NE ARG A 11 3.912 1.701 3.058 1.00 0.00 N ATOM 146 CZ ARG A 11 3.463 2.699 3.773 1.00 0.00 C ATOM 147 NH1 ARG A 11 3.410 3.902 3.262 1.00 0.00 N ATOM 148 NH2 ARG A 11 3.067 2.497 5.000 1.00 0.00 N ATOM 149 H ARG A 11 1.193 1.730 -0.954 1.00 0.00 H ATOM 150 HA ARG A 11 3.135 -0.329 -0.532 1.00 0.00 H ATOM 151 HB2 ARG A 11 1.222 1.081 1.369 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.659 0.187 1.868 1.00 0.00 H ATOM 153 HG2 ARG A 11 3.327 2.084 -0.216 1.00 0.00 H ATOM 154 HG3 ARG A 11 2.531 2.903 1.128 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.968 1.095 1.316 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.923 2.848 1.594 1.00 0.00 H ATOM 157 HE ARG A 11 3.948 0.801 3.445 1.00 0.00 H ATOM 158 HH11 ARG A 11 3.711 4.061 2.322 1.00 0.00 H ATOM 159 HH12 ARG A 11 3.066 4.662 3.812 1.00 0.00 H ATOM 160 HH21 ARG A 11 3.106 1.578 5.391 1.00 0.00 H ATOM 161 HH22 ARG A 11 2.725 3.260 5.548 1.00 0.00 H ATOM 162 N LEU A 12 -0.006 -1.113 -0.228 1.00 0.00 N ATOM 163 CA LEU A 12 -0.958 -2.245 -0.092 1.00 0.00 C ATOM 164 C LEU A 12 -0.737 -3.213 -1.240 1.00 0.00 C ATOM 165 O LEU A 12 -0.529 -4.376 -1.037 1.00 0.00 O ATOM 166 CB LEU A 12 -2.322 -1.570 -0.146 1.00 0.00 C ATOM 167 CG LEU A 12 -3.435 -2.510 -0.625 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.340 -2.749 -2.134 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.346 -3.844 0.112 1.00 0.00 C ATOM 170 H LEU A 12 -0.339 -0.232 -0.497 1.00 0.00 H ATOM 171 HA LEU A 12 -0.817 -2.737 0.847 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.564 -1.224 0.844 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.257 -0.730 -0.810 1.00 0.00 H ATOM 174 HG LEU A 12 -4.382 -2.044 -0.412 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.141 -3.419 -2.447 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.376 -3.200 -2.371 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.435 -1.799 -2.660 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.378 -4.305 -0.086 1.00 0.00 H ATOM 179 HD22 LEU A 12 -4.140 -4.505 -0.235 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.456 -3.676 1.183 1.00 0.00 H ATOM 181 N ALA A 13 -0.734 -2.741 -2.436 1.00 0.00 N ATOM 182 CA ALA A 13 -0.467 -3.644 -3.578 1.00 0.00 C ATOM 183 C ALA A 13 0.823 -4.409 -3.317 1.00 0.00 C ATOM 184 O ALA A 13 1.031 -5.500 -3.808 1.00 0.00 O ATOM 185 CB ALA A 13 -0.257 -2.703 -4.735 1.00 0.00 C ATOM 186 H ALA A 13 -0.876 -1.792 -2.588 1.00 0.00 H ATOM 187 HA ALA A 13 -1.296 -4.307 -3.766 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.050 -3.277 -5.638 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.587 -2.047 -4.522 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.155 -2.103 -4.884 1.00 0.00 H ATOM 191 N ASN A 14 1.680 -3.833 -2.522 1.00 0.00 N ATOM 192 CA ASN A 14 2.955 -4.482 -2.175 1.00 0.00 C ATOM 193 C ASN A 14 2.700 -5.331 -0.951 1.00 0.00 C ATOM 194 O ASN A 14 3.412 -6.272 -0.664 1.00 0.00 O ATOM 195 CB ASN A 14 3.921 -3.340 -1.860 1.00 0.00 C ATOM 196 CG ASN A 14 4.725 -2.991 -3.114 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.517 -3.783 -3.582 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.554 -1.827 -3.681 1.00 0.00 N ATOM 199 H ASN A 14 1.465 -2.974 -2.121 1.00 0.00 H ATOM 200 HA ASN A 14 3.320 -5.077 -2.994 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.362 -2.474 -1.538 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.597 -3.644 -1.075 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.912 -1.185 -3.301 1.00 0.00 H ATOM 204 HD22 ASN A 14 5.067 -1.595 -4.489 1.00 0.00 H ATOM 205 N PHE A 15 1.659 -5.009 -0.233 1.00 0.00 N ATOM 206 CA PHE A 15 1.337 -5.820 0.964 1.00 0.00 C ATOM 207 C PHE A 15 0.361 -6.903 0.529 1.00 0.00 C ATOM 208 O PHE A 15 0.328 -8.005 1.040 1.00 0.00 O ATOM 209 CB PHE A 15 0.723 -4.831 1.988 1.00 0.00 C ATOM 210 CG PHE A 15 -0.636 -5.307 2.491 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.803 -6.616 2.965 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.733 -4.433 2.475 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.057 -7.046 3.409 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.983 -4.864 2.922 1.00 0.00 C ATOM 215 CZ PHE A 15 -3.148 -6.171 3.388 1.00 0.00 C ATOM 216 H PHE A 15 1.065 -4.257 -0.513 1.00 0.00 H ATOM 217 HA PHE A 15 2.234 -6.248 1.346 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.393 -4.733 2.827 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.606 -3.865 1.516 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.036 -7.296 2.982 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.615 -3.428 2.125 1.00 0.00 H ATOM 222 HE1 PHE A 15 -2.183 -8.051 3.767 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.822 -4.184 2.898 1.00 0.00 H ATOM 224 HZ PHE A 15 -4.116 -6.504 3.732 1.00 0.00 H ATOM 225 N LEU A 16 -0.435 -6.549 -0.414 1.00 0.00 N ATOM 226 CA LEU A 16 -1.460 -7.443 -0.962 1.00 0.00 C ATOM 227 C LEU A 16 -0.828 -8.452 -1.918 1.00 0.00 C ATOM 228 O LEU A 16 -1.451 -9.407 -2.338 1.00 0.00 O ATOM 229 CB LEU A 16 -2.358 -6.458 -1.695 1.00 0.00 C ATOM 230 CG LEU A 16 -3.762 -7.006 -1.752 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.402 -6.860 -0.372 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.560 -6.212 -2.787 1.00 0.00 C ATOM 233 H LEU A 16 -0.361 -5.642 -0.776 1.00 0.00 H ATOM 234 HA LEU A 16 -2.009 -7.936 -0.176 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.362 -5.522 -1.160 1.00 0.00 H ATOM 236 HB3 LEU A 16 -1.987 -6.294 -2.691 1.00 0.00 H ATOM 237 HG LEU A 16 -3.721 -8.046 -2.031 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.418 -7.253 -0.399 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.427 -5.807 -0.092 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.817 -7.416 0.361 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.586 -5.161 -2.499 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.578 -6.599 -2.837 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.086 -6.309 -3.764 1.00 0.00 H ATOM 244 N VAL A 17 0.410 -8.244 -2.259 1.00 0.00 N ATOM 245 CA VAL A 17 1.099 -9.187 -3.184 1.00 0.00 C ATOM 246 C VAL A 17 0.902 -10.626 -2.705 1.00 0.00 C ATOM 247 O VAL A 17 0.609 -11.515 -3.478 1.00 0.00 O ATOM 248 CB VAL A 17 2.579 -8.810 -3.115 1.00 0.00 C ATOM 249 CG1 VAL A 17 3.386 -9.742 -4.021 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.761 -7.367 -3.583 1.00 0.00 C ATOM 251 H VAL A 17 0.885 -7.467 -1.907 1.00 0.00 H ATOM 252 HA VAL A 17 0.732 -9.064 -4.189 1.00 0.00 H ATOM 253 HB VAL A 17 2.928 -8.907 -2.097 1.00 0.00 H ATOM 254 HG11 VAL A 17 4.441 -9.473 -3.972 1.00 0.00 H ATOM 255 HG12 VAL A 17 3.034 -9.645 -5.048 1.00 0.00 H ATOM 256 HG13 VAL A 17 3.258 -10.772 -3.689 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.410 -7.271 -4.610 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.816 -7.099 -3.534 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.187 -6.701 -2.939 1.00 0.00 H ATOM 260 N ARG A 18 1.063 -10.860 -1.431 1.00 0.00 N ATOM 261 CA ARG A 18 0.886 -12.241 -0.896 1.00 0.00 C ATOM 262 C ARG A 18 -0.589 -12.645 -0.966 1.00 0.00 C ATOM 263 O ARG A 18 -0.924 -13.737 -1.380 1.00 0.00 O ATOM 264 CB ARG A 18 1.357 -12.163 0.557 1.00 0.00 C ATOM 265 CG ARG A 18 1.888 -13.530 0.996 1.00 0.00 C ATOM 266 CD ARG A 18 0.827 -14.244 1.835 1.00 0.00 C ATOM 267 NE ARG A 18 1.492 -15.483 2.325 1.00 0.00 N ATOM 268 CZ ARG A 18 1.019 -16.117 3.365 1.00 0.00 C ATOM 269 NH1 ARG A 18 -0.043 -15.670 3.980 1.00 0.00 N ATOM 270 NH2 ARG A 18 1.608 -17.201 3.789 1.00 0.00 N ATOM 271 H ARG A 18 1.301 -10.126 -0.823 1.00 0.00 H ATOM 272 HA ARG A 18 1.496 -12.938 -1.447 1.00 0.00 H ATOM 273 HB2 ARG A 18 2.142 -11.427 0.640 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.529 -11.881 1.189 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.119 -14.124 0.124 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.780 -13.395 1.588 1.00 0.00 H ATOM 277 HD2 ARG A 18 0.524 -13.622 2.667 1.00 0.00 H ATOM 278 HD3 ARG A 18 -0.027 -14.498 1.226 1.00 0.00 H ATOM 279 HE ARG A 18 2.289 -15.823 1.867 1.00 0.00 H ATOM 280 HH11 ARG A 18 -0.497 -14.840 3.657 1.00 0.00 H ATOM 281 HH12 ARG A 18 -0.401 -16.158 4.775 1.00 0.00 H ATOM 282 HH21 ARG A 18 2.421 -17.544 3.320 1.00 0.00 H ATOM 283 HH22 ARG A 18 1.247 -17.688 4.585 1.00 0.00 H ATOM 284 N SER A 19 -1.473 -11.774 -0.563 1.00 0.00 N ATOM 285 CA SER A 19 -2.924 -12.110 -0.606 1.00 0.00 C ATOM 286 C SER A 19 -3.760 -10.910 -0.153 1.00 0.00 C ATOM 287 O SER A 19 -3.303 -9.785 -0.179 1.00 0.00 O ATOM 288 CB SER A 19 -3.087 -13.277 0.368 1.00 0.00 C ATOM 289 OG SER A 19 -3.680 -12.808 1.572 1.00 0.00 O ATOM 290 H SER A 19 -1.182 -10.898 -0.232 1.00 0.00 H ATOM 291 HA SER A 19 -3.210 -12.416 -1.599 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.723 -14.028 -0.072 1.00 0.00 H ATOM 293 HB3 SER A 19 -2.118 -13.708 0.576 1.00 0.00 H ATOM 294 HG SER A 19 -3.062 -12.205 1.991 1.00 0.00 H HETATM 295 N NH2 A 20 -4.980 -11.106 0.266 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -5.527 -10.347 0.559 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -5.350 -12.012 0.287 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 17 ATOM 1 N LYS A 1 0.614 14.143 2.241 1.00 0.00 N ATOM 2 CA LYS A 1 0.721 12.860 2.993 1.00 0.00 C ATOM 3 C LYS A 1 -0.064 11.758 2.274 1.00 0.00 C ATOM 4 O LYS A 1 -0.899 11.097 2.860 1.00 0.00 O ATOM 5 CB LYS A 1 0.104 13.151 4.361 1.00 0.00 C ATOM 6 CG LYS A 1 1.215 13.401 5.383 1.00 0.00 C ATOM 7 CD LYS A 1 1.755 14.822 5.211 1.00 0.00 C ATOM 8 CE LYS A 1 2.569 15.211 6.448 1.00 0.00 C ATOM 9 NZ LYS A 1 2.398 16.684 6.573 1.00 0.00 N ATOM 10 H1 LYS A 1 0.956 14.924 2.837 1.00 0.00 H ATOM 11 H2 LYS A 1 -0.380 14.311 1.982 1.00 0.00 H ATOM 12 H3 LYS A 1 1.193 14.090 1.379 1.00 0.00 H ATOM 13 HA LYS A 1 1.755 12.574 3.108 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.526 14.026 4.292 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.487 12.305 4.677 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.819 13.282 6.381 1.00 0.00 H ATOM 17 HG3 LYS A 1 2.016 12.693 5.225 1.00 0.00 H ATOM 18 HD2 LYS A 1 2.385 14.866 4.336 1.00 0.00 H ATOM 19 HD3 LYS A 1 0.929 15.508 5.097 1.00 0.00 H ATOM 20 HE2 LYS A 1 2.183 14.709 7.324 1.00 0.00 H ATOM 21 HE3 LYS A 1 3.611 14.970 6.302 1.00 0.00 H ATOM 22 HZ1 LYS A 1 3.074 17.166 5.948 1.00 0.00 H ATOM 23 HZ2 LYS A 1 2.572 16.970 7.558 1.00 0.00 H ATOM 24 HZ3 LYS A 1 1.430 16.945 6.301 1.00 0.00 H ATOM 25 N CYS A 2 0.194 11.557 1.010 1.00 0.00 N ATOM 26 CA CYS A 2 -0.544 10.499 0.261 1.00 0.00 C ATOM 27 C CYS A 2 -0.257 9.121 0.867 1.00 0.00 C ATOM 28 O CYS A 2 -1.037 8.199 0.731 1.00 0.00 O ATOM 29 CB CYS A 2 -0.021 10.585 -1.175 1.00 0.00 C ATOM 30 SG CYS A 2 1.689 9.996 -1.244 1.00 0.00 S ATOM 31 H CYS A 2 0.870 12.101 0.554 1.00 0.00 H ATOM 32 HA CYS A 2 -1.604 10.700 0.277 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.636 9.973 -1.819 1.00 0.00 H ATOM 34 HB3 CYS A 2 -0.061 11.610 -1.512 1.00 0.00 H ATOM 35 N ASN A 3 0.854 8.972 1.538 1.00 0.00 N ATOM 36 CA ASN A 3 1.187 7.652 2.156 1.00 0.00 C ATOM 37 C ASN A 3 -0.036 7.086 2.878 1.00 0.00 C ATOM 38 O ASN A 3 -0.260 5.891 2.906 1.00 0.00 O ATOM 39 CB ASN A 3 2.298 7.961 3.160 1.00 0.00 C ATOM 40 CG ASN A 3 3.652 7.598 2.551 1.00 0.00 C ATOM 41 OD1 ASN A 3 3.799 7.555 1.345 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.656 7.329 3.341 1.00 0.00 N ATOM 43 H ASN A 3 1.469 9.728 1.639 1.00 0.00 H ATOM 44 HA ASN A 3 1.546 6.958 1.417 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.280 9.015 3.400 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.142 7.384 4.058 1.00 0.00 H ATOM 47 HD21 ASN A 3 4.537 7.364 4.316 1.00 0.00 H ATOM 48 HD22 ASN A 3 5.532 7.095 2.958 1.00 0.00 H ATOM 49 N THR A 4 -0.819 7.937 3.477 1.00 0.00 N ATOM 50 CA THR A 4 -2.019 7.462 4.220 1.00 0.00 C ATOM 51 C THR A 4 -3.132 6.970 3.281 1.00 0.00 C ATOM 52 O THR A 4 -3.625 5.869 3.423 1.00 0.00 O ATOM 53 CB THR A 4 -2.494 8.682 5.011 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.451 9.124 5.868 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.719 8.307 5.847 1.00 0.00 C ATOM 56 H THR A 4 -0.608 8.894 3.452 1.00 0.00 H ATOM 57 HA THR A 4 -1.742 6.678 4.906 1.00 0.00 H ATOM 58 HB THR A 4 -2.759 9.474 4.328 1.00 0.00 H ATOM 59 HG1 THR A 4 -0.921 8.360 6.108 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.519 7.969 5.189 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.056 9.178 6.410 1.00 0.00 H ATOM 62 HG23 THR A 4 -3.456 7.507 6.539 1.00 0.00 H ATOM 63 N ALA A 5 -3.574 7.789 2.359 1.00 0.00 N ATOM 64 CA ALA A 5 -4.702 7.359 1.472 1.00 0.00 C ATOM 65 C ALA A 5 -4.248 6.866 0.088 1.00 0.00 C ATOM 66 O ALA A 5 -4.385 5.703 -0.236 1.00 0.00 O ATOM 67 CB ALA A 5 -5.567 8.610 1.322 1.00 0.00 C ATOM 68 H ALA A 5 -3.200 8.691 2.278 1.00 0.00 H ATOM 69 HA ALA A 5 -5.279 6.591 1.961 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.422 8.387 0.684 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.977 9.408 0.872 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.920 8.928 2.303 1.00 0.00 H ATOM 73 N THR A 6 -3.767 7.744 -0.753 1.00 0.00 N ATOM 74 CA THR A 6 -3.379 7.316 -2.134 1.00 0.00 C ATOM 75 C THR A 6 -2.115 6.451 -2.148 1.00 0.00 C ATOM 76 O THR A 6 -2.097 5.385 -2.732 1.00 0.00 O ATOM 77 CB THR A 6 -3.133 8.618 -2.893 1.00 0.00 C ATOM 78 OG1 THR A 6 -4.335 9.376 -2.932 1.00 0.00 O ATOM 79 CG2 THR A 6 -2.684 8.298 -4.319 1.00 0.00 C ATOM 80 H THR A 6 -3.703 8.687 -0.495 1.00 0.00 H ATOM 81 HA THR A 6 -4.194 6.782 -2.597 1.00 0.00 H ATOM 82 HB THR A 6 -2.364 9.187 -2.396 1.00 0.00 H ATOM 83 HG1 THR A 6 -4.886 9.101 -2.193 1.00 0.00 H ATOM 84 HG21 THR A 6 -1.763 7.715 -4.288 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.508 9.227 -4.862 1.00 0.00 H ATOM 86 HG23 THR A 6 -3.460 7.724 -4.825 1.00 0.00 H ATOM 87 N CYS A 7 -1.056 6.891 -1.533 1.00 0.00 N ATOM 88 CA CYS A 7 0.188 6.072 -1.550 1.00 0.00 C ATOM 89 C CYS A 7 0.050 4.878 -0.601 1.00 0.00 C ATOM 90 O CYS A 7 0.892 4.003 -0.565 1.00 0.00 O ATOM 91 CB CYS A 7 1.294 7.013 -1.079 1.00 0.00 C ATOM 92 SG CYS A 7 1.584 8.292 -2.325 1.00 0.00 S ATOM 93 H CYS A 7 -1.075 7.755 -1.073 1.00 0.00 H ATOM 94 HA CYS A 7 0.399 5.732 -2.552 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.994 7.480 -0.163 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.204 6.453 -0.920 1.00 0.00 H ATOM 97 N ALA A 8 -1.009 4.832 0.160 1.00 0.00 N ATOM 98 CA ALA A 8 -1.202 3.687 1.095 1.00 0.00 C ATOM 99 C ALA A 8 -1.515 2.419 0.300 1.00 0.00 C ATOM 100 O ALA A 8 -0.919 1.380 0.505 1.00 0.00 O ATOM 101 CB ALA A 8 -2.396 4.080 1.967 1.00 0.00 C ATOM 102 H ALA A 8 -1.680 5.545 0.111 1.00 0.00 H ATOM 103 HA ALA A 8 -0.325 3.546 1.707 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.601 3.285 2.683 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.272 4.235 1.337 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.167 5.001 2.503 1.00 0.00 H ATOM 107 N THR A 9 -2.444 2.501 -0.612 1.00 0.00 N ATOM 108 CA THR A 9 -2.799 1.308 -1.434 1.00 0.00 C ATOM 109 C THR A 9 -1.569 0.818 -2.199 1.00 0.00 C ATOM 110 O THR A 9 -1.402 -0.361 -2.438 1.00 0.00 O ATOM 111 CB THR A 9 -3.873 1.800 -2.404 1.00 0.00 C ATOM 112 OG1 THR A 9 -3.345 2.853 -3.200 1.00 0.00 O ATOM 113 CG2 THR A 9 -5.081 2.311 -1.617 1.00 0.00 C ATOM 114 H THR A 9 -2.906 3.352 -0.762 1.00 0.00 H ATOM 115 HA THR A 9 -3.195 0.524 -0.810 1.00 0.00 H ATOM 116 HB THR A 9 -4.183 0.987 -3.042 1.00 0.00 H ATOM 117 HG1 THR A 9 -3.378 3.662 -2.683 1.00 0.00 H ATOM 118 HG21 THR A 9 -5.487 1.503 -1.008 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.845 2.661 -2.311 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.773 3.133 -0.971 1.00 0.00 H ATOM 121 N GLN A 10 -0.710 1.718 -2.587 1.00 0.00 N ATOM 122 CA GLN A 10 0.512 1.309 -3.340 1.00 0.00 C ATOM 123 C GLN A 10 1.291 0.285 -2.521 1.00 0.00 C ATOM 124 O GLN A 10 1.513 -0.829 -2.951 1.00 0.00 O ATOM 125 CB GLN A 10 1.323 2.595 -3.511 1.00 0.00 C ATOM 126 CG GLN A 10 1.528 2.875 -5.000 1.00 0.00 C ATOM 127 CD GLN A 10 2.159 1.654 -5.669 1.00 0.00 C ATOM 128 OE1 GLN A 10 2.727 0.809 -5.006 1.00 0.00 O ATOM 129 NE2 GLN A 10 2.084 1.523 -6.965 1.00 0.00 N ATOM 130 H GLN A 10 -0.867 2.659 -2.379 1.00 0.00 H ATOM 131 HA GLN A 10 0.248 0.903 -4.303 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.790 3.419 -3.057 1.00 0.00 H ATOM 133 HB3 GLN A 10 2.284 2.481 -3.032 1.00 0.00 H ATOM 134 HG2 GLN A 10 0.573 3.086 -5.460 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.180 3.726 -5.120 1.00 0.00 H ATOM 136 HE21 GLN A 10 1.624 2.206 -7.502 1.00 0.00 H ATOM 137 HE22 GLN A 10 2.488 0.739 -7.404 1.00 0.00 H ATOM 138 N ARG A 11 1.672 0.636 -1.327 1.00 0.00 N ATOM 139 CA ARG A 11 2.394 -0.343 -0.475 1.00 0.00 C ATOM 140 C ARG A 11 1.440 -1.501 -0.211 1.00 0.00 C ATOM 141 O ARG A 11 1.833 -2.639 -0.043 1.00 0.00 O ATOM 142 CB ARG A 11 2.725 0.404 0.819 1.00 0.00 C ATOM 143 CG ARG A 11 4.167 0.913 0.757 1.00 0.00 C ATOM 144 CD ARG A 11 4.630 1.310 2.162 1.00 0.00 C ATOM 145 NE ARG A 11 5.406 0.139 2.655 1.00 0.00 N ATOM 146 CZ ARG A 11 5.686 0.026 3.927 1.00 0.00 C ATOM 147 NH1 ARG A 11 5.290 0.943 4.769 1.00 0.00 N ATOM 148 NH2 ARG A 11 6.365 -1.003 4.356 1.00 0.00 N ATOM 149 H ARG A 11 1.455 1.528 -0.985 1.00 0.00 H ATOM 150 HA ARG A 11 3.295 -0.687 -0.960 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.050 1.240 0.933 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.616 -0.264 1.659 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.808 0.132 0.373 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.218 1.773 0.108 1.00 0.00 H ATOM 155 HD2 ARG A 11 5.258 2.189 2.114 1.00 0.00 H ATOM 156 HD3 ARG A 11 3.781 1.486 2.802 1.00 0.00 H ATOM 157 HE ARG A 11 5.709 -0.550 2.027 1.00 0.00 H ATOM 158 HH11 ARG A 11 4.772 1.732 4.445 1.00 0.00 H ATOM 159 HH12 ARG A 11 5.505 0.852 5.742 1.00 0.00 H ATOM 160 HH21 ARG A 11 6.670 -1.704 3.712 1.00 0.00 H ATOM 161 HH22 ARG A 11 6.579 -1.090 5.329 1.00 0.00 H ATOM 162 N LEU A 12 0.171 -1.197 -0.213 1.00 0.00 N ATOM 163 CA LEU A 12 -0.874 -2.234 -0.004 1.00 0.00 C ATOM 164 C LEU A 12 -0.830 -3.220 -1.159 1.00 0.00 C ATOM 165 O LEU A 12 -0.611 -4.387 -0.987 1.00 0.00 O ATOM 166 CB LEU A 12 -2.167 -1.446 -0.038 1.00 0.00 C ATOM 167 CG LEU A 12 -3.168 -2.023 0.941 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.646 -3.377 0.420 1.00 0.00 C ATOM 169 CD2 LEU A 12 -2.507 -2.186 2.312 1.00 0.00 C ATOM 170 H LEU A 12 -0.100 -0.270 -0.377 1.00 0.00 H ATOM 171 HA LEU A 12 -0.747 -2.733 0.941 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.961 -0.423 0.224 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.577 -1.491 -1.033 1.00 0.00 H ATOM 174 HG LEU A 12 -4.006 -1.348 1.018 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.368 -3.801 1.118 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.795 -4.051 0.324 1.00 0.00 H ATOM 177 HD13 LEU A 12 -4.117 -3.246 -0.554 1.00 0.00 H ATOM 178 HD21 LEU A 12 -1.654 -2.859 2.227 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.228 -2.601 3.016 1.00 0.00 H ATOM 180 HD23 LEU A 12 -2.168 -1.214 2.670 1.00 0.00 H ATOM 181 N ALA A 13 -0.997 -2.754 -2.343 1.00 0.00 N ATOM 182 CA ALA A 13 -0.915 -3.666 -3.507 1.00 0.00 C ATOM 183 C ALA A 13 0.347 -4.509 -3.387 1.00 0.00 C ATOM 184 O ALA A 13 0.421 -5.627 -3.852 1.00 0.00 O ATOM 185 CB ALA A 13 -0.775 -2.723 -4.676 1.00 0.00 C ATOM 186 H ALA A 13 -1.147 -1.803 -2.474 1.00 0.00 H ATOM 187 HA ALA A 13 -1.801 -4.273 -3.603 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.705 -3.297 -5.600 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.126 -2.122 -4.553 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.645 -2.067 -4.721 1.00 0.00 H ATOM 191 N ASN A 14 1.333 -3.961 -2.740 1.00 0.00 N ATOM 192 CA ASN A 14 2.609 -4.665 -2.532 1.00 0.00 C ATOM 193 C ASN A 14 2.492 -5.464 -1.249 1.00 0.00 C ATOM 194 O ASN A 14 3.224 -6.402 -1.002 1.00 0.00 O ATOM 195 CB ASN A 14 3.649 -3.554 -2.395 1.00 0.00 C ATOM 196 CG ASN A 14 4.044 -3.050 -3.783 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.623 -3.776 -4.566 1.00 0.00 O ATOM 198 ND2 ASN A 14 3.754 -1.823 -4.125 1.00 0.00 N ATOM 199 H ASN A 14 1.221 -3.073 -2.357 1.00 0.00 H ATOM 200 HA ASN A 14 2.841 -5.303 -3.369 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.230 -2.741 -1.821 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.519 -3.937 -1.890 1.00 0.00 H ATOM 203 HD21 ASN A 14 3.285 -1.235 -3.490 1.00 0.00 H ATOM 204 HD22 ASN A 14 4.004 -1.490 -5.016 1.00 0.00 H ATOM 205 N PHE A 15 1.548 -5.096 -0.431 1.00 0.00 N ATOM 206 CA PHE A 15 1.344 -5.833 0.833 1.00 0.00 C ATOM 207 C PHE A 15 0.284 -6.900 0.580 1.00 0.00 C ATOM 208 O PHE A 15 0.152 -7.878 1.289 1.00 0.00 O ATOM 209 CB PHE A 15 0.895 -4.761 1.853 1.00 0.00 C ATOM 210 CG PHE A 15 -0.451 -5.091 2.483 1.00 0.00 C ATOM 211 CD1 PHE A 15 -1.595 -5.226 1.685 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.552 -5.241 3.869 1.00 0.00 C ATOM 213 CE1 PHE A 15 -2.830 -5.515 2.267 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.791 -5.530 4.452 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.930 -5.667 3.652 1.00 0.00 C ATOM 216 H PHE A 15 0.934 -4.353 -0.678 1.00 0.00 H ATOM 217 HA PHE A 15 2.267 -6.271 1.133 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.636 -4.686 2.633 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.822 -3.807 1.351 1.00 0.00 H ATOM 220 HD1 PHE A 15 -1.522 -5.113 0.625 1.00 0.00 H ATOM 221 HD2 PHE A 15 0.326 -5.137 4.488 1.00 0.00 H ATOM 222 HE1 PHE A 15 -3.705 -5.618 1.644 1.00 0.00 H ATOM 223 HE2 PHE A 15 -1.868 -5.642 5.520 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.886 -5.889 4.105 1.00 0.00 H ATOM 225 N LEU A 16 -0.489 -6.656 -0.430 1.00 0.00 N ATOM 226 CA LEU A 16 -1.595 -7.536 -0.816 1.00 0.00 C ATOM 227 C LEU A 16 -1.130 -8.548 -1.861 1.00 0.00 C ATOM 228 O LEU A 16 -1.783 -9.542 -2.111 1.00 0.00 O ATOM 229 CB LEU A 16 -2.565 -6.528 -1.417 1.00 0.00 C ATOM 230 CG LEU A 16 -3.964 -7.098 -1.452 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.707 -6.629 -0.203 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.665 -6.578 -2.706 1.00 0.00 C ATOM 233 H LEU A 16 -0.354 -5.836 -0.944 1.00 0.00 H ATOM 234 HA LEU A 16 -2.034 -8.017 0.039 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.565 -5.635 -0.813 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.252 -6.276 -2.418 1.00 0.00 H ATOM 237 HG LEU A 16 -3.917 -8.176 -1.472 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.720 -7.031 -0.210 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.749 -5.540 -0.192 1.00 0.00 H ATOM 240 HD13 LEU A 16 -4.183 -6.981 0.686 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.707 -5.489 -2.674 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.678 -6.979 -2.749 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.111 -6.894 -3.590 1.00 0.00 H ATOM 244 N VAL A 17 -0.009 -8.299 -2.483 1.00 0.00 N ATOM 245 CA VAL A 17 0.480 -9.249 -3.516 1.00 0.00 C ATOM 246 C VAL A 17 0.579 -10.663 -2.935 1.00 0.00 C ATOM 247 O VAL A 17 0.381 -11.643 -3.624 1.00 0.00 O ATOM 248 CB VAL A 17 1.866 -8.754 -3.939 1.00 0.00 C ATOM 249 CG1 VAL A 17 1.720 -7.563 -4.887 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.673 -8.329 -2.710 1.00 0.00 C ATOM 251 H VAL A 17 0.498 -7.489 -2.274 1.00 0.00 H ATOM 252 HA VAL A 17 -0.183 -9.232 -4.359 1.00 0.00 H ATOM 253 HB VAL A 17 2.385 -9.551 -4.451 1.00 0.00 H ATOM 254 HG11 VAL A 17 2.708 -7.213 -5.186 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.188 -6.758 -4.380 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.160 -7.868 -5.771 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.150 -7.525 -2.192 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.656 -7.979 -3.024 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.788 -9.180 -2.038 1.00 0.00 H ATOM 260 N ARG A 18 0.895 -10.772 -1.672 1.00 0.00 N ATOM 261 CA ARG A 18 1.018 -12.121 -1.044 1.00 0.00 C ATOM 262 C ARG A 18 -0.350 -12.804 -0.966 1.00 0.00 C ATOM 263 O ARG A 18 -0.556 -13.864 -1.524 1.00 0.00 O ATOM 264 CB ARG A 18 1.566 -11.854 0.361 1.00 0.00 C ATOM 265 CG ARG A 18 2.703 -10.833 0.281 1.00 0.00 C ATOM 266 CD ARG A 18 3.961 -11.411 0.934 1.00 0.00 C ATOM 267 NE ARG A 18 5.086 -10.621 0.362 1.00 0.00 N ATOM 268 CZ ARG A 18 6.315 -10.853 0.745 1.00 0.00 C ATOM 269 NH1 ARG A 18 6.563 -11.790 1.621 1.00 0.00 N ATOM 270 NH2 ARG A 18 7.295 -10.150 0.248 1.00 0.00 N ATOM 271 H ARG A 18 1.056 -9.966 -1.137 1.00 0.00 H ATOM 272 HA ARG A 18 1.713 -12.731 -1.598 1.00 0.00 H ATOM 273 HB2 ARG A 18 0.776 -11.465 0.988 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.940 -12.774 0.782 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.909 -10.604 -0.754 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.414 -9.931 0.799 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.918 -11.287 2.009 1.00 0.00 H ATOM 278 HD3 ARG A 18 4.073 -12.453 0.681 1.00 0.00 H ATOM 279 HE ARG A 18 4.906 -9.922 -0.300 1.00 0.00 H ATOM 280 HH11 ARG A 18 5.814 -12.332 2.001 1.00 0.00 H ATOM 281 HH12 ARG A 18 7.503 -11.966 1.912 1.00 0.00 H ATOM 282 HH21 ARG A 18 7.108 -9.435 -0.424 1.00 0.00 H ATOM 283 HH22 ARG A 18 8.236 -10.328 0.542 1.00 0.00 H ATOM 284 N SER A 19 -1.288 -12.210 -0.279 1.00 0.00 N ATOM 285 CA SER A 19 -2.636 -12.832 -0.168 1.00 0.00 C ATOM 286 C SER A 19 -3.712 -11.866 -0.671 1.00 0.00 C ATOM 287 O SER A 19 -4.768 -12.283 -1.108 1.00 0.00 O ATOM 288 CB SER A 19 -2.821 -13.113 1.323 1.00 0.00 C ATOM 289 OG SER A 19 -1.620 -13.664 1.849 1.00 0.00 O ATOM 290 H SER A 19 -1.104 -11.360 0.165 1.00 0.00 H ATOM 291 HA SER A 19 -2.666 -13.751 -0.721 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.046 -12.197 1.841 1.00 0.00 H ATOM 293 HB3 SER A 19 -3.639 -13.809 1.457 1.00 0.00 H ATOM 294 HG SER A 19 -1.283 -13.060 2.513 1.00 0.00 H HETATM 295 N NH2 A 20 -3.490 -10.581 -0.628 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.175 -9.955 -0.945 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -2.641 -10.242 -0.276 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 18 ATOM 1 N LYS A 1 0.297 14.373 1.993 1.00 0.00 N ATOM 2 CA LYS A 1 0.452 13.114 2.776 1.00 0.00 C ATOM 3 C LYS A 1 -0.299 11.969 2.092 1.00 0.00 C ATOM 4 O LYS A 1 -1.266 11.448 2.613 1.00 0.00 O ATOM 5 CB LYS A 1 -0.164 13.419 4.141 1.00 0.00 C ATOM 6 CG LYS A 1 0.949 13.597 5.177 1.00 0.00 C ATOM 7 CD LYS A 1 0.858 14.998 5.787 1.00 0.00 C ATOM 8 CE LYS A 1 0.565 14.885 7.284 1.00 0.00 C ATOM 9 NZ LYS A 1 -0.923 14.882 7.389 1.00 0.00 N ATOM 10 H1 LYS A 1 1.115 14.992 2.167 1.00 0.00 H ATOM 11 H2 LYS A 1 -0.574 14.857 2.286 1.00 0.00 H ATOM 12 H3 LYS A 1 0.247 14.147 0.980 1.00 0.00 H ATOM 13 HA LYS A 1 1.496 12.866 2.890 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.747 14.327 4.078 1.00 0.00 H ATOM 15 HB3 LYS A 1 -0.803 12.602 4.441 1.00 0.00 H ATOM 16 HG2 LYS A 1 0.839 12.856 5.956 1.00 0.00 H ATOM 17 HG3 LYS A 1 1.909 13.478 4.698 1.00 0.00 H ATOM 18 HD2 LYS A 1 1.795 15.515 5.640 1.00 0.00 H ATOM 19 HD3 LYS A 1 0.063 15.549 5.306 1.00 0.00 H ATOM 20 HE2 LYS A 1 0.972 13.963 7.677 1.00 0.00 H ATOM 21 HE3 LYS A 1 0.971 15.733 7.813 1.00 0.00 H ATOM 22 HZ1 LYS A 1 -1.332 15.302 6.531 1.00 0.00 H ATOM 23 HZ2 LYS A 1 -1.211 15.440 8.219 1.00 0.00 H ATOM 24 HZ3 LYS A 1 -1.261 13.905 7.492 1.00 0.00 H ATOM 25 N CYS A 2 0.138 11.573 0.926 1.00 0.00 N ATOM 26 CA CYS A 2 -0.551 10.461 0.210 1.00 0.00 C ATOM 27 C CYS A 2 -0.261 9.127 0.905 1.00 0.00 C ATOM 28 O CYS A 2 -1.018 8.183 0.798 1.00 0.00 O ATOM 29 CB CYS A 2 0.036 10.475 -1.203 1.00 0.00 C ATOM 30 SG CYS A 2 1.745 9.873 -1.161 1.00 0.00 S ATOM 31 H CYS A 2 0.918 12.006 0.523 1.00 0.00 H ATOM 32 HA CYS A 2 -1.615 10.642 0.169 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.553 9.837 -1.843 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.021 11.484 -1.588 1.00 0.00 H ATOM 35 N ASN A 3 0.832 9.044 1.610 1.00 0.00 N ATOM 36 CA ASN A 3 1.181 7.772 2.311 1.00 0.00 C ATOM 37 C ASN A 3 -0.041 7.209 3.039 1.00 0.00 C ATOM 38 O ASN A 3 -0.194 6.012 3.177 1.00 0.00 O ATOM 39 CB ASN A 3 2.262 8.167 3.318 1.00 0.00 C ATOM 40 CG ASN A 3 1.780 9.363 4.143 1.00 0.00 C ATOM 41 OD1 ASN A 3 0.857 9.244 4.923 1.00 0.00 O ATOM 42 ND2 ASN A 3 2.370 10.517 4.003 1.00 0.00 N ATOM 43 H ASN A 3 1.429 9.818 1.679 1.00 0.00 H ATOM 44 HA ASN A 3 1.577 7.048 1.620 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.464 7.333 3.975 1.00 0.00 H ATOM 46 HB3 ASN A 3 3.165 8.438 2.791 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.120 10.612 3.371 1.00 0.00 H ATOM 48 HD22 ASN A 3 2.066 11.292 4.529 1.00 0.00 H ATOM 49 N THR A 4 -0.900 8.060 3.521 1.00 0.00 N ATOM 50 CA THR A 4 -2.100 7.571 4.260 1.00 0.00 C ATOM 51 C THR A 4 -3.133 6.921 3.326 1.00 0.00 C ATOM 52 O THR A 4 -3.497 5.775 3.503 1.00 0.00 O ATOM 53 CB THR A 4 -2.691 8.823 4.911 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.756 9.355 5.840 1.00 0.00 O ATOM 55 CG2 THR A 4 -3.985 8.460 5.639 1.00 0.00 C ATOM 56 H THR A 4 -0.752 9.023 3.411 1.00 0.00 H ATOM 57 HA THR A 4 -1.803 6.876 5.025 1.00 0.00 H ATOM 58 HB THR A 4 -2.902 9.559 4.152 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.440 10.193 5.497 1.00 0.00 H ATOM 60 HG21 THR A 4 -4.701 8.050 4.926 1.00 0.00 H ATOM 61 HG22 THR A 4 -4.405 9.353 6.102 1.00 0.00 H ATOM 62 HG23 THR A 4 -3.774 7.717 6.408 1.00 0.00 H ATOM 63 N ALA A 5 -3.645 7.645 2.366 1.00 0.00 N ATOM 64 CA ALA A 5 -4.689 7.054 1.470 1.00 0.00 C ATOM 65 C ALA A 5 -4.145 6.623 0.099 1.00 0.00 C ATOM 66 O ALA A 5 -4.105 5.453 -0.223 1.00 0.00 O ATOM 67 CB ALA A 5 -5.722 8.168 1.297 1.00 0.00 C ATOM 68 H ALA A 5 -3.369 8.579 2.252 1.00 0.00 H ATOM 69 HA ALA A 5 -5.156 6.215 1.958 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.528 7.820 0.651 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.246 9.039 0.846 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.130 8.441 2.270 1.00 0.00 H ATOM 73 N THR A 6 -3.781 7.566 -0.729 1.00 0.00 N ATOM 74 CA THR A 6 -3.303 7.224 -2.106 1.00 0.00 C ATOM 75 C THR A 6 -2.038 6.359 -2.096 1.00 0.00 C ATOM 76 O THR A 6 -1.973 5.344 -2.761 1.00 0.00 O ATOM 77 CB THR A 6 -3.014 8.574 -2.762 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.971 9.528 -2.322 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.096 8.431 -4.283 1.00 0.00 C ATOM 80 H THR A 6 -3.862 8.506 -0.462 1.00 0.00 H ATOM 81 HA THR A 6 -4.086 6.724 -2.652 1.00 0.00 H ATOM 82 HB THR A 6 -2.026 8.903 -2.489 1.00 0.00 H ATOM 83 HG1 THR A 6 -4.017 10.226 -2.979 1.00 0.00 H ATOM 84 HG21 THR A 6 -2.361 7.699 -4.620 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.890 9.394 -4.751 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.095 8.098 -4.564 1.00 0.00 H ATOM 87 N CYS A 7 -1.025 6.750 -1.380 1.00 0.00 N ATOM 88 CA CYS A 7 0.229 5.940 -1.377 1.00 0.00 C ATOM 89 C CYS A 7 0.097 4.732 -0.445 1.00 0.00 C ATOM 90 O CYS A 7 0.919 3.837 -0.459 1.00 0.00 O ATOM 91 CB CYS A 7 1.312 6.894 -0.879 1.00 0.00 C ATOM 92 SG CYS A 7 1.681 8.118 -2.160 1.00 0.00 S ATOM 93 H CYS A 7 -1.079 7.580 -0.860 1.00 0.00 H ATOM 94 HA CYS A 7 0.462 5.614 -2.377 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.961 7.399 0.002 1.00 0.00 H ATOM 96 HB3 CYS A 7 2.206 6.335 -0.645 1.00 0.00 H ATOM 97 N ALA A 8 -0.928 4.692 0.361 1.00 0.00 N ATOM 98 CA ALA A 8 -1.100 3.531 1.283 1.00 0.00 C ATOM 99 C ALA A 8 -1.555 2.297 0.503 1.00 0.00 C ATOM 100 O ALA A 8 -1.239 1.178 0.854 1.00 0.00 O ATOM 101 CB ALA A 8 -2.180 3.962 2.272 1.00 0.00 C ATOM 102 H ALA A 8 -1.584 5.420 0.358 1.00 0.00 H ATOM 103 HA ALA A 8 -0.180 3.329 1.808 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.363 3.158 2.985 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.100 4.184 1.732 1.00 0.00 H ATOM 106 HB3 ALA A 8 -1.849 4.852 2.807 1.00 0.00 H ATOM 107 N THR A 9 -2.295 2.493 -0.557 1.00 0.00 N ATOM 108 CA THR A 9 -2.772 1.331 -1.364 1.00 0.00 C ATOM 109 C THR A 9 -1.635 0.818 -2.247 1.00 0.00 C ATOM 110 O THR A 9 -1.508 -0.362 -2.504 1.00 0.00 O ATOM 111 CB THR A 9 -3.908 1.885 -2.223 1.00 0.00 C ATOM 112 OG1 THR A 9 -3.522 3.141 -2.761 1.00 0.00 O ATOM 113 CG2 THR A 9 -5.160 2.056 -1.363 1.00 0.00 C ATOM 114 H THR A 9 -2.535 3.402 -0.823 1.00 0.00 H ATOM 115 HA THR A 9 -3.141 0.550 -0.723 1.00 0.00 H ATOM 116 HB THR A 9 -4.121 1.197 -3.027 1.00 0.00 H ATOM 117 HG1 THR A 9 -4.310 3.577 -3.093 1.00 0.00 H ATOM 118 HG21 THR A 9 -5.454 1.090 -0.952 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.971 2.451 -1.975 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.950 2.749 -0.548 1.00 0.00 H ATOM 121 N GLN A 10 -0.805 1.706 -2.705 1.00 0.00 N ATOM 122 CA GLN A 10 0.338 1.294 -3.569 1.00 0.00 C ATOM 123 C GLN A 10 1.258 0.361 -2.775 1.00 0.00 C ATOM 124 O GLN A 10 1.490 -0.770 -3.154 1.00 0.00 O ATOM 125 CB GLN A 10 1.039 2.613 -3.937 1.00 0.00 C ATOM 126 CG GLN A 10 2.552 2.408 -4.048 1.00 0.00 C ATOM 127 CD GLN A 10 3.199 3.666 -4.630 1.00 0.00 C ATOM 128 OE1 GLN A 10 4.028 3.584 -5.515 1.00 0.00 O ATOM 129 NE2 GLN A 10 2.855 4.837 -4.166 1.00 0.00 N ATOM 130 H GLN A 10 -0.933 2.645 -2.474 1.00 0.00 H ATOM 131 HA GLN A 10 -0.018 0.801 -4.460 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.655 2.967 -4.884 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.835 3.349 -3.173 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.958 2.213 -3.066 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.755 1.568 -4.696 1.00 0.00 H ATOM 136 HE21 GLN A 10 2.186 4.904 -3.449 1.00 0.00 H ATOM 137 HE22 GLN A 10 3.268 5.652 -4.536 1.00 0.00 H ATOM 138 N ARG A 11 1.754 0.816 -1.660 1.00 0.00 N ATOM 139 CA ARG A 11 2.624 -0.057 -0.829 1.00 0.00 C ATOM 140 C ARG A 11 1.790 -1.249 -0.368 1.00 0.00 C ATOM 141 O ARG A 11 2.292 -2.325 -0.116 1.00 0.00 O ATOM 142 CB ARG A 11 3.043 0.807 0.362 1.00 0.00 C ATOM 143 CG ARG A 11 4.289 0.209 1.020 1.00 0.00 C ATOM 144 CD ARG A 11 5.523 1.007 0.597 1.00 0.00 C ATOM 145 NE ARG A 11 6.443 0.942 1.766 1.00 0.00 N ATOM 146 CZ ARG A 11 7.677 1.357 1.654 1.00 0.00 C ATOM 147 NH1 ARG A 11 8.110 1.832 0.518 1.00 0.00 N ATOM 148 NH2 ARG A 11 8.479 1.296 2.683 1.00 0.00 N ATOM 149 H ARG A 11 1.536 1.720 -1.359 1.00 0.00 H ATOM 150 HA ARG A 11 3.490 -0.382 -1.387 1.00 0.00 H ATOM 151 HB2 ARG A 11 3.263 1.809 0.020 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.239 0.841 1.082 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.182 0.252 2.095 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.401 -0.819 0.710 1.00 0.00 H ATOM 155 HD2 ARG A 11 5.982 0.554 -0.273 1.00 0.00 H ATOM 156 HD3 ARG A 11 5.258 2.032 0.392 1.00 0.00 H ATOM 157 HE ARG A 11 6.121 0.587 2.621 1.00 0.00 H ATOM 158 HH11 ARG A 11 7.499 1.879 -0.271 1.00 0.00 H ATOM 159 HH12 ARG A 11 9.055 2.148 0.438 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.149 0.934 3.554 1.00 0.00 H ATOM 161 HH22 ARG A 11 9.424 1.614 2.599 1.00 0.00 H ATOM 162 N LEU A 12 0.506 -1.043 -0.269 1.00 0.00 N ATOM 163 CA LEU A 12 -0.409 -2.128 0.164 1.00 0.00 C ATOM 164 C LEU A 12 -0.579 -3.128 -0.969 1.00 0.00 C ATOM 165 O LEU A 12 -0.402 -4.302 -0.789 1.00 0.00 O ATOM 166 CB LEU A 12 -1.696 -1.386 0.492 1.00 0.00 C ATOM 167 CG LEU A 12 -2.946 -2.259 0.354 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.283 -2.507 -1.117 1.00 0.00 C ATOM 169 CD2 LEU A 12 -2.732 -3.592 1.064 1.00 0.00 C ATOM 170 H LEU A 12 0.139 -0.159 -0.488 1.00 0.00 H ATOM 171 HA LEU A 12 -0.021 -2.612 1.036 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.631 -1.035 1.507 1.00 0.00 H ATOM 173 HB3 LEU A 12 -1.777 -0.547 -0.171 1.00 0.00 H ATOM 174 HG LEU A 12 -3.773 -1.740 0.811 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.175 -3.130 -1.186 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.448 -3.014 -1.601 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.466 -1.554 -1.614 1.00 0.00 H ATOM 178 HD21 LEU A 12 -1.882 -4.109 0.618 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.626 -4.207 0.961 1.00 0.00 H ATOM 180 HD23 LEU A 12 -2.534 -3.414 2.121 1.00 0.00 H ATOM 181 N ALA A 13 -0.876 -2.677 -2.138 1.00 0.00 N ATOM 182 CA ALA A 13 -1.001 -3.615 -3.277 1.00 0.00 C ATOM 183 C ALA A 13 0.269 -4.444 -3.374 1.00 0.00 C ATOM 184 O ALA A 13 0.280 -5.549 -3.878 1.00 0.00 O ATOM 185 CB ALA A 13 -1.095 -2.707 -4.476 1.00 0.00 C ATOM 186 H ALA A 13 -0.992 -1.722 -2.278 1.00 0.00 H ATOM 187 HA ALA A 13 -1.878 -4.233 -3.192 1.00 0.00 H ATOM 188 HB1 ALA A 13 -1.191 -3.308 -5.380 1.00 0.00 H ATOM 189 HB2 ALA A 13 -0.195 -2.095 -4.541 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.967 -2.060 -4.375 1.00 0.00 H ATOM 191 N ASN A 14 1.337 -3.906 -2.864 1.00 0.00 N ATOM 192 CA ASN A 14 2.627 -4.613 -2.870 1.00 0.00 C ATOM 193 C ASN A 14 2.683 -5.436 -1.602 1.00 0.00 C ATOM 194 O ASN A 14 3.413 -6.402 -1.496 1.00 0.00 O ATOM 195 CB ASN A 14 3.687 -3.513 -2.861 1.00 0.00 C ATOM 196 CG ASN A 14 3.930 -3.024 -4.290 1.00 0.00 C ATOM 197 OD1 ASN A 14 5.059 -2.859 -4.705 1.00 0.00 O ATOM 198 ND2 ASN A 14 2.907 -2.783 -5.066 1.00 0.00 N ATOM 199 H ASN A 14 1.282 -3.034 -2.438 1.00 0.00 H ATOM 200 HA ASN A 14 2.726 -5.231 -3.745 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.345 -2.689 -2.250 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.607 -3.903 -2.454 1.00 0.00 H ATOM 203 HD21 ASN A 14 1.993 -2.915 -4.728 1.00 0.00 H ATOM 204 HD22 ASN A 14 3.055 -2.468 -5.986 1.00 0.00 H ATOM 205 N PHE A 15 1.889 -5.059 -0.634 1.00 0.00 N ATOM 206 CA PHE A 15 1.876 -5.834 0.631 1.00 0.00 C ATOM 207 C PHE A 15 0.768 -6.874 0.528 1.00 0.00 C ATOM 208 O PHE A 15 0.837 -7.968 1.052 1.00 0.00 O ATOM 209 CB PHE A 15 1.617 -4.797 1.756 1.00 0.00 C ATOM 210 CG PHE A 15 0.434 -5.194 2.634 1.00 0.00 C ATOM 211 CD1 PHE A 15 0.352 -6.484 3.179 1.00 0.00 C ATOM 212 CD2 PHE A 15 -0.584 -4.267 2.897 1.00 0.00 C ATOM 213 CE1 PHE A 15 -0.742 -6.838 3.976 1.00 0.00 C ATOM 214 CE2 PHE A 15 -1.673 -4.623 3.693 1.00 0.00 C ATOM 215 CZ PHE A 15 -1.754 -5.909 4.234 1.00 0.00 C ATOM 216 H PHE A 15 1.273 -4.283 -0.759 1.00 0.00 H ATOM 217 HA PHE A 15 2.825 -6.299 0.764 1.00 0.00 H ATOM 218 HB2 PHE A 15 2.499 -4.718 2.372 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.414 -3.836 1.306 1.00 0.00 H ATOM 220 HD1 PHE A 15 1.130 -7.204 2.980 1.00 0.00 H ATOM 221 HD2 PHE A 15 -0.530 -3.277 2.488 1.00 0.00 H ATOM 222 HE1 PHE A 15 -0.804 -7.830 4.386 1.00 0.00 H ATOM 223 HE2 PHE A 15 -2.455 -3.901 3.886 1.00 0.00 H ATOM 224 HZ PHE A 15 -2.596 -6.186 4.850 1.00 0.00 H ATOM 225 N LEU A 16 -0.251 -6.487 -0.150 1.00 0.00 N ATOM 226 CA LEU A 16 -1.439 -7.330 -0.355 1.00 0.00 C ATOM 227 C LEU A 16 -1.138 -8.418 -1.381 1.00 0.00 C ATOM 228 O LEU A 16 -1.876 -9.372 -1.536 1.00 0.00 O ATOM 229 CB LEU A 16 -2.437 -6.315 -0.886 1.00 0.00 C ATOM 230 CG LEU A 16 -3.846 -6.806 -0.655 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.249 -6.474 0.782 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.777 -6.096 -1.636 1.00 0.00 C ATOM 233 H LEU A 16 -0.239 -5.591 -0.537 1.00 0.00 H ATOM 234 HA LEU A 16 -1.786 -7.750 0.573 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.297 -5.381 -0.363 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.273 -6.155 -1.938 1.00 0.00 H ATOM 237 HG LEU A 16 -3.884 -7.871 -0.809 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.265 -6.823 0.965 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.203 -5.395 0.933 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.566 -6.967 1.474 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.728 -5.020 -1.470 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.799 -6.440 -1.481 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.469 -6.320 -2.657 1.00 0.00 H ATOM 244 N VAL A 17 -0.051 -8.275 -2.079 1.00 0.00 N ATOM 245 CA VAL A 17 0.325 -9.289 -3.101 1.00 0.00 C ATOM 246 C VAL A 17 0.232 -10.699 -2.512 1.00 0.00 C ATOM 247 O VAL A 17 -0.169 -11.634 -3.176 1.00 0.00 O ATOM 248 CB VAL A 17 1.775 -8.967 -3.449 1.00 0.00 C ATOM 249 CG1 VAL A 17 1.834 -7.650 -4.221 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.588 -8.837 -2.157 1.00 0.00 C ATOM 251 H VAL A 17 0.517 -7.492 -1.934 1.00 0.00 H ATOM 252 HA VAL A 17 -0.297 -9.193 -3.975 1.00 0.00 H ATOM 253 HB VAL A 17 2.186 -9.760 -4.057 1.00 0.00 H ATOM 254 HG11 VAL A 17 2.870 -7.420 -4.470 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.422 -6.849 -3.607 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.252 -7.740 -5.138 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.173 -8.036 -1.545 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.625 -8.607 -2.401 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.545 -9.775 -1.604 1.00 0.00 H ATOM 260 N ARG A 18 0.603 -10.859 -1.272 1.00 0.00 N ATOM 261 CA ARG A 18 0.540 -12.210 -0.642 1.00 0.00 C ATOM 262 C ARG A 18 -0.812 -12.869 -0.928 1.00 0.00 C ATOM 263 O ARG A 18 -0.885 -13.921 -1.530 1.00 0.00 O ATOM 264 CB ARG A 18 0.708 -11.958 0.856 1.00 0.00 C ATOM 265 CG ARG A 18 2.175 -12.145 1.245 1.00 0.00 C ATOM 266 CD ARG A 18 2.372 -13.537 1.848 1.00 0.00 C ATOM 267 NE ARG A 18 3.510 -13.388 2.797 1.00 0.00 N ATOM 268 CZ ARG A 18 4.031 -14.440 3.368 1.00 0.00 C ATOM 269 NH1 ARG A 18 3.552 -15.629 3.121 1.00 0.00 N ATOM 270 NH2 ARG A 18 5.035 -14.301 4.192 1.00 0.00 N ATOM 271 H ARG A 18 0.926 -10.092 -0.754 1.00 0.00 H ATOM 272 HA ARG A 18 1.346 -12.830 -1.003 1.00 0.00 H ATOM 273 HB2 ARG A 18 0.399 -10.948 1.088 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.099 -12.658 1.410 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.796 -12.042 0.366 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.454 -11.398 1.972 1.00 0.00 H ATOM 277 HD2 ARG A 18 1.478 -13.848 2.372 1.00 0.00 H ATOM 278 HD3 ARG A 18 2.624 -14.250 1.077 1.00 0.00 H ATOM 279 HE ARG A 18 3.869 -12.497 2.991 1.00 0.00 H ATOM 280 HH11 ARG A 18 2.782 -15.738 2.492 1.00 0.00 H ATOM 281 HH12 ARG A 18 3.956 -16.432 3.560 1.00 0.00 H ATOM 282 HH21 ARG A 18 5.402 -13.392 4.384 1.00 0.00 H ATOM 283 HH22 ARG A 18 5.436 -15.106 4.630 1.00 0.00 H ATOM 284 N SER A 19 -1.883 -12.256 -0.500 1.00 0.00 N ATOM 285 CA SER A 19 -3.227 -12.852 -0.750 1.00 0.00 C ATOM 286 C SER A 19 -3.553 -12.819 -2.244 1.00 0.00 C ATOM 287 O SER A 19 -2.763 -12.357 -3.045 1.00 0.00 O ATOM 288 CB SER A 19 -4.201 -11.970 0.032 1.00 0.00 C ATOM 289 OG SER A 19 -5.254 -12.775 0.546 1.00 0.00 O ATOM 290 H SER A 19 -1.803 -11.409 -0.017 1.00 0.00 H ATOM 291 HA SER A 19 -3.266 -13.863 -0.376 1.00 0.00 H ATOM 292 HB2 SER A 19 -3.684 -11.497 0.850 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.603 -11.210 -0.625 1.00 0.00 H ATOM 294 HG SER A 19 -6.012 -12.680 -0.036 1.00 0.00 H HETATM 295 N NH2 A 20 -4.692 -13.300 -2.661 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.910 -13.288 -3.617 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -5.330 -13.674 -2.018 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 19 ATOM 1 N LYS A 1 1.619 12.229 3.830 1.00 0.00 N ATOM 2 CA LYS A 1 1.162 12.737 2.504 1.00 0.00 C ATOM 3 C LYS A 1 0.282 11.686 1.812 1.00 0.00 C ATOM 4 O LYS A 1 -0.745 11.292 2.330 1.00 0.00 O ATOM 5 CB LYS A 1 2.452 12.990 1.718 1.00 0.00 C ATOM 6 CG LYS A 1 3.191 14.183 2.325 1.00 0.00 C ATOM 7 CD LYS A 1 4.458 13.694 3.031 1.00 0.00 C ATOM 8 CE LYS A 1 4.437 14.152 4.491 1.00 0.00 C ATOM 9 NZ LYS A 1 4.625 15.629 4.434 1.00 0.00 N ATOM 10 H1 LYS A 1 0.863 11.666 4.266 1.00 0.00 H ATOM 11 H2 LYS A 1 1.853 13.035 4.447 1.00 0.00 H ATOM 12 H3 LYS A 1 2.462 11.634 3.701 1.00 0.00 H ATOM 13 HA LYS A 1 0.617 13.661 2.624 1.00 0.00 H ATOM 14 HB2 LYS A 1 3.081 12.113 1.767 1.00 0.00 H ATOM 15 HB3 LYS A 1 2.211 13.205 0.688 1.00 0.00 H ATOM 16 HG2 LYS A 1 3.460 14.875 1.539 1.00 0.00 H ATOM 17 HG3 LYS A 1 2.551 14.678 3.038 1.00 0.00 H ATOM 18 HD2 LYS A 1 4.500 12.616 2.991 1.00 0.00 H ATOM 19 HD3 LYS A 1 5.326 14.108 2.540 1.00 0.00 H ATOM 20 HE2 LYS A 1 3.487 13.907 4.948 1.00 0.00 H ATOM 21 HE3 LYS A 1 5.247 13.698 5.040 1.00 0.00 H ATOM 22 HZ1 LYS A 1 3.803 16.066 3.972 1.00 0.00 H ATOM 23 HZ2 LYS A 1 5.486 15.846 3.892 1.00 0.00 H ATOM 24 HZ3 LYS A 1 4.716 16.003 5.399 1.00 0.00 H ATOM 25 N CYS A 2 0.666 11.225 0.650 1.00 0.00 N ATOM 26 CA CYS A 2 -0.157 10.205 -0.057 1.00 0.00 C ATOM 27 C CYS A 2 -0.093 8.863 0.681 1.00 0.00 C ATOM 28 O CYS A 2 -0.965 8.027 0.547 1.00 0.00 O ATOM 29 CB CYS A 2 0.470 10.090 -1.448 1.00 0.00 C ATOM 30 SG CYS A 2 2.074 9.259 -1.326 1.00 0.00 S ATOM 31 H CYS A 2 1.492 11.549 0.240 1.00 0.00 H ATOM 32 HA CYS A 2 -1.180 10.540 -0.141 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.183 9.521 -2.091 1.00 0.00 H ATOM 34 HB3 CYS A 2 0.607 11.079 -1.860 1.00 0.00 H ATOM 35 N ASN A 3 0.939 8.647 1.450 1.00 0.00 N ATOM 36 CA ASN A 3 1.069 7.355 2.191 1.00 0.00 C ATOM 37 C ASN A 3 -0.257 6.964 2.847 1.00 0.00 C ATOM 38 O ASN A 3 -0.674 5.826 2.795 1.00 0.00 O ATOM 39 CB ASN A 3 2.125 7.628 3.263 1.00 0.00 C ATOM 40 CG ASN A 3 3.490 7.818 2.601 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.188 6.859 2.334 1.00 0.00 O ATOM 42 ND2 ASN A 3 3.903 9.023 2.322 1.00 0.00 N ATOM 43 H ASN A 3 1.633 9.332 1.539 1.00 0.00 H ATOM 44 HA ASN A 3 1.412 6.571 1.538 1.00 0.00 H ATOM 45 HB2 ASN A 3 1.861 8.523 3.808 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.170 6.791 3.944 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.337 9.799 2.537 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.781 9.155 1.896 1.00 0.00 H ATOM 49 N THR A 4 -0.905 7.897 3.483 1.00 0.00 N ATOM 50 CA THR A 4 -2.191 7.581 4.173 1.00 0.00 C ATOM 51 C THR A 4 -3.344 7.335 3.188 1.00 0.00 C ATOM 52 O THR A 4 -4.078 6.375 3.321 1.00 0.00 O ATOM 53 CB THR A 4 -2.481 8.814 5.030 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.776 9.931 4.506 1.00 0.00 O ATOM 55 CG2 THR A 4 -2.031 8.551 6.468 1.00 0.00 C ATOM 56 H THR A 4 -0.540 8.803 3.527 1.00 0.00 H ATOM 57 HA THR A 4 -2.064 6.726 4.814 1.00 0.00 H ATOM 58 HB THR A 4 -3.540 9.020 5.022 1.00 0.00 H ATOM 59 HG1 THR A 4 -0.971 10.040 5.016 1.00 0.00 H ATOM 60 HG21 THR A 4 -2.573 7.694 6.868 1.00 0.00 H ATOM 61 HG22 THR A 4 -2.237 9.429 7.080 1.00 0.00 H ATOM 62 HG23 THR A 4 -0.961 8.342 6.482 1.00 0.00 H ATOM 63 N ALA A 5 -3.552 8.209 2.237 1.00 0.00 N ATOM 64 CA ALA A 5 -4.710 8.019 1.305 1.00 0.00 C ATOM 65 C ALA A 5 -4.319 7.404 -0.050 1.00 0.00 C ATOM 66 O ALA A 5 -4.697 6.294 -0.363 1.00 0.00 O ATOM 67 CB ALA A 5 -5.266 9.427 1.096 1.00 0.00 C ATOM 68 H ALA A 5 -2.981 9.001 2.160 1.00 0.00 H ATOM 69 HA ALA A 5 -5.462 7.410 1.778 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.122 9.384 0.423 1.00 0.00 H ATOM 71 HB2 ALA A 5 -4.494 10.062 0.661 1.00 0.00 H ATOM 72 HB3 ALA A 5 -5.579 9.841 2.055 1.00 0.00 H ATOM 73 N THR A 6 -3.618 8.134 -0.875 1.00 0.00 N ATOM 74 CA THR A 6 -3.272 7.602 -2.233 1.00 0.00 C ATOM 75 C THR A 6 -2.215 6.495 -2.182 1.00 0.00 C ATOM 76 O THR A 6 -2.387 5.443 -2.765 1.00 0.00 O ATOM 77 CB THR A 6 -2.734 8.811 -2.997 1.00 0.00 C ATOM 78 OG1 THR A 6 -3.239 10.004 -2.414 1.00 0.00 O ATOM 79 CG2 THR A 6 -3.170 8.733 -4.460 1.00 0.00 C ATOM 80 H THR A 6 -3.358 9.045 -0.624 1.00 0.00 H ATOM 81 HA THR A 6 -4.162 7.240 -2.722 1.00 0.00 H ATOM 82 HB THR A 6 -1.657 8.815 -2.950 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.406 10.633 -3.120 1.00 0.00 H ATOM 84 HG21 THR A 6 -2.778 7.820 -4.908 1.00 0.00 H ATOM 85 HG22 THR A 6 -2.784 9.597 -5.001 1.00 0.00 H ATOM 86 HG23 THR A 6 -4.259 8.727 -4.515 1.00 0.00 H ATOM 87 N CYS A 7 -1.117 6.717 -1.520 1.00 0.00 N ATOM 88 CA CYS A 7 -0.059 5.666 -1.479 1.00 0.00 C ATOM 89 C CYS A 7 -0.447 4.528 -0.526 1.00 0.00 C ATOM 90 O CYS A 7 0.229 3.521 -0.447 1.00 0.00 O ATOM 91 CB CYS A 7 1.194 6.389 -0.988 1.00 0.00 C ATOM 92 SG CYS A 7 1.800 7.500 -2.280 1.00 0.00 S ATOM 93 H CYS A 7 -0.978 7.575 -1.067 1.00 0.00 H ATOM 94 HA CYS A 7 0.114 5.276 -2.469 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.950 6.963 -0.113 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.958 5.665 -0.745 1.00 0.00 H ATOM 97 N ALA A 8 -1.524 4.676 0.197 1.00 0.00 N ATOM 98 CA ALA A 8 -1.947 3.596 1.139 1.00 0.00 C ATOM 99 C ALA A 8 -2.211 2.294 0.374 1.00 0.00 C ATOM 100 O ALA A 8 -1.774 1.229 0.770 1.00 0.00 O ATOM 101 CB ALA A 8 -3.236 4.109 1.780 1.00 0.00 C ATOM 102 H ALA A 8 -2.057 5.494 0.119 1.00 0.00 H ATOM 103 HA ALA A 8 -1.195 3.441 1.897 1.00 0.00 H ATOM 104 HB1 ALA A 8 -3.610 3.369 2.487 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.984 4.282 1.006 1.00 0.00 H ATOM 106 HB3 ALA A 8 -3.035 5.043 2.305 1.00 0.00 H ATOM 107 N THR A 9 -2.920 2.369 -0.721 1.00 0.00 N ATOM 108 CA THR A 9 -3.209 1.137 -1.516 1.00 0.00 C ATOM 109 C THR A 9 -1.950 0.704 -2.270 1.00 0.00 C ATOM 110 O THR A 9 -1.691 -0.463 -2.473 1.00 0.00 O ATOM 111 CB THR A 9 -4.311 1.545 -2.497 1.00 0.00 C ATOM 112 OG1 THR A 9 -5.364 2.178 -1.786 1.00 0.00 O ATOM 113 CG2 THR A 9 -4.846 0.301 -3.204 1.00 0.00 C ATOM 114 H THR A 9 -3.257 3.236 -1.024 1.00 0.00 H ATOM 115 HA THR A 9 -3.561 0.348 -0.875 1.00 0.00 H ATOM 116 HB THR A 9 -3.911 2.227 -3.230 1.00 0.00 H ATOM 117 HG1 THR A 9 -5.819 1.508 -1.269 1.00 0.00 H ATOM 118 HG21 THR A 9 -4.036 -0.185 -3.748 1.00 0.00 H ATOM 119 HG22 THR A 9 -5.631 0.589 -3.903 1.00 0.00 H ATOM 120 HG23 THR A 9 -5.253 -0.390 -2.466 1.00 0.00 H ATOM 121 N GLN A 10 -1.165 1.651 -2.682 1.00 0.00 N ATOM 122 CA GLN A 10 0.088 1.328 -3.423 1.00 0.00 C ATOM 123 C GLN A 10 0.976 0.425 -2.561 1.00 0.00 C ATOM 124 O GLN A 10 1.324 -0.672 -2.950 1.00 0.00 O ATOM 125 CB GLN A 10 0.733 2.700 -3.682 1.00 0.00 C ATOM 126 CG GLN A 10 2.258 2.613 -3.591 1.00 0.00 C ATOM 127 CD GLN A 10 2.884 3.707 -4.457 1.00 0.00 C ATOM 128 OE1 GLN A 10 3.457 4.650 -3.947 1.00 0.00 O ATOM 129 NE2 GLN A 10 2.801 3.619 -5.757 1.00 0.00 N ATOM 130 H GLN A 10 -1.398 2.578 -2.496 1.00 0.00 H ATOM 131 HA GLN A 10 -0.142 0.842 -4.357 1.00 0.00 H ATOM 132 HB2 GLN A 10 0.455 3.041 -4.669 1.00 0.00 H ATOM 133 HB3 GLN A 10 0.371 3.405 -2.949 1.00 0.00 H ATOM 134 HG2 GLN A 10 2.560 2.749 -2.562 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.585 1.646 -3.939 1.00 0.00 H ATOM 136 HE21 GLN A 10 2.339 2.854 -6.169 1.00 0.00 H ATOM 137 HE22 GLN A 10 3.199 4.318 -6.324 1.00 0.00 H ATOM 138 N ARG A 11 1.324 0.862 -1.384 1.00 0.00 N ATOM 139 CA ARG A 11 2.161 0.006 -0.499 1.00 0.00 C ATOM 140 C ARG A 11 1.361 -1.244 -0.156 1.00 0.00 C ATOM 141 O ARG A 11 1.901 -2.303 0.105 1.00 0.00 O ATOM 142 CB ARG A 11 2.429 0.846 0.749 1.00 0.00 C ATOM 143 CG ARG A 11 3.747 1.599 0.577 1.00 0.00 C ATOM 144 CD ARG A 11 4.890 0.764 1.157 1.00 0.00 C ATOM 145 NE ARG A 11 5.425 -0.012 0.003 1.00 0.00 N ATOM 146 CZ ARG A 11 6.227 -1.023 0.209 1.00 0.00 C ATOM 147 NH1 ARG A 11 6.564 -1.359 1.425 1.00 0.00 N ATOM 148 NH2 ARG A 11 6.694 -1.699 -0.805 1.00 0.00 N ATOM 149 H ARG A 11 1.017 1.740 -1.077 1.00 0.00 H ATOM 150 HA ARG A 11 3.088 -0.254 -0.986 1.00 0.00 H ATOM 151 HB2 ARG A 11 1.622 1.552 0.888 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.495 0.200 1.611 1.00 0.00 H ATOM 153 HG2 ARG A 11 3.926 1.777 -0.473 1.00 0.00 H ATOM 154 HG3 ARG A 11 3.692 2.543 1.099 1.00 0.00 H ATOM 155 HD2 ARG A 11 5.655 1.408 1.568 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.518 0.092 1.914 1.00 0.00 H ATOM 157 HE ARG A 11 5.175 0.235 -0.913 1.00 0.00 H ATOM 158 HH11 ARG A 11 6.209 -0.844 2.204 1.00 0.00 H ATOM 159 HH12 ARG A 11 7.179 -2.133 1.577 1.00 0.00 H ATOM 160 HH21 ARG A 11 6.437 -1.443 -1.737 1.00 0.00 H ATOM 161 HH22 ARG A 11 7.307 -2.474 -0.651 1.00 0.00 H ATOM 162 N LEU A 12 0.065 -1.118 -0.167 1.00 0.00 N ATOM 163 CA LEU A 12 -0.811 -2.275 0.137 1.00 0.00 C ATOM 164 C LEU A 12 -0.768 -3.245 -1.028 1.00 0.00 C ATOM 165 O LEU A 12 -0.546 -4.412 -0.855 1.00 0.00 O ATOM 166 CB LEU A 12 -2.183 -1.641 0.333 1.00 0.00 C ATOM 167 CG LEU A 12 -3.341 -2.580 -0.033 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.464 -2.753 -1.548 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.140 -3.946 0.618 1.00 0.00 C ATOM 170 H LEU A 12 -0.336 -0.251 -0.390 1.00 0.00 H ATOM 171 HA LEU A 12 -0.487 -2.756 1.038 1.00 0.00 H ATOM 172 HB2 LEU A 12 -2.279 -1.367 1.371 1.00 0.00 H ATOM 173 HB3 LEU A 12 -2.235 -0.760 -0.273 1.00 0.00 H ATOM 174 HG LEU A 12 -4.255 -2.142 0.331 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.294 -3.424 -1.771 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.540 -3.175 -1.942 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.647 -1.783 -2.011 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.204 -4.382 0.268 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.968 -4.602 0.350 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.104 -3.831 1.701 1.00 0.00 H ATOM 181 N ALA A 13 -0.925 -2.777 -2.221 1.00 0.00 N ATOM 182 CA ALA A 13 -0.833 -3.694 -3.378 1.00 0.00 C ATOM 183 C ALA A 13 0.506 -4.414 -3.323 1.00 0.00 C ATOM 184 O ALA A 13 0.672 -5.507 -3.828 1.00 0.00 O ATOM 185 CB ALA A 13 -0.862 -2.777 -4.572 1.00 0.00 C ATOM 186 H ALA A 13 -1.073 -1.824 -2.360 1.00 0.00 H ATOM 187 HA ALA A 13 -1.658 -4.387 -3.402 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.798 -3.368 -5.486 1.00 0.00 H ATOM 189 HB2 ALA A 13 -0.017 -2.090 -4.524 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.792 -2.208 -4.572 1.00 0.00 H ATOM 191 N ASN A 14 1.452 -3.799 -2.674 1.00 0.00 N ATOM 192 CA ASN A 14 2.787 -4.404 -2.520 1.00 0.00 C ATOM 193 C ASN A 14 2.742 -5.251 -1.270 1.00 0.00 C ATOM 194 O ASN A 14 3.526 -6.161 -1.083 1.00 0.00 O ATOM 195 CB ASN A 14 3.754 -3.232 -2.352 1.00 0.00 C ATOM 196 CG ASN A 14 4.531 -3.017 -3.651 1.00 0.00 C ATOM 197 OD1 ASN A 14 4.906 -3.965 -4.312 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.791 -1.802 -4.047 1.00 0.00 N ATOM 199 H ASN A 14 1.271 -2.944 -2.249 1.00 0.00 H ATOM 200 HA ASN A 14 3.045 -4.995 -3.383 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.196 -2.338 -2.113 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.446 -3.449 -1.552 1.00 0.00 H ATOM 203 HD21 ASN A 14 4.487 -1.034 -3.509 1.00 0.00 H ATOM 204 HD22 ASN A 14 5.290 -1.654 -4.881 1.00 0.00 H ATOM 205 N PHE A 15 1.795 -4.971 -0.415 1.00 0.00 N ATOM 206 CA PHE A 15 1.678 -5.787 0.814 1.00 0.00 C ATOM 207 C PHE A 15 0.700 -6.910 0.508 1.00 0.00 C ATOM 208 O PHE A 15 0.798 -8.022 0.987 1.00 0.00 O ATOM 209 CB PHE A 15 1.157 -4.826 1.914 1.00 0.00 C ATOM 210 CG PHE A 15 -0.098 -5.368 2.588 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.136 -6.685 3.066 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.229 -4.553 2.721 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.296 -7.180 3.664 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.387 -5.047 3.322 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.424 -6.363 3.792 1.00 0.00 C ATOM 216 H PHE A 15 1.135 -4.249 -0.611 1.00 0.00 H ATOM 217 HA PHE A 15 2.637 -6.171 1.073 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.926 -4.693 2.659 1.00 0.00 H ATOM 219 HB3 PHE A 15 0.933 -3.869 1.467 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.732 -7.320 2.965 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.210 -3.540 2.366 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.323 -8.194 4.024 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.258 -4.412 3.414 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.321 -6.746 4.255 1.00 0.00 H ATOM 225 N LEU A 16 -0.247 -6.574 -0.295 1.00 0.00 N ATOM 226 CA LEU A 16 -1.304 -7.503 -0.712 1.00 0.00 C ATOM 227 C LEU A 16 -0.747 -8.521 -1.703 1.00 0.00 C ATOM 228 O LEU A 16 -1.369 -9.520 -2.004 1.00 0.00 O ATOM 229 CB LEU A 16 -2.295 -6.557 -1.371 1.00 0.00 C ATOM 230 CG LEU A 16 -3.669 -7.185 -1.405 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.370 -6.895 -0.079 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.459 -6.569 -2.560 1.00 0.00 C ATOM 233 H LEU A 16 -0.267 -5.657 -0.638 1.00 0.00 H ATOM 234 HA LEU A 16 -1.755 -7.989 0.138 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.339 -5.639 -0.803 1.00 0.00 H ATOM 236 HB3 LEU A 16 -1.972 -6.336 -2.374 1.00 0.00 H ATOM 237 HG LEU A 16 -3.572 -8.250 -1.545 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.364 -7.342 -0.088 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.458 -5.817 0.058 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.789 -7.319 0.740 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.547 -5.493 -2.408 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.454 -7.013 -2.598 1.00 0.00 H ATOM 243 HD23 LEU A 16 -3.940 -6.761 -3.499 1.00 0.00 H ATOM 244 N VAL A 17 0.429 -8.273 -2.205 1.00 0.00 N ATOM 245 CA VAL A 17 1.040 -9.225 -3.170 1.00 0.00 C ATOM 246 C VAL A 17 0.976 -10.643 -2.601 1.00 0.00 C ATOM 247 O VAL A 17 0.925 -11.617 -3.327 1.00 0.00 O ATOM 248 CB VAL A 17 2.492 -8.770 -3.317 1.00 0.00 C ATOM 249 CG1 VAL A 17 3.216 -9.670 -4.321 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.522 -7.326 -3.817 1.00 0.00 C ATOM 251 H VAL A 17 0.911 -7.462 -1.942 1.00 0.00 H ATOM 252 HA VAL A 17 0.537 -9.170 -4.122 1.00 0.00 H ATOM 253 HB VAL A 17 2.986 -8.830 -2.358 1.00 0.00 H ATOM 254 HG11 VAL A 17 4.251 -9.343 -4.423 1.00 0.00 H ATOM 255 HG12 VAL A 17 2.719 -9.609 -5.289 1.00 0.00 H ATOM 256 HG13 VAL A 17 3.195 -10.701 -3.967 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.022 -7.265 -4.784 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.556 -6.999 -3.923 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.009 -6.683 -3.102 1.00 0.00 H ATOM 260 N ARG A 18 0.968 -10.763 -1.301 1.00 0.00 N ATOM 261 CA ARG A 18 0.896 -12.112 -0.671 1.00 0.00 C ATOM 262 C ARG A 18 -0.523 -12.672 -0.795 1.00 0.00 C ATOM 263 O ARG A 18 -0.729 -13.773 -1.264 1.00 0.00 O ATOM 264 CB ARG A 18 1.251 -11.879 0.798 1.00 0.00 C ATOM 265 CG ARG A 18 2.469 -12.725 1.172 1.00 0.00 C ATOM 266 CD ARG A 18 2.176 -14.198 0.883 1.00 0.00 C ATOM 267 NE ARG A 18 2.470 -14.907 2.159 1.00 0.00 N ATOM 268 CZ ARG A 18 2.132 -16.160 2.305 1.00 0.00 C ATOM 269 NH1 ARG A 18 1.533 -16.796 1.332 1.00 0.00 N ATOM 270 NH2 ARG A 18 2.393 -16.778 3.424 1.00 0.00 N ATOM 271 H ARG A 18 1.004 -9.963 -0.735 1.00 0.00 H ATOM 272 HA ARG A 18 1.610 -12.780 -1.124 1.00 0.00 H ATOM 273 HB2 ARG A 18 1.478 -10.834 0.952 1.00 0.00 H ATOM 274 HB3 ARG A 18 0.414 -12.161 1.420 1.00 0.00 H ATOM 275 HG2 ARG A 18 3.322 -12.405 0.591 1.00 0.00 H ATOM 276 HG3 ARG A 18 2.683 -12.604 2.224 1.00 0.00 H ATOM 277 HD2 ARG A 18 1.138 -14.327 0.607 1.00 0.00 H ATOM 278 HD3 ARG A 18 2.823 -14.562 0.100 1.00 0.00 H ATOM 279 HE ARG A 18 2.916 -14.431 2.890 1.00 0.00 H ATOM 280 HH11 ARG A 18 1.330 -16.324 0.475 1.00 0.00 H ATOM 281 HH12 ARG A 18 1.277 -17.757 1.446 1.00 0.00 H ATOM 282 HH21 ARG A 18 2.851 -16.292 4.169 1.00 0.00 H ATOM 283 HH22 ARG A 18 2.138 -17.738 3.537 1.00 0.00 H ATOM 284 N SER A 19 -1.503 -11.918 -0.378 1.00 0.00 N ATOM 285 CA SER A 19 -2.910 -12.399 -0.470 1.00 0.00 C ATOM 286 C SER A 19 -3.499 -12.053 -1.840 1.00 0.00 C ATOM 287 O SER A 19 -4.003 -12.913 -2.537 1.00 0.00 O ATOM 288 CB SER A 19 -3.655 -11.654 0.638 1.00 0.00 C ATOM 289 OG SER A 19 -4.142 -12.591 1.590 1.00 0.00 O ATOM 290 H SER A 19 -1.315 -11.033 -0.004 1.00 0.00 H ATOM 291 HA SER A 19 -2.954 -13.460 -0.295 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.984 -10.969 1.128 1.00 0.00 H ATOM 293 HB3 SER A 19 -4.479 -11.101 0.206 1.00 0.00 H ATOM 294 HG SER A 19 -3.844 -12.313 2.459 1.00 0.00 H HETATM 295 N NH2 A 20 -3.456 -10.820 -2.261 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -3.832 -10.586 -3.135 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -3.051 -10.126 -1.699 1.00 0.00 H TER 298 NH2 A 20 ENDMDL MODEL 20 ATOM 1 N LYS A 1 1.071 14.002 2.299 1.00 0.00 N ATOM 2 CA LYS A 1 0.313 13.073 3.187 1.00 0.00 C ATOM 3 C LYS A 1 -0.444 12.040 2.345 1.00 0.00 C ATOM 4 O LYS A 1 -1.465 11.523 2.751 1.00 0.00 O ATOM 5 CB LYS A 1 -0.666 13.967 3.951 1.00 0.00 C ATOM 6 CG LYS A 1 0.015 14.505 5.210 1.00 0.00 C ATOM 7 CD LYS A 1 -0.435 13.690 6.425 1.00 0.00 C ATOM 8 CE LYS A 1 0.024 14.386 7.708 1.00 0.00 C ATOM 9 NZ LYS A 1 1.472 14.663 7.497 1.00 0.00 N ATOM 10 H1 LYS A 1 0.551 14.135 1.411 1.00 0.00 H ATOM 11 H2 LYS A 1 2.008 13.596 2.096 1.00 0.00 H ATOM 12 H3 LYS A 1 1.185 14.919 2.773 1.00 0.00 H ATOM 13 HA LYS A 1 0.980 12.583 3.877 1.00 0.00 H ATOM 14 HB2 LYS A 1 -0.966 14.793 3.322 1.00 0.00 H ATOM 15 HB3 LYS A 1 -1.536 13.393 4.232 1.00 0.00 H ATOM 16 HG2 LYS A 1 1.087 14.428 5.102 1.00 0.00 H ATOM 17 HG3 LYS A 1 -0.258 15.541 5.354 1.00 0.00 H ATOM 18 HD2 LYS A 1 -1.514 13.609 6.424 1.00 0.00 H ATOM 19 HD3 LYS A 1 -0.001 12.704 6.377 1.00 0.00 H ATOM 20 HE2 LYS A 1 -0.521 15.309 7.850 1.00 0.00 H ATOM 21 HE3 LYS A 1 -0.107 13.735 8.559 1.00 0.00 H ATOM 22 HZ1 LYS A 1 1.592 15.632 7.139 1.00 0.00 H ATOM 23 HZ2 LYS A 1 1.857 13.986 6.806 1.00 0.00 H ATOM 24 HZ3 LYS A 1 1.980 14.565 8.398 1.00 0.00 H ATOM 25 N CYS A 2 0.056 11.734 1.178 1.00 0.00 N ATOM 26 CA CYS A 2 -0.629 10.732 0.311 1.00 0.00 C ATOM 27 C CYS A 2 -0.354 9.318 0.826 1.00 0.00 C ATOM 28 O CYS A 2 -1.190 8.440 0.749 1.00 0.00 O ATOM 29 CB CYS A 2 -0.006 10.923 -1.075 1.00 0.00 C ATOM 30 SG CYS A 2 -0.663 9.678 -2.215 1.00 0.00 S ATOM 31 H CYS A 2 0.883 12.162 0.873 1.00 0.00 H ATOM 32 HA CYS A 2 -1.689 10.924 0.272 1.00 0.00 H ATOM 33 HB2 CYS A 2 -0.247 11.909 -1.445 1.00 0.00 H ATOM 34 HB3 CYS A 2 1.066 10.817 -1.006 1.00 0.00 H ATOM 35 N ASN A 3 0.823 9.093 1.345 1.00 0.00 N ATOM 36 CA ASN A 3 1.183 7.740 1.863 1.00 0.00 C ATOM 37 C ASN A 3 0.060 7.157 2.726 1.00 0.00 C ATOM 38 O ASN A 3 -0.095 5.958 2.828 1.00 0.00 O ATOM 39 CB ASN A 3 2.427 7.980 2.719 1.00 0.00 C ATOM 40 CG ASN A 3 3.589 7.146 2.179 1.00 0.00 C ATOM 41 OD1 ASN A 3 4.066 6.247 2.842 1.00 0.00 O ATOM 42 ND2 ASN A 3 4.065 7.407 0.994 1.00 0.00 N ATOM 43 H ASN A 3 1.479 9.820 1.387 1.00 0.00 H ATOM 44 HA ASN A 3 1.426 7.072 1.055 1.00 0.00 H ATOM 45 HB2 ASN A 3 2.688 9.027 2.686 1.00 0.00 H ATOM 46 HB3 ASN A 3 2.222 7.691 3.739 1.00 0.00 H ATOM 47 HD21 ASN A 3 3.677 8.137 0.458 1.00 0.00 H ATOM 48 HD22 ASN A 3 4.812 6.876 0.638 1.00 0.00 H ATOM 49 N THR A 4 -0.700 7.994 3.372 1.00 0.00 N ATOM 50 CA THR A 4 -1.784 7.482 4.256 1.00 0.00 C ATOM 51 C THR A 4 -2.963 6.882 3.472 1.00 0.00 C ATOM 52 O THR A 4 -3.324 5.740 3.673 1.00 0.00 O ATOM 53 CB THR A 4 -2.246 8.703 5.053 1.00 0.00 C ATOM 54 OG1 THR A 4 -1.845 9.887 4.375 1.00 0.00 O ATOM 55 CG2 THR A 4 -1.615 8.671 6.445 1.00 0.00 C ATOM 56 H THR A 4 -0.541 8.958 3.296 1.00 0.00 H ATOM 57 HA THR A 4 -1.386 6.747 4.937 1.00 0.00 H ATOM 58 HB THR A 4 -3.319 8.688 5.147 1.00 0.00 H ATOM 59 HG1 THR A 4 -1.649 10.554 5.037 1.00 0.00 H ATOM 60 HG21 THR A 4 -1.922 7.762 6.963 1.00 0.00 H ATOM 61 HG22 THR A 4 -1.944 9.541 7.014 1.00 0.00 H ATOM 62 HG23 THR A 4 -0.529 8.687 6.353 1.00 0.00 H ATOM 63 N ALA A 5 -3.603 7.647 2.627 1.00 0.00 N ATOM 64 CA ALA A 5 -4.793 7.099 1.900 1.00 0.00 C ATOM 65 C ALA A 5 -4.489 6.664 0.459 1.00 0.00 C ATOM 66 O ALA A 5 -4.535 5.495 0.132 1.00 0.00 O ATOM 67 CB ALA A 5 -5.795 8.252 1.892 1.00 0.00 C ATOM 68 H ALA A 5 -3.333 8.579 2.500 1.00 0.00 H ATOM 69 HA ALA A 5 -5.211 6.273 2.452 1.00 0.00 H ATOM 70 HB1 ALA A 5 -6.704 7.941 1.377 1.00 0.00 H ATOM 71 HB2 ALA A 5 -5.360 9.108 1.376 1.00 0.00 H ATOM 72 HB3 ALA A 5 -6.037 8.531 2.918 1.00 0.00 H ATOM 73 N THR A 6 -4.238 7.601 -0.414 1.00 0.00 N ATOM 74 CA THR A 6 -4.000 7.252 -1.850 1.00 0.00 C ATOM 75 C THR A 6 -2.713 6.447 -2.055 1.00 0.00 C ATOM 76 O THR A 6 -2.713 5.427 -2.716 1.00 0.00 O ATOM 77 CB THR A 6 -3.898 8.598 -2.571 1.00 0.00 C ATOM 78 OG1 THR A 6 -4.256 9.647 -1.681 1.00 0.00 O ATOM 79 CG2 THR A 6 -4.842 8.604 -3.774 1.00 0.00 C ATOM 80 H THR A 6 -4.247 8.542 -0.136 1.00 0.00 H ATOM 81 HA THR A 6 -4.841 6.703 -2.238 1.00 0.00 H ATOM 82 HB THR A 6 -2.887 8.747 -2.913 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.549 10.297 -1.688 1.00 0.00 H ATOM 84 HG21 THR A 6 -4.564 7.803 -4.459 1.00 0.00 H ATOM 85 HG22 THR A 6 -4.770 9.562 -4.288 1.00 0.00 H ATOM 86 HG23 THR A 6 -5.866 8.451 -3.434 1.00 0.00 H ATOM 87 N CYS A 7 -1.616 6.900 -1.525 1.00 0.00 N ATOM 88 CA CYS A 7 -0.339 6.157 -1.728 1.00 0.00 C ATOM 89 C CYS A 7 -0.295 4.905 -0.848 1.00 0.00 C ATOM 90 O CYS A 7 0.606 4.095 -0.950 1.00 0.00 O ATOM 91 CB CYS A 7 0.756 7.144 -1.328 1.00 0.00 C ATOM 92 SG CYS A 7 0.899 8.445 -2.581 1.00 0.00 S ATOM 93 H CYS A 7 -1.625 7.730 -1.007 1.00 0.00 H ATOM 94 HA CYS A 7 -0.224 5.888 -2.766 1.00 0.00 H ATOM 95 HB2 CYS A 7 0.503 7.586 -0.383 1.00 0.00 H ATOM 96 HB3 CYS A 7 1.698 6.622 -1.241 1.00 0.00 H ATOM 97 N ALA A 8 -1.259 4.736 0.014 1.00 0.00 N ATOM 98 CA ALA A 8 -1.268 3.531 0.893 1.00 0.00 C ATOM 99 C ALA A 8 -1.528 2.272 0.061 1.00 0.00 C ATOM 100 O ALA A 8 -1.149 1.181 0.434 1.00 0.00 O ATOM 101 CB ALA A 8 -2.411 3.766 1.879 1.00 0.00 C ATOM 102 H ALA A 8 -1.979 5.398 0.082 1.00 0.00 H ATOM 103 HA ALA A 8 -0.333 3.446 1.425 1.00 0.00 H ATOM 104 HB1 ALA A 8 -2.482 2.920 2.562 1.00 0.00 H ATOM 105 HB2 ALA A 8 -3.348 3.870 1.332 1.00 0.00 H ATOM 106 HB3 ALA A 8 -2.220 4.676 2.448 1.00 0.00 H ATOM 107 N THR A 9 -2.173 2.421 -1.064 1.00 0.00 N ATOM 108 CA THR A 9 -2.465 1.238 -1.929 1.00 0.00 C ATOM 109 C THR A 9 -1.176 0.713 -2.566 1.00 0.00 C ATOM 110 O THR A 9 -1.015 -0.469 -2.788 1.00 0.00 O ATOM 111 CB THR A 9 -3.415 1.766 -3.004 1.00 0.00 C ATOM 112 OG1 THR A 9 -4.556 2.343 -2.384 1.00 0.00 O ATOM 113 CG2 THR A 9 -3.851 0.616 -3.912 1.00 0.00 C ATOM 114 H THR A 9 -2.465 3.313 -1.343 1.00 0.00 H ATOM 115 HA THR A 9 -2.950 0.465 -1.357 1.00 0.00 H ATOM 116 HB THR A 9 -2.909 2.514 -3.597 1.00 0.00 H ATOM 117 HG1 THR A 9 -4.294 3.188 -2.011 1.00 0.00 H ATOM 118 HG21 THR A 9 -2.975 0.176 -4.388 1.00 0.00 H ATOM 119 HG22 THR A 9 -4.528 0.994 -4.678 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.361 -0.143 -3.319 1.00 0.00 H ATOM 121 N GLN A 10 -0.262 1.588 -2.868 1.00 0.00 N ATOM 122 CA GLN A 10 1.017 1.149 -3.502 1.00 0.00 C ATOM 123 C GLN A 10 1.749 0.169 -2.587 1.00 0.00 C ATOM 124 O GLN A 10 2.012 -0.959 -2.954 1.00 0.00 O ATOM 125 CB GLN A 10 1.829 2.433 -3.674 1.00 0.00 C ATOM 126 CG GLN A 10 2.165 2.627 -5.152 1.00 0.00 C ATOM 127 CD GLN A 10 3.569 2.088 -5.430 1.00 0.00 C ATOM 128 OE1 GLN A 10 3.861 0.943 -5.147 1.00 0.00 O ATOM 129 NE2 GLN A 10 4.460 2.871 -5.976 1.00 0.00 N ATOM 130 H GLN A 10 -0.420 2.532 -2.680 1.00 0.00 H ATOM 131 HA GLN A 10 0.829 0.697 -4.462 1.00 0.00 H ATOM 132 HB2 GLN A 10 1.249 3.275 -3.321 1.00 0.00 H ATOM 133 HB3 GLN A 10 2.742 2.361 -3.105 1.00 0.00 H ATOM 134 HG2 GLN A 10 1.447 2.094 -5.757 1.00 0.00 H ATOM 135 HG3 GLN A 10 2.131 3.679 -5.394 1.00 0.00 H ATOM 136 HE21 GLN A 10 4.224 3.799 -6.205 1.00 0.00 H ATOM 137 HE22 GLN A 10 5.365 2.533 -6.158 1.00 0.00 H ATOM 138 N ARG A 11 2.055 0.580 -1.391 1.00 0.00 N ATOM 139 CA ARG A 11 2.742 -0.345 -0.450 1.00 0.00 C ATOM 140 C ARG A 11 1.791 -1.492 -0.134 1.00 0.00 C ATOM 141 O ARG A 11 2.193 -2.595 0.179 1.00 0.00 O ATOM 142 CB ARG A 11 3.027 0.490 0.800 1.00 0.00 C ATOM 143 CG ARG A 11 4.517 0.831 0.856 1.00 0.00 C ATOM 144 CD ARG A 11 4.689 2.342 1.023 1.00 0.00 C ATOM 145 NE ARG A 11 6.098 2.522 1.473 1.00 0.00 N ATOM 146 CZ ARG A 11 6.682 3.685 1.354 1.00 0.00 C ATOM 147 NH1 ARG A 11 6.038 4.692 0.830 1.00 0.00 N ATOM 148 NH2 ARG A 11 7.913 3.837 1.757 1.00 0.00 N ATOM 149 H ARG A 11 1.816 1.486 -1.107 1.00 0.00 H ATOM 150 HA ARG A 11 3.661 -0.711 -0.877 1.00 0.00 H ATOM 151 HB2 ARG A 11 2.449 1.403 0.762 1.00 0.00 H ATOM 152 HB3 ARG A 11 2.754 -0.074 1.678 1.00 0.00 H ATOM 153 HG2 ARG A 11 4.972 0.321 1.693 1.00 0.00 H ATOM 154 HG3 ARG A 11 4.993 0.515 -0.060 1.00 0.00 H ATOM 155 HD2 ARG A 11 4.525 2.845 0.079 1.00 0.00 H ATOM 156 HD3 ARG A 11 4.011 2.718 1.773 1.00 0.00 H ATOM 157 HE ARG A 11 6.586 1.768 1.862 1.00 0.00 H ATOM 158 HH11 ARG A 11 5.096 4.578 0.517 1.00 0.00 H ATOM 159 HH12 ARG A 11 6.490 5.580 0.738 1.00 0.00 H ATOM 160 HH21 ARG A 11 8.408 3.066 2.157 1.00 0.00 H ATOM 161 HH22 ARG A 11 8.361 4.728 1.669 1.00 0.00 H ATOM 162 N LEU A 12 0.519 -1.222 -0.227 1.00 0.00 N ATOM 163 CA LEU A 12 -0.504 -2.261 0.048 1.00 0.00 C ATOM 164 C LEU A 12 -0.534 -3.259 -1.097 1.00 0.00 C ATOM 165 O LEU A 12 -0.460 -4.440 -0.891 1.00 0.00 O ATOM 166 CB LEU A 12 -1.792 -1.458 0.171 1.00 0.00 C ATOM 167 CG LEU A 12 -3.044 -2.266 -0.197 1.00 0.00 C ATOM 168 CD1 LEU A 12 -3.129 -2.480 -1.711 1.00 0.00 C ATOM 169 CD2 LEU A 12 -3.024 -3.614 0.518 1.00 0.00 C ATOM 170 H LEU A 12 0.234 -0.320 -0.487 1.00 0.00 H ATOM 171 HA LEU A 12 -0.283 -2.756 0.971 1.00 0.00 H ATOM 172 HB2 LEU A 12 -1.886 -1.127 1.191 1.00 0.00 H ATOM 173 HB3 LEU A 12 -1.719 -0.606 -0.475 1.00 0.00 H ATOM 174 HG LEU A 12 -3.910 -1.707 0.116 1.00 0.00 H ATOM 175 HD11 LEU A 12 -4.024 -3.055 -1.947 1.00 0.00 H ATOM 176 HD12 LEU A 12 -2.248 -3.024 -2.052 1.00 0.00 H ATOM 177 HD13 LEU A 12 -3.175 -1.514 -2.213 1.00 0.00 H ATOM 178 HD21 LEU A 12 -2.137 -4.172 0.218 1.00 0.00 H ATOM 179 HD22 LEU A 12 -3.916 -4.181 0.251 1.00 0.00 H ATOM 180 HD23 LEU A 12 -3.005 -3.454 1.596 1.00 0.00 H ATOM 181 N ALA A 13 -0.595 -2.803 -2.300 1.00 0.00 N ATOM 182 CA ALA A 13 -0.576 -3.741 -3.446 1.00 0.00 C ATOM 183 C ALA A 13 0.653 -4.626 -3.327 1.00 0.00 C ATOM 184 O ALA A 13 0.688 -5.746 -3.792 1.00 0.00 O ATOM 185 CB ALA A 13 -0.426 -2.838 -4.644 1.00 0.00 C ATOM 186 H ALA A 13 -0.624 -1.849 -2.455 1.00 0.00 H ATOM 187 HA ALA A 13 -1.483 -4.320 -3.505 1.00 0.00 H ATOM 188 HB1 ALA A 13 -0.401 -3.440 -5.552 1.00 0.00 H ATOM 189 HB2 ALA A 13 0.501 -2.271 -4.559 1.00 0.00 H ATOM 190 HB3 ALA A 13 -1.270 -2.149 -4.688 1.00 0.00 H ATOM 191 N ASN A 14 1.653 -4.115 -2.676 1.00 0.00 N ATOM 192 CA ASN A 14 2.894 -4.873 -2.467 1.00 0.00 C ATOM 193 C ASN A 14 2.716 -5.674 -1.196 1.00 0.00 C ATOM 194 O ASN A 14 3.386 -6.660 -0.957 1.00 0.00 O ATOM 195 CB ASN A 14 3.980 -3.812 -2.310 1.00 0.00 C ATOM 196 CG ASN A 14 4.010 -2.926 -3.558 1.00 0.00 C ATOM 197 OD1 ASN A 14 3.135 -3.011 -4.397 1.00 0.00 O ATOM 198 ND2 ASN A 14 4.987 -2.075 -3.718 1.00 0.00 N ATOM 199 H ASN A 14 1.573 -3.225 -2.289 1.00 0.00 H ATOM 200 HA ASN A 14 3.103 -5.513 -3.309 1.00 0.00 H ATOM 201 HB2 ASN A 14 3.768 -3.205 -1.442 1.00 0.00 H ATOM 202 HB3 ASN A 14 4.936 -4.290 -2.189 1.00 0.00 H ATOM 203 HD21 ASN A 14 5.695 -2.006 -3.040 1.00 0.00 H ATOM 204 HD22 ASN A 14 5.011 -1.502 -4.518 1.00 0.00 H ATOM 205 N PHE A 15 1.785 -5.260 -0.382 1.00 0.00 N ATOM 206 CA PHE A 15 1.533 -6.013 0.867 1.00 0.00 C ATOM 207 C PHE A 15 0.418 -7.014 0.579 1.00 0.00 C ATOM 208 O PHE A 15 0.319 -8.077 1.159 1.00 0.00 O ATOM 209 CB PHE A 15 1.125 -4.950 1.921 1.00 0.00 C ATOM 210 CG PHE A 15 -0.189 -5.311 2.605 1.00 0.00 C ATOM 211 CD1 PHE A 15 -0.379 -6.587 3.152 1.00 0.00 C ATOM 212 CD2 PHE A 15 -1.225 -4.368 2.679 1.00 0.00 C ATOM 213 CE1 PHE A 15 -1.593 -6.915 3.763 1.00 0.00 C ATOM 214 CE2 PHE A 15 -2.436 -4.697 3.288 1.00 0.00 C ATOM 215 CZ PHE A 15 -2.625 -5.971 3.829 1.00 0.00 C ATOM 216 H PHE A 15 1.224 -4.474 -0.621 1.00 0.00 H ATOM 217 HA PHE A 15 2.428 -6.509 1.162 1.00 0.00 H ATOM 218 HB2 PHE A 15 1.901 -4.880 2.667 1.00 0.00 H ATOM 219 HB3 PHE A 15 1.020 -3.994 1.433 1.00 0.00 H ATOM 220 HD1 PHE A 15 0.414 -7.318 3.103 1.00 0.00 H ATOM 221 HD2 PHE A 15 -1.091 -3.385 2.269 1.00 0.00 H ATOM 222 HE1 PHE A 15 -1.739 -7.898 4.176 1.00 0.00 H ATOM 223 HE2 PHE A 15 -3.231 -3.962 3.334 1.00 0.00 H ATOM 224 HZ PHE A 15 -3.562 -6.227 4.302 1.00 0.00 H ATOM 225 N LEU A 16 -0.430 -6.619 -0.306 1.00 0.00 N ATOM 226 CA LEU A 16 -1.600 -7.416 -0.704 1.00 0.00 C ATOM 227 C LEU A 16 -1.221 -8.456 -1.755 1.00 0.00 C ATOM 228 O LEU A 16 -1.923 -9.426 -1.963 1.00 0.00 O ATOM 229 CB LEU A 16 -2.503 -6.338 -1.290 1.00 0.00 C ATOM 230 CG LEU A 16 -3.954 -6.739 -1.140 1.00 0.00 C ATOM 231 CD1 LEU A 16 -4.379 -6.507 0.309 1.00 0.00 C ATOM 232 CD2 LEU A 16 -4.800 -5.875 -2.076 1.00 0.00 C ATOM 233 H LEU A 16 -0.304 -5.740 -0.717 1.00 0.00 H ATOM 234 HA LEU A 16 -2.069 -7.874 0.150 1.00 0.00 H ATOM 235 HB2 LEU A 16 -2.335 -5.415 -0.758 1.00 0.00 H ATOM 236 HB3 LEU A 16 -2.270 -6.191 -2.330 1.00 0.00 H ATOM 237 HG LEU A 16 -4.067 -7.781 -1.395 1.00 0.00 H ATOM 238 HD11 LEU A 16 -5.424 -6.792 0.432 1.00 0.00 H ATOM 239 HD12 LEU A 16 -4.259 -5.453 0.559 1.00 0.00 H ATOM 240 HD13 LEU A 16 -3.758 -7.110 0.971 1.00 0.00 H ATOM 241 HD21 LEU A 16 -4.677 -4.825 -1.812 1.00 0.00 H ATOM 242 HD22 LEU A 16 -5.849 -6.153 -1.979 1.00 0.00 H ATOM 243 HD23 LEU A 16 -4.477 -6.031 -3.106 1.00 0.00 H ATOM 244 N VAL A 17 -0.123 -8.262 -2.428 1.00 0.00 N ATOM 245 CA VAL A 17 0.282 -9.246 -3.469 1.00 0.00 C ATOM 246 C VAL A 17 0.232 -10.665 -2.899 1.00 0.00 C ATOM 247 O VAL A 17 -0.178 -11.597 -3.559 1.00 0.00 O ATOM 248 CB VAL A 17 1.715 -8.893 -3.881 1.00 0.00 C ATOM 249 CG1 VAL A 17 1.686 -7.794 -4.944 1.00 0.00 C ATOM 250 CG2 VAL A 17 2.515 -8.405 -2.669 1.00 0.00 C ATOM 251 H VAL A 17 0.425 -7.471 -2.253 1.00 0.00 H ATOM 252 HA VAL A 17 -0.371 -9.159 -4.319 1.00 0.00 H ATOM 253 HB VAL A 17 2.190 -9.770 -4.295 1.00 0.00 H ATOM 254 HG11 VAL A 17 2.706 -7.544 -5.236 1.00 0.00 H ATOM 255 HG12 VAL A 17 1.197 -6.908 -4.538 1.00 0.00 H ATOM 256 HG13 VAL A 17 1.135 -8.146 -5.816 1.00 0.00 H ATOM 257 HG21 VAL A 17 2.038 -7.519 -2.251 1.00 0.00 H ATOM 258 HG22 VAL A 17 3.531 -8.158 -2.979 1.00 0.00 H ATOM 259 HG23 VAL A 17 2.547 -9.190 -1.914 1.00 0.00 H ATOM 260 N ARG A 18 0.649 -10.834 -1.673 1.00 0.00 N ATOM 261 CA ARG A 18 0.628 -12.193 -1.059 1.00 0.00 C ATOM 262 C ARG A 18 -0.813 -12.699 -0.948 1.00 0.00 C ATOM 263 O ARG A 18 -1.102 -13.845 -1.232 1.00 0.00 O ATOM 264 CB ARG A 18 1.240 -12.010 0.329 1.00 0.00 C ATOM 265 CG ARG A 18 2.654 -11.441 0.191 1.00 0.00 C ATOM 266 CD ARG A 18 3.522 -12.416 -0.607 1.00 0.00 C ATOM 267 NE ARG A 18 4.893 -12.265 -0.041 1.00 0.00 N ATOM 268 CZ ARG A 18 5.586 -11.183 -0.279 1.00 0.00 C ATOM 269 NH1 ARG A 18 5.083 -10.229 -1.016 1.00 0.00 N ATOM 270 NH2 ARG A 18 6.787 -11.059 0.216 1.00 0.00 N ATOM 271 H ARG A 18 0.977 -10.069 -1.157 1.00 0.00 H ATOM 272 HA ARG A 18 1.225 -12.878 -1.637 1.00 0.00 H ATOM 273 HB2 ARG A 18 0.632 -11.327 0.905 1.00 0.00 H ATOM 274 HB3 ARG A 18 1.285 -12.964 0.832 1.00 0.00 H ATOM 275 HG2 ARG A 18 2.613 -10.492 -0.323 1.00 0.00 H ATOM 276 HG3 ARG A 18 3.085 -11.302 1.172 1.00 0.00 H ATOM 277 HD2 ARG A 18 3.167 -13.429 -0.475 1.00 0.00 H ATOM 278 HD3 ARG A 18 3.524 -12.150 -1.652 1.00 0.00 H ATOM 279 HE ARG A 18 5.273 -12.979 0.511 1.00 0.00 H ATOM 280 HH11 ARG A 18 4.164 -10.322 -1.399 1.00 0.00 H ATOM 281 HH12 ARG A 18 5.617 -9.403 -1.196 1.00 0.00 H ATOM 282 HH21 ARG A 18 7.175 -11.790 0.779 1.00 0.00 H ATOM 283 HH22 ARG A 18 7.319 -10.231 0.039 1.00 0.00 H ATOM 284 N SER A 19 -1.720 -11.855 -0.536 1.00 0.00 N ATOM 285 CA SER A 19 -3.142 -12.292 -0.409 1.00 0.00 C ATOM 286 C SER A 19 -4.046 -11.081 -0.158 1.00 0.00 C ATOM 287 O SER A 19 -5.014 -10.871 -0.862 1.00 0.00 O ATOM 288 CB SER A 19 -3.161 -13.235 0.793 1.00 0.00 C ATOM 289 OG SER A 19 -4.505 -13.591 1.087 1.00 0.00 O ATOM 290 H SER A 19 -1.468 -10.936 -0.313 1.00 0.00 H ATOM 291 HA SER A 19 -3.453 -12.818 -1.297 1.00 0.00 H ATOM 292 HB2 SER A 19 -2.600 -14.125 0.564 1.00 0.00 H ATOM 293 HB3 SER A 19 -2.715 -12.740 1.645 1.00 0.00 H ATOM 294 HG SER A 19 -4.749 -13.176 1.917 1.00 0.00 H HETATM 295 N NH2 A 20 -3.769 -10.269 0.824 1.00 0.00 N HETATM 296 HN1 NH2 A 20 -4.339 -9.491 0.995 1.00 0.00 H HETATM 297 HN2 NH2 A 20 -2.987 -10.438 1.392 1.00 0.00 H TER 298 NH2 A 20 ENDMDL CONECT 30 92 CONECT 92 30 CONECT 295 296 297 CONECT 296 295 CONECT 297 295 MASTER 125 0 1 1 0 0 0 6 145 1 5 2 END