ARG HB3 Chemical Shift Outliers

___________________________________________________
ARG HB3 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
24398
1.766
-.74
3.74
0.271


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
16493
16
ARG
HB3
2.58
2
5187
90
ARG
HB3
2.58
2
16494
16
ARG
HB3
2.58
2
11298
10
ARG
HB3
2.586
2
15783
17
ARG
HB3
2.587
.
5663
28
ARG
HB3
2.59
.
6564
41
ARG
HB3
2.6
2
6866
51
ARG
HB3
2.605
2
18200
87
ARG
HB3
2.606
1
25573
40
ARG
HB3
2.6128
2
19106
117
ARG
HB3
2.618
.
15072
41
ARG
HB3
2.62
2
4084
14
ARG
HB3
2.62
1
34101
92
ARG
HB3
2.622
2
6147
112
ARG
HB3
2.639
1
19654
134
ARG
HB3
2.667
.
26765
159
ARG
HB3
2.67
1
19758
45
ARG
HB3
2.673
1
25387
31
ARG
HB3
2.676
2
4497
63
ARG
HB3
2.68
.
4599
63
ARG
HB3
2.68
.
11298
51
ARG
HB3
2.684
2
11094
93
ARG
HB3
2.702
2
6272
45
ARG
HB3
2.73
1
19807
24
ARG
HB3
2.749
1
11298
21
ARG
HB3
2.754
2
15229
63
ARG
HB3
2.763
.
16790
98
ARG
HB3
2.763
2
6726
82
ARG
HB3
2.775
2
34029
55
ARG
HB3
2.795
.
10024
19
ARG
HB3
2.82
1
25573
36
ARG
HB3
2.845
2
5398
87
ARG
HB3
2.888
1
6826
24
ARG
HB3
2.891
2
6315
81
ARG
HB3
2.9
2
15960
115
ARG
HB3
2.91
.
5312
38
ARG
HB3
2.96
2
15801
107
ARG
HB3
2.988
.
4317
19
ARG
HB3
2.99
2
4300
150
ARG
HB3
2.99
2
16030
22
ARG
HB3
3
2
6250
87
ARG
HB3
3
1
4299
150
ARG
HB3
3.02
2
7287
109
ARG
HB3
3.026
1
16256
49
ARG
HB3
3.097
1
7124
4
ARG
HB3
3.104
1
18200
89
ARG
HB3
3.114
1
6786
18
ARG
HB3
3.149
1
25009
1
ARG
HB3
3.182
2
750
145
ARG
HB3
3.29
1
16782
95
ARG
HB3
3.32
2
27781
92
ARG
HB3
3.466
1
15438
14
ARG
HB3
3.74
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
4109
97
ARG
HB3
-.004
2
30247
41
ARG
HB3
-.025
.
11428
90
ARG
HB3
-.09
2
15016
26
ARG
HB3
-.12
.
18502
10
ARG
HB3
-.124
2
6189
31
ARG
HB3
-.139
1
10287
58
ARG
HB3
-.14
2
19446
96
ARG
HB3
-.143
2
11388
86
ARG
HB3
-.178
2
4925
12
ARG
HB3
-.197
2
15585
10
ARG
HB3
-.208
2
25314
6
ARG
HB3
-.212
2
17407
52
ARG
HB3
-.219
2
10025
81
ARG
HB3
-.221
2
25142
60
ARG
HB3
-.237
.
25313
6
ARG
HB3
-.245
2
7063
31
ARG
HB3
-.266
2
17484
55
ARG
HB3
-.278
2
15807
41
ARG
HB3
-.289
2
17541
9
ARG
HB3
-.29
2
17542
12
ARG
HB3
-.29
2
17139
38
ARG
HB3
-.297
2
11389
83
ARG
HB3
-.336
2
10294
58
ARG
HB3
-.383
2
16613
166
ARG
HB3
-.431
2
16692
54
ARG
HB3
-.436
2
16008
35
ARG
HB3
-.439
2
4242
116
ARG
HB3
-.46
2
16252
58
ARG
HB3
-.467
2
19491
169
ARG
HB3
-.513
.
10281
58
ARG
HB3
-.554
2
18394
96
ARG
HB3
-.723
2
4242
105
ARG
HB3
-.74
1
10110
59
ARG
HB3
.023
2
6876
92
ARG
HB3
.036
2
10150
49
ARG
HB3
.04
2
17518
23
ARG
HB3
.044
.
19225
114
ARG
HB3
.048
2
10074
97
ARG
HB3
.066
2
5628
52
ARG
HB3
.1
2
5778
41
ARG
HB3
.112
2
4109
97
ARG
HB3
.118
2
10147
115
ARG
HB3
.125
2
11145
109
ARG
HB3
.135
2
19835
174
ARG
HB3
.143
2
6201
96
ARG
HB3
.159
2
4109
97
ARG
HB3
.161
2
17582
175
ARG
HB3
.163
2
6201
96
ARG
HB3
.163
2
17576
175
ARG
HB3
.17
2
1675
50
ARG
HB3
.175
2
18990
104
ARG
HB3
.183
2
25694
22
ARG
HB3
.202
2
18642
31
ARG
HB3
.215
2
25159
77
ARG
HB3
.247
2
2070
72
ARG
HB3
.25
1
5105
36
ARG
HB3
.25
2
15442
29
ARG
HB3
.257
2
4333
52
ARG
HB3
.258
2
10115
17
ARG
HB3
.259
2
11227
57
ARG
HB3
.268
2
6226
55
ARG
HB3
.28
2
15810
32
ARG
HB3
.28
2
4782
115
ARG
HB3
.29
1
18533
58
ARG
HB3
.29
2
6221
79
ARG
HB3
.303
4
975
72
ARG
HB3
.32
2
11096
64
ARG
HB3
.324
2
15813
13
ARG
HB3
.327
2
11225
39
ARG
HB3
.339
2
2071
72
ARG
HB3
.34
1
15801
31
ARG
HB3
.341
.
34334
17
ARG
HB3
.35
2
16172
70
ARG
HB3
.35
2
10164
83
ARG
HB3
.353
2
19551
8
ARG
HB3
.355
2
5009
99
ARG
HB3
.363
.
6176
74
ARG
HB3
.37
2
5359
42
ARG
HB3
.37
2
15694
78
ARG
HB3
.376
2
6936
40
ARG
HB3
.383
2
15611
78
ARG
HB3
.389
2
25000
15
ARG
HB3
.393
2
26661
53
ARG
HB3
.395
1
16171
70
ARG
HB3
.4
2
10317
15
ARG
HB3
.401
2
26660
53
ARG
HB3
.402
1
16157
17
ARG
HB3
.405
2
60
19
ARG
HB3
.41
2
5628
103
ARG
HB3
.41
2
4091
117
ARG
HB3
.41
2
15557
78
ARG
HB3
.41
2
5482
19
ARG
HB3
.41
2
5381
42
ARG
HB3
.42
1
25925
68
ARG
HB3
.434
2
16370
104
ARG
HB3
.438
2
16380
31
ARG
HB3
.442
2
17374
85
ARG
HB3
.442
.
27078
166
ARG
HB3
.45
2
18502
25
ARG
HB3
.458
2
19047
199
ARG
HB3
.459
1
19047
199
ARG
HB3
.459
1
15636
22
ARG
HB3
.461
2
19048
199
ARG
HB3
.47
1
19048
199
ARG
HB3
.48
1
7242
66
ARG
HB3
.486
2
5669
30
ARG
HB3
.488
1
15823
84
ARG
HB3
.489
2
5165
135
ARG
HB3
.499
1
11141
29
ARG
HB3
.507
2
10295
68
ARG
HB3
.507
2
16094
11
ARG
HB3
.508
2
5107
46
ARG
HB3
.508
2
15369
84
ARG
HB3
.509
2
10144
139
ARG
HB3
.516
2
10145
149
ARG
HB3
.529
2
16997
99
ARG
HB3
.546
2
5107
50
ARG
HB3
.551
2
15059
65
ARG
HB3
.556
2
25159
99
ARG
HB3
.556
2
11329
68
ARG
HB3
.558
2
15652
89
ARG
HB3
.56
2
15715
17
ARG
HB3
.56
2
11333
108
ARG
HB3
.564
2
15988
24
ARG
HB3
.566
2
6292
52
ARG
HB3
.57
2
6902
95
ARG
HB3
.57
1
5068
115
ARG
HB3
.57
2
5803
115
ARG
HB3
.57
2
7160
114
ARG
HB3
.57
.
5804
115
ARG
HB3
.57
2
18971
15
ARG
HB3
.575
2
15700
109
ARG
HB3
.577
2
19290
132
ARG
HB3
.577
2
18717
115
ARG
HB3
.577
2
19299
19
ARG
HB3
.58
2
4782
116
ARG
HB3
.58
1
26061
43
ARG
HB3
.58
.
16675
144
ARG
HB3
.58
2
17711
111
ARG
HB3
.5812
2
11119
65
ARG
HB3
.582
2
18500
10
ARG
HB3
.583
2
11227
82
ARG
HB3
.583
2
17543
11
ARG
HB3
.583
2
7231
36
ARG
HB3
.585
2
16189
27
ARG
HB3
.587
2
18380
36
ARG
HB3
.589
2
18887
74
ARG
HB3
.59
.
18228
122
ARG
HB3
.592
1
4943
114
ARG
HB3
.6
2
17405
92
ARG
HB3
.601
2
10114
44
ARG
HB3
.603
2
17323
45
ARG
HB3
.605
1
18320
70
ARG
HB3
.609
2
6367
48
ARG
HB3
.61
2
18200
101
ARG
HB3
.611
2
36013
91
ARG
HB3
.614
1
15012
98
ARG
HB3
.615
2
4259
65
ARG
HB3
.62
1
30260
19
ARG
HB3
.62
.
4943
114
ARG
HB3
.62
2
36084
46
ARG
HB3
.622
2
19187
56
ARG
HB3
.633
2
25945
26
ARG
HB3
.641
2
17452
54
ARG
HB3
.642
2
17490
93
ARG
HB3
.643
2
11117
80
ARG
HB3
.645
2
17830
45
ARG
HB3
.645
2
1037
53
ARG
HB3
.65
1
6604
62
ARG
HB3
.657
2
17831
45
ARG
HB3
.657
2
17258
124
ARG
HB3
.659
2
6415
115
ARG
HB3
.66
2
4935
65
ARG
HB3
.66
2
19977
109
ARG
HB3
.66
2
26995
54
ARG
HB3
.661
1
18015
54
ARG
HB3
.669
2
1198
19
ARG
HB3
.67
2
17493
141
ARG
HB3
.674
2
613
36
ARG
HB3
.675
1
6799
16
ARG
HB3
.68
2
18179
113
ARG
HB3
.682
1
17147
54
ARG
HB3
.686
2
5862
37
ARG
HB3
.69
1
10253
10
ARG
HB3
.694
2
18492
36
ARG
HB3
.697
2
6594
37
ARG
HB3
.7
2
11029
112
ARG
HB3
.702
2
19067
116
ARG
HB3
.708
2
17388
26
ARG
HB3
.708
2
10292
64
ARG
HB3
.708
2
4952
40
ARG
HB3
.71
2
17076
125
ARG
HB3
.71
2
10265
93
ARG
HB3
.711
2
27453
112
ARG
HB3
.713
2
25649
17
ARG
HB3
.713
2
25081
70
ARG
HB3
.715
2
27307
106
ARG
HB3
.721
2
25205
24
ARG
HB3
.724
2
11594
91
ARG
HB3
.728
1
4969
38
ARG
HB3
.73
2
27606
34
ARG
HB3
.732
2
17074
125
ARG
HB3
.734
2
17609
22
ARG
HB3
.737
2
15452
110
ARG
HB3
.74
1
16018
43
ARG
HB3
.74
2
16096
34
ARG
HB3
.741
2
10278
10
ARG
HB3
.745
2
10106
37
ARG
HB3
.746
2
19711
25
ARG
HB3
.75
2
27519
39
ARG
HB3
.75
1
5171
20
ARG
HB3
.75
.
11088
10
ARG
HB3
.754
2
19231
19
ARG
HB3
.754
2
18355
18
ARG
HB3
.758
2
2249
48
ARG
HB3
.76
1
17962
65
ARG
HB3
.761
2
16991
2
ARG
HB3
.762
2
16397
45
ARG
HB3
.762
2
18464
36
ARG
HB3
.763
2
17443
140
ARG
HB3
.765
2
10250
28
ARG
HB3
.767
2
17707
83
ARG
HB3
.769
2
10256
40
ARG
HB3
.77
2
5199
34
ARG
HB3
.77
1
11277
13
ARG
HB3
.772
2
10298
57
ARG
HB3
.775
2
15318
40
ARG
HB3
.775
2
10282
73
ARG
HB3
.776
2
18541
84
ARG
HB3
.778
1
15989
93
ARG
HB3
.778
2
6753
158
ARG
HB3
.78
.
4091
80
ARG
HB3
.78
2
7086
99
ARG
HB3
.78
2
16085
134
ARG
HB3
.781
2
11350
29
ARG
HB3
.782
2
11131
30
ARG
HB3
.784
2
16398
52
ARG
HB3
.785
2
10148
57
ARG
HB3
.788
2
18249
140
ARG
HB3
.788
2
19551
71
ARG
HB3
.789
2
4423
5
ARG
HB3
.79
2
6752
243
ARG
HB3
.79
.
16100
24
ARG
HB3
.791
2
36107
19
ARG
HB3
.793
2
19726
53
ARG
HB3
.794
1
6551
50
ARG
HB3
.796
.
25887
18
ARG
HB3
.802
2
30129
61
ARG
HB3
.806
.
15785
121
ARG
HB3
.807
.
15952
121
ARG
HB3
.807
.
11227
84
ARG
HB3
.808
2
5359
20
ARG
HB3
.81
2
4891
36
ARG
HB3
.811
1
7059
123
ARG
HB3
.816
2
5999
13
ARG
HB3
.816
2
4333
25
ARG
HB3
.819
2
25883
27
ARG
HB3
.82
2
6890
33
ARG
HB3
.82
2
5042
18
ARG
HB3
.82
2
16176
60
ARG
HB3
.82125
1
18596
77
ARG
HB3
.83
2
10069
46
ARG
HB3
.831
2
34110
34
ARG
HB3
.834
2
16733
32
ARG
HB3
.836
2
16732
100
ARG
HB3
.836
2
10309
25
ARG
HB3
.837
2
30130
115
ARG
HB3
.838
2
30131
115
ARG
HB3
.84
2
2024
22
ARG
HB3
.84
2
15757
78
ARG
HB3
.84
2
7256
17
ARG
HB3
.84
2
5758
95
ARG
HB3
.841
2
25232
57
ARG
HB3
.844
.
15110
17
ARG
HB3
.849
1
6620
108
ARG
HB3
.849
2
4210
46
ARG
HB3
.85
2
5778
15
ARG
HB3
.851
2
10307
24
ARG
HB3
.852
2
25530
70
ARG
HB3
.854
2
30154
70
ARG
HB3
.854
2
15634
48
ARG
HB3
.857
2
27610
45
ARG
HB3
.857
2
16791
31
ARG
HB3
.858
2
17160
141
ARG
HB3
.86
2
6869
23
ARG
HB3
.86
1
17020
79
ARG
HB3
.86
2
25833
31
ARG
HB3
.86
2
5595
120
ARG
HB3
.86
2
4974
48
ARG
HB3
.861
2
18837
52
ARG
HB3
.863
2
10318
81
ARG
HB3
.869
2
11591
109
ARG
HB3
.869
2
5998
6
ARG
HB3
.87
2
6242
77
ARG
HB3
.87
2
16305
38
ARG
HB3
.874
2
11450
67
ARG
HB3
.875
2
6198
11
ARG
HB3
.875
2
11380
24
ARG
HB3
.877
2
18447
65
ARG
HB3
.877
2
34079
55
ARG
HB3
.878
1
6904
57
ARG
HB3
.88
2
19282
119
ARG
HB3
.88
.
4798
45
ARG
HB3
.88
2
17543
34
ARG
HB3
.883
1
4639
52
ARG
HB3
.883
1
18500
33
ARG
HB3
.883
2
26853
115
ARG
HB3
.885
2
15927
52
ARG
HB3
.885
1
7085
68
ARG
HB3
.887
2
6727
35
ARG
HB3
.888
2
27268
12
ARG
HB3
.89
.
10228
24
ARG
HB3
.892
2
10255
80
ARG
HB3
.893
2
26909
80
ARG
HB3
.898
2
25834
91
ARG
HB3
.899
1
17160
66
ARG
HB3
.9
2
6578
60
ARG
HB3
.9
2
17452
26
ARG
HB3
.9018
2
2049
43
ARG
HB3
.902
2
18015
26
ARG
HB3
.902
2
11149
10
ARG
HB3
.904
2
11443
10
ARG
HB3
.904
2
25744
54
ARG
HB3
.906
1
16083
55
ARG
HB3
.907
2
5058
17
ARG
HB3
.908
2
15115
16
ARG
HB3
.908
.
6536
68
ARG
HB3
.909
2
15020
123
ARG
HB3
.91
1
11393
24
ARG
HB3
.91
2
2169
42
ARG
HB3
.91
2
19530
42
ARG
HB3
.913
.
36106
19
ARG
HB3
.918
2
4371
16
ARG
HB3
.919
.
16370
51
ARG
HB3
.922
2
19147
32
ARG
HB3
.924
2
26517
23
ARG
HB3
.924
2
17104
43
ARG
HB3
.925
2
6794
89
ARG
HB3
.93
2
4084
55
ARG
HB3
.93
2
6448
70
ARG
HB3
.932
2
11061
19
ARG
HB3
.933
2
11222
10
ARG
HB3
.94
2
18514
22
ARG
HB3
.941
2
15924
77
ARG
HB3
.942
1
18540
84
ARG
HB3
.942
1
15633
43
ARG
HB3
.944
2
27162
14
ARG
HB3
.944
1
18200
30
ARG
HB3
.944
2
15608
62
ARG
HB3
.945
2
15528
103
ARG
HB3
.946
2
7261
38
ARG
HB3
.947
1
25690
71
ARG
HB3
.948
2
16911
58
ARG
HB3
.95
1
19984
69
ARG
HB3
.95
2
17396
38
ARG
HB3
.95
1
36059
46
ARG
HB3
.952
2