ARG HG3 Chemical Shift Outliers

___________________________________________________
ARG HG3 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
21467
1.536
-1.298
5.47
0.304


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
10288
79
ARG
HG3
2.452
2
18919
73
ARG
HG3
2.458
.
6031
40
ARG
HG3
2.465
1
18151
115
ARG
HG3
2.474
2
1170
91
ARG
HG3
2.48
1
6147
81
ARG
HG3
2.484
1
18679
20
ARG
HG3
2.485
1
10293
59
ARG
HG3
2.49
2
15722
43
ARG
HG3
2.5
2
4193
119
ARG
HG3
2.5
1
10287
59
ARG
HG3
2.507
2
15058
52
ARG
HG3
2.516
1
18680
20
ARG
HG3
2.517
1
4832
37
ARG
HG3
2.54
.
4136
106
ARG
HG3
2.54
2
16306
66
ARG
HG3
2.55
2
16675
118
ARG
HG3
2.559
2
18578
86
ARG
HG3
2.561
2
18728
15
ARG
HG3
2.564
2
15835
46
ARG
HG3
2.567
2
5606
129
ARG
HG3
2.58
1
17493
89
ARG
HG3
2.593
2
5745
72
ARG
HG3
2.6
2
10120
71
ARG
HG3
2.612
2
11299
48
ARG
HG3
2.613
2
16307
66
ARG
HG3
2.62
2
4602
68
ARG
HG3
2.63
9
5142
101
ARG
HG3
2.658
.
6111
40
ARG
HG3
2.7
1
6921
72
ARG
HG3
2.784
2
4129
113
ARG
HG3
2.82
2
5404
66
ARG
HG3
2.902
1
6131
66
ARG
HG3
2.927
1
6727
35
ARG
HG3
2.985
1
6685
122
ARG
HG3
3.009
2
15091
62
ARG
HG3
3.019
2
4443
37
ARG
HG3
3.05
.
5573
56
ARG
HG3
3.11
1
4683
150
ARG
HG3
3.124
1
7414
83
ARG
HG3
3.133
2
6059
59
ARG
HG3
3.16
.
18989
134
ARG
HG3
3.16
2
6582
126
ARG
HG3
3.17
1
4514
17
ARG
HG3
3.17
.
15751
13
ARG
HG3
3.177
1
6821
79
ARG
HG3
3.219
.
15801
88
ARG
HG3
3.222
.
6054
32
ARG
HG3
3.35
1
6345
132
ARG
HG3
3.392
.
16025
32
ARG
HG3
3.51
1
1439
42
ARG
HG3
5.47
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
10147
115
ARG
HG3
-.003
2
10267
61
ARG
HG3
-.005
2
11022
37
ARG
HG3
-.01
1
5126
49
ARG
HG3
-.03
.
6597
77
ARG
HG3
-.048
2
6041
5
ARG
HG3
-.055
.
11082
12
ARG
HG3
-.057
2
17518
23
ARG
HG3
-.079
.
16517
62
ARG
HG3
-.08
2
6262
64
ARG
HG3
-.09
2
4342
77
ARG
HG3
-.09
2
18012
121
ARG
HG3
-.092
2
15718
102
ARG
HG3
-.099
1
17543
11
ARG
HG3
-.102
2
18500
10
ARG
HG3
-.102
2
15560
26
ARG
HG3
-.11
2
17414
26
ARG
HG3
-.112
2
15928
77
ARG
HG3
-.113
2
10069
72
ARG
HG3
-.117
2
17421
118
ARG
HG3
-.121
2
6876
92
ARG
HG3
-.126
2
10093
70
ARG
HG3
-.141
2
11322
41
ARG
HG3
-.145
2
18352
56
ARG
HG3
-.153
2
17147
26
ARG
HG3
-.159
2
10292
64
ARG
HG3
-.178
2
19048
199
ARG
HG3
-.219
1
1037
53
ARG
HG3
-.22
1
6175
28
ARG
HG3
-.223
1
17147
54
ARG
HG3
-.225
2
4198
131
ARG
HG3
-.23
2
17145
54
ARG
HG3
-.23
2
6906
53
ARG
HG3
-.238
9
19048
199
ARG
HG3
-.241
1
17452
54
ARG
HG3
-.246
2
18944
58
ARG
HG3
-.247
1
19047
199
ARG
HG3
-.248
1
17553
87
ARG
HG3
-.252
2
19047
199
ARG
HG3
-.252
1
11247
21
ARG
HG3
-.26
2
5778
15
ARG
HG3
-.26
2
10287
58
ARG
HG3
-.28
2
17509
63
ARG
HG3
-.282
2
18015
26
ARG
HG3
-.293
2
17452
26
ARG
HG3
-.296
2
7185
10
ARG
HG3
-.3
2
16929
162
ARG
HG3
-.302
2
18539
14
ARG
HG3
-.316
1
18805
60
ARG
HG3
-.337
2
6041
5
ARG
HG3
-.34
.
5181
93
ARG
HG3
-.38
2
17519
23
ARG
HG3
-.395
1
6517
20
ARG
HG3
-.4
2
10294
58
ARG
HG3
-.41
2
16094
11
ARG
HG3
-.416
2
17484
55
ARG
HG3
-.438
2
7203
54
ARG
HG3
-.496
.
18909
47
ARG
HG3
-.497
2
6620
103
ARG
HG3
-.507
2
4909
62
ARG
HG3
-.51
2
17953
108
ARG
HG3
-.512
2
11300
50
ARG
HG3
-.53
2
6594
37
ARG
HG3
-.56
2
15989
93
ARG
HG3
-.57
2
10296
58
ARG
HG3
-.589
2
18015
54
ARG
HG3
-.597
2
18200
101
ARG
HG3
-.627
2
17582
175
ARG
HG3
-.631
2
10295
68
ARG
HG3
-.656
2
18338
62
ARG
HG3
-.658
.
10281
58
ARG
HG3
-.668
2
16085
134
ARG
HG3
-.668
2
11160
67
ARG
HG3
-.742
2
6957
10
ARG
HG3
-.75
2
11017
12
ARG
HG3
-.91
2
16173
177
ARG
HG3
-1.05
2
11042
41
ARG
HG3
-1.075
2
17501
44
ARG
HG3
-1.298
2
11348
102
ARG
HG3
.009
2
10282
73
ARG
HG3
.012
2
16306
32
ARG
HG3
.02
2
10164
116
ARG
HG3
.022
2
15807
41
ARG
HG3
.034
2
5629
37
ARG
HG3
.047
2
4925
12
ARG
HG3
.048
2
4186
136
ARG
HG3
.06
2
15683
90
ARG
HG3
.07
2
1037
25
ARG
HG3
.07
2
18840
43
ARG
HG3
.0742
2
15988
24
ARG
HG3
.081
2
7261
38
ARG
HG3
.095
2
6054
12
ARG
HG3
.1
1
6053
12
ARG
HG3
.1
1
18464
36
ARG
HG3
.103
2
19195
35
ARG
HG3
.108
2
17694
36
ARG
HG3
.11
.
4114
46
ARG
HG3
.11
1
5822
46
ARG
HG3
.12
2
5823
164
ARG
HG3
.12
2
17365
30
ARG
HG3
.124
2
10031
43
ARG
HG3
.13
2
6001
23
ARG
HG3
.14
1
19045
59
ARG
HG3
.146
2
10288
78
ARG
HG3
.148
1
16307
32
ARG
HG3
.15
2
5713
38
ARG
HG3
.15
2
16255
84
ARG
HG3
.15
2
15757
78
ARG
HG3
.15
2
18596
77
ARG
HG3
.15
2
16592
58
ARG
HG3
.154
2
16065
26
ARG
HG3
.154
2
6865
25
ARG
HG3
.168
2
6207
11
ARG
HG3
.17
1
16255
73
ARG
HG3
.17
2
18967
49
ARG
HG3
.171
1
4138
65
ARG
HG3
.18
2
17521
99
ARG
HG3
.186
2
4959
76
ARG
HG3
.19
1
15723
106
ARG
HG3
.193
2
15528
103
ARG
HG3
.198
2
11247
91
ARG
HG3
.212
2
11227
84
ARG
HG3
.222
2
16563
53
ARG
HG3
.224
2
18426
67
ARG
HG3
.225
1
6906
25
ARG
HG3
.228
9
11113
18
ARG
HG3
.228
2
4423
5
ARG
HG3
.23
2
4295
50
ARG
HG3
.23
2
17005
115
ARG
HG3
.234
2
10002
27
ARG
HG3
.237
2
18550
72
ARG
HG3
.238
2
15349
41
ARG
HG3
.239
2
16307
117
ARG
HG3
.24
2
17632
18
ARG
HG3
.244
2
10114
44
ARG
HG3
.246
2
11323
28
ARG
HG3
.246
2
5338
20
ARG
HG3
.247
1
5130
115
ARG
HG3
.258
.
4333
25
ARG
HG3
.263
2
19268
71
ARG
HG3
.263
2
15846
5
ARG
HG3
.27
2
1198
19
ARG
HG3
.27
2
5105
36
ARG
HG3
.27
2
19423
17
ARG
HG3
.271
2
4782
116
ARG
HG3
.28
1
16096
34
ARG
HG3
.291
2
4641
71
ARG
HG3
.292
.
5669
30
ARG
HG3
.293
2
15312
4
ARG
HG3
.295
.
11139
29
ARG
HG3
.296
2
17711
111
ARG
HG3
.2992
2
6794
89
ARG
HG3
.304
2
4620
38
ARG
HG3
.31
2
5378
38
ARG
HG3
.31
2
4434
69
ARG
HG3
.31
2
4564
167
ARG
HG3
.31
1
17714
72
ARG
HG3
.313
2
21006
11
ARG
HG3
.317
2
6903
47
ARG
HG3
.322
1
18502
10
ARG
HG3
.325
2
10104
112
ARG
HG3
.326
2
4402
136
ARG
HG3
.33
2
15634
48
ARG
HG3
.334
1
15718
23
ARG
HG3
.335
2
19398
68
ARG
HG3
.34
2
4379
38
ARG
HG3
.34
2
15602
126
ARG
HG3
.34
2
6367
48
ARG
HG3
.34
2
15939
74
ARG
HG3
.34
2
16544
24
ARG
HG3
.342
2
10259
19
ARG
HG3
.343
2
10002
29
ARG
HG3
.345
2
11362
31
ARG
HG3
.349
2
16176
59
ARG
HG3
.3495
1
4990
42
ARG
HG3
.35
1
4563
38
ARG
HG3
.35
1
4935
26
ARG
HG3
.35
2
11472
94
ARG
HG3
.358
2
4846
11
ARG
HG3
.359
1
4736
38
ARG
HG3
.36
2
16206
25
ARG
HG3
.36
.
17175
31
ARG
HG3
.36
2
7104
40
ARG
HG3
.36
4
7081
150
ARG
HG3
.361
.
16372
14
ARG
HG3
.362
2
10298
57
ARG
HG3
.367
2
17265
74
ARG
HG3
.368
2
19067
116
ARG
HG3
.369
2
4930
14
ARG
HG3
.37
1
60
19
ARG
HG3
.37
1
16306
117
ARG
HG3
.37
2
4428
46
ARG
HG3
.37
.
4933
14
ARG
HG3
.37
1
11115
31
ARG
HG3
.373
2
15245
15
ARG
HG3
.376
2
15585
10
ARG
HG3
.377
2
17365
39
ARG
HG3
.379
2
10324
76
ARG
HG3
.379
2
5120
41
ARG
HG3
.38
2
18539
93
ARG
HG3
.386
1
15846
66
ARG
HG3
.39
2
6934
138
ARG
HG3
.39
2
18540
84
ARG
HG3
.399
1
4833
85
ARG
HG3
.4
2
10129
92
ARG
HG3
.4
2
6904
47
ARG
HG3
.4
2
15727
90
ARG
HG3
.401
2
17033
72
ARG
HG3
.402
2
11132
15
ARG
HG3
.403
2
6601
6
ARG
HG3
.407
2
6175
30
ARG
HG3
.407
1
4514
22
ARG
HG3
.41
.
16066
26
ARG
HG3
.411
2
17927
117
ARG
HG3
.414
2
10144
139
ARG
HG3
.42
2
5771
18
ARG
HG3
.42
2
5804
62
ARG
HG3
.42
2
5310
18
ARG
HG3
.42
2
6147
116
ARG
HG3
.421
1
10102
53
ARG
HG3
.425
2
5467
80
ARG
HG3
.428
2
6380
38
ARG
HG3
.43
2
5222
127
ARG
HG3
.43
2
6292
52
ARG
HG3
.43
1
4451
39
ARG
HG3
.43
1
11105
103
ARG
HG3
.431
2
10145
149
ARG
HG3
.432
2
11404
40
ARG
HG3
.434
2
5532
64
ARG
HG3
.438
1
5939
25
ARG
HG3
.439
1
17711
20
ARG
HG3
.4392
2
5173
40
ARG
HG3
.44
4
4027
12
ARG
HG3
.44
2
10142
86
ARG
HG3
.442
2
17835
34
ARG
HG3
.443
2
10258
83
ARG
HG3
.448
2
11225
39
ARG
HG3
.449
2
19147
32
ARG
HG3
.449
2
5042
18
ARG
HG3
.45
2
15318
40
ARG
HG3
.451
2
15166
79
ARG
HG3
.453
2
18501
11
ARG
HG3
.455
2
4035
61
ARG
HG3
.46
1
6044
90
ARG
HG3
.461
2
6168
5
ARG
HG3
.466
2
6753
15
ARG
HG3
.47
.
6752
15
ARG
HG3
.47
.
15139
110
ARG
HG3
.47
1
6292
103
ARG
HG3
.47
2
10286
63
ARG
HG3
.475
2
17173
125
ARG
HG3
.479
2
17504
15
ARG
HG3
.479
.
10315
18
ARG
HG3
.48
2
15139
81
ARG
HG3
.48
2
6739
93
ARG
HG3
.48
2
18179
109
ARG
HG3
.483
1
4308
75
ARG
HG3
.484
1
10238
129
ARG
HG3
.486
2
16560
95
ARG
HG3
.488
2
18328
59
ARG
HG3
.49
2
10239
138
ARG
HG3
.49
2
11088
10
ARG
HG3
.49
2
15540
67
ARG
HG3
.495
2
17389
62
ARG
HG3
.498
2
4998
32
ARG
HG3
.5
1
6910
39
ARG
HG3
.5
2
5165
135
ARG
HG3
.501
1
18705
6
ARG
HG3
.501
1
17368
20
ARG
HG3
.502
2
17544
30
ARG
HG3
.504
1
18501
31
ARG
HG3
.504
2
6865
27
ARG
HG3
.505
2
4901
91
ARG
HG3
.51
1
6195
34
ARG
HG3
.51
.
4909
79
ARG
HG3
.51
2
17082
38
ARG
HG3
.512
2
17392
97
ARG
HG3
.514
2
10127
52
ARG
HG3
.516
2
16734
115
ARG
HG3
.517
2
16377
42
ARG
HG3
.52
2
4251
76
ARG
HG3
.52
2
10039
16
ARG
HG3
.522
2
16596
25
ARG
HG3
.526
2
11286
63
ARG
HG3
.528
2
18469
29
ARG
HG3
.529
2
18496
29
ARG
HG3
.529
2
17084
38
ARG
HG3
.529
2
5335
34
ARG
HG3
.53
2
5482
19
ARG
HG3
.53
2
18539
127
ARG
HG3
.533
1
17085
108
ARG
HG3
.533
2
18492
36
ARG
HG3
.534
2
17529
38
ARG
HG3
.535
2
15845
38
ARG
HG3
.538
2
4920
37
ARG
HG3
.538
2
16193
77
ARG
HG3
.543
2
11136
29
ARG
HG3
.548
2
16723
37
ARG
HG3
.549
2
2999
28
ARG
HG3
.55
2
10113
20
ARG
HG3
.55
2
18501
25
ARG
HG3
.551
2
5328
23
ARG
HG3
.5525
1
10289
56
ARG
HG3
.553
1
18909
39
ARG
HG3
.56
2
5335
28
ARG
HG3
.56
2
10150
49
ARG
HG3
.56
2
6576
33
ARG
HG3
.56
2
5966
15
ARG
HG3
.56
2
16681
49
ARG
HG3
.562
2
6658
117
ARG
HG3
.564
2
4748
28
ARG
HG3
.565
1
15110
17
ARG
HG3
.565
2
5706
87
ARG
HG3
.567
1
18663
95
ARG
HG3
.568
2
10299
81
ARG
HG3
.569
2
11141
29
ARG
HG3
.569
1
6897
11
ARG
HG3
.569
2
17493
160
ARG
HG3
.57
2
16266
35
ARG
HG3
.57
2
18518
68
ARG
HG3
.573
1
17752
86
ARG
HG3
.574
2
6159
158
ARG
HG3
.575
2
11103
83
ARG
HG3
.578
2
5892
87
ARG
HG3
.578
2
10291
30
ARG
HG3
.579
2
6576
33
ARG
HG3
.58
2
5009
99
ARG
HG3
.58
.
15924
77
ARG
HG3
.58
1
4748
28
ARG
HG3
.58
1
7086
99
ARG
HG3
.58
2
7178
86
ARG
HG3
.58
2
6032
63
ARG
HG3
.58
.
4301
40
ARG
HG3
.58
2
4935
65
ARG
HG3
.58
2
18953
116
ARG
HG3
.582
2
11145
109
ARG
HG3
.583
2
16102
20
ARG
HG3
.583
2
17595
136
ARG
HG3
.583
2
11516
79
ARG
HG3
.585
2
16272
56
ARG
HG3
.586
2
16722
37
ARG
HG3
.586
2
17501
124
ARG
HG3
.587
2
15059
65
ARG
HG3
.588
2
18823
51
ARG
HG3
.588
2
1808
38
ARG
HG3
.59
1
5492
65
ARG
HG3
.59
2
4590
15
ARG
HG3
.59
2
4420
11
ARG
HG3
.591
1
16283
56
ARG
HG3
.592
2
11337
119
ARG
HG3
.592
2
15402
122
ARG
HG3
.592
2
11127
92
ARG
HG3
.596
2
5512
124
ARG
HG3
.599
2
4077
40
ARG
HG3
.6
2
6456
14
ARG
HG3
.6
2
17953
39
ARG
HG3
.6
2
18990
104
ARG
HG3
.6
2
6383
38
ARG
HG3
.6
2
4925
49
ARG
HG3
.6
2
6771
13
ARG
HG3
.602
2
10256
40
ARG
HG3
.603
2
17081
38
ARG
HG3
.604
2
16370
104
ARG
HG3
.604
2
6899
20
ARG
HG3
.605
1
18200
30
ARG
HG3
.605
2
17213
38
ARG
HG3
.605
2
16176
60
ARG
HG3
.60675
1
15439
48
ARG
HG3
.607
.
16008
35
ARG
HG3
.607
2
4675
60
ARG
HG3
.607
2
10235
83
ARG
HG3
.607
2
16439
97
ARG
HG3
.607
2
17147
33
ARG
HG3
.608
2
18642
31
ARG
HG3
.609
2
11061
19
ARG
HG3
.61
2
18510
5
ARG
HG3
.61
2
4399
11
ARG
HG3
.61
2
17087
38
ARG
HG3
.612
2
15894
120
ARG
HG3
.615
2
15895
120
ARG
HG3
.615
2
15370
64
ARG
HG3
.617
2
11424
18
ARG
HG3
.619
1
5100
16
ARG
HG3
.62
1
5670
17
ARG
HG3
.62
2
18016
99
ARG
HG3
.62
2
6903
83
ARG
HG3
.62
1
17988
2
ARG
HG3
.621
2
6346
68
ARG
HG3
.622
1
17200
21
ARG
HG3
0
2