GLY H Chemical Shift Outliers

___________________________________________________
GLY H Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
52490
8.328
-15.3
112.83
0.850


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
16617
56
GLY
H
10.882
.
16989
48
GLY
H
10.884
1
4381
62
GLY
H
10.886
1
6820
81
GLY
H
10.89
1
6918
81
GLY
H
10.89
1
5975
70
GLY
H
10.893
1
7015
98
GLY
H
10.895
.
6081
67
GLY
H
10.897
1
17328
144
GLY
H
10.9
1
18627
114
GLY
H
10.905
1
4288
62
GLY
H
10.92
1
15425
86
GLY
H
10.93
1
18533
78
GLY
H
10.93
1
11067
47
GLY
H
10.9329
1
11182
64
GLY
H
10.935
1
17404
133
GLY
H
10.94
1
479
13
GLY
H
10.94
1
6722
79
GLY
H
10.944
1
17249
57
GLY
H
10.95
1
5503
36
GLY
H
10.95
1
5324
46
GLY
H
10.96
1
6209
52
GLY
H
10.961
1
16267
94
GLY
H
10.963
1
18099
144
GLY
H
10.9711
1
7089
79
GLY
H
10.98
1
4082
66
GLY
H
10.98
1
5738
71
GLY
H
10.986
1
19297
77
GLY
H
10.987
1
4401
71
GLY
H
10.99
1
6820
45
GLY
H
11
1
6918
45
GLY
H
11
1
5992
26
GLY
H
11
1
4173
79
GLY
H
11.03
1
6104
25
GLY
H
11.038
1
16599
38
GLY
H
11.04
1
15809
26
GLY
H
11.055
1
15065
233
GLY
H
11.06
1
15452
112
GLY
H
11.06
1
15626
26
GLY
H
11.076
1
6103
38
GLY
H
11.077
1
15755
26
GLY
H
11.08
1
16366
60
GLY
H
11.09
1
7130
92
GLY
H
11.108
1
16446
114
GLY
H
11.111
1
6418
76
GLY
H
11.115
1
6014
79
GLY
H
11.12
1
16599
83
GLY
H
11.12
1
16210
23
GLY
H
11.136
1
18653
8
GLY
H
11.185
1
17525
33
GLY
H
11.209
1
18044
184
GLY
H
11.21
1
6868
38
GLY
H
11.215
1
17660
58
GLY
H
11.24
1
16675
41
GLY
H
11.293
1
15120
74
GLY
H
11.3
.
7189
54
GLY
H
11.306
1
16634
5
GLY
H
11.31
1
4171
101
GLY
H
11.32
1
15560
5
GLY
H
11.32
1
15065
171
GLY
H
11.32
1
17414
5
GLY
H
11.322
1
5231
79
GLY
H
11.33
1
15396
74
GLY
H
11.33
.
15395
74
GLY
H
11.331
.
1995
83
GLY
H
11.34
1
16481
162
GLY
H
11.355
1
7425
33
GLY
H
11.386
1
16464
330
GLY
H
11.4
1
10017
69
GLY
H
11.41
1
18103
101
GLY
H
11.412
1
19015
101
GLY
H
11.418
1
4064
78
GLY
H
11.42
1
16481
162
GLY
H
11.453
1
16916
140
GLY
H
11.461
1
16956
57
GLY
H
11.52
1
7418
33
GLY
H
11.533
1
19108
170
GLY
H
11.556
.
1996
83
GLY
H
11.57
1
16451
330
GLY
H
11.57
1
4364
72
GLY
H
11.57
1
10017
69
GLY
H
11.57
1
16447
330
GLY
H
11.67
1
17722
141
GLY
H
11.693
.
2443
95
GLY
H
11.75
1
6024
3
GLY
H
11.755
1
16929
77
GLY
H
11.755
1
6390
45
GLY
H
11.76
1
17249
56
GLY
H
11.82
1
7264
209
GLY
H
11.868
1
7265
209
GLY
H
11.921
1
5746
14
GLY
H
11.925
.
6685
150
GLY
H
11.925
1
15716
48
GLY
H
11.96
1
15383
31
GLY
H
11.966
1
5618
155
GLY
H
112.83
1
6542
332
GLY
H
12.09
1
15383
105
GLY
H
12.174
1
1474
12
GLY
H
12.22
1
16677
104
GLY
H
12.346
1
6935
43
GLY
H
12.67
1
6832
43
GLY
H
12.68
1
6686
60
GLY
H
14.8
.
6686
62
GLY
H
14.8
.
6686
26
GLY
H
15.7
.
6300
1
GLY
H
62.01
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
821
44
GLY
H
-15.3
1
7016
38
GLY
H
.02
.
7016
21
GLY
H
.02
.
7016
23
GLY
H
.02
.
15116
9
GLY
H
.767
1
4803
39
GLY
H
1
1
4809
39
GLY
H
1.03
1
4808
39
GLY
H
1.03
1
4130
41
GLY
H
1.04
.
4804
39
GLY
H
1.06
1
5091
41
GLY
H
1.1
1
4131
41
GLY
H
1.1
.
15189
109
GLY
H
2.821
1
6372
125
GLY
H
3.01
1
5219
238
GLY
H
3.03
1
4263
47
GLY
H
3.15
1
4683
47
GLY
H
3.198
1
10089
43
GLY
H
3.295
1
16476
32
GLY
H
3.335
1
10237
33
GLY
H
3.372
1
15438
35
GLY
H
3.38
1
10236
33
GLY
H
3.385
1
10239
88
GLY
H
3.391
1
10238
79
GLY
H
3.398
1
4510
42
GLY
H
3.62
1
4830
143
GLY
H
3.64
1
16207
61
GLY
H
3.674
1
6416
186
GLY
H
3.69
.
10235
33
GLY
H
3.714
1
16842
36
GLY
H
3.888
1
18290
22
GLY
H
3.908
1
18787
36
GLY
H
3.99
1
4236
189
GLY
H
4.05
2
5381
37
GLY
H
4.26
1
16466
15
GLY
H
4.28
1
6309
37
GLY
H
4.32
1
4868
37
GLY
H
4.32
1
5359
37
GLY
H
4.36
1
4855
37
GLY
H
4.37
9
4342
82
GLY
H
4.38
1
5179
24
GLY
H
4.4
.
5358
37
GLY
H
4.4
1
6963
42
GLY
H
4.406
1
18215
48
GLY
H
4.424
1
6046
40
GLY
H
4.46
1
17062
14
GLY
H
4.465
1
4471
82
GLY
H
4.5
1
16311
18
GLY
H
4.504
1
350
17
GLY
H
4.52
1
287
50
GLY
H
4.53
1
11104
98
GLY
H
4.546
1
4276
15
GLY
H
4.57
1
18180
41
GLY
H
4.59
1
5828
84
GLY
H
4.6
1
10129
46
GLY
H
4.665
1
5827
84
GLY
H
4.67
1
4777
82
GLY
H
4.67
1
10255
34
GLY
H
4.68
1
5361
32
GLY
H
4.83
1
11086
128
GLY
H
4.858
1
17845
89
GLY
H
4.91
1
4302
95
GLY
H
4.93
1
17403
125
GLY
H
4.93
1
4057
15
GLY
H
4.96
1
6249
125
GLY
H
4.97
1
18375
14
GLY
H
4.99
1
11116
101
GLY
H
4.995
1
4465
45
GLY
H
5.05
1
4878
68
GLY
H
5.05
1
4058
15
GLY
H
5.07
1
196
15
GLY
H
5.08
1
11100
108
GLY
H
5.087
1
4448
114
GLY
H
5.09
1
4059
15
GLY
H
5.1
1
4102
142
GLY
H
5.1
1
18180
124
GLY
H
5.103
1
15603
90
GLY
H
5.111
1
18662
14
GLY
H
5.12
1
15335
55
GLY
H
5.12
1
4263
38
GLY
H
5.12
1
17524
30
GLY
H
5.13
1
11101
108
GLY
H
5.14
1
4683
38
GLY
H
5.147
1
4453
52
GLY
H
5.15
1
11114
99
GLY
H
5.152
1
4168
35
GLY
H
5.16
1
192
15
GLY
H
5.16
1
17632
14
GLY
H
5.183
1
7140
13
GLY
H
5.187
1
7141
13
GLY
H
5.187
1
18518
40
GLY
H
5.188
1
11303
33
GLY
H
5.195
1
11508
11
GLY
H
5.202
1
15706
258
GLY
H
5.216
1
4704
92
GLY
H
5.22
1
4092
33
GLY
H
5.22
1
11296
33
GLY
H
5.224
1
4705
92
GLY
H
5.225
1
4648
97
GLY
H
5.24
.
6331
21
GLY
H
5.257
1
5054
114
GLY
H
5.26
1
6868
35
GLY
H
5.27
1
16353
22
GLY
H
5.28
1
18424
62
GLY
H
5.28
1
5504
21
GLY
H
5.295
.
4848
93
GLY
H
5.31
.
17144
83
GLY
H
5.31
1
4451
83
GLY
H
5.31
1
349
54
GLY
H
5.32
1
5317
31
GLY
H
5.33
1
17080
62
GLY
H
5.331
1
16734
98
GLY
H
5.355
1
11055
4
GLY
H
5.36
1
4049
92
GLY
H
5.36
1
11522
130
GLY
H
5.366
1
5566
58
GLY
H
5.37
1
4589
34
GLY
H
5.37
.
18423
62
GLY
H
5.38
1
11113
94
GLY
H
5.386
1
6901
84
GLY
H
5.387
1
5958
40
GLY
H
5.39
1
16470
42
GLY
H
5.395
1
10163
64
GLY
H
5.406
1
7273
6
GLY
H
5.407
.
4919
114
GLY
H
5.413
1
15361
84
GLY
H
5.413
1
18348
124
GLY
H
5.417
1
6972
96
GLY
H
5.42
1
16490
40
GLY
H
5.443
1
4210
24
GLY
H
5.45
1
15877
41
GLY
H
5.457
1
4983
192
GLY
H
5.46
1
15314
79
GLY
H
5.46
1
5334
33
GLY
H
5.46
1
5772
91
GLY
H
5.461
1
16380
32
GLY
H
5.465
1
5231
89
GLY
H
5.47
1
18364
49
GLY
H
5.472
1
11398
65
GLY
H
5.472
1
17960
18
GLY
H
5.479
1
16578
80
GLY
H
5.481
1
4649
33
GLY
H
5.4893
.
17368
16
GLY
H
5.494
1
10089
34
GLY
H
5.495
1
10239
79
GLY
H
5.496
1
10238
70
GLY
H
5.498
1
17369
16
GLY
H
5.503
1
10235
24
GLY
H
5.506
1
10237
24
GLY
H
5.509
1
4364
82
GLY
H
5.51
1
11194
21
GLY
H
5.51
1
5693
63
GLY
H
5.51
1
10236
24
GLY
H
5.511
1
18333
17
GLY
H
5.5155
1
15382
24
GLY
H
5.52
.
4369
54
GLY
H
5.52
1
5819
124
GLY
H
5.53
1
11102
120
GLY
H
5.532
1
5679
81
GLY
H
5.54
1
4173
89
GLY
H
5.55
1
15208
28
GLY
H
5.553
1
17950
26
GLY
H
5.553
.
5212
9
GLY
H
5.555
.
4705
96
GLY
H
5.562
1
11232
62
GLY
H
5.565
1
4679
89
GLY
H
5.57
.
16712
12
GLY
H
5.572
1
16713
12
GLY
H
5.573
1
18320
101
GLY
H
5.574
1
4311
33
GLY
H
5.577
1
5485
65
GLY
H
5.587
1
4311
33
GLY
H
5.589
1
5211
9
GLY
H
5.598
.
6604
8
GLY
H
5.606
1
4704
96
GLY
H
5.61
1
11522
78
GLY
H
5.613
1
6001
96
GLY
H
5.62
1
15578
84
GLY
H
5.621
1
6249
92
GLY
H
5.63
1
5947
82
GLY
H
5.636
1
6249
148
GLY
H
5.64
1
4252
72
GLY
H
5.64
1
6444
84
GLY
H
5.648
.
4979
20
GLY
H
5.65
1
5589
117
GLY
H
5.65
1
4908
97
GLY
H
5.65
1
17493
144
GLY
H
5.659
1
4765
112
GLY
H
5.66
1
6391
90
GLY
H
5.66
1
5352
86
GLY
H
5.66
.
17927
95
GLY
H
5.666
1
11155
59
GLY
H
5.679
1
4064
88
GLY
H
5.68
1
6965
124
GLY
H
5.7
1
4251
72
GLY
H
5.72
1
17809
68
GLY
H
5.74
1
7179
35
GLY
H
5.74
1
11107
98
GLY
H
5.741
1
5819
122
GLY
H
5.75
1
7089
89
GLY
H
5.75
1
6503
8
GLY
H
5.759
1
16009
114
GLY
H
5.766
1
18636
48
GLY
H
5.767
1
6249
65
GLY
H
5.77
1
17311
98
GLY
H
5.775
1