VAL CG1 Chemical Shift Outliers

___________________________________________________
VAL CG1 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
30904
21.512
12.071
32.27
1.363


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
30410
37
VAL
CG1
25.623
.
19837
422
VAL
CG1
25.626
2
17866
35
VAL
CG1
25.64
2
15313
146
VAL
CG1
25.673
2
25159
28
VAL
CG1
25.692
2
17827
34
VAL
CG1
25.7
1
26717
52
VAL
CG1
25.7
1
15057
89
VAL
CG1
25.709
1
34155
51
VAL
CG1
25.714
1
30456
422
VAL
CG1
25.729
1
19413
151
VAL
CG1
25.747
1
19256
67
VAL
CG1
25.75742
.
18375
20
VAL
CG1
25.77
1
7377
56
VAL
CG1
25.771
1
11399
68
VAL
CG1
25.791
2
15750
56
VAL
CG1
25.8
1
19835
422
VAL
CG1
25.816
2
5595
134
VAL
CG1
25.82
2
10312
88
VAL
CG1
25.848
2
19156
100
VAL
CG1
25.854
2
18811
71
VAL
CG1
25.8607
1
27244
59
VAL
CG1
25.878
2
30456
358
VAL
CG1
25.882
1
18517
203
VAL
CG1
25.92
2
6705
47
VAL
CG1
25.92
.
25530
51
VAL
CG1
25.932
1
30154
51
VAL
CG1
25.932
1
27048
104
VAL
CG1
25.945
2
19156
41
VAL
CG1
25.957
2
17212
94
VAL
CG1
25.975
2
19835
358
VAL
CG1
25.978
2
15826
70
VAL
CG1
26.009
2
4791
17
VAL
CG1
26.01
2
17866
14
VAL
CG1
26.04
1
16007
23
VAL
CG1
26.084
2
30100
80
VAL
CG1
26.095
.
6000
10
VAL
CG1
26.12
1
17653
36
VAL
CG1
26.14
2
19837
358
VAL
CG1
26.181
2
4740
30
VAL
CG1
26.2
1
16813
48
VAL
CG1
26.209
2
25453
123
VAL
CG1
26.256
2
15663
134
VAL
CG1
26.26
1
30375
113
VAL
CG1
26.288
.
26760
148
VAL
CG1
26.293
1
4740
25
VAL
CG1
26.3
1
5055
80
VAL
CG1
26.37
1
18628
28
VAL
CG1
26.392
2
4791
87
VAL
CG1
26.46
2
19703
60
VAL
CG1
26.514
.
17653
49
VAL
CG1
26.52
2
18864
77
VAL
CG1
26.541
2
11080
77
VAL
CG1
26.541
2
6950
2
VAL
CG1
26.571
1
19984
28
VAL
CG1
26.6
1
19869
35
VAL
CG1
26.664
1
4740
32
VAL
CG1
26.7
1
34291
61
VAL
CG1
26.712
.
17653
53
VAL
CG1
26.82
2
5373
37
VAL
CG1
26.89
2
5982
84
VAL
CG1
26.89
.
4722
154
VAL
CG1
26.9
2
18505
132
VAL
CG1
27.09
.
5862
92
VAL
CG1
27.1
1
6705
44
VAL
CG1
27.133
.
5982
81
VAL
CG1
27.23
.
27411
155
VAL
CG1
27.3
1
17866
78
VAL
CG1
27.84
2
25832
145
VAL
CG1
27.869
1
16305
124
VAL
CG1
28.049
2
4981
14
VAL
CG1
28.1
2
4961
59
VAL
CG1
28.345
2
15826
121
VAL
CG1
28.511
2
5894
37
VAL
CG1
28.78
1
4740
51
VAL
CG1
29
1
25656
68
VAL
CG1
29.378
.
5101
19
VAL
CG1
32.27
2


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
26012
154
VAL
CG1
12.071
.
4901
88
VAL
CG1
13.53
1
5312
33
VAL
CG1
14.7
1
6645
37
VAL
CG1
14.77
2
30401
16
VAL
CG1
14.838
.
11126
91
VAL
CG1
14.957
2
5312
19
VAL
CG1
15
1
25226
48
VAL
CG1
15.023
1
19321
82
VAL
CG1
15.044
2
5312
47
VAL
CG1
15.1
1
5887
113
VAL
CG1
15.1
2
19033
57
VAL
CG1
15.103
2
1642
33
VAL
CG1
15.3
2
16884
58
VAL
CG1
15.4
1
17806
61
VAL
CG1
15.599
2
16884
43
VAL
CG1
15.6
1
19776
196
VAL
CG1
15.62
.
7019
85
VAL
CG1
15.646
1
18801
13
VAL
CG1
15.771
.
19033
5
VAL
CG1
15.825
2
17799
83
VAL
CG1
15.834
2
19736
27
VAL
CG1
15.862
1
19777
196
VAL
CG1
15.879
.
27249
76
VAL
CG1
15.909
.
6913
58
VAL
CG1
15.959
1
19778
207
VAL
CG1
15.96
.
6912
57
VAL
CG1
16
1
6058
95
VAL
CG1
16
2
4516
22
VAL
CG1
16
1
6904
6
VAL
CG1
16.08
1
11125
78
VAL
CG1
16.09
2
34058
86
VAL
CG1
16.128
2
18364
101
VAL
CG1
16.145
2
16884
85
VAL
CG1
16.2
1
6903
6
VAL
CG1
16.2034
1
16613
7
VAL
CG1
16.211
2
18205
109
VAL
CG1
16.216
.
17499
121
VAL
CG1
16.249
2
16708
182
VAL
CG1
16.3
1
6132
152
VAL
CG1
16.3
2
18613
46
VAL
CG1
16.304
1
17707
44
VAL
CG1
16.307
2
18794
46
VAL
CG1
16.317
1
19974
88
VAL
CG1
16.33
1
17957
88
VAL
CG1
16.33
1
30401
127
VAL
CG1
16.397
.
6242
15
VAL
CG1
16.4
1
15046
21
VAL
CG1
16.5
1
30375
222
VAL
CG1
16.505
.
7250
127
VAL
CG1
16.506
2
4959
125
VAL
CG1
16.506
2
7275
127
VAL
CG1
16.506
2
7267
127
VAL
CG1
16.506
2
19232
133
VAL
CG1
16.52
1
7126
45
VAL
CG1
16.52
1
27503
4
VAL
CG1
16.548
2
27249
34
VAL
CG1
16.551
.
19431
110
VAL
CG1
16.584
2
25754
6
VAL
CG1
16.612
2
25970
115
VAL
CG1
16.614
.
30401
162
VAL
CG1
16.635
.
6679
54
VAL
CG1
16.636
1
16007
61
VAL
CG1
16.638
2
16002
55
VAL
CG1
16.64
.
5813
114
VAL
CG1
16.655
1
11011
114
VAL
CG1
16.655
1
5935
140
VAL
CG1
16.679
2
25752
167
VAL
CG1
16.698
1
1642
31
VAL
CG1
16.7
2
4964
45
VAL
CG1
16.7
1
6141
128
VAL
CG1
16.719
.
10036
76
VAL
CG1
16.732
2
27503
129
VAL
CG1
16.736
2
6242
41
VAL
CG1
16.8
1
25573
89
VAL
CG1
16.8099
2
15315
151
VAL
CG1
16.811
1
7036
57
VAL
CG1
16.814
1
18190
14
VAL
CG1
16.84
2
7360
21
VAL
CG1
16.851
1
7179
41
VAL
CG1
16.86
1
19776
87
VAL
CG1
16.86
.
17319
35
VAL
CG1
16.866
2
25701
167
VAL
CG1
16.895
1
6612
93
VAL
CG1
16.9
.
25573
100
VAL
CG1
16.9062
2
19321
116
VAL
CG1
16.908
2
4884
41
VAL
CG1
16.92
2
19778
41
VAL
CG1
16.956
.
27086
49
VAL
CG1
16.958
1
30172
50
VAL
CG1
16.958
1
6620
135
VAL
CG1
16.959
1
34039
50
VAL
CG1
16.973
1
15973
9
VAL
CG1
16.973
2
16840
54
VAL
CG1
16.991
2
6612
41
VAL
CG1
17
.
25157
98
VAL
CG1
17
2
4282
72
VAL
CG1
17
1
15535
39
VAL
CG1
17.013
1
34078
13
VAL
CG1
17.028
2
5303
6
VAL
CG1
17.038
2
18534
43
VAL
CG1
17.04
1
27019
86
VAL
CG1
17.044
.
5303
39
VAL
CG1
17.05
2
6141
93
VAL
CG1
17.074
.
27271
29
VAL
CG1
17.082
1
25028
47
VAL
CG1
17.084
2
7019
32
VAL
CG1
17.099
1
4023
14
VAL
CG1
17.1
2
5928
44
VAL
CG1
17.1
2
15106
14
VAL
CG1
17.1
.
25391
14
VAL
CG1
17.105
2
7022
108
VAL
CG1
17.108
2
19842
103
VAL
CG1
17.109
2
19726
93
VAL
CG1
17.123
1
11027
46
VAL
CG1
17.123
1
17089
46
VAL
CG1
17.123
1
19778
179
VAL
CG1
17.14
.
16902
228
VAL
CG1
17.141
2
15315
75
VAL
CG1
17.142
1
4281
16
VAL
CG1
17.156
1
25924
47
VAL
CG1
17.157
.
7286
61
VAL
CG1
17.159
2
25924
35
VAL
CG1
17.159
.
6901
66
VAL
CG1
17.162
1
11141
115
VAL
CG1
17.166
2
11335
43
VAL
CG1
17.167
2
6073
14
VAL
CG1
17.17
.
19033
41
VAL
CG1
17.176
2
11181
89
VAL
CG1
17.185
2
30172
35
VAL
CG1
17.195
1
27086
34
VAL
CG1
17.195
1
18205
53
VAL
CG1
17.2
.
7122
132
VAL
CG1
17.2
1
15279
77
VAL
CG1
17.2
1
15485
98
VAL
CG1
17.202
.
16002
87
VAL
CG1
17.21
2
16007
117
VAL
CG1
17.227
2
18954
70
VAL
CG1
17.227
1
15266
109
VAL
CG1
17.23
1
11124
126
VAL
CG1
17.231
2
6911
76
VAL
CG1
17.252
2
16205
235
VAL
CG1
17.256
1
27608
76
VAL
CG1
17.256
.
27832
187
VAL
CG1
17.256
2
27863
6
VAL
CG1
17.26
1
18734
74
VAL
CG1
17.274
1
11060
27
VAL
CG1
17.276
2
19778
75
VAL
CG1
17.28
.
19321
12
VAL
CG1
17.286
2
11129
103
VAL
CG1
17.293
2
6877
31
VAL
CG1
17.298
1
30375
224
VAL
CG1
17.298
.
15836
80
VAL
CG1
17.3
1
6612
14
VAL
CG1
17.3
.
4857
97
VAL
CG1
17.31
1
5943
103
VAL
CG1
17.32
2
25833
98
VAL
CG1
17.334
1
18826
89
VAL
CG1
17.34
2
6585
13
VAL
CG1
17.35
1
15796
37
VAL
CG1
17.351
2
7036
5
VAL
CG1
17.354
1
11145
21
VAL
CG1
17.367
2
5324
78
VAL
CG1
17.368
1
5513
140
VAL
CG1
17.37
2
17499
97
VAL
CG1
17.377
2
11010
77
VAL
CG1
17.39
1
27705
82
VAL
CG1
17.395
2
7034
85
VAL
CG1
17.398
.
30537
34
VAL
CG1
17.4
1
5928
26
VAL
CG1
17.4
2
4127
115
VAL
CG1
17.4
1
6972
75
VAL
CG1
17.4
2
4122
62
VAL
CG1
17.4
1
19777
87
VAL
CG1
17.403
.
34039
35
VAL
CG1
17.405
1
6324
55
VAL
CG1
17.412
1
17706
44
VAL
CG1
17.413
2
25294
30
VAL
CG1
17.417
.