VAL CG1 Chemical Shift Outliers

___________________________________________________
VAL CG1 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
21452
21.513
13.53
32.27
1.357


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15935
89
VAL
CG1
25.595
2
6028
35
VAL
CG1
25.6
1
4636
27
VAL
CG1
25.6
.
17866
35
VAL
CG1
25.64
2
15313
146
VAL
CG1
25.673
2
17827
34
VAL
CG1
25.7
1
15057
89
VAL
CG1
25.709
1
16992
49
VAL
CG1
25.734
1
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
5595
134
VAL
CG1
25.82
2
16992
166
VAL
CG1
25.821
1
18811
71
VAL
CG1
25.8607
1
18517
203
VAL
CG1
25.92
2
6705
47
VAL
CG1
25.92
.
17212
94
VAL
CG1
25.975
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
6000
10
VAL
CG1
26.12
1
17653
36
VAL
CG1
26.14
2
4740
30
VAL
CG1
26.2
1
16813
48
VAL
CG1
26.209
2
15663
134
VAL
CG1
26.26
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
17653
49
VAL
CG1
26.52
2
11080
77
VAL
CG1
26.541
2
6950
2
VAL
CG1
26.571
1
4740
32
VAL
CG1
26.7
1
17653
53
VAL
CG1
26.82
2
5982
84
VAL
CG1
26.89
.
5373
37
VAL
CG1
26.89
2
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
.
17191
104
VAL
CG1
27.163
1
5982
81
VAL
CG1
27.23
.
17866
78
VAL
CG1
27.84
2
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
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
4901
88
VAL
CG1
13.53
1
5312
33
VAL
CG1
14.7
1
11236
17
VAL
CG1
14.757
2
6645
37
VAL
CG1
14.77
2
11126
91
VAL
CG1
14.957
2
5312
19
VAL
CG1
15
1
5312
47
VAL
CG1
15.1
1
5887
113
VAL
CG1
15.1
2
19033
57
VAL
CG1
15.103
.
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
7019
85
VAL
CG1
15.646
1
19033
5
VAL
CG1
15.825
.
17799
83
VAL
CG1
15.834
2
6913
58
VAL
CG1
15.959
1
4516
22
VAL
CG1
16
1
6058
95
VAL
CG1
16
2
6912
57
VAL
CG1
16
1
6904
6
VAL
CG1
16.08
1
11125
78
VAL
CG1
16.09
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
2
17499
121
VAL
CG1
16.249
2
16708
182
VAL
CG1
16.3
1
6132
152
VAL
CG1
16.3
2
17707
44
VAL
CG1
16.307
2
17957
88
VAL
CG1
16.33
1
6242
15
VAL
CG1
16.4
1
15046
21
VAL
CG1
16.5
1
4959
125
VAL
CG1
16.506
2
7250
127
VAL
CG1
16.506
2
7275
127
VAL
CG1
16.506
2
7267
127
VAL
CG1
16.506
2
7126
45
VAL
CG1
16.52
1
4931
66
VAL
CG1
16.52
1
6679
54
VAL
CG1
16.636
1
16007
61
VAL
CG1
16.638
2
16002
55
VAL
CG1
16.64
.
11011
114
VAL
CG1
16.655
1
5813
114
VAL
CG1
16.655
1
5935
140
VAL
CG1
16.679
2
1642
31
VAL
CG1
16.7
2
6141
128
VAL
CG1
16.719
.
10036
76
VAL
CG1
16.732
2
6242
41
VAL
CG1
16.8
1
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
17319
35
VAL
CG1
16.866
2
6612
93
VAL
CG1
16.9
.
11236
23
VAL
CG1
16.903
2
4884
41
VAL
CG1
16.92
2
6620
130
VAL
CG1
16.959
1
15973
9
VAL
CG1
16.973
2
16840
54
VAL
CG1
16.991
2
4282
72
VAL
CG1
17
1
6612
41
VAL
CG1
17
.
15535
39
VAL
CG1
17.013
1
5303
6
VAL
CG1
17.038
2
18534
43
VAL
CG1
17.04
1
5303
39
VAL
CG1
17.05
2
6141
93
VAL
CG1
17.074
.
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
.
7022
108
VAL
CG1
17.108
2
11027
46
VAL
CG1
17.123
1
17089
46
VAL
CG1
17.123
1
16902
228
VAL
CG1
17.141
2
15315
75
VAL
CG1
17.142
1
4281
16
VAL
CG1
17.156
1
7286
61
VAL
CG1
17.159
2
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
.
11181
89
VAL
CG1
17.185
2
18205
53
VAL
CG1
17.2
1
15279
77
VAL
CG1
17.2
1
7122
132
VAL
CG1
17.2
1
15485
98
VAL
CG1
17.202
.
16002
87
VAL
CG1
17.21
2
18954
70
VAL
CG1
17.227
1
16007
117
VAL
CG1
17.227
2
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
18734
74
VAL
CG1
17.274
1
11060
27
VAL
CG1
17.276
2
11129
103
VAL
CG1
17.293
2
6877
31
VAL
CG1
17.298
1
6612
14
VAL
CG1
17.3
.
4857
97
VAL
CG1
17.31
1
5943
103
VAL
CG1
17.32
2
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
7034
85
VAL
CG1
17.398
.
6972
70
VAL
CG1
17.4
2
4122
62
VAL
CG1
17.4
1
5928
26
VAL
CG1
17.4
2
6324
55
VAL
CG1
17.412
1
17706
44
VAL
CG1
17.413
2
5952
31
VAL
CG1
17.43
1
15973
1
VAL
CG1
17.433
2