VAL CG2 Chemical Shift Outliers

___________________________________________________
VAL CG2 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
28612
21.329
-5.648
121.47
2.066


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15380
39
VAL
CG2
121.47
2
18663
121
VAL
CG2
27.769
2
6434
60
VAL
CG2
27.998
1
16305
124
VAL
CG2
28.049
2
6826
17
VAL
CG2
28.221
1
6826
10
VAL
CG2
28.485
1
6826
38
VAL
CG2
28.497
1
4284
121
VAL
CG2
28.743
1
4895
27
VAL
CG2
28.8
.
5303
6
VAL
CG2
30.463
2
5275
99
VAL
CG2
31.103
1
15873
58
VAL
CG2
39.618
1
15874
58
VAL
CG2
39.618
1
15873
24
VAL
CG2
40.909
1
15874
24
VAL
CG2
40.909
1
5041
12
VAL
CG2
41.626
1
5041
39
VAL
CG2
44.1
1
6723
37
VAL
CG2
44.299
.
6723
42
VAL
CG2
45.397
.
15129
32
VAL
CG2
48.617
1
4736
48
VAL
CG2
51.4
1
15877
16
VAL
CG2
51.657
2
4854
213
VAL
CG2
54
.
5631
15
VAL
CG2
56.1
1
5631
101
VAL
CG2
56.2
1
5631
50
VAL
CG2
56.7
1
5631
31
VAL
CG2
56.9
1
5631
47
VAL
CG2
57.2
1
5631
17
VAL
CG2
57.3
1
5631
98
VAL
CG2
57.8
1
5631
93
VAL
CG2
59.4
1
4150
36
VAL
CG2
59.885
.
5631
83
VAL
CG2
60.4
1
4150
80
VAL
CG2
60.762
.
4150
4
VAL
CG2
60.957
.
4150
14
VAL
CG2
61.431
.
4150
70
VAL
CG2
62.023
.
17497
74
VAL
CG2
62.781
1
7184
82
VAL
CG2
65.44
1
5179
74
VAL
CG2
67.48
.
5179
66
VAL
CG2
68.48
.
5179
44
VAL
CG2
68.88
.
5179
78
VAL
CG2
68.88
.
5179
18
VAL
CG2
71.18
.


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15584
92
VAL
CG2
-5.648
1
4431
87
VAL
CG2
11.3
2
4431
107
VAL
CG2
13.2
2
4431
64
VAL
CG2
13.2
2
18621
36
VAL
CG2
13.257
2
4431
39
VAL
CG2
13.4
2
4431
68
VAL
CG2
13.5
2
5303
39
VAL
CG2
13.582
2
4431
109
VAL
CG2
14.2
2
6645
37
VAL
CG2
14.33
2
17762
118
VAL
CG2
14.511
2
18388
57
VAL
CG2
14.626
2
16872
15
VAL
CG2
14.626
1
6903
12
VAL
CG2
14.6458
1
6904
12
VAL
CG2
14.74
1
7351
51
VAL
CG2
14.779
1
17456
64
VAL
CG2
14.79
1
17762
108
VAL
CG2
14.803
2
18471
11
VAL
CG2
14.811
2
7414
108
VAL
CG2
14.819
1
18734
74
VAL
CG2
14.841
1
4758
4
VAL
CG2
14.85
1
7414
156
VAL
CG2
14.956
1
16712
73
VAL
CG2
14.963
1
11086
104
VAL
CG2
15.001
2
18389
57
VAL
CG2
15.029
2
18118
94
VAL
CG2
15.071
2
16713
73
VAL
CG2
15.115
1
6904
69
VAL
CG2
15.12
1
15086
38
VAL
CG2
8.224
1