LEU CG Chemical Shift Outliers

___________________________________________________
LEU CG Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
10617
26.742
15.569
41.217
1.228


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
4497
29
LEU
CG
30.5
.
4599
29
LEU
CG
30.5
.
5177
37
LEU
CG
30.5
1
10137
109
LEU
CG
30.51
1
4974
1
LEU
CG
30.542
1
7274
44
LEU
CG
30.56
1
4342
112
LEU
CG
30.6
1
6787
21
LEU
CG
30.65
1
5516
55
LEU
CG
30.7
1
15204
66
LEU
CG
30.7
1
5942
151
LEU
CG
30.749
1
5973
16
LEU
CG
30.773
.
6532
56
LEU
CG
30.783
.
5678
42
LEU
CG
30.8
1
6147
56
LEU
CG
30.819
1
5678
129
LEU
CG
30.85
1
7070
101
LEU
CG
30.879
1
4722
161
LEU
CG
30.9
1
4472
46
LEU
CG
30.9
1
4901
28
LEU
CG
30.93
1
5224
116
LEU
CG
31
1
6532
9
LEU
CG
31.041
.
7093
5
LEU
CG
31.173
1
5973
50
LEU
CG
31.224
.
6901
53
LEU
CG
31.29
1
6514
128
LEU
CG
31.3
1
15020
31
LEU
CG
31.305
1
15385
117
LEU
CG
31.35
1
7260
65
LEU
CG
31.357
1
6315
118
LEU
CG
31.5
1
7204
118
LEU
CG
31.544
1
6635
83
LEU
CG
31.629
1
6365
87
LEU
CG
31.7
1
5328
77
LEU
CG
31.8
1
6712
47
LEU
CG
31.807
1
15304
7
LEU
CG
31.9
1
5309
65
LEU
CG
31.9
1
6843
76
LEU
CG
31.92
1
5070
38
LEU
CG
32
1
15280
144
LEU
CG
32.163
1
6331
31
LEU
CG
32.214
1
7089
125
LEU
CG
32.3
1
6843
78
LEU
CG
32.36
1
6148
51
LEU
CG
32.411
1
6147
78
LEU
CG
32.431
1
7286
77
LEU
CG
32.467
1
7310
24
LEU
CG
32.475
1
6141
24
LEU
CG
32.475
.
5942
68
LEU
CG
32.493
1
4136
99
LEU
CG
32.6
1
4296
45
LEU
CG
32.7
1
6147
94
LEU
CG
32.719
1
7084
24
LEU
CG
32.77
.
6277
3
LEU
CG
32.796
1
4394
75
LEU
CG
32.8
1
7089
115
LEU
CG
33
1
4339
76
LEU
CG
33
1
6125
179
LEU
CG
33
1
7089
127
LEU
CG
33
1
6272
29
LEU
CG
33.31
1
5973
81
LEU
CG
33.667
.
5894
82
LEU
CG
34.37
1
5070
66
LEU
CG
34.5
1
6531
46
LEU
CG
35.203
.
5404
111
LEU
CG
35.604
1
6923
70
LEU
CG
36.082
1
4001
33
LEU
CG
36.31
1
6540
115
LEU
CG
36.41
1
4001
36
LEU
CG
36.83
1
6799
62
LEU
CG
37.7
1
6883
55
LEU
CG
38.621
1
15011
19
LEU
CG
39.561
1
4668
63
LEU
CG
41.217
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
5242
44
LEU
CG
15.569
1
6331
88
LEU
CG
19.292
1
4929
48
LEU
CG
19.32
1
6331
32
LEU
CG
19.622
1
15200
51
LEU
CG
20.1
1
5887
121
LEU
CG
20.1
1
6990
6
LEU
CG
20.192
1
6331
103
LEU
CG
20.236
1
6129
51
LEU
CG
20.3
.
6130
51
LEU
CG
20.3
.
6331
70
LEU
CG
20.396
1
4162
45
LEU
CG
20.53
1
6727
101
LEU
CG
20.609
1
4401
49
LEU
CG
20.74
1
5946
15
LEU
CG
21.15
1
5312
66
LEU
CG
21.2
1
6242
40
LEU
CG
21.3
1
5312
51
LEU
CG
21.4
1
6190
45
LEU
CG
21.406
.
4473
11
LEU
CG
21.42
1
15011
7
LEU
CG
21.44
1
5276
40
LEU
CG
21.5
1
15008
7
LEU
CG
21.506
1
5165
69
LEU
CG
21.596
1
4829
87
LEU
CG
21.596
1
5312
58
LEU
CG
21.6
1
7103
28
LEU
CG
21.8
1
4162
3
LEU
CG
21.89
1
7287
20
LEU
CG
21.897
1
4085
87
LEU
CG
21.9
1
5077
94
LEU
CG
21.91
1
5594
45
LEU
CG
21.97
1
5000
139
LEU
CG
21.97
1
6531
49
LEU
CG
21.999
.
6348
19
LEU
CG
22
.
15591
29
LEU
CG
22.074
1
5127
84
LEU
CG
22.091
1
6015
59
LEU
CG
22.094
1
5235
93
LEU
CG
22.11
1
4047
85
LEU
CG
22.2
1
6331
17
LEU
CG
22.21
1
6540
38
LEU
CG
22.22
1
7002
15
LEU
CG
22.23
1
6267
28
LEU
CG
22.24
1
15385
121
LEU
CG
22.3
1
7129
30
LEU
CG
22.33
1
6787
71
LEU
CG
22.338
1
6331
13
LEU
CG
22.352
1
15011
18
LEU
CG
22.374
1
4863
70
LEU
CG
22.4
1
1062
66
LEU
CG
22.45
1
5324
105
LEU
CG
22.463
1
5129
54
LEU
CG
22.47
1
7351
24
LEU
CG
22.474
1
5772
45
LEU
CG
22.487
1
15032
30
LEU
CG
22.5
1
4045
71
LEU
CG
22.5
1
6317
20
LEU
CG
22.508
1
15010
18
LEU
CG
22.523
1
6903
61
LEU
CG
22.547
1
6850
13
LEU
CG
22.562
1
4299
125
LEU
CG
22.58
1
4300
125
LEU
CG
22.58
1
6709
21
LEU
CG
22.598
1
6348
29
LEU
CG
22.6
.
6348
32
LEU
CG
22.6
.
5813
128
LEU
CG
22.605
1
4829
55
LEU
CG
22.608
1
6334
92
LEU
CG
22.6117
1
4829
24
LEU
CG
22.624
1
5077
79
LEU
CG
22.63
1
6904
61
LEU
CG
22.69
1
4317
69
LEU
CG
22.7
1
6348
35
LEU
CG
22.7
.
5678
137
LEU
CG
22.72
1
4593
59
LEU
CG
22.73
1
5772
128
LEU
CG
22.735
1
7351
97
LEU
CG
22.782
1
5929
120
LEU
CG
22.8
1
6390
7
LEU
CG
22.8
1
6990
43
LEU
CG
22.857
1
11001
45
LEU
CG
22.9
1
6031
60
LEU
CG
22.91
1
5813
139
LEU
CG
22.918
1
6531
93
LEU
CG
22.925
.
6532
63
LEU
CG
22.925
.
4829
26
LEU
CG
22.927
1
6787
121
LEU
CG
22.94
1
5324
53
LEU
CG
22.959
1
5594
27
LEU
CG
22.98
1
4869
62
LEU
CG
23
1
15385
57
LEU
CG
23
1
4858
41
LEU
CG
23
1
6374
20
LEU
CG
23.047
.