LYS CD Chemical Shift Outliers

___________________________________________________
LYS CD Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
8501
28.900
21.199
42.6
1.267


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15266
97
LYS
CD
32.83
1
15266
42
LYS
CD
32.9
1
7324
72
LYS
CD
32.922
1
4567
75
LYS
CD
32.96
1
7276
9
LYS
CD
32.997
1
15266
71
LYS
CD
33
1
15193
88
LYS
CD
33
1
5696
84
LYS
CD
33
1
15266
92
LYS
CD
33
1
6071
102
LYS
CD
33
9
6933
84
LYS
CD
33.026
1
6356
72
LYS
CD
33.083
.
5842
122
LYS
CD
33.1
1
15384
2
LYS
CD
33.23
1
7276
8
LYS
CD
33.436
1
7087
46
LYS
CD
33.5
1
5696
82
LYS
CD
33.5
1
4077
52
LYS
CD
33.6
1
4424
48
LYS
CD
33.65
1
4317
41
LYS
CD
33.8
1
4394
97
LYS
CD
33.9
1
6121
17
LYS
CD
34.08
1
5992
3
LYS
CD
34.4
1
5992
74
LYS
CD
34.4
1
5992
10
LYS
CD
34.4
1
4117
13
LYS
CD
34.7
1
6624
106
LYS
CD
35.169
1
6883
126
LYS
CD
35.43
1
5242
51
LYS
CD
35.462
1
6086
31
LYS
CD
35.787
1
6680
8
LYS
CD
36.373
1
6679
19
LYS
CD
37.689
1
6727
40
LYS
CD
38.458
1
4267
135
LYS
CD
38.6
1
6484
100
LYS
CD
39.2
1
6484
101
LYS
CD
40.1
1
6883
172
LYS
CD
41.432
1
5566
203
LYS
CD
41.49
1
6181
105
LYS
CD
41.54
1
4648
202
LYS
CD
42.1
.
6816
36
LYS
CD
42.256
1
4334
75
LYS
CD
42.6
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
4281
42
LYS
CD
21.199
1
4431
18
LYS
CD
21.4
1
4281
49
LYS
CD
21.5
1
4281
46
LYS
CD
21.596
1
4281
2
LYS
CD
21.752
1
7036
54
LYS
CD
21.979
1
4082
25
LYS
CD
22
1
5991
79
LYS
CD
22.144
1
6242
33
LYS
CD
22.2
1
5299
40
LYS
CD
22.33
1
5276
33
LYS
CD
22.4
1
5678
21
LYS
CD
22.47
1
4281
9
LYS
CD
22.744
1
5992
7
LYS
CD
22.8
1
5992
18
LYS
CD
22.8
1
6331
98
LYS
CD
22.819
1
6331
97
LYS
CD
22.845
1
4281
31
LYS
CD
22.985
1
6821
30
LYS
CD
23.157
.
15120
32
LYS
CD
23.17
.
6912
79
LYS
CD
23.2
1
4281
47
LYS
CD
23.294
1
4317
20
LYS
CD
23.5
1
5085
21
LYS
CD
23.5
1
4081
133
LYS
CD
23.5
1
6583
46
LYS
CD
23.5
1
4821
52
LYS
CD
23.565
1
6453
29
LYS
CD
23.57
1
6052
96
LYS
CD
23.6
1
4394
69
LYS
CD
23.6
1
4858
29
LYS
CD
23.7
1
7095
28
LYS
CD
23.74
1
6080
91
LYS
CD
23.74
1
5233
69
LYS
CD
23.74
4
6111
19
LYS
CD
23.75
1
4248
5
LYS
CD
23.75
1
6883
39
LYS
CD
23.8
1
6484
62
LYS
CD
23.81
1
4771
81
LYS
CD
23.82
1
5991
81
LYS
CD
23.824
1
7022
140
LYS
CD
23.889
1
4574
44
LYS
CD
23.9
1
4721
21
LYS
CD
23.9
1
4857
124
LYS
CD
23.92
1
5902
21
LYS
CD
23.93
1
6334
73
LYS
CD
23.979
1
5233
24
LYS
CD
24
4
5404
18
LYS
CD
24.159
1
5217
77
LYS
CD
24.2
1
5991
64
LYS
CD
24.204
1
5678
123
LYS
CD
24.22
1
15120
4
LYS
CD
24.24
.
5678
67
LYS
CD
24.26
1
6725
3
LYS
CD
24.27
1
5873
31
LYS
CD
24.3
1
5873
20
LYS
CD
24.3
1
6607
111
LYS
CD
24.33
1
7055
41
LYS
CD
24.361
1
7055
144
LYS
CD
24.361
1
5991
136
LYS
CD
24.383
1
5991
5
LYS
CD
24.383
1
15020
78
LYS
CD
24.395
1
15167
72
LYS
CD
24.4
1
7279
46
LYS
CD
24.4
1
6538
101
LYS
CD
24.42
1
4497
155
LYS
CD
24.43
.
4599
155
LYS
CD
24.43
.
5991
16
LYS
CD
24.44
1
4678
47
LYS
CD
24.47
.
4562
1
LYS
CD
24.48
1
6147
67
LYS
CD
24.485
1
4856
56
LYS
CD
24.5
4
4869
85
LYS
CD
24.5
1
4856
56
LYS
CD
24.5
4
5873
42
LYS
CD
24.5
1
4391
24
LYS
CD
24.51
1
7097
11
LYS
CD
24.53
.
5991
99
LYS
CD
24.569
9
5991
18
LYS
CD
24.57
1
5902
71
LYS
CD
24.597
1
5873
53
LYS
CD
24.6
1
4317
70
LYS
CD
24.6
1
4117
23
LYS
CD
24.6
1
15131
71
LYS
CD
24.6
1
15452
131
LYS
CD
24.6
1
6607
17
LYS
CD
24.62
1
5991
1
LYS
CD
24.649
1
15060
63
LYS
CD
24.65
1
6361
66
LYS
CD
24.661
1
7270
26
LYS
CD
24.68
1
6071
131
LYS
CD
24.7
1
7279
92
LYS
CD
24.7
1
6121
101
LYS
CD
24.7
1
15167
94
LYS
CD
24.7
1
6910
32
LYS
CD
24.7
1
5217
42
LYS
CD
24.7
1
6051
3
LYS
CD
24.715
1
4901
104
LYS
CD
24.72
1
4901
62
LYS
CD
24.72
1
7020
20
LYS
CD
24.725
1
5902
88
LYS
CD
24.727
1
5678
127
LYS
CD
24.73
1
15060
98
LYS
CD
24.76
1
6502
38
LYS
CD
24.788
1
6955
78
LYS
CD
24.788
1
6612
64
LYS
CD
24.8
.
5217
71
LYS
CD
24.8
1
5598
7
LYS
CD
24.8
.
4796
122
LYS
CD
24.8
1
5389
87
LYS
CD
24.8
1
15369
200
LYS
CD
24.811
1
10137
44
LYS
CD
24.814
1
6607
116
LYS
CD
24.82
1
10137
115
LYS
CD
24.828
1
15039
98
LYS
CD
24.844
1
15060
23
LYS
CD
24.85
1
5748
72
LYS
CD
24.86
1
5107
76
LYS
CD
24.865
4
5991
77
LYS
CD
24.895
1
5929
15
LYS
CD
24.9
1
4091
85
LYS
CD
24.9
1
4394
17
LYS
CD
24.9
1
15232
28
LYS
CD
24.918
1
4788
89
LYS
CD
24.95
1
4737
67
LYS
CD
24.953
1
15060
85
LYS
CD
24.96
1
4455
29
LYS
CD
24.96
1
4455
9
LYS
CD
24.96
1
5678
10
LYS
CD
24.97
1
15014
35
LYS
CD
24.98
1
4829
22
LYS
CD
24.984
1
6903
42
LYS
CD
24.9891
1
5129
46
LYS
CD
24.99
1
4318
2
LYS
CD
24.99
1
7272
26
LYS
CD
24.997
1
5560
61
LYS
CD
25
1
15384
60
LYS
CD
25
1
5758
43
LYS
CD
25
1
4860
123
LYS
CD
25
1
5873
35
LYS
CD
25
1
15384
61
LYS
CD
25
1
6003
65
LYS
CD
25.003
1
5185
74
LYS
CD
25.01
1
5499
37
LYS
CD
25.02
.
6121
166
LYS
CD
25.02
1
6531
59
LYS
CD
25.022
.
6531
91
LYS
CD
25.022
.
6073
76
LYS
CD
25.03
.
6607
63
LYS
CD
25.03
1
7095
85
LYS
CD
25.035
1
15424
144
LYS
CD
25.057
1
15060
31
LYS
CD
25.07
1
6334
3
LYS
CD
25.08
1
5324
114
LYS
CD
25.083
1
5665
26
LYS
CD
25.096
1