LYS CD Chemical Shift Outliers

___________________________________________________
LYS CD Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
26614
28.972
15.366
77.48
1.536


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
4077
52
LYS
CD
33.6
1
5126
7
LYS
CD
33.65
.
4424
48
LYS
CD
33.65
1
16666
58
LYS
CD
33.654
1
17767
77
LYS
CD
33.78
1
4317
41
LYS
CD
33.8
1
17866
49
LYS
CD
33.84
1
4027
52
LYS
CD
33.9
1
4394
97
LYS
CD
33.9
1
15716
117
LYS
CD
34
1
6121
17
LYS
CD
34.08
1
18228
130
LYS
CD
34.103
1
5992
74
LYS
CD
34.4
1
5992
3
LYS
CD
34.4
1
5992
10
LYS
CD
34.4
1
16053
35
LYS
CD
34.56
.
4117
13
LYS
CD
34.7
1
6330
47
LYS
CD
34.9
1
4100
43
LYS
CD
35.08
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
6732
24
LYS
CD
35.862
.
5572
16
LYS
CD
36.33
1
6680
8
LYS
CD
36.373
1
18543
140
LYS
CD
36.425
1
6679
19
LYS
CD
37.689
1
6727
40
LYS
CD
38.458
1
4267
135
LYS
CD
38.6
1
18587
20
LYS
CD
38.878
1
17262
31
LYS
CD
39.2
1
6484
100
LYS
CD
39.2
1
16693
15
LYS
CD
39.24
1
18732
35
LYS
CD
39.561
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
15602
95
LYS
CD
42
1
15581
75
LYS
CD
42.043
1
4648
202
LYS
CD
42.1
.
15813
48
LYS
CD
42.21
.
6816
36
LYS
CD
42.256
1
4334
75
LYS
CD
42.6
1
17768
15
LYS
CD
42.7
1
17693
16
LYS
CD
43.635
1
16914
71
LYS
CD
49.797
.
15113
22
LYS
CD
52.639
1
15083
40
LYS
CD
53.041
1
15877
14
LYS
CD
58.966
1
15581
134
LYS
CD
59.274
1
18340
6
LYS
CD
59.4294
1
4448
155
LYS
CD
67
1
7184
89
LYS
CD
68.06
1
4150
91
LYS
CD
68.292
.
4150
74
LYS
CD
68.731
.
4150
34
LYS
CD
68.767
.
4150
48
LYS
CD
68.911
.
4150
3
LYS
CD
68.965
.
16807
92
LYS
CD
69.268
1
4150
87
LYS
CD
69.324
.
4150
5
LYS
CD
69.324
.
4150
25
LYS
CD
69.502
.
4150
40
LYS
CD
69.534
.
5179
48
LYS
CD
73.08
.
5179
15
LYS
CD
77.48
.


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15840
10
LYS
CD
15.366
1
19154
5
LYS
CD
20.1
1
6442
101
LYS
CD
20.62
1
17598
7
LYS
CD
21.033
1
4281
42
LYS
CD
21.199
1
16114
57
LYS
CD
21.235
1
18613
152
LYS
CD
21.321
1
4431
18
LYS
CD
21.4
1
4281
49
LYS
CD
21.5
1
7414
21
LYS
CD
21.557
1
16019
40
LYS
CD
21.596
1
4281
46
LYS
CD
21.596
1
17425
3
LYS
CD
21.7511
1
4281
2
LYS
CD
21.752
1
18388
8
LYS
CD
21.932
1
7036
54
LYS
CD
21.979
1
4082
25
LYS
CD
22
1
7184
3
LYS
CD
22.08
1
5991
79
LYS
CD
22.144
1
16205
86
LYS
CD
22.197
4
6242
33
LYS
CD
22.2
1
7184
43
LYS
CD
22.3
1
5299
40
LYS
CD
22.33
1
5276
33
LYS
CD
22.4
1
18534
58
LYS
CD
22.42
1
5678
21
LYS
CD
22.47
1
18534
29
LYS
CD
22.5
1
15941
136
LYS
CD
22.501
1
17806
101
LYS
CD
22.539
1
16205
225
LYS
CD
22.595
4
7384
32
LYS
CD
22.6
1
15364
32
LYS
CD
22.6
1
16205
228
LYS
CD
22.678
4
7184
73
LYS
CD
22.7
1
4281
9
LYS
CD
22.744
1
17314
79
LYS
CD
22.78
1
15941
100
LYS
CD
22.785
1
5992
7
LYS
CD
22.8
1
5992
18
LYS
CD
22.8
1
6331
98
LYS
CD
22.819
1
17705
51
LYS
CD
22.834
1
16205
63
LYS
CD
22.84
4
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
4089
80
LYS
CD
23.3
1
6358
73
LYS
CD
23.3
.
16141
26
LYS
CD
23.37
.
16884
81
LYS
CD
23.4
1
16884
47
LYS
CD
23.4
1
16884
6
LYS
CD
23.5
1
5085
21
LYS
CD
23.5
1
4317
20
LYS
CD
23.5
1
16884
91
LYS
CD
23.5
1
4081
133
LYS
CD
23.5
1
6583
46
LYS
CD
23.5
1
4313
128
LYS
CD
23.5
1
16108
181
LYS
CD
23.532
1
4821
52
LYS
CD
23.565
1
6453
29
LYS
CD
23.57
1
16884
84
LYS
CD
23.6
1
6052
96
LYS
CD
23.6
1
4394
69
LYS
CD
23.6
1
7350
13
LYS
CD
23.602
.
4858
29
LYS
CD
23.7
1
6358
46
LYS
CD
23.7
.
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
11086
119
LYS
CD
23.765
1
16114
36
LYS
CD
23.787
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
6528
54
LYS
CD
23.85
1
17005
122
LYS
CD
23.876
1
16141
36
LYS
CD
23.88
.
7022
140
LYS
CD
23.889
1
4574
44
LYS
CD
23.9
1
4721
21
LYS
CD
23.9
1
17456
29
LYS
CD
23.909
1
4857
124
LYS
CD
23.92
1
5902
21
LYS
CD
23.93
1
16179
14
LYS
CD
23.95
1
16180
14
LYS
CD
23.95
1
16671
14
LYS
CD
23.95
1
6334
73
LYS
CD
23.979
1
17456
20
LYS
CD
23.991
1
5233
24
LYS
CD
24
4
16115
114
LYS
CD
24
1
15961
135
LYS
CD
24
1
5572
81
LYS
CD
24.05
1
4224
66
LYS
CD
24.06
1
16006
26
LYS
CD
24.076
1
4867
25
LYS
CD
24.1
1
17754
75
LYS
CD
24.1
1
15084
35
LYS
CD
24.1
1
17160
36
LYS
CD
24.1
1
15361
152
LYS
CD
24.1
1
11502
80
LYS
CD
24.123
.
16181
14
LYS
CD
24.14
1
18471
14
LYS
CD
24.146
1
5404
18
LYS
CD
24.159
1
17456
71
LYS
CD
24.161
1
16205
35
LYS
CD
24.17
4
4985
50
LYS
CD
24.2
1
6142
140
LYS
CD
24.2
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
.
15560
89
LYS
CD
24.26
1
5678
67
LYS
CD
24.26
1
6725
3
LYS
CD
24.27
1
15681
82
LYS
CD
24.275
1
18113
97
LYS
CD
24.288
1
5787
18
LYS
CD
24.296
1
7125
127
LYS
CD
24.296
1
5873
31
LYS
CD
24.3
1
5873
20
LYS
CD
24.3
1
6607
111
LYS
CD
24.33
1
4050
2
LYS
CD
24.34
1
7055
144
LYS
CD
24.361
1
7055
41
LYS
CD
24.361
1