LYS CD Chemical Shift Outliers

___________________________________________________
LYS CD Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
36616
28.994
.834
329.284
2.696


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
25442
34
LYS
CD
328.7
.
25442
30
LYS
CD
329.284
.
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
19830
91
LYS
CD
39.329
1
34131
18
LYS
CD
39.731
1
6484
101
LYS
CD
40.1
1
18934
8
LYS
CD
40.584
1
25155
107
LYS
CD
40.78
.
6883
172
LYS
CD
41.432
1
5566
203
LYS
CD
41.49
1
6181
105
LYS
CD
41.54
1
27165
105
LYS
CD
41.7
1
30529
17
LYS
CD
41.82
1
19214
22
LYS
CD
41.9
1
25155
130
LYS
CD
41.98
.
25864
33
LYS
CD
42
1
15602
95
LYS
CD
42
1
19738
10
LYS
CD
42.04
1
15581
75
LYS
CD
42.043
1
19866
165
LYS
CD
42.044
.
4648
202
LYS
CD
42.1
.
15813
48
LYS
CD
42.21
.
6816
36
LYS
CD
42.256
1
34225
47
LYS
CD
42.4
1
4334
75
LYS
CD
42.6
1
17768
15
LYS
CD
42.7
1
25176
14
LYS
CD
43.08
.
25176
23
LYS
CD
43.08
.
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
26552
68
LYS
CD
56.5817
.
34022
43
LYS
CD
56.5817
.
25382
85
LYS
CD
56.827
.
25382
6
LYS
CD
57.001
.
25382
68
LYS
CD
57.06
.
25382
9
LYS
CD
57.074
.
25382
57
LYS
CD
57.104
.
25382
25
LYS
CD
57.206
.
34022
79
LYS
CD
57.5667
.
26552
104
LYS
CD
57.5667
.
25382
8
LYS
CD
58.102
.
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
5
LYS
CD
69.324
.
4150
87
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
25681
32
LYS
CD
.834
.
15840
10
LYS
CD
15.366
1
25924
50
LYS
CD
19.726
.
19154
5
LYS
CD
20.1
1
6442
101
LYS
CD
20.62
1