GLU CA Chemical Shift Outliers

___________________________________________________
GLU CA Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
56801
57.338
41.955
70.384
2.069


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
26589
34
GLU
CA
63.602
.
19680
35
GLU
CA
63.65
1
15988
69
GLU
CA
63.854
1
18526
147
GLU
CA
63.885
1
18853
156
GLU
CA
63.926
1
19686
35
GLU
CA
63.93
1
16361
68
GLU
CA
63.946
1
26889
34
GLU
CA
63.99
1
17579
106
GLU
CA
64.025
1
6148
60
GLU
CA
64.254
1
5736
101
GLU
CA
64.6
.
27631
46
GLU
CA
64.656
.
19144
55
GLU
CA
64.887
1
27631
275
GLU
CA
64.96
.
17822
13
GLU
CA
65.061
1
34124
31
GLU
CA
65.325
.
25807
24
GLU
CA
66.844
1
19708
70
GLU
CA
66.94
1
34040
1
GLU
CA
70.384
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
30437
41
GLU
CA
41.955
.
6141
134
GLU
CA
44.348
1
15130
20
GLU
CA
44.963
1
15548
62
GLU
CA
44.97
1
5076
60
GLU
CA
45.46
1
19063
27
GLU
CA
46.212
.
27198
8
GLU
CA
47.161
1
27089
131
GLU
CA
47.661
1
25573
123
GLU
CA
47.9025
1
17948
15
GLU
CA
48.017
1
27482
187
GLU
CA
49.197
1
36017
9
GLU
CA
49.2
1
6586
58
GLU
CA
49.309
1
19063
72
GLU
CA
49.322
.
26851
30
GLU
CA
49.552
1
26848
30
GLU
CA
49.569
1
15315
131
GLU
CA
49.573
1
16002
81
GLU
CA
49.6
1
15315
54
GLU
CA
49.669
1
5886
101
GLU
CA
49.69
1
18373
136
GLU
CA
49.704
1
25226
9
GLU
CA
49.712
1
25225
9
GLU
CA
49.712
1
15796
40
GLU
CA
49.793
1
26793
14
GLU
CA
49.8
1
26792
81
GLU
CA
49.8
1
6725
82
GLU
CA
49.84
1
11145
86
GLU
CA
49.888
1
5752
15
GLU
CA
49.938
1
19063
31
GLU
CA
49.944
.
5886
284
GLU
CA
49.97
1
17704
9
GLU
CA
49.995
1
26793
15
GLU
CA
50
1
25754
7
GLU
CA
50.017
1
17425
1
GLU
CA
50.1064
1
25972
18
GLU
CA
50.107
.
19033
58
GLU
CA
50.156
1
15796
73
GLU
CA
50.182
1
17782
28
GLU
CA
50.292
1
16884
7
GLU
CA
50.3
1
7308
91
GLU
CA
50.3
1
25504
250
GLU
CA
50.303
1
26851
102
GLU
CA
50.328
1
26619
73
GLU
CA
50.331
.
7360
24
GLU
CA
50.386
1
27859
214
GLU
CA
50.4
.
15120
97
GLU
CA
50.4
.
19560
230
GLU
CA
50.41
1
5514
32
GLU
CA
50.45
1
25481
59
GLU
CA
50.47
1
17781
30
GLU
CA
50.578
1
30375
203
GLU
CA
50.597
.
26793
44
GLU
CA
50.6
1
27859
236
GLU
CA
50.6
.
5222
63
GLU
CA
50.6
1
26848
102
GLU
CA
50.612
1
18245
4
GLU
CA
50.618
1
18246
4
GLU
CA
50.618
1
27482
54
GLU
CA
50.623
1
18905
16
GLU
CA
50.628
.
6586
59
GLU
CA
50.654
1
17443
115
GLU
CA
50.672
1
7241
6
GLU
CA
50.7
1
11142
94
GLU
CA
50.738
1
6911
40
GLU
CA
50.749
1
18373
29
GLU
CA
50.759
1
15315
60
GLU
CA
50.761
1
17806
5
GLU
CA
50.777
1
26647
4
GLU
CA
50.78
1
4354
153
GLU
CA
50.806
1
18760
59
GLU
CA
50.827
.
6725
80
GLU
CA
50.84
1
11222
33
GLU
CA
50.845
1
17781
51
GLU
CA
50.848
1
17477
9
GLU
CA
50.86
1
25481
16
GLU
CA
50.88
1
26756
13
GLU
CA
50.886
.
27122
255
GLU
CA
50.899
.
36083
8
GLU
CA
50.9
1
4987
153
GLU
CA
50.9
1
18353
122
GLU
CA
50.904
1
19333
36
GLU
CA
50.92
1
17782
49
GLU
CA
50.949
1
1642
29
GLU
CA
50.95
1
6484
73
GLU
CA
50.96
1
6531
70
GLU
CA
50.991
.
30094
63
GLU
CA
51
1
4986
153
GLU
CA
51
1
6586
130
GLU
CA
51.008
1
5594
43
GLU
CA
51.03
1
11143
96
GLU
CA
51.067
1
27482
168
GLU
CA
51.072
1
25792
45
GLU
CA
51.094
.
26792
59
GLU
CA
51.1
1
26793
32
GLU
CA
51.1
1
5300
151
GLU
CA
51.1
1
6353
51
GLU
CA
51.1
1
27130
106
GLU
CA
51.107
1