HIS CA Chemical Shift Outliers

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HIS CA Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
15661
56.498
43.308
77.562
2.318


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
18760
50
HIS
CA
63.496
.
5116
52
HIS
CA
63.5
1
17009
52
HIS
CA
63.523
1
17232
54
HIS
CA
63.55
1
16716
52
HIS
CA
63.558
1
16717
52
HIS
CA
63.558
1
27631
192
HIS
CA
63.575
.
18756
50
HIS
CA
63.597
.
16716
118
HIS
CA
63.615
1
30006
32
HIS
CA
63.631
1
16718
85
HIS
CA
63.654
1
17306
14
HIS
CA
63.662
1
5115
52
HIS
CA
63.7
1
4526
83
HIS
CA
63.7
.
4086
75
HIS
CA
63.7
1
16716
85
HIS
CA
63.713
1
16717
85
HIS
CA
63.772
1
15826
178
HIS
CA
63.8
1
18759
50
HIS
CA
63.852
.
25575
55
HIS
CA
63.88
1
15518
125
HIS
CA
63.9
1
6074
42
HIS
CA
63.974
1
4701
83
HIS
CA
64
1
19224
325
HIS
CA
64.005
1
17550
38
HIS
CA
64.041
1
15878
133
HIS
CA
64.045
.
17306
47
HIS
CA
64.095
1
5898
45
HIS
CA
64.3
1
5898
111
HIS
CA
64.5
1
5898
144
HIS
CA
64.6
1
5898
78
HIS
CA
64.6
1
5898
177
HIS
CA
64.7
1
19366
101
HIS
CA
64.846
1
6549
60
HIS
CA
65.15
.
4105
91
HIS
CA
65.4
1
16475
163
HIS
CA
66.77
1
5862
122
HIS
CA
66.98
1
19819
96
HIS
CA
70.19
1
19819
96
HIS
CA
71.15
1
25422
18
HIS
CA
77.562
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
19063
16
HIS
CA
43.308
.
27262
88
HIS
CA
45.552
1
5128
69
HIS
CA
46.01
1
19063
18
HIS
CA
46.142
.
5090
3
HIS
CA
48.3
1
19063
77
HIS
CA
48.492
.
6586
6
HIS
CA
48.529
1
16884
3
HIS
CA
48.6
1
7034
42
HIS
CA
48.607
.
19807
147
HIS
CA
48.853
1
5547
209
HIS
CA
48.9
1
30447
1
HIS
CA
48.922
.
30446
1
HIS
CA
48.922
.
30447
6
HIS
CA
48.955
.
30446
6
HIS
CA
48.955
.
19560
35
HIS
CA
48.98
1
27508
75
HIS
CA
48.982
.
27859
119
HIS
CA
49
.
26792
44
HIS
CA
49
1
6904
11
HIS
CA
49.01
1
5754
80
HIS
CA
49.059
1
6073
37
HIS
CA
49.13
.
26792
99
HIS
CA
49.2
1
18509
46
HIS
CA
49.206
1
18708
46
HIS
CA
49.206
1
16713
27
HIS
CA
49.431
1
6903
11
HIS
CA
49.48
1