TRP CA Chemical Shift Outliers

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TRP CA Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
11147
57.720
2.966
362.099
4.915


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
27080
189
TRP
CA
126.32
1
25442
18
TRP
CA
357.804
.
25442
31
TRP
CA
362.099
.
16336
42
TRP
CA
81
1
15877
8
TRP
CA
87.02
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
25679
30
TRP
CA
2.966
.
19716
13
TRP
CA
28.7436
1
18951
12
TRP
CA
30.705
1
18951
36
TRP
CA
35.255
1
15874
55
TRP
CA
39.808
1
15873
55
TRP
CA
39.808
1
25681
30
TRP
CA
7.107
.