HIS HE2 Chemical Shift Outliers

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HIS HE2 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
286
11.553
-15
76.4
9.044


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
813
46
HIS
HE2
48.6
1
814
46
HIS
HE2
48.8
1
811
46
HIS
HE2
50
1
1487
46
HIS
HE2
50.1
1
1486
46
HIS
HE2
50.2
1
505
44
HIS
HE2
50.3
1
812
46
HIS
HE2
50.9
1
3085
119
HIS
HE2
76.3
1
3084
119
HIS
HE2
76.4
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code