HIS HE1 Chemical Shift Outliers

___________________________________________________
HIS HE1 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
8813
7.821
-26.6
134.811
2.606


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
25040
191
HIS
HE1
134.811
1
5809
87
HIS
HE1
18
1
292
93
HIS
HE1
19.2
1
505
46
HIS
HE1
19.6
1
811
48
HIS
HE1
19.8
1
1487
48
HIS
HE1
20
1
1486
48
HIS
HE1
20.1
1
814
46
HIS
HE1
20.2
1
812
48
HIS
HE1
20.3
1
6230
92
HIS
HE1
20.4
1
6230
92
HIS
HE1
20.68
1
813
48
HIS
HE1
21.4
1
814
48
HIS
HE1
22.4
1
500
19
HIS
HE1
23.19
1
1719
23
HIS
HE1
23.39
1
346
23
HIS
HE1
24.24
1
1171
18
HIS
HE1
24.24
1
923
23
HIS
HE1
24.24
1
499
18
HIS
HE1
24.3
1
505
44
HIS
HE1
25.3
1
813
46
HIS
HE1
25.5
1
811
46
HIS
HE1
25.8
1
812
46
HIS
HE1
26.7
1
812
120
HIS
HE1
37.9
1
813
120
HIS
HE1
38.7
1
1486
120
HIS
HE1
38.9
1
1487
120
HIS
HE1
38.9
1
505
118
HIS
HE1
39
1
811
120
HIS
HE1
39.1
1
814
120
HIS
HE1
43.8
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
5466
10
HIS
HE1
-10
.
4801
69
HIS
HE1
-11.3
1
5269
46
HIS
HE1
-11.6
1
5026
18
HIS
HE1
-11.95
.
17903
23
HIS
HE1
-11.98
.
4801
69
HIS
HE1
-12.23
1
4602
63
HIS
HE1
-14
1
2641
119
HIS
HE1
-18.5
1
2642
119
HIS
HE1
-19.2
1
5809
87
HIS
HE1
-2.2
1
5172
15
HIS
HE1
-20.25
1
1571
102
HIS
HE1
-21.2
1
1839
175
HIS
HE1
-22
1
956
18
HIS
HE1
-23.5
1
317
18
HIS
HE1
-24.3
1
4777
18
HIS
HE1
-24.3
1
285
18
HIS
HE1
-25.6
1
274
18
HIS
HE1
-25.6
1
1793
22
HIS
HE1
-26.11
1
1797
22
HIS
HE1
-26.37
1
1791
22
HIS
HE1
-26.43
1
1192
22
HIS
HE1
-26.5
1
1194
23
HIS
HE1
-26.5
1
330
23
HIS
HE1
-26.5
1
1795
22
HIS
HE1
-26.58
1
331
23
HIS
HE1
-26.6
1
332
23
HIS
HE1
-26.6
1
2038
177
HIS
HE1
-8.8
1
2640
119
HIS
HE1
-9.5
1
5304
18
HIS
HE1
0
1