VAL N Chemical Shift Outliers

___________________________________________________
VAL N Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
45676
121.234
.2
529
8.528


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
6697
61
VAL
N
153.202
1
5877
2
VAL
N
164.1
.
15602
94
VAL
N
174.7
1
15380
39
VAL
N
175.07
1
5815
29
VAL
N
185.3
1
5877
27
VAL
N
191
.
5815
33
VAL
N
193.2
1
5877
8
VAL
N
203.1
.
5877
31
VAL
N
205.2
.
5815
31
VAL
N
210
1
5877
35
VAL
N
215
.
5815
30
VAL
N
217
1
4066
44
VAL
N
228.4
1
6661
44
VAL
N
243
1
6664
44
VAL
N
248
1
6669
44
VAL
N
256
1
6670
44
VAL
N
256
1
4137
44
VAL
N
256.4
1
4137
44
VAL
N
262.8
1
6668
44
VAL
N
267
1
6662
44
VAL
N
270
1
6663
44
VAL
N
327
1
4066
44
VAL
N
336.6
1
6667
44
VAL
N
343
1
6659
44
VAL
N
346
1
6660
44
VAL
N
368
1
6674
8
VAL
N
450
1
6677
8
VAL
N
451
1
4137
8
VAL
N
465.2
1
4137
8
VAL
N
477.7
1
6672
8
VAL
N
484
1
6678
8
VAL
N
493
1
4066
8
VAL
N
494.5
1
6673
8
VAL
N
497
1
4066
8
VAL
N
508.99
1
6676
8
VAL
N
511
1
6671
8
VAL
N
517
1
6659
8
VAL
N
525
1
6675
8
VAL
N
529
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
7016
33
VAL
N
.2
.
7016
46
VAL
N
.2
.
7016
61
VAL
N
.2
.
7016
67
VAL
N
.2
.
7016
16
VAL
N
.2
.
5684
73
VAL
N
16.77
1
7184
82
VAL
N
20.4
1
5757
85
VAL
N
93.4
1