PHE N Chemical Shift Outliers

___________________________________________________
PHE N Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
28747
120.374
101.474
139.02
4.109


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
25779
68
PHE
N
132.8
1
18432
106
PHE
N
132.826
.
19203
75
PHE
N
132.829
1
10318
61
PHE
N
132.885
1
18632
104
PHE
N
132.886
1
18632
104
PHE
N
132.89
1
7313
25
PHE
N
132.9
1
19160
124
PHE
N
132.911
1
25910
53
PHE
N
132.937
1
25909
53
PHE
N
132.958
1
11338
77
PHE
N
132.967
1
15112
47
PHE
N
133.151
1
17364
54
PHE
N
133.248
1
19233
21
PHE
N
133.349
1
26751
190
PHE
N
133.494
1
6986
48
PHE
N
133.5
1
5514
223
PHE
N
133.75
1
17745
85
PHE
N
133.76
1
6542
93
PHE
N
133.8
1
10110
29
PHE
N
133.807
1
30207
54
PHE
N
133.88
.
19038
14
PHE
N
133.9
.
27078
173
PHE
N
134.1
1
11348
52
PHE
N
134.543
1
4580
29
PHE
N
134.6
1
7420
10
PHE
N
134.826
1
7126
56
PHE
N
134.9
1
27078
173
PHE
N
135.2
1
25476
97
PHE
N
135.23
1
18576
69
PHE
N
135.3
1
18585
69
PHE
N
135.3
1
5866
68
PHE
N
135.4
1
4964
56
PHE
N
135.4
1
27020
131
PHE
N
135.767
1
7089
86
PHE
N
135.9
1
25859
86
PHE
N
135.9
1
5514
83
PHE
N
136.01
1
26717
4
PHE
N
136.8
1
11142
53
PHE
N
138.826
1
5514
100
PHE
N
139.02
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
36080
59
PHE
N
101.474
.
15243
14
PHE
N
102.2
1
5128
103
PHE
N
102.76
1
5058
105
PHE
N
102.825
1
16537
162
PHE
N
103.2
1
27691
173
PHE
N
104.37
1
25834
94
PHE
N
104.48
1
7421
10
PHE
N
104.658
1
16838
174
PHE
N
104.768
1
4821
74
PHE
N
104.778
1
4883
39
PHE
N
104.911
1
4887
39
PHE
N
104.911
1
4876
39
PHE
N
104.93
1
4831
38
PHE
N
105.04
.
5049
21
PHE
N
105.38
1
18346
22
PHE
N
105.457
1
18687
81
PHE
N
105.46
.
18686
81
PHE
N
105.52
.
18683
81
PHE
N
105.55
.
6613
120
PHE
N
105.586
1
16986
35
PHE
N
105.7
1
25535
94
PHE
N
105.787
1
16365
97
PHE
N
105.8
1
19419
98
PHE
N
106
1
18021
55
PHE
N
106.214
.
18020
55
PHE
N
106.241
.
17570
313
PHE
N
106.342
1
17499
245
PHE
N
106.344
1
15485
55
PHE
N
106.503
.
18882
12
PHE
N
106.529
.
25761
103
PHE
N
106.623
.
6404
123
PHE
N
106.8
1
27287
118
PHE
N
106.8059
1
15412
53
PHE
N
106.833
1
19459
16
PHE
N
106.863
.
19182
128
PHE
N
106.884
1
15485
39
PHE
N
107
.
15485
52
PHE
N
107.003
.
15809
89
PHE
N
107.053
1
27268
94
PHE
N
107.1
.
4986
169
PHE
N
107.1
1
26822
75
PHE
N
107.367
1
18598
26
PHE
N
107.41
1
6578
91
PHE
N
107.517
1
5934
3
PHE
N
107.6
1
25770
94
PHE
N
107.608
1
30410
23
PHE
N
107.71
.
6644
160
PHE
N
107.81
1
17361
156
PHE
N
107.817
1
6807
169
PHE
N
107.884
1
15897
66
PHE
N
107.899
1
15896
66
PHE
N
107.899
1
4354
169
PHE
N
107.99
1
18883
12
PHE
N
108.003
.