GLN NE2 Chemical Shift Outliers

___________________________________________________
GLN NE2 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
13596
111.859
33.9
155
2.168


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
10188
24
GLN
NE2
118.399
1
5554
94
GLN
NE2
118.4
1
4788
12
GLN
NE2
118.4
1
11224
52
GLN
NE2
118.409
1
15020
111
GLN
NE2
118.456
1
15958
10
GLN
NE2
118.648
1
16994
89
GLN
NE2
118.7
1
4382
52
GLN
NE2
118.73
1
5791
26
GLN
NE2
118.75
1
5791
18
GLN
NE2
118.8
1
16994
19
GLN
NE2
118.8
1
4206
89
GLN
NE2
118.85
1
4463
17
GLN
NE2
118.87
1
6847
92
GLN
NE2
118.878
1
4302
38
GLN
NE2
118.9
1
6971
97
GLN
NE2
118.9
1
7113
47
GLN
NE2
118.95
1
15134
48
GLN
NE2
119
1
16563
62
GLN
NE2
119.06
1
17953
114
GLN
NE2
119.146
1
11146
93
GLN
NE2
119.166
1
10087
35
GLN
NE2
119.388
1
5159
96
GLN
NE2
119.4
1
5054
41
GLN
NE2
119.4
1
5742
60
GLN
NE2
119.553
.
6603
92
GLN
NE2
119.577
1
17022
83
GLN
NE2
119.679
1
4162
50
GLN
NE2
119.73
1
15355
57
GLN
NE2
119.777
.
15332
57
GLN
NE2
119.777
.
11055
18
GLN
NE2
119.8
1
4827
16
GLN
NE2
119.8
.
4828
16
GLN
NE2
119.85
.
11104
70
GLN
NE2
119.937
1
5558
18
GLN
NE2
120.125
1
17137
65
GLN
NE2
120.4
1
4682
125
GLN
NE2
121
.
10120
62
GLN
NE2
121.096
1
4030
18
GLN
NE2
121.2
1
10149
70
GLN
NE2
121.959
1
11143
70
GLN
NE2
122.054
1
5355
156
GLN
NE2
122.152
1
4101
71
GLN
NE2
122.3
1
18394
73
GLN
NE2
122.349
1
5224
35
GLN
NE2
122.4
1
18651
66
GLN
NE2
122.656
1
5887
101
GLN
NE2
122.8
1
5888
101
GLN
NE2
122.9
1
11390
60
GLN
NE2
123.97
1
7219
161
GLN
NE2
124.302
1
18283
52
GLN
NE2
125.331
1
4881
99
GLN
NE2
125.4
1
5054
44
GLN
NE2
125.6
1
15129
21
GLN
NE2
129.253
1
5044
5
GLN
NE2
133.301
1
15941
152
GLN
NE2
133.88
1
6026
93
GLN
NE2
155
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15603
56
GLN
NE2
100.104
1
16101
52
GLN
NE2
101.3
1
5579
108
GLN
NE2
101.4
.
11256
48
GLN
NE2
101.576
1
5578
108
GLN
NE2
102
.
18424
42
GLN
NE2
102
1
16880
41
GLN
NE2
102.037
1
16885
41
GLN
NE2
102.045
1
11263
48
GLN
NE2
102.08
1
18423
42
GLN
NE2
102.2
1
7002
41
GLN
NE2
102.78
1
18416
62
GLN
NE2
102.8
.
10112
57
GLN
NE2
103.236
1
6631
52
GLN
NE2
103.32
1
11279
48
GLN
NE2
103.4
1
4154
25
GLN
NE2
103.5
1
4493
41
GLN
NE2
103.64
1
4663
41
GLN
NE2
103.9
1
5404
50
GLN
NE2
104.023
1
17906
29
GLN
NE2
104.025
1
17907
29
GLN
NE2
104.025
1
16210
20
GLN
NE2
104.074
1
6159
138
GLN
NE2
104.084
1
17017
41
GLN
NE2
104.1
1
6457
41
GLN
NE2
104.17
.
16228
41
GLN
NE2
104.238
1
16355
51
GLN
NE2
104.3
1
4769
41
GLN
NE2
104.37
1
18364
16
GLN
NE2
104.398
1
16652
58
GLN
NE2
104.4
1
11266
50
GLN
NE2
104.428
1
5333
16
GLN
NE2
104.5
1
5387
41
GLN
NE2
104.5
1
18411
39
GLN
NE2
104.556
1
11028
24
GLN
NE2
104.6
1
4089
50
GLN
NE2
104.6
1
11064
24
GLN
NE2
104.6
1
16371
8
GLN
NE2
104.7
1
17370
52
GLN
NE2
104.7
1
15335
101
GLN
NE2
104.8
1
17176
53
GLN
NE2
104.8
1
5048
129
GLN
NE2
104.8
1
11073
75
GLN
NE2
104.807
1
16021
75
GLN
NE2
104.811
1
10087
48
GLN
NE2
104.914
1
18415
47
GLN
NE2
105.038
1
4087
67
GLN
NE2
105.1
1
11055
47
GLN
NE2
105.1
1
7025
9
GLN
NE2
105.139
1
18351
58
GLN
NE2
105.168
1
10130
48
GLN
NE2
105.197
1
16561
79
GLN
NE2
105.265
1
17767
11
GLN
NE2
105.3
1
4829
14
GLN
NE2
105.311
1
4384
180
GLN
NE2
105.343
1
4593
5
GLN
NE2
105.35
1
6330
65
GLN
NE2
33.9
1
6300
37
GLN
NE2
47.1
1
4224
47
GLN
NE2
64.1
1
4224
118
GLN
NE2
64.5
1
4224
111
GLN
NE2
65
1
16592
51
GLN
NE2
81.255
1
4116
73
GLN
NE2
92.49
1
5048
109
GLN
NE2
97.9
1
17064
109
GLN
NE2
98.3
1
18595
109
GLN
NE2
98.301
1
5319
109
GLN
NE2
98.7
1
18424
46
GLN
NE2
99
1
18423
46
GLN
NE2
99.9
1