TYR CE2 Chemical Shift Outliers

___________________________________________________
TYR CE2 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
7956
117.763
34.1221
154.1
3.413


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
16679
57
TYR
CE2
128.669
1
30421
126
TYR
CE2
128.7
3
19967
59
TYR
CE2
128.752
1
4825
39
TYR
CE2
129.01
1
34229
69
TYR
CE2
129.127
1
34227
69
TYR
CE2
129.127
1
26771
42
TYR
CE2
129.319
1
18966
27
TYR
CE2
129.49
3
4267
139
TYR
CE2
129.8
1
34248
121
TYR
CE2
130.304
1
19967
40
TYR
CE2
130.449
1
34202
92
TYR
CE2
130.459
.
18966
107
TYR
CE2
130.583
3
18435
128
TYR
CE2
130.7
3
19961
46
TYR
CE2
130.84
1
19967
86
TYR
CE2
130.959
1
4952
65
TYR
CE2
131.17
1
18462
79
TYR
CE2
131.419
1
447
98
TYR
CE2
131.6
1
4267
65
TYR
CE2
131.7
1
15813
97
TYR
CE2
132.1
.
15530
27
TYR
CE2
132.21
1
4267
101
TYR
CE2
132.9
1
4405
75
TYR
CE2
133.23
1
4405
84
TYR
CE2
133.31
1
15325
5
TYR
CE2
133.414
.
27284
188
TYR
CE2
133.425
.
25453
104
TYR
CE2
133.595
3
7190
54
TYR
CE2
134.009
1
16449
3
TYR
CE2
134.4
.
18356
162
TYR
CE2
134.4
1
18356
122
TYR
CE2
134.5
1
18152
93
TYR
CE2
135.823
3
4706
139
TYR
CE2
141.104
1
34216
13
TYR
CE2
149.609
.
34216
94
TYR
CE2
150.36
.
5631
72
TYR
CE2
154.1
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
16195
44
TYR
CE2
100.43
3
18152
135
TYR
CE2
106.548
3
19716
19
TYR
CE2
34.1221
2
18235
65
TYR
CE2
42.4
3
17667
48
TYR
CE2
47.3
3
30322
191
TYR
CE2
50.994
1
5363
89
TYR
CE2
51.5
2
5363
19
TYR
CE2
52.53
2
34234
39
TYR
CE2
53.84
.
25382
52
TYR
CE2
61.688
.
6072
61
TYR
CE2
61.9
1
6072
25
TYR
CE2
62.3
1
25382
46
TYR
CE2
62.636
.
5179
23
TYR
CE2
70.12
.
5179
77
TYR
CE2
70.72
.
6247
19
TYR
CE2
72.036
.
34042
45
TYR
CE2
75.755
.
34042
85
TYR
CE2
76.925
.
34042
112
TYR
CE2
76.927
.
34042
25
TYR
CE2
77.375
.
34042
71
TYR
CE2
77.466
.
34042
15
TYR
CE2
77.555
.
34042
65
TYR
CE2
77.915
.
4150
45
TYR
CE2
78.094
.
34042
107
TYR
CE2
78.195
.
4150
93
TYR
CE2
78.257
.
4150
106
TYR
CE2
78.599
.
4150
79
TYR
CE2
78.958
.
16195
108
TYR
CE2
97.436
3
16195
34
TYR
CE2
99.752
3