PHE CE1 Chemical Shift Outliers

___________________________________________________
PHE CE1 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
2160
130.605
114.754
135.6
1.547


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
4248
10
PHE
CE1
135.6
3


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
6536
19
PHE
CE1
114.754
1
5678
147
PHE
CE1
116.5
1
5678
148
PHE
CE1
116.7
1
5678
62
PHE
CE1
116.9
1
5678
107
PHE
CE1
116.9
1
5678
119
PHE
CE1
117.1
1
6759
103
PHE
CE1
117.338
.
15003
25
PHE
CE1
117.895
1
6857
10
PHE
CE1
118.034
1
6857
9
PHE
CE1
118.247
1
5131
14
PHE
CE1
118.72
3
6275
64
PHE
CE1
121.3
1
6391
87
PHE
CE1
121.49
3
5798
42
PHE
CE1
124.2
2
6960
85
PHE
CE1
124.817
.
6780
27
PHE
CE1
125.003
1
15404
9
PHE
CE1
125.033
1
6073
80
PHE
CE1
125.12
.
6780
92
PHE
CE1
125.402
1
4670
82
PHE
CE1
125.5
.
15404
19
PHE
CE1
125.623
1
15200
107
PHE
CE1
125.7
1