ALA C Chemical Shift Outliers

___________________________________________________
ALA C Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
51513
177.713
.037
187.2
3.891


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
18132
72
ALA
C
.037
1
5618
142
ALA
C
122.8
1
17109
139
ALA
C
13.789
1
16258
83
ALA
C
130.33
1
6730
43
ALA
C
130.414
.
6730
12
ALA
C
131.425
.
6730
92
ALA
C
131.972
.
6730
26
ALA
C
133.014
.
6730
35
ALA
C
134.108
.
17109
17
ALA
C
14.664
1
17109
34
ALA
C
16.174
1
27707
11
ALA
C
16.709
1
17109
131
ALA
C
16.791
1
25554
151
ALA
C
160.742
1
25554
183
ALA
C
160.742
1
19852
151
ALA
C
160.742
1
19854
151
ALA
C
160.742
1
19852
183
ALA
C
160.742
1
6233
111
ALA
C
164.477
1
19854
165
ALA
C
165.723
1
19852
165
ALA
C
165.723
1
25554
165
ALA
C
165.723
1
16984
213
ALA
C
165.751
1
17109
103
ALA
C
17.587
1
27707
73
ALA
C
18.525
1
27707
28
ALA
C
18.858
1
17109
37
ALA
C
19.598
1
27707
3
ALA
C
20.926
1
27707
59
ALA
C
21.593
1
27707
105
ALA
C
22.128
1
27707
37
ALA
C
22.541
1
27707
14
ALA
C
23.032
1
27202
127
ALA
C
25.276
.
4349
13
ALA
C
49.3
1
17914
56
ALA
C
51.63
1
16449
51
ALA
C
56.633
.
7282
13
ALA
C
60.66
1
18439
52
ALA
C
7.864
1
17125
80
ALA
C
71.681
1
18439
34
ALA
C
9.106
1