LYS HD3 Chemical Shift Outliers

___________________________________________________
LYS HD3 Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
9147
1.601
-1.016
3.61
0.236


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
4010
49
LYS
HD3
2.32
1
4285
26
LYS
HD3
2.35
1
4001
29
LYS
HD3
2.35
1
7322
96
LYS
HD3
2.426
1
6995
155
LYS
HD3
2.43
2
6050
18
LYS
HD3
2.437
1
4159
23
LYS
HD3
2.458
1
6680
8
LYS
HD3
2.481
1
2282
8
LYS
HD3
2.53
2
6147
88
LYS
HD3
2.573
1
2282
7
LYS
HD3
2.58
2
5624
148
LYS
HD3
2.61
4
5506
101
LYS
HD3
2.67
1
1991
50
LYS
HD3
2.7
1
4651
21
LYS
HD3
2.73
.
4651
6
LYS
HD3
2.76
.
4559
49
LYS
HD3
2.81
.
5866
3
LYS
HD3
2.83
1
5235
56
LYS
HD3
2.83
1
48
46
LYS
HD3
2.85
1
5328
84
LYS
HD3
2.858
1
4334
75
LYS
HD3
2.86
1
7286
72
LYS
HD3
2.895
2
4179
5
LYS
HD3
2.93
1
4678
7
LYS
HD3
2.95
.
5094
57
LYS
HD3
2.96
.
1495
6
LYS
HD3
2.96
1
5094
35
LYS
HD3
2.97
.
4179
10
LYS
HD3
2.97
1
1495
63
LYS
HD3
2.98
1
5952
70
LYS
HD3
3.02
1
1495
69
LYS
HD3
3.02
1
5804
14
LYS
HD3
3.02
2
1495
16
LYS
HD3
3.02
1
6415
14
LYS
HD3
3.03
2
5068
14
LYS
HD3
3.03
2
5662
33
LYS
HD3
3.03
.
5803
14
LYS
HD3
3.03
2
4010
97
LYS
HD3
3.05
1
1495
37
LYS
HD3
3.07
1
5094
7
LYS
HD3
3.07
.
6883
172
LYS
HD3
3.089
2
6576
38
LYS
HD3
3.1
1
6576
38
LYS
HD3
3.1
1
2281
63
LYS
HD3
3.18
1
5094
56
LYS
HD3
3.23
.
758
28
LYS
HD3
3.61
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
5902
29
LYS
HD3
-.007
2
5009
98
LYS
HD3
-.014
.
5963
18
LYS
HD3
-.102
1
5991
79
LYS
HD3
-.148
2
5844
65
LYS
HD3
-1.016
2
4884
61
LYS
HD3
.03
2
5094
87
LYS
HD3
.04
.
6731
60
LYS
HD3
.102
2
5349
56
LYS
HD3
.12
2
6603
134
LYS
HD3
.125
2
7203
26
LYS
HD3
.141
.
4121
54
LYS
HD3
.28
2
4186
53
LYS
HD3
.29
2
5578
40
LYS
HD3
.3
.
7123
38
LYS
HD3
.306
1
5319
41
LYS
HD3
.31
1
4424
48
LYS
HD3
.32
1
5579
40
LYS
HD3
.34
.
4455
9
LYS
HD3
.35
2
7242
8
LYS
HD3
.357
2
15002
68
LYS
HD3
.357
.
5539
49
LYS
HD3
.37
1
6001
37
LYS
HD3
.37
2
4080
23
LYS
HD3
.38
2
5048
41
LYS
HD3
.38
1
4639
50
LYS
HD3
.389
1
5222
60
LYS
HD3
.4
4
4081
133
LYS
HD3
.4
2
7025
46
LYS
HD3
.407
2
4574
44
LYS
HD3
.43
1
15553
92
LYS
HD3
.44
1
7063
25
LYS
HD3
.446
2
1875
133
LYS
HD3
.46
1
5667
40
LYS
HD3
.465
.
4969
98
LYS
HD3
.48
2
4681
41
LYS
HD3
.49
.
6693
116
LYS
HD3
.496
2
15020
78
LYS
HD3
.498
2
15382
41
LYS
HD3
.5
.
5565
63
LYS
HD3
.51
2
6525
7
LYS
HD3
.515
4
4572
68
LYS
HD3
.52
2
7036
54
LYS
HD3
.52
2
7194
15
LYS
HD3
.522
2
4681
3
LYS
HD3
.53
.
7281
13
LYS
HD3
.53
2
4670
117
LYS
HD3
.58
.
15020
25
LYS
HD3
.581
2
5388
9
LYS
HD3
.59
2
5105
23
LYS
HD3
.6
2
5803
34
LYS
HD3
.61
2
5807
97
LYS
HD3
.61
2
6759
132
LYS
HD3
.615
.
15603
28
LYS
HD3
.617
2
5068
34
LYS
HD3
.62
2
5804
34
LYS
HD3
.63
2
6312
108
LYS
HD3
.639
2
5554
13
LYS
HD3
.64
2
4682
3
LYS
HD3
.65
.
4079
56
LYS
HD3
.66
2
4893
83
LYS
HD3
.66
2
6073
27
LYS
HD3
.66
.
6799
69
LYS
HD3
.66
2
15322
74
LYS
HD3
.668
2
4878
67
LYS
HD3
.67
2
5950
36
LYS
HD3
.67
1
6303
39
LYS
HD3
.67
1
4305
90
LYS
HD3
.69
1
4682
41
LYS
HD3
.69
.
7304
63
LYS
HD3
.696
2
5499
14
LYS
HD3
.698
.
4858
29
LYS
HD3
.7
2
4562
33
LYS
HD3
.7
2
4317
62
LYS
HD3
.7
1
6469
49
LYS
HD3
.702
2
6902
16
LYS
HD3
.72
1
4424
40
LYS
HD3
.72
1
7243
66
LYS
HD3
.722
2
6159
104
LYS
HD3
.728
2
5060
92
LYS
HD3
.73
2
6854
10
LYS
HD3
.73
2
15536
54
LYS
HD3
.73
2
4972
45
LYS
HD3
.73
2
5615
70
LYS
HD3
.73
2
5991
104
LYS
HD3
.738
2
11032
79
LYS
HD3
.738
2
4424
39
LYS
HD3
.74
1
7105
135
LYS
HD3
.74
2
6222
13
LYS
HD3
.74
2
6302
43
LYS
HD3
.74
1
15595
135
LYS
HD3
.747
2
7105
51
LYS
HD3
.748
2
15085
65
LYS
HD3
.751
2
6999
3
LYS
HD3
.752
1
6322
35
LYS
HD3
.758
1
4860
104
LYS
HD3
.76
2
5128
24
LYS
HD3
.76
4
6615
20
LYS
HD3
.76
1
11033
81
LYS
HD3
.766
2
15074
45
LYS
HD3
.768
2
4149
79
LYS
HD3
.77
2
5707
25
LYS
HD3
.77
2
15061
80
LYS
HD3
.779
2
4901
53
LYS
HD3
.78
1
6872
19
LYS
HD3
.784
.
7095
28
LYS
HD3
.788
1
4472
7
LYS
HD3
.8
2
6159
187
LYS
HD3
.805
2
6003
66
LYS
HD3
.807
2
6096
87
LYS
HD3
.809
2
6128
44
LYS
HD3
.81
2
5251
46
LYS
HD3
.81
1
6169
5
LYS
HD3
.811
2
7310
154
LYS
HD3
.814
2
5241
93
LYS
HD3
.82
1
5036
51
LYS
HD3
.82
.
4010
64
LYS
HD3
.82
1
6705
97
LYS
HD3
.821
.
6226
57
LYS
HD3
.83
1
4083
6
LYS
HD3
.83
2
5628
21
LYS
HD3
.83
2
5309
52
LYS
HD3
.83
2
6850
48
LYS
HD3
.835
2
4010
24
LYS
HD3
.84
1
6443
126
LYS
HD3
.84
1
1876
28
LYS
HD3
.84
1
15627
64
LYS
HD3
.846
2
5128
48
LYS
HD3
.85
4
4160
54
LYS
HD3
.85
2
6004
152
LYS
HD3
.85
1
6590
45
LYS
HD3
.85
2
7019
20
LYS
HD3
.855
2
6615
91
LYS
HD3
.86
1
4782
102
LYS
HD3
.86
2
6465
113
LYS
HD3
.864
2
6635
101
LYS
HD3
.867
1
480
9
LYS
HD3
.87
1
5978
26
LYS
HD3
.87
1
481
9
LYS
HD3
.87
1
6563
50
LYS
HD3
.874
2
6198
63
LYS
HD3
.88
2
4828
88
LYS
HD3
.88
.
7097
11
LYS
HD3
.88
.
6254
28
LYS
HD3
.881
2
6254
45
LYS
HD3
.881
2
4145
32
LYS
HD3
.882
2
6052
96
LYS
HD3
.89
2