LEU H Chemical Shift Outliers

___________________________________________________
LEU H Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
46318
8.221
4.077
13.22
0.642


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
15127
43
LEU
H
10.15
1
4332
53
LEU
H
10.15
1
15112
117
LEU
H
10.15
1
18257
213
LEU
H
10.151
1
15795
92
LEU
H
10.159
1
16395
197
LEU
H
10.169
1
6333
10
LEU
H
10.179
1
5999
26
LEU
H
10.18
1
17298
30
LEU
H
10.19
1
17909
141
LEU
H
10.195
1
16317
77
LEU
H
10.195
1
5090
100
LEU
H
10.199
1
19154
12
LEU
H
10.2
1
18721
141
LEU
H
10.20582
.
4821
119
LEU
H
10.206
1
17432
189
LEU
H
10.207
1
17967
14
LEU
H
10.21
1
4367
230
LEU
H
10.21
1
17968
14
LEU
H
10.21
1
7425
48
LEU
H
10.215
1
5959
36
LEU
H
10.22
1
15112
141
LEU
H
10.223
1
4886
93
LEU
H
10.23
1
16451
170
LEU
H
10.24
1
4091
148
LEU
H
10.24
1
11299
27
LEU
H
10.244
1
16440
42
LEU
H
10.244
1
16516
236
LEU
H
10.245
1
18257
213
LEU
H
10.253
1
6090
190
LEU
H
10.262
1
18027
1
LEU
H
10.263
1
16447
170
LEU
H
10.28
1
10115
75
LEU
H
10.286
1
11299
14
LEU
H
10.289
1
15783
7
LEU
H
10.297
.
11218
30
LEU
H
10.299
1
6364
8
LEU
H
10.3
1
15277
66
LEU
H
10.31
1
6359
10
LEU
H
10.315
1
11060
71
LEU
H
10.32
1
4573
72
LEU
H
10.32
1
17171
58
LEU
H
10.327
1
10011
68
LEU
H
10.349
1
4091
31
LEU
H
10.35
1
16464
170
LEU
H
10.36
1
6484
74
LEU
H
10.36
1
15061
9
LEU
H
10.361
1
11285
58
LEU
H
10.382
1
15595
44
LEU
H
10.397
1
4022
147
LEU
H
10.4
1
5606
82
LEU
H
10.4
1
4300
96
LEU
H
10.41
1
6542
50
LEU
H
10.41
1
6875
13
LEU
H
10.42
1
16379
64
LEU
H
10.42
1
16493
6
LEU
H
10.42
1
16494
6
LEU
H
10.42
1
7418
48
LEU
H
10.421
1
4811
53
LEU
H
10.44
1
6502
46
LEU
H
10.44
1
18587
27
LEU
H
10.457
1
5031
98
LEU
H
10.46
1
6199
160
LEU
H
10.47
1
18708
126
LEU
H
10.483
1
18509
126
LEU
H
10.483
1
5090
143
LEU
H
10.484
1
6748
28
LEU
H
10.493
.
6603
102
LEU
H
10.498
1
6551
42
LEU
H
10.5
.
6038
10
LEU
H
10.5
.
6038
10
LEU
H
10.5
.
18779
205
LEU
H
10.502
1
5232
104
LEU
H
10.53
1
434
60
LEU
H
10.53
1
435
59
LEU
H
10.53
1
6038
10
LEU
H
10.54
.
5689
68
LEU
H
10.565
1
6853
215
LEU
H
10.667
1
15088
90
LEU
H
10.67
1
18312
34
LEU
H
10.67
1
6542
290
LEU
H
10.67
1
7423
32
LEU
H
10.708
1
6549
262
LEU
H
10.73
.
18169
5
LEU
H
10.744
1
10108
34
LEU
H
10.862
1
5522
141
LEU
H
10.88
1
11311
138
LEU
H
10.893
1
16311
64
LEU
H
10.919
1
7192
44
LEU
H
10.93
1
17255
29
LEU
H
10.951
1
6644
9
LEU
H
11.01
1
15927
3
LEU
H
11.07
1
5884
9
LEU
H
11.088
1
4309
84
LEU
H
11.1
1
6611
34
LEU
H
11.1
1
16905
9
LEU
H
11.109
1
5022
77
LEU
H
11.11
.
7022
139
LEU
H
11.118
1
7055
106
LEU
H
11.131
1
16362
2
LEU
H
11.19
1
16630
2
LEU
H
11.219
1
6011
78
LEU
H
11.23
1
4304
22
LEU
H
11.24
1
17811
106
LEU
H
11.263
1
15518
270
LEU
H
11.27
1
15606
4
LEU
H
11.327
1
17507
128
LEU
H
11.33
1
15334
34
LEU
H
11.385
1
15120
131
LEU
H
11.4
.
16518
110
LEU
H
11.465
1
17320
25
LEU
H
11.5
1
15396
131
LEU
H
11.51
.
15395
131
LEU
H
11.512
.
15518
203
LEU
H
11.53
1
16629
130
LEU
H
11.534
1
6549
195
LEU
H
11.54
.
4173
136
LEU
H
11.58
1
15209
12
LEU
H
11.68
1
6540
55
LEU
H
11.74
1
4318
77
LEU
H
11.75
1
5012
30
LEU
H
12.13
1
6418
106
LEU
H
12.292
1
7418
32
LEU
H
12.529
1
7425
32
LEU
H
12.573
1
6542
131
LEU
H
13.22
1


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
16912
77
LEU
H
4.077
1
10094
27
LEU
H
4.254
1
11036
30
LEU
H
4.525
1
4703
15
LEU
H
4.89
1
5232
62
LEU
H
4.97
1
15110
18
LEU
H
4.991
1
7024
20
LEU
H
5.049
.
11061
116
LEU
H
5.107
1
5073
20
LEU
H
5.206
.
10141
101
LEU
H
5.223
1
15902
60
LEU
H
5.32
1
5042
19
LEU
H
5.33
1
4852
23
LEU
H
5.38
1
4775
68
LEU
H
5.39
1
16803
19
LEU
H
5.392
1
4914
20
LEU
H
5.41
1
11303
13
LEU
H
5.455
1
11296
13
LEU
H
5.467
1
7224
36
LEU
H
5.47
1
15596
15
LEU
H
5.485
1
18679
41
LEU
H
5.598
1
17729
36
LEU
H
5.622
1
16929
41
LEU
H
5.645
1
15072
81
LEU
H
5.72
1
6564
81
LEU
H
5.72
1
18774
80
LEU
H
5.732
1
18001
69
LEU
H
5.74
1
6726
83
LEU
H
5.747
1
18775
80
LEU
H
5.76
1
7138
224
LEU
H
5.775
.
6535
124
LEU
H
5.775
1
19080
86
LEU
H
5.776
1
5537
52
LEU
H
5.78
1
16372
82
LEU
H
5.83
1
4296
45
LEU
H
5.85
1
7416
39
LEU
H
5.857
1
7424
39
LEU
H
5.899
1
11053
141
LEU
H
5.906
1
17521
186
LEU
H
5.929
1
1324
44
LEU
H
5.94
1
4580
38
LEU
H
5.94
1
16359
70
LEU
H
5.969
1
5355
42
LEU
H
5.969
1
6840
12
LEU
H
5.97
1
1208
44
LEU
H
5.97
1
18680
41
LEU
H
5.975
1
16035
261
LEU
H
5.983
1
4309
76
LEU
H
5.99
1
5658
149
LEU
H
5.99
1
7417
18
LEU
H
5.997
1
6057
112
LEU
H
6
1
15412
71
LEU
H
6.005
1
7186
4
LEU
H
6.01
1
16832
146
LEU
H
6.034
1
16673
53
LEU
H
6.037
1
4718
12
LEU
H
6.04
1
6710
47
LEU
H
6.04
1
11308
19
LEU
H
6.044
1
15448
99
LEU
H
6.08
1
15305
9
LEU
H
6.089
1
4716
113
LEU
H
6.09
1
17006
78
LEU
H
6.107
1
4815
9
LEU
H
6.12
1
15305
9
LEU
H
6.126
1
18574
114
LEU
H
6.136
1
6783
65
LEU
H
6.14
1
6372
65
LEU
H
6.14
1
18575
114
LEU
H
6.151
1
15617
44
LEU
H
6.177
1
15966
43
LEU
H
6.177
1
6695
156
LEU
H
6.18
1
5173
46
LEU
H
6.19
1
7249
87
LEU
H
6.196
1
6617
111
LEU
H
6.199
1
15249
88
LEU
H
6.204
1
17257
64
LEU
H
6.213
1
15700
92
LEU
H
6.214
1
10087
43
LEU
H
6.217
1
6047
98
LEU
H
6.23
1
4987
304
LEU
H
6.23
1
15643
88
LEU
H
6.238
1
15783
77
LEU
H
6.241
.
16031
72
LEU
H
6.242
1
11333
91
LEU
H
6.25
1
6785
39
LEU
H
6.257
1
6051
38
LEU
H
6.257
1
17943
72
LEU
H
6.26
1
4775
175
LEU
H
6.27
1
4519
122
LEU
H
6.277
1
16109
81
LEU
H
6.281
1