LEU H Chemical Shift Outliers

___________________________________________________
LEU H Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
61095
8.225
.006
13.22
0.663


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
5959
36
LEU
H
10.22
1
5368
24
LEU
H
10.22
1
15112
141
LEU
H
10.223
1
6336
100
LEU
H
10.23
1
6453
11
LEU
H
10.23
1
4886
93
LEU
H
10.23
1
16451
170
LEU
H
10.24
1
6330
100
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
4881
93
LEU
H
10.26
1
6090
190
LEU
H
10.262
1
18027
1
LEU
H
10.263
1
11306
68
LEU
H
10.267
1
16447
170
LEU
H
10.28
1
6546
142
LEU
H
10.28
1
10115
75
LEU
H
10.286
1
11299
14
LEU
H
10.289
1
15960
7
LEU
H
10.29
.
6697
31
LEU
H
10.296
1
17674
7
LEU
H
10.297
.
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
15584
63
LEU
H
10.311
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
16024
64
LEU
H
10.338
1
10011
68
LEU
H
10.349
1
4091
31
LEU
H
10.35
1
6782
145
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
5779
11
LEU
H
10.376
1
11285
58
LEU
H
10.382
1
16502
5
LEU
H
10.39
1
15595
44
LEU
H
10.397
1
4022
147
LEU
H
10.4
1
5606
82
LEU
H
10.4
1
16337
136
LEU
H
10.4
1
4300
96
LEU
H
10.41
1
6542
50
LEU
H
10.41
1
7264
166
LEU
H
10.413
1
4712
6
LEU
H
10.42
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
17421
20
LEU
H
10.437
1
4811
53
LEU
H
10.44
1
6502
46
LEU
H
10.44
1
7265
166
LEU
H
10.441
1
17902
38
LEU
H
10.448
1
17890
38
LEU
H
10.455
1
18587
27
LEU
H
10.457
1
5031
98
LEU
H
10.46
1
6199
160
LEU
H
10.47
1
447
66
LEU
H
10.48
1
6821
126
LEU
H
10.482
.
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
.
6847
102
LEU
H
10.498
1
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
4202
126
LEU
H
10.53
1
6038
10
LEU
H
10.54
.
4565
82
LEU
H
10.56
1
18263
55
LEU
H
10.56
1
5689
68
LEU
H
10.565
1
4706
148
LEU
H
10.582
1
16805
55
LEU
H
10.625
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
6697
69
LEU
H
10.697
1
18032
55
LEU
H
10.7
1
17421
123
LEU
H
10.702
1
7423
32
LEU
H
10.708
1
6313
68
LEU
H
10.72
1
6549
262
LEU
H
10.73
.
10082
78
LEU
H
10.744
1
18169
5
LEU
H
10.744
1
17515
16
LEU
H
10.764
1
15594
28
LEU
H
10.81
1
6312
133
LEU
H
10.822
1
11175
151
LEU
H
10.842
1
10108
34
LEU
H
10.862
1
6685
185
LEU
H
10.88
1
5522
141
LEU
H
10.88
1
6295
79
LEU
H
10.881
1
11311
138
LEU
H
10.893
1
17975
267
LEU
H
10.9149
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
4881
65
LEU
H
11.15
1
15597
109
LEU
H
11.166
1
16441
42
LEU
H
11.189
1
16362
2
LEU
H
11.19
1
16507
23
LEU
H
11.192
1
16630
2
LEU
H
11.219
1
5631
23
LEU
H
11.22
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
15598
109
LEU
H
11.394
1
15120
131
LEU
H
11.4
.
4565
137
LEU
H
11.45
1
16518
110
LEU
H
11.465
1
5231
136
LEU
H
11.47
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
.
17976
200
LEU
H
11.5423
1
17975
200
LEU
H
11.5426
1
6697
32
LEU
H
11.551
1
17977
200
LEU
H
11.5543
1
15717
77
LEU
H
11.568
.
17546
55
LEU
H
11.568
.
5263
42
LEU
H
11.57
.
4173
136
LEU
H
11.58
1
4668
135
LEU
H
11.594
1
4364
129
LEU
H
11.66
1
17942
12
LEU
H
11.668
1
6697
49
LEU
H
11.67
1
15209
12
LEU
H
11.68
1
6540
55
LEU
H
11.74
1
4318
77
LEU
H
11.75
1
16443
36
LEU
H
11.83
1
15063
47
LEU
H
12.003
1
5012
30
LEU
H
12.13
1
4679
136
LEU
H
12.17
.
4064
135
LEU
H
12.26
1
6418
106
LEU
H
12.292
1
7418
32
LEU
H
12.529
1
16376
61
LEU
H
12.56
1
7425
32
LEU
H
12.573
1
6697
28
LEU
H
12.923
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
18132
58
LEU
H
.006
1
18132
54
LEU
H
.01
1
7016
41
LEU
H
.02
.
7016
30
LEU
H
.02
.
7016
37
LEU
H
.02
.
4854
153
LEU
H
.09
.
1162
19
LEU
H
2.15
1
17415
357
LEU
H
2.74
1
6249
212
LEU
H
3.01
1
16134
106
LEU
H
3.012
1
5081
76
LEU
H
3.335
1
6249
273
LEU
H
3.73
1
5897
81
LEU
H
3.8807
1
5220
7
LEU
H
3.985
1
16635
77
LEU
H
4.067
1
16912
77
LEU
H
4.077
1
6249
88
LEU
H
4.25
1
10094
27
LEU
H
4.254
1
4114
87
LEU
H
4.3
1
6966
118
LEU
H
4.35
1
6249
207
LEU
H
4.38
1
6249
255
LEU
H
4.44
1
11036
30
LEU
H
4.525
1
6967
118
LEU
H
4.69
1
6249
272
LEU
H
4.69
1
6249
258
LEU
H
4.72
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
.
6249
165
LEU
H
5.08
1
11061
116
LEU
H
5.107
1
10031
62
LEU
H
5.11
1
5073
20
LEU
H
5.206
.
10141
101
LEU
H
5.223
1
15622
30
LEU
H
5.227
1
6832
152
LEU
H
5.23
1
15902
60
LEU
H
5.32
1
5042
19
LEU
H
5.33
1
6935
152
LEU
H
5.37
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
6249
221
LEU
H
5.46
1
11296
13
LEU
H
5.467
1
7224
36
LEU
H
5.47
1
15596
15
LEU
H
5.485
1
6249
179
LEU
H
5.53
1
6249
94
LEU
H
5.54
1
4132
89
LEU
H
5.56
1
4127
124
LEU
H
5.59
1
18679
41
LEU
H
5.598
1
17236
74
LEU
H
5.61
1
17729
36
LEU
H
5.622
1
17415
355
LEU
H
5.63
1
16929
41
LEU
H
5.645
1
6249
189
LEU
H
5.66
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
6249
103
LEU
H
5.8
1
16372
82
LEU
H
5.83
1
4296
45
LEU
H
5.85
1
7416
39
LEU
H
5.857
1
17251
141
LEU
H
5.863
1
6249
167
LEU
H
5.87
1
7424
39
LEU
H
5.899
1
4895
40
LEU
H
5.9
.
11053
141
LEU
H
5.906
1
17521
186
LEU
H
5.929
1
6249
162
LEU
H
5.93
1
1324
44
LEU
H
5.94
1
4580
38
LEU
H
5.94
1
294
44
LEU
H
5.96
1
16359
70
LEU
H
5.969
1
5355
42
LEU
H
5.969
1
6840
12
LEU
H
5.97
1
6249
190
LEU
H
5.97
1
1208
44
LEU
H
5.97
1
18680
41
LEU
H
5.975
1
295
44
LEU
H
5.98
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
5091
46
LEU
H
6.01
1
7186
4
LEU
H
6.01
1
4130
46
LEU
H
6.01
.
16276
104
LEU
H
6.014
1
4809
44
LEU
H
6.03
1
4803
44
LEU
H
6.03
1
4804
44
LEU
H
6.03
1
4808
44
LEU
H
6.03
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
4131
46
LEU
H
6.13
.
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
6249
90
LEU
H
6.16
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
15960
77
LEU
H
6.23
.
4987
304
LEU
H
6.23
1
6935
183
LEU
H
6.23
1