BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

ILE HB Chemical Shift Outliers

Average chemical shift: 1.783
Standard deviation: 0.397

Low-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
27475HB3.521
34680HB3.451
92380HB3.451
117175HB3.451
171980HB3.371
474467HB3.054
5005104HB2.991
500529HB3.411
502675HB3.41
517242HB2.991
5231157HB3.6511
570653HB38.7001
614244HB3.251
634441HB3.011
684323HB3.871
690137HB2.9771
10023159HB38.051
1564434HB3.1251
1575122HB3.1861
17314104HB3.0791
1790380HB3.270
1963880HB3.386
1995789HB2.9761
2590875HB3.478
2725475HB3.4041
3418584HB2.991

High-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
6648HB.561
13234HB.281
28765HB.31
29299HB-.121
120499HB.561
141399HB01
155197HB.461
1663131HB.441
175299HB-.11
204939HB-.5671
401123HB0.471
403550HB-1.121
405133HB0.572
410063HB0.531
4206125HB0.50001
422253HB0.40
430586HB0.2201
431436HB0.571
437751HB0.341
463353HB0.5
4700101HB0.4081
474439HB0.426
491183HB0.23001
491283HB0.22001
49276HB0.5261
493183HB0.16001
494274HB0.591
505235HB0.0101
514547HB0.551
51487HB0.3611
526353HB0.219
527937HB-2.442
527939HB0.439
527967HB0.17
5299120HB-1.2801
560033HB0.541
569035HB0.121
574161HB0.551
5814117HB0.551
5819115HB0.501
582222HB0.471
5823140HB0.471
595248HB-1.0401
609683HB0.31
6159141HB-0.3901
62537HB-0.3461
625395HB0.0791
637574HB0.4031
639276HB0.501
639376HB0.311
6546123HB0.371
668628HB-1.13
668664HB0.13
672679HB-0.0031
675910HB0.5620
692241HB0.4921
6965115HB0.581
698068HB0.0621
706184HB0.4900
715085HB0.441
721136HB0.041
729158HB0.471
729736HB0.5671
1005632HB0.2971
1006961HB0.2741
10115104HB0.3281
1021421HB0.5821
10251104HB-0.2491
1025994HB0.5241
1031983HB-0.1531
1032131HB0.2191
1032571HB-0.1971
1032779HB0.4881
1033169HB0.4451
1100169HB0.201
11152106HB0.3751
1121242HB-0.0581
1122356HB0.5131
1123668HB0.1191
1131620HB0.4991
1142825HB0.431
11570130HB0.04101
1159143HB0.1911
1159243HB0.0311
1521786HB0.361
15315105HB0.4471
1533569HB0.4921
1551282HB0.0441
15595142HB0.5211
1561041HB-0.191
15627118HB0.2211
1576353HB0.521
1580467HB0.4931
15927161HB0.0441
15928103HB0.4121
160634HB-0.06901
1609722HB0.2381
1610383HB0.3171
1617312HB-0.1481
1617398HB0.2881
1630686HB0.231
1630786HB0.221
16362160HB0.0611
163767HB0.3011
16439105HB0.3591
16630160HB0.0701
16632138HB0.3031
16632138HB0.3081
16811130HB0.03701
1685715HB0.4301
1688125HB0.061
1706753HB0.521
1712765HB0.0641
1720646HB0.1751
1727771HB0.4121
173818HB0.3881
17404157HB0.001
174204HB0.0131
17481105HB0.1441
175768HB-0.3641
1757696HB0.0541
1757842HB0.5361
1757942HB0.5541
175828HB-0.3611
1758296HB0.0431
176113HB0.231
1768078HB0.5411
178093HB0.211
1786478HB0.3401
17890116HB0.4671
17902116HB0.4731
1837528HB0.331
1838765HB0.4321
184425HB0.4271
1849820HB0.5011
18526101HB-0.4621
18613122HB0.1321
18632102HB-0.2321
189534HB-0.18001
19001109HB0.3159
1901262HB0.2601
1902733HB0.4461
19045106HB0.3791
1911765HB-0.3111
19169140HB-0.5861
1920418HB0.376
1928748HB0.4881
1941745HB0.2661
1943311HB0.3251
19835246HB0.5231
19836246HB0.5841
19837246HB0.5521
1989388HB0.1511
1994536HB0.236
19952203HB0.1261
2508368HB0.068
2518817HB0.4511
25194102HB0.5711
2534381HB0.3891
2538557HB0.50041
2566376HB0.190
2580217HB0.0501
259933HB-0.3971
2603174HB0.5631
2651893HB0.5061
2678018HB0.3901
2703262HB0.50501
274397HB0.1981
30094124HB0.5551
30186101HB0.0071
3042399HB0.3291
3053262HB0.44601
3076568HB0.3191
34121223HB0.4811
3420129HB0.5091
342016HB-0.0281
3421839HB0.4641
3421939HB0.4211
34341106HB0.2371
343625HB0.4081
3616156HB0.50001
50181102HB0.5671
50182102HB0.5671
50183102HB0.5671
50269131HB0.471
5026995HB0.401
50410120HB0.4561
5041223HB0.57711