BMRB - Biological Magnetic Resonance Bank

ILE CD1 Chemical Shift Outliers

Average chemical shift: 13.489
Standard deviation: 3.308

Low-field shifts outside of three standard deviations from the average
Entry ID	Comp. index ID	Atom ID	Chemical Shift Value	Ambiguity code
4078	9	CD1	39.7	1
4130	24	CD1	40.79
4130	75	CD1	54.89
4131	24	CD1	40.79
4131	75	CD1	54.89
4150	104	CD1	53.696
4150	15	CD1	53.617
4150	23	CD1	54.010
4150	33	CD1	53.878
4150	37	CD1	52.516
4150	38	CD1	52.291
4150	43	CD1	54.026
4150	56	CD1	51.401
4150	83	CD1	52.871
4214	60	CD1	30.209
4330	157	CD1	27.000
4649	79	CD1	78.6400
4649	87	CD1	77.8330
4993	6	CD1	65.809	1
5041	16	CD1	53.949	1
5041	75	CD1	52.052	1
5041	79	CD1	55.551	1
5179	25	CD1	59.780
5179	43	CD1	58.880
5631	45	CD1	44.30	1
5631	67	CD1	48.30	1
5631	75	CD1	47.30	1
5631	96	CD1	47.70	1
6384	24	CD1	43.369	1
6384	29	CD1	47.682	1
6625	109	CD1	67.530	1
6688	176	CD1	25.018	1
6723	69	CD1	35.333
7059	133	CD1	24.992	1
7059	52	CD1	29.595	1
7178	110	CD1	41.0	1
7184	76	CD1	26.000	1
15084	111	CD1	49.200	1
15084	119	CD1	47.900	1
15084	28	CD1	47.860	1
15084	34	CD1	46.960	1
15084	37	CD1	48.000	1
15084	40	CD1	47.600	1
15129	25	CD1	44.596	1
15129	28	CD1	42.581	1
15736	42	CD1	73.739	1
15828	17	CD1	79.337	1
15873	31	CD1	33.400	1
15873	9	CD1	30.173	1
15874	31	CD1	33.400	1
15874	9	CD1	30.173	1
15932	209	CD1	29.951	1
16126	67	CD1	27.314	1
16145	40	CD1	55.781	1
16534	55	CD1	25.231	1
16682	39	CD1	25.3	1
17067	134	CD1	24.5	1
17160	164	CD1	28.6	1
17434	42	CD1	64.866	1
18235	81	CD1	30.6	1
18613	111	CD1	23.523	1
18613	63	CD1	23.595	1
18951	10	CD1	38.275	1
18951	24	CD1	42.295	1
19458	127	CD1	25.2490
19716	2	CD1	40.6225	1
19716	7	CD1	46.0053	1
19904	116	CD1	27.504	1
19945	144	CD1	78.322
19945	18	CD1	78.206
25176	38	CD1	25.14
25382	10	CD1	69.753
25382	12	CD1	70.500
25382	37	CD1	70.721
25382	43	CD1	70.987
25382	50	CD1	70.093
25382	79	CD1	69.946
25382	81	CD1	70.023
25382	83	CD1	69.863
25442	12	CD1	314.600
25442	38	CD1	313.121
26552	103	CD1	46.3587
26552	119	CD1	44.5757
26552	145	CD1	46.6027
26552	179	CD1	46.8197
26552	44	CD1	46.0127
26552	58	CD1	44.6327
26552	79	CD1	46.9057
26552	93	CD1	45.2557
26765	25	CD1	24.551	1
28131	101	CD1	44.40	1
30133	12	CD1	24.603	9
34022	120	CD1	46.6027
34022	154	CD1	46.8197
34022	19	CD1	46.0127
34022	33	CD1	44.6327
34022	54	CD1	46.9057
34022	68	CD1	45.2557
34022	78	CD1	46.3587
34022	94	CD1	44.5757
34042	144	CD1	53.830
34042	151	CD1	56.605
34042	153	CD1	51.725
34042	17	CD1	54.948
34042	26	CD1	55.325
34042	7	CD1	54.584
34042	97	CD1	53.630
34560	14	CD1	23.667	1
36117	17	CD1	32.919
50022	136	CD1	24.204
50022	71	CD1	27.055
50022	98	CD1	41.227
50024	589	CD1	24.063
50309	19	CD1	31.913	1
52193	127	CD1	24.90	1

High-field shifts outside of three standard deviations from the average
Entry ID	Comp. index ID	Atom ID	Chemical Shift Value	Ambiguity code
4431	52	CD1	3.2	1
6348	16	CD1	2.7
51401	9	CD1	1.358