BMRB - Biological Magnetic Resonance Bank

ASP HB3 Chemical Shift Outliers

Average chemical shift: 2.666
Standard deviation: 0.499

Low-field shifts outside of three standard deviations from the average
Entry ID	Comp. index ID	Atom ID	Chemical Shift Value	Ambiguity code
505	81	HB3	35.6	2
811	83	HB3	36	2
812	83	HB3	36	1
813	83	HB3	36.3	1
814	83	HB3	36.5	1
1486	83	HB3	36	2
1487	83	HB3	37.2	1
4528	54	HB3	4.22	2
4782	80	HB3	4.47	2
4837	98	HB3	4.92	1
4890	2	HB3	4.58	1
6686	25	HB3	4.18
6686	65	HB3	10.08
15385	75	HB3	4.231	2
16850	60	HB3	6.931	2
17310	8	HB3	4.203	2
19117	123	HB3	4.320	2
25477	2	HB3	4.489	2
27987	2	HB3	4.521	2
28099	87	HB3	5.147
34460	79	HB3	4.664

High-field shifts outside of three standard deviations from the average
Entry ID	Comp. index ID	Atom ID	Chemical Shift Value	Ambiguity code
2384	87	HB3	1.14	2
4064	98	HB3	0.58	2
4173	99	HB3	0.65	2
4211	2	HB3	0.92	1
4229	35	HB3	0.982	2
4229	35	HB3	1.032	2
4231	35	HB3	0.982
4231	35	HB3	1.032
4268	35	HB3	0.95	2
4291	71	HB3	0.745	1
4679	128	HB3	1.1148
4679	99	HB3	0.9848
4700	63	HB3	1.163	2
4722	100	HB3	0.99	2
4722	30	HB3	0.99	2
5156	33	HB3	0.77	2
5163	21	HB3	1.105
5239	32	HB3	-1.46	2
6086	27	HB3	0.602	2
6120	52	HB3	0.67	2
6132	12	HB3	1.08	2
6686	21	HB3	0.48
6688	25	HB3	1.1	1
6854	34	HB3	1.093	2
6890	29	HB3	0.59	2
7192	38	HB3	0.84	2
10080	90	HB3	1.080	2
10214	32	HB3	0.091	2
10215	32	HB3	0.172	2
11040	37	HB3	0.722	2
11134	36	HB3	1.090	2
11405	41	HB3	1.106	2
11408	41	HB3	1.100	2
12021	11	HB3	0.097
15016	37	HB3	0.019
15351	36	HB3	1.112	2
15361	94	HB3	0.993	2
15369	31	HB3	0.987	2
15404	58	HB3	0.798	2
15407	57	HB3	0.472	2
15510	37	HB3	1.11	2
15510	37	HB3	1.12	2
15663	127	HB3	0.78	1
15685	59	HB3	0.990	2
15710	38	HB3	0.717	2
15746	82	HB3	0.733	2
16141	32	HB3	0.97
16250	76	HB3	1.018	2
16271	94	HB3	0.409	9
16307	48	HB3	1.13	2
16574	31	HB3	-0.126125	1
16575	31	HB3	-0.232	1
16643	57	HB3	0.8220	2
16648	92	HB3	1.025	2
16679	185	HB3	0.890	2
17158	53	HB3	0.944	2
17447	99	HB3	1.129	2
17518	64	HB3	1.107	1
17519	64	HB3	1.118	1
17529	26	HB3	-0.362	2
17543	22	HB3	-0.226	2
17715	29	HB3	0.350	1
17755	19	HB3	1.0860	2
18053	30	HB3	0.789	2
18112	138	HB3	0.157	2
18167	130	HB3	0.882	2
18292	26	HB3	0.172	2
18415	66	HB3	0.568	2
18459	78	HB3	1.001	2
18500	21	HB3	-0.226	2
18502	21	HB3	-0.182	2
18717	88	HB3	0.974	2
18948	9	HB3	1.131
18953	109	HB3	0.0000	2
19047	90	HB3	0.388	1
19047	90	HB3	0.400	1
19048	90	HB3	0.507	1
19048	90	HB3	0.527	1
19132	5	HB3	1.038	2
19449	39	HB3	1.160
19609	20	HB3	1.146	2
25000	26	HB3	-0.039	2
25349	26	HB3	0.263	2
25754	9	HB3	0.849	2
25865	24	HB3	0.0260	2
25866	24	HB3	0.2930	2
27078	169	HB3	1.09	2
30011	28	HB3	1.024	2
30317	27	HB3	0.958
30684	56	HB3	0.958	2
30857	25	HB3	0.105
30858	46	HB3	0.097
31062	26	HB3	0.818	2
31103	13	HB3	1.07	2
34227	24	HB3	0.942	2
34229	24	HB3	0.942	2
34407	93	HB3	0.057	2
52100	70	HB3	0.920