BMRB - Biological Magnetic Resonance Bank

MET HB2 Chemical Shift Outliers

Average chemical shift: 2.03
Standard deviation: 0.321

Low-field shifts outside of three standard deviations from the average
Entry ID	Comp. index ID	Atom ID	Chemical Shift Value	Ambiguity code
274	80	HB2	12.85	1
285	80	HB2	12.85	1
317	80	HB2	3	2
346	85	HB2	12.94	1
499	80	HB2	6.6	2
500	81	HB2	6.04	2
923	85	HB2	12.94	1
1171	80	HB2	12.28	1
1719	85	HB2	12.4	1
1736	80	HB2	6.7	2
4291	11	HB2	3.038	1
4397	1	HB2	4.07	1
4777	78	HB2	11.26	1
4935	78	HB2	3.00	2
5018	60	HB2	3.1600
5269	66	HB2	3.97	2
5333	11	HB2	3.08	1
5504	88	HB2	3.873
5677	47	HB2	33.750	2
5770	14	HB2	3.01	2
5770	14	HB2	3.11	1
5973	37	HB2	3.193
6946	132	HB2	3.27	2
6995	132	HB2	3.17	2
7122	158	HB2	3.20	2
10029	72	HB2	3.380	2
10093	76	HB2	2.995	2
10264	143	HB2	3.003	2
11298	22	HB2	3.230	2
15057	91	HB2	3.202	1
15339	1	HB2	3.049	2
15369	164	HB2	3.166	2
15791	1	HB2	3.172	2
15826	227	HB2	3.106	2
15847	1	HB2	3.086	2
15850	1	HB2	3.136	2
15945	51	HB2	3.2190	2
16161	37	HB2	3.266	2
16306	65	HB2	3.66	1
16307	65	HB2	3.45	1
16555	42	HB2	3.003	2
16711	43	HB2	3.237	2
17028	57	HB2	3.188	1
17092	11	HB2	3.072	1
17144	79	HB2	10.38	2
17161	1	HB2	3.06	1
17226	77	HB2	3.698	2
17272	18	HB2	3.259	2
17273	18	HB2	3.235	2
17299	7	HB2	3.124	2
17300	7	HB2	3.145	2
17693	10	HB2	4.580	2
18434	57	HB2	3.160	2
18439	110	HB2	3.0700	2
18455	57	HB2	3.114	2
18606	70	HB2	3.141
18642	36	HB2	3.0560	2
18990	109	HB2	3.0380	2
19377	158	HB2	3.04	2
19417	75	HB2	3.174	2
19601	26	HB2	3.240	2
19717	105	HB2	4.07	1
19738	110	HB2	3.0700	2
25588	109	HB2	3.498	2
26509	35	HB2	2.995	1
26986	39	HB2	3.013	2
27048	15	HB2	3.005	2
27254	80	HB2	3.452	1
27284	2	HB2	2.995
27692	125	HB2	3.835	2
27869	48	HB2	3.787	2
28121	1	HB2	3.914	1
30208	5	HB2	4.557	1
31039	127	HB2	3.3590	1
50509	3	HB2	3.012	1
50789	34	HB2	3.070	2
51800	45	HB2	2.995	1
51811	25	HB2	3.053	2
52009	72	HB2	3.223

High-field shifts outside of three standard deviations from the average
Entry ID	Comp. index ID	Atom ID	Chemical Shift Value	Ambiguity code
131	85	HB2	-.22	1
286	80	HB2	-.2	1
337	56	HB2	0.3	2
345	85	HB2	-.18	1
376	97	HB2	.17	2
385	29	HB2	.98	1
545	80	HB2	.19	2
569	105	HB2	.91	2
759	61	HB2	.89	2
922	85	HB2	.18	2
1093	105	HB2	.48	2
1379	57	HB2	.99	2
1379	97	HB2	.16	2
1734	61	HB2	.83	2
1770	105	HB2	-.92	1
1771	105	HB2	-.97	1
2030	48	HB2	.88	2
2366	80	HB2	.19	2
2367	80	HB2	.4	2
2368	80	HB2	-2.36	1
2858	105	HB2	-.91	1
4033	72	HB2	0.86	1
4034	72	HB2	0.99	2
4039	87	HB2	1.05	1
4150	86	HB2	0.561
4153	71	HB2	0.63	2
4155	62	HB2	0.47	2
4184	69	HB2	0.74	1
4189	80	HB2	-0.22	1
4208	57	HB2	-0.78	1
4234	18	HB2	1.0279	2
4284	72	HB2	1.000	1
4288	73	HB2	0.78	1
4291	69	HB2	0.251	1
4296	5	HB2	1.06	1
4370	30	HB2	0.93	2
4379	11	HB2	0.93	2
4402	109	HB2	0.89	2
4407	29	HB2	1.05	1
4434	42	HB2	0.90	2
4471	78	HB2	-2.51	1
4562	105	HB2	-0.99	2
4563	11	HB2	0.97	2
4564	140	HB2	0.93	2
4578	61	HB2	-2.81	1
4620	11	HB2	0.94	2
4736	11	HB2	0.93	2
4800	106	HB2	-1.87	2
4800	106	HB2	-1.92	2
4801	106	HB2	-9.13	2
4801	106	HB2	-9.84	2
4943	105	HB2	0.43	2
4959	44	HB2	1.052	2
4978	146	HB2	0.75	4
4980	30	HB2	0.81	1
5055	73	HB2	1.046	2
5068	106	HB2	-1.05	2
5069	106	HB2	-1.02	2
5086	59	HB2	-0.61	2
5088	60	HB2	-0.61	2
5172	50	HB2	-0.30	2
5224	37	HB2	0.76	2
5304	56	HB2	-0.88	1
5315	69	HB2	0.303	1
5319	50	HB2	1.06	1
5333	69	HB2	-0.26	2
5348	3	HB2	0.91	2
5363	72	HB2	0.690	1
5372	80	HB2	-2.61	1
5378	11	HB2	1.05	2
5389	70	HB2	1.00	2
5406	80	HB2	-0.225	2
5407	65	HB2	1.037
5480	72	HB2	0.970	2
5579	49	HB2	1.05
5597	50	HB2	-0.59	1
5625	11	HB2	0.62	2
5625	69	HB2	0.17	2
5713	11	HB2	0.88	2
5803	106	HB2	-1.03	2
5804	106	HB2	-1.04	2
5827	80	HB2	-2.56	4
5975	81	HB2	0.910	2
5975	81	HB2	0.919	2
5981	37	HB2	0.664	2
6000	14	HB2	0.70	1
6033	59	HB2	-0.76000	1
6208	39	HB2	0.88	2
6248	86	HB2	1.03	1
6279	29	HB2	0.863	2
6365	38	HB2	0.77	2
6375	51	HB2	0.907	2
6378	11	HB2	0.96	2
6380	11	HB2	1.00	2
6381	11	HB2	0.92	2
6383	11	HB2	1.00	2
6403	11	HB2	1.06	2
6631	47	HB2	0.882	2
6634	11	HB2	0.69	2
6634	69	HB2	0.20	2
6686	73	HB2	1.04
6883	100	HB2	1.043	2
6966	71	HB2	0.13	9
6980	113	HB2	0.691	2
6995	93	HB2	0.97	2
7025	92	HB2	1.03	2
7054	120	HB2	0.75	2
7112	56	HB2	0.530	2
7144	105	HB2	-0.96
7159	105	HB2	-1.02
7160	105	HB2	-1.05
7218	78	HB2	0.430
7220	134	HB2	0.820	2
7249	72	HB2	0.630	2
7296	61	HB2	-2.762	2
7381	78	HB2	0.659	2
10035	20	HB2	0.158	2
10113	27	HB2	1.043	2
10120	64	HB2	0.803	2
10213	23	HB2	0.700	2
10282	22	HB2	0.945	2
10293	22	HB2	0.905	2
10312	14	HB2	-0.918	2
10335	84	HB2	0.459	2
11097	96	HB2	0.950	2
11142	89	HB2	0.607	2
11209	56	HB2	1.059	2
11212	77	HB2	0.792	2
11256	67	HB2	0.647	2
11339	61	HB2	0.918	2
11346	30	HB2	0.663	2
11508	6	HB2	0.212	2
11532	66	HB2	0.515	2
11570	64	HB2	0.3350	1
15126	79	HB2	0.210	2
15230	36	HB2	0.182	2
15371	20	HB2	0.878	2
15385	81	HB2	1.030	2
15388	81	HB2	1.030	2
15400	81	HB2	1.060	2
15401	78	HB2	0.659	2
15402	78	HB2	0.687	2
15507	93	HB2	1.041	2
15525	38	HB2	-0.086	2
15554	74	HB2	0.936	2
15597	113	HB2	0.945	2
15598	113	HB2	0.945	2
15610	26	HB2	0.87	2
15763	63	HB2	0.44	2
15765	45	HB2	0.380	1
15785	87	HB2	1.058
15803	38	HB2	-0.086	2
15824	11	HB2	1.045	2
15843	3	HB2	0.816	1
15845	11	HB2	0.907	2
15914	46	HB2	0.502	2
15938	3	HB2	1.047	2
15952	87	HB2	1.058
15988	67	HB2	0.833	2
16061	38	HB2	0.945	2
16082	9	HB2	1.043	2
16183	11	HB2	0.912	2
16184	11	HB2	1.002	2
16216	74	HB2	0.84	2
16305	84	HB2	0.078	2
16328	39	HB2	1.02	1
16389	12	HB2	0.294	2
16572	39	HB2	0.857	2
16630	161	HB2	0.692	2
16720	11	HB2	0.903	2
16722	10	HB2	0.931	2
16723	10	HB2	0.904	2
16779	86	HB2	0.532
16789	103	HB2	0.960	2
16811	64	HB2	0.3050	2
17074	8	HB2	0.958	2
17076	8	HB2	1.032	2
17081	11	HB2	0.925	2
17084	11	HB2	0.957	2
17087	11	HB2	0.929	2
17103	81	HB2	1.000	2
17146	79	HB2	-0.02	2
17174	11	HB2	1.007	2
17175	53	HB2	1.05	2
17213	11	HB2	0.911	2
17237	23	HB2	-0.053	1
17247	19	HB2	0.871	2
17369	11	HB2	0.365	2
17388	65	HB2	0.634	2
17467	52	HB2	0.9503	2
17509	128	HB2	0.767	2
17530	38	HB2	0.96	2
17762	29	HB2	0.870	2
17771	72	HB2	0.762	2
17771	72	HB2	1.050	2
17904	85	HB2	-2.402
17957	56	HB2	-0.5000	2
17960	85	HB2	0.860	2
18001	59	HB2	0.86	1
18086	33	HB2	0.537	2
18388	42	HB2	0.648	2
18389	42	HB2	0.951	2
18426	40	HB2	0.939	1
18569	106	HB2	1.029	2
18628	87	HB2	0.616	2
18642	38	HB2	0.9030	2
18709	62	HB2	0.495	2
18728	138	HB2	1.038	2
18734	38	HB2	0.828	1
18908	76	HB2	0.818	2
18953	104	HB2	0.6930	2
18953	99	HB2	0.9190	2
18990	111	HB2	0.8910	2
19195	79	HB2	0.952	2
19315	38	HB2	1.0430	2
19415	27	HB2	0.426	1
19421	131	HB2	0.613	1
19553	50	HB2	0.156	2
19604	72	HB2	1.022	1
19627	89	HB2	0.989	2
19638	85	HB2	-27.312
19681	75	HB2	0.344	2
19687	66	HB2	0.532	2
19737	25	HB2	0.840	1
19749	11	HB2	0.96	2
19952	83	HB2	1.046	1
19974	56	HB2	-0.5000	2
25020	34	HB2	0.945
25243	5	HB2	0.983
25250	52	HB2	0.95	2
25326	109	HB2	0.924
25455	60	HB2	-3.010	2
25477	45	HB2	0.813	2
25485	42	HB2	0.716	2
25495	81	HB2	1.017	2
25530	25	HB2	0.884	2
25660	80	HB2	-0.261	1
25797	81	HB2	1.0530	2
25870	77	HB2	0.975	1
25907	80	HB2	-2.572
25917	6	HB2	0.624
25933	78	HB2	0.950	2
26010	158	HB2	0.319
26780	78	HB2	0.923	2
26947	67	HB2	0.9980	2
27313	11	HB2	0.505	2
27313	45	HB2	0.691	2
27519	84	HB2	1.01	1
27869	67	HB2	0.071	2
28118	12	HB2	1.049	1
30010	10	HB2	0.792
30010	52	HB2	0.479
30118	54	HB2	0.5853	2
30154	25	HB2	0.884	2
30156	72	HB2	1.054	2
30288	81	HB2	0.9820	2
30308	81	HB2	1.0270	2
30311	13	HB2	0.826
30521	6	HB2	0.619
30529	81	HB2	1.0300	2
30590	29	HB2	1.036	2
30774	81	HB2	1.0100	2
30963	60	HB2	0.542
30965	81	HB2	1.065
31005	81	HB2	1.0300	2
31138	31	HB2	0.7840	2
31200	9	HB2	0.8084291706	2
34041	64	HB2	0.76	1
34058	47	HB2	0.307	2
34058	64	HB2	0.685	2
34064	55	HB2	-2.994	1
34079	46	HB2	0.493	1
34080	43	HB2	0.726	2
34161	146	HB2	0.974	2
34235	16	HB2	0.872	1
34236	39	HB2	0.96	1
34399	110	HB2	0.77	2
34459	32	HB2	1.025	1
34813	100	HB2	0.850	2
34887	52	HB2	0.978	2
34968	94	HB2	0.464	2
34998	146	HB2	0.5222
35048	5	HB2	0.746
36059	37	HB2	0.662	2
36085	77	HB2	0.171
36250	84	HB2	1.01	1
36473	110	HB2	0.599
36675	82	HB2	0.4800	2
50015	66	HB2	0.522	1
50269	83	HB2	-0.82	2
50711	52	HB2	1.054	1
51054	39	HB2	0.793	2
51154	58	HB2	0.801	2
51379	124	HB2	0.353	2
51715	73	HB2	0.965	1
52557	83	HB2	0.970	1
53197	205	HB2	-0.1600	2
53521	114	HB2	0.9722899199	2
53617	105	HB2	0.811	2
53618	105	HB2	0.754	2