BMRBj - BMREntryMaster

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	2	SER	H	H	8.212	0.05	1
2	1	2	SER	HA	H	4.555	0.05	1
3	1	2	SER	HB2	H	3.835	0.05	2
4	1	2	SER	HB3	H	3.864	0.05	2
5	1	2	SER	C	C	174.577	0.3	1
6	1	2	SER	CA	C	58.241	0.3	1
7	1	2	SER	CB	C	64	0.3	1
8	1	2	SER	N	N	115.171	0.13	1
9	1	3	THR	H	H	8.327	0.05	1
10	1	3	THR	HA	H	4.344	0.05	1
11	1	3	THR	HB	H	4.257	0.05	1
12	1	3	THR	HG21	H	1.253	0.05	1
13	1	3	THR	HG22	H	1.253	0.05	1
14	1	3	THR	HG23	H	1.253	0.05	1
15	1	3	THR	C	C	174.024	0.3	1
16	1	3	THR	CA	C	61.852	0.3	1
17	1	3	THR	CB	C	69.858	0.3	1
18	1	3	THR	CG2	C	20.881	0.3	1
19	1	3	THR	N	N	116.072	0.13	1
20	1	4	ALA	H	H	8.367	0.05	1
21	1	4	ALA	HA	H	4.468	0.05	1
22	1	4	ALA	HB1	H	1.429	0.05	1
23	1	4	ALA	HB2	H	1.429	0.05	1
24	1	4	ALA	HB3	H	1.429	0.05	1
25	1	4	ALA	C	C	177.713	0.3	1
26	1	4	ALA	CA	C	52.526	0.3	1
27	1	4	ALA	CB	C	19.299	0.3	1
28	1	4	ALA	N	N	126.55	0.13	1
29	1	5	THR	H	H	8.209	0.05	1
30	1	5	THR	HA	H	4.404	0.05	1
31	1	5	THR	HB	H	4.254	0.05	1
32	1	5	THR	HG21	H	1.255	0.05	1
33	1	5	THR	HG22	H	1.255	0.05	1
34	1	5	THR	HG23	H	1.255	0.05	1
35	1	5	THR	C	C	175.209	0.3	1
36	1	5	THR	CA	C	61.828	0.3	1
37	1	5	THR	CB	C	70.192	0.3	1
38	1	5	THR	CG2	C	20.884	0.3	1
39	1	5	THR	N	N	112.622	0.13	1
40	1	6	GLY	H	H	8.29	0.05	1
41	1	6	GLY	HA2	H	4.005	0.05	1
42	1	6	GLY	HA3	H	4.005	0.05	1
43	1	6	GLY	C	C	173.591	0.3	1
44	1	6	GLY	CA	C	45.498	0.3	1
45	1	6	GLY	N	N	110.864	0.13	1
46	1	7	ILE	H	H	8.522	0.05	1
47	1	7	ILE	HA	H	3.953	0.05	1
48	1	7	ILE	HB	H	1.733	0.05	1
49	1	7	ILE	HG12	H	1.027	0.05	2
50	1	7	ILE	HG13	H	1.549	0.05	2
51	1	7	ILE	HG21	H	1.074	0.05	1
52	1	7	ILE	HG22	H	1.074	0.05	1
53	1	7	ILE	HG23	H	1.074	0.05	1
54	1	7	ILE	HD11	H	0.817	0.05	1
55	1	7	ILE	HD12	H	0.817	0.05	1
56	1	7	ILE	HD13	H	0.817	0.05	1
57	1	7	ILE	C	C	175.781	0.3	1
58	1	7	ILE	CA	C	61.894	0.3	1
59	1	7	ILE	CB	C	39.161	0.3	1
60	1	7	ILE	CG1	C	28.161	0.3	1
61	1	7	ILE	CG2	C	19.029	0.3	1
62	1	7	ILE	CD1	C	13.295	0.3	1
63	1	7	ILE	N	N	122.847	0.13	1
64	1	8	THR	H	H	8.666	0.05	1
65	1	8	THR	HA	H	5.344	0.05	1
66	1	8	THR	HB	H	3.87	0.05	1
67	1	8	THR	HG21	H	1.007	0.05	1
68	1	8	THR	HG22	H	1.007	0.05	1
69	1	8	THR	HG23	H	1.007	0.05	1
70	1	8	THR	C	C	174.312	0.3	1
71	1	8	THR	CA	C	58.835	0.3	1
72	1	8	THR	CB	C	73.445	0.3	1
73	1	8	THR	CG2	C	22.006	0.3	1
74	1	8	THR	N	N	116.429	0.13	1
75	1	9	VAL	H	H	8.869	0.05	1
76	1	9	VAL	HA	H	3.774	0.05	1
77	1	9	VAL	HB	H	2.316	0.05	1
78	1	9	VAL	HG11	H	0.836	0.05	2
79	1	9	VAL	HG12	H	0.836	0.05	2
80	1	9	VAL	HG13	H	0.836	0.05	2
81	1	9	VAL	HG21	H	0.993	0.05	2
82	1	9	VAL	HG22	H	0.993	0.05	2
83	1	9	VAL	HG23	H	0.993	0.05	2
84	1	9	VAL	C	C	176.075	0.3	1
85	1	9	VAL	CA	C	64.583	0.3	1
86	1	9	VAL	CB	C	32.433	0.3	1
87	1	9	VAL	CG1	C	23.453	0.3	2
88	1	9	VAL	CG2	C	24.527	0.3	2
89	1	9	VAL	N	N	121.984	0.13	1
90	1	10	SER	H	H	7.811	0.05	1
91	1	10	SER	HA	H	4.801	0.05	1
92	1	10	SER	HB2	H	3.169	0.05	2
93	1	10	SER	HB3	H	3.492	0.05	2
94	1	10	SER	C	C	173.042	0.3	1
95	1	10	SER	CA	C	55.718	0.3	1
96	1	10	SER	CB	C	62.946	0.3	1
97	1	10	SER	N	N	124.664	0.13	1
98	1	11	GLY	H	H	9.17	0.05	1
99	1	11	GLY	HA2	H	3.459	0.05	2
100	1	11	GLY	HA3	H	4.18	0.05	2
101	1	11	GLY	C	C	172.061	0.3	1
102	1	11	GLY	CA	C	43.544	0.3	1
103	1	11	GLY	N	N	116.023	0.13	1
104	1	12	ALA	H	H	8.282	0.05	1
105	1	12	ALA	HA	H	4.289	0.05	1
106	1	12	ALA	HB1	H	1.372	0.05	1
107	1	12	ALA	HB2	H	1.372	0.05	1
108	1	12	ALA	HB3	H	1.372	0.05	1
109	1	12	ALA	C	C	178.881	0.3	1
110	1	12	ALA	CA	C	52.951	0.3	1
111	1	12	ALA	CB	C	18.107	0.3	1
112	1	12	ALA	N	N	124.601	0.13	1
113	1	13	GLN	H	H	8.191	0.05	1
114	1	13	GLN	HA	H	4.433	0.05	1
115	1	13	GLN	HB2	H	1.92	0.05	2
116	1	13	GLN	HB3	H	1.436	0.05	2
117	1	13	GLN	HG2	H	2.045	0.05	2
118	1	13	GLN	HG3	H	2.045	0.05	2
119	1	13	GLN	C	C	172.394	0.3	1
120	1	13	GLN	CA	C	55.564	0.3	1
121	1	13	GLN	CB	C	35.279	0.3	1
122	1	13	GLN	CG	C	34.387	0.3	1
123	1	13	GLN	N	N	124.071	0.13	1
124	1	14	SER	H	H	7.729	0.05	1
125	1	14	SER	HA	H	4.667	0.05	1
126	1	14	SER	HB2	H	3.612	0.05	2
127	1	14	SER	HB3	H	3.72	0.05	2
128	1	14	SER	C	C	172.983	0.3	1
129	1	14	SER	CA	C	56.37	0.3	1
130	1	14	SER	CB	C	65.009	0.3	1
131	1	14	SER	N	N	115.677	0.13	1
132	1	15	PHE	H	H	8.48	0.05	1
133	1	15	PHE	HA	H	4.803	0.05	1
134	1	15	PHE	HB2	H	3.064	0.05	1
135	1	15	PHE	HB3	H	2.889	0.05	1
136	1	15	PHE	HD1	H	7.407	0.05	3
137	1	15	PHE	HD2	H	7.407	0.05	3
138	1	15	PHE	HE1	H	7.229	0.05	3
139	1	15	PHE	HE2	H	7.229	0.05	3
140	1	15	PHE	HZ	H	6.979	0.05	1
141	1	15	PHE	C	C	174.412	0.3	1
142	1	15	PHE	CA	C	57.29	0.3	1
143	1	15	PHE	CB	C	41.072	0.3	1
144	1	15	PHE	CD1	C	130.633	0.3	3
145	1	15	PHE	CD2	C	130.633	0.3	3
146	1	15	PHE	CE1	C	130.549	0.3	3
147	1	15	PHE	CE2	C	130.549	0.3	3
148	1	15	PHE	CZ	C	126.299	0.3	1
149	1	15	PHE	N	N	120.569	0.13	1
150	1	16	LYS	H	H	8.796	0.05	1
151	1	16	LYS	HA	H	4.79	0.05	1
152	1	16	LYS	HB2	H	1.704	0.05	2
153	1	16	LYS	HB3	H	1.703	0.05	2
154	1	16	LYS	HG2	H	1.484	0.05	2
155	1	16	LYS	HG3	H	1.372	0.05	2
156	1	16	LYS	HD2	H	1.562	0.05	2
157	1	16	LYS	HD3	H	1.621	0.05	2
158	1	16	LYS	HE2	H	2.914	0.05	2
159	1	16	LYS	HE3	H	2.914	0.05	2
160	1	16	LYS	C	C	174.481	0.3	1
161	1	16	LYS	CA	C	52.639	0.3	1
162	1	16	LYS	CB	C	33.344	0.3	1
163	1	16	LYS	CG	C	25.162	0.3	1
164	1	16	LYS	CD	C	28.898	0.3	1
165	1	16	LYS	CE	C	42.18	0.3	1
166	1	16	LYS	N	N	120.37	0.13	1
167	1	17	PRO	HA	H	4.544	0.05	1
168	1	17	PRO	HB2	H	1.646	0.05	2
169	1	17	PRO	HB3	H	1.96	0.05	2
170	1	17	PRO	HG2	H	2.076	0.05	2
171	1	17	PRO	HG3	H	2.313	0.05	2
172	1	17	PRO	HD2	H	3.67	0.05	2
173	1	17	PRO	HD3	H	3.489	0.05	2
174	1	17	PRO	C	C	175.513	0.3	1
175	1	17	PRO	CA	C	62.252	0.3	1
176	1	17	PRO	CB	C	31.448	0.3	1
177	1	17	PRO	CG	C	26.976	0.3	1
178	1	17	PRO	CD	C	49.662	0.3	1
179	1	18	VAL	H	H	8.1	0.05	1
180	1	18	VAL	HA	H	4.065	0.05	1
181	1	18	VAL	HB	H	1.875	0.05	1
182	1	18	VAL	HG11	H	0.815	0.05	2
183	1	18	VAL	HG12	H	0.815	0.05	2
184	1	18	VAL	HG13	H	0.815	0.05	2
185	1	18	VAL	HG21	H	0.824	0.05	2
186	1	18	VAL	HG22	H	0.824	0.05	2
187	1	18	VAL	HG23	H	0.824	0.05	2
188	1	18	VAL	C	C	174.903	0.3	1
189	1	18	VAL	CA	C	61.63	0.3	1
190	1	18	VAL	CB	C	33.143	0.3	1
191	1	18	VAL	CG1	C	21.43	0.3	2
192	1	18	VAL	CG2	C	20.558	0.3	2
193	1	18	VAL	N	N	119.994	0.13	1
194	1	19	ALA	H	H	8.28	0.05	1
195	1	19	ALA	HA	H	4.314	0.05	1
196	1	19	ALA	HB1	H	1.268	0.05	1
197	1	19	ALA	HB2	H	1.268	0.05	1
198	1	19	ALA	HB3	H	1.268	0.05	1
199	1	19	ALA	C	C	176.744	0.3	1
200	1	19	ALA	CA	C	52.137	0.3	1
201	1	19	ALA	CB	C	19.899	0.3	1
202	1	19	ALA	N	N	127.513	0.13	1
203	1	20	TRP	H	H	7.724	0.05	1
204	1	20	TRP	HA	H	2.873	0.05	1
205	1	20	TRP	HB3	H	3.151	0.05	1
206	1	20	TRP	HD1	H	7.282	0.05	1
207	1	20	TRP	HE1	H	10.177	0.05	1
208	1	20	TRP	HZ2	H	7.465	0.05	1
209	1	20	TRP	HZ3	H	7.032	0.05	1
210	1	20	TRP	HH2	H	7.186	0.05	1
211	1	20	TRP	C	C	174.984	0.3	1
212	1	20	TRP	CA	C	59.658	0.3	1
213	1	20	TRP	CB	C	29.666	0.3	1
214	1	20	TRP	N	N	119.004	0.13	1
215	1	20	TRP	NE1	N	129.696	0.13	1
216	1	21	GLN	HA	H	4.009	0.05	1
217	1	21	GLN	HB2	H	2.043	0.05	2
218	1	21	GLN	HB3	H	2.047	0.05	2
219	1	21	GLN	HG2	H	2.494	0.05	2
220	1	21	GLN	HG3	H	2.427	0.05	2
221	1	21	GLN	CA	C	55.09	0.3	1
222	1	21	GLN	CB	C	33.338	0.3	1
223	1	21	GLN	CG	C	30.895	0.3	1
224	1	22	LEU	HB2	H	1.664	0.05	2
225	1	22	LEU	HB3	H	1.515	0.05	2
226	1	22	LEU	HG	H	1.652	0.05	1
227	1	22	LEU	HD11	H	0.825	0.05	2
228	1	22	LEU	HD12	H	0.825	0.05	2
229	1	22	LEU	HD13	H	0.825	0.05	2
230	1	22	LEU	HD21	H	0.936	0.05	2
231	1	22	LEU	HD22	H	0.936	0.05	2
232	1	22	LEU	HD23	H	0.936	0.05	2
233	1	22	LEU	CA	C	55.015	0.3	1
234	1	22	LEU	CB	C	43.097	0.3	1
235	1	22	LEU	CG	C	27.094	0.3	1
236	1	22	LEU	CD1	C	23.786	0.3	2
237	1	22	LEU	CD2	C	25.026	0.3	2
238	1	23	ASP	CA	C	54.573	0.3	1
239	1	23	ASP	CB	C	38.729	0.3	1
240	1	24	ASN	H	H	8.341	0.05	1
241	1	24	ASN	C	C	175.454	0.3	1
242	1	24	ASN	CA	C	54.877	0.3	1
243	1	24	ASN	CB	C	38.958	0.3	1
244	1	24	ASN	N	N	117.168	0.13	1
245	1	25	ASP	H	H	8.184	0.05	1
246	1	25	ASP	HA	H	4.696	0.05	1
247	1	25	ASP	HB2	H	2.639	0.05	2
248	1	25	ASP	HB3	H	2.791	0.05	2
249	1	25	ASP	C	C	176.329	0.3	1
250	1	25	ASP	CA	C	54.491	0.3	1
251	1	25	ASP	CB	C	41.757	0.3	1
252	1	25	ASP	N	N	119.267	0.13	1
253	1	26	GLY	H	H	8.175	0.05	1
254	1	26	GLY	HA2	H	3.75	0.05	2
255	1	26	GLY	HA3	H	4.087	0.05	2
256	1	26	GLY	C	C	174.062	0.3	1
257	1	26	GLY	CA	C	45.827	0.3	1
258	1	26	GLY	N	N	108.387	0.13	1
259	1	27	ASN	H	H	8.489	0.05	1
260	1	27	ASN	HA	H	4.707	0.05	1
261	1	27	ASN	HB2	H	2.696	0.05	2
262	1	27	ASN	HB3	H	2.858	0.05	2
263	1	27	ASN	C	C	174.896	0.3	1
264	1	27	ASN	CA	C	53.114	0.3	1
265	1	27	ASN	CB	C	39.112	0.3	1
266	1	27	ASN	N	N	119.09	0.13	1
267	1	28	LYS	H	H	8.334	0.05	1
268	1	28	LYS	HA	H	4.431	0.05	1
269	1	28	LYS	HB2	H	1.663	0.05	1
270	1	28	LYS	HB3	H	1.663	0.05	1
271	1	28	LYS	HG2	H	1.347	0.05	2
272	1	28	LYS	HG3	H	1.159	0.05	2
273	1	28	LYS	HD2	H	1.337	0.05	2
274	1	28	LYS	HD3	H	1.381	0.05	2
275	1	28	LYS	HE2	H	2.635	0.05	2
276	1	28	LYS	HE3	H	2.574	0.05	2
277	1	28	LYS	C	C	176.384	0.3	1
278	1	28	LYS	CA	C	56.812	0.3	1
279	1	28	LYS	CB	C	32.903	0.3	1
280	1	28	LYS	CG	C	24.972	0.3	1
281	1	28	LYS	CD	C	28.921	0.3	1
282	1	28	LYS	CE	C	41.715	0.3	1
283	1	28	LYS	N	N	121.266	0.13	1
284	1	29	VAL	H	H	8.561	0.05	1
285	1	29	VAL	HA	H	4.273	0.05	1
286	1	29	VAL	HB	H	2.059	0.05	1
287	1	29	VAL	HG11	H	0.904	0.05	2
288	1	29	VAL	HG12	H	0.904	0.05	2
289	1	29	VAL	HG13	H	0.904	0.05	2
290	1	29	VAL	HG21	H	0.904	0.05	2
291	1	29	VAL	HG22	H	0.904	0.05	2
292	1	29	VAL	HG23	H	0.904	0.05	2
293	1	29	VAL	C	C	175.402	0.3	1
294	1	29	VAL	CA	C	61.701	0.3	1
295	1	29	VAL	CB	C	33.667	0.3	1
296	1	29	VAL	CG1	C	20.428	0.3	2
297	1	29	VAL	CG2	C	21.331	0.3	2
298	1	29	VAL	N	N	121.631	0.13	1
299	1	30	ASN	H	H	8.496	0.05	1
300	1	30	ASN	HA	H	4.765	0.05	1
301	1	30	ASN	HB2	H	2.624	0.05	2
302	1	30	ASN	HB3	H	2.735	0.05	2
303	1	30	ASN	C	C	174.98	0.3	1
304	1	30	ASN	CA	C	53.436	0.3	1
305	1	30	ASN	CB	C	39.011	0.3	1
306	1	30	ASN	N	N	122.256	0.13	1
307	1	31	VAL	H	H	7.978	0.05	1
308	1	31	VAL	HA	H	4.145	0.05	1
309	1	31	VAL	HB	H	1.992	0.05	1
310	1	31	VAL	HG11	H	0.814	0.05	2
311	1	31	VAL	HG12	H	0.814	0.05	2
312	1	31	VAL	HG13	H	0.814	0.05	2
313	1	31	VAL	HG21	H	0.807	0.05	2
314	1	31	VAL	HG22	H	0.807	0.05	2
315	1	31	VAL	HG23	H	0.807	0.05	2
316	1	31	VAL	C	C	175.018	0.3	1
317	1	31	VAL	CA	C	61.866	0.3	1
318	1	31	VAL	CB	C	33.231	0.3	1
319	1	31	VAL	CG1	C	21.363	0.3	2
320	1	31	VAL	CG2	C	20.478	0.3	2
321	1	31	VAL	N	N	120.065	0.13	1
322	1	32	ASP	H	H	8.328	0.05	1
323	1	32	ASP	HA	H	4.601	0.05	1
324	1	32	ASP	HB2	H	2.595	0.05	2
325	1	32	ASP	HB3	H	2.881	0.05	2
326	1	32	ASP	C	C	176.312	0.3	1
327	1	32	ASP	CA	C	54.075	0.3	1
328	1	32	ASP	CB	C	41.822	0.3	1
329	1	32	ASP	N	N	123.567	0.13	1
330	1	33	ASN	H	H	8.619	0.05	1
331	1	33	ASN	HA	H	4.658	0.05	1
332	1	33	ASN	C	C	175.535	0.3	1
333	1	33	ASN	CA	C	53.495	0.3	1
334	1	33	ASN	CB	C	39.43	0.3	1
335	1	33	ASN	N	N	122.169	0.13	1
336	1	34	ARG	H	H	8.127	0.05	1
337	1	34	ARG	HA	H	4.012	0.05	1
338	1	34	ARG	HB2	H	1.096	0.05	2
339	1	34	ARG	HB3	H	1.121	0.05	2
340	1	34	ARG	HG2	H	1.412	0.05	2
341	1	34	ARG	HG3	H	1.527	0.05	2
342	1	34	ARG	HD2	H	3.143	0.05	2
343	1	34	ARG	HD3	H	2.894	0.05	2
344	1	34	ARG	C	C	176.123	0.3	1
345	1	34	ARG	CA	C	58.476	0.3	1
346	1	34	ARG	CB	C	30.84	0.3	1
347	1	34	ARG	CG	C	26.84	0.3	1
348	1	34	ARG	CD	C	43.579	0.3	1
349	1	34	ARG	N	N	118.426	0.13	1
350	1	35	PHE	H	H	7.72	0.05	1
351	1	35	PHE	HA	H	5.738	0.05	1
352	1	35	PHE	HB2	H	2.818	0.05	1
353	1	35	PHE	HB3	H	3.199	0.05	1
354	1	35	PHE	HD1	H	7.097	0.05	3
355	1	35	PHE	HD2	H	7.097	0.05	3
356	1	35	PHE	HE1	H	7.228	0.05	3
357	1	35	PHE	HE2	H	7.228	0.05	3
358	1	35	PHE	C	C	174.765	0.3	1
359	1	35	PHE	CA	C	55.373	0.3	1
360	1	35	PHE	CB	C	42.483	0.3	1
361	1	35	PHE	CD1	C	131.173	0.3	3
362	1	35	PHE	CD2	C	131.173	0.3	3
363	1	35	PHE	CE1	C	131.576	0.3	3
364	1	35	PHE	CE2	C	131.576	0.3	3
365	1	35	PHE	N	N	116.288	0.13	1
366	1	36	ALA	H	H	8.553	0.05	1
367	1	36	ALA	HA	H	4.514	0.05	1
368	1	36	ALA	HB1	H	0.408	0.05	1
369	1	36	ALA	HB2	H	0.408	0.05	1
370	1	36	ALA	HB3	H	0.408	0.05	1
371	1	36	ALA	C	C	175.472	0.3	1
372	1	36	ALA	CA	C	50.697	0.3	1
373	1	36	ALA	CB	C	22.354	0.3	1
374	1	36	ALA	N	N	121.623	0.13	1
375	1	37	THR	H	H	8.64	0.05	1
376	1	37	THR	HA	H	5.089	0.05	1
377	1	37	THR	HB	H	4.103	0.05	1
378	1	37	THR	HG21	H	1.142	0.05	1
379	1	37	THR	HG22	H	1.142	0.05	1
380	1	37	THR	HG23	H	1.142	0.05	1
381	1	37	THR	C	C	173.426	0.3	1
382	1	37	THR	CA	C	62.615	0.3	1
383	1	37	THR	CB	C	68.686	0.3	1
384	1	37	THR	CG2	C	21.508	0.3	1
385	1	37	THR	N	N	119.506	0.13	1
386	1	38	VAL	H	H	9.255	0.05	1
387	1	38	VAL	HA	H	4.666	0.05	1
388	1	38	VAL	HB	H	1.844	0.05	1
389	1	38	VAL	HG11	H	0.814	0.05	2
390	1	38	VAL	HG12	H	0.814	0.05	2
391	1	38	VAL	HG13	H	0.814	0.05	2
392	1	38	VAL	HG21	H	0.77	0.05	2
393	1	38	VAL	HG22	H	0.77	0.05	2
394	1	38	VAL	HG23	H	0.77	0.05	2
395	1	38	VAL	C	C	174.966	0.3	1
396	1	38	VAL	CA	C	60.406	0.3	1
397	1	38	VAL	CB	C	35.016	0.3	1
398	1	38	VAL	CG1	C	22.181	0.3	2
399	1	38	VAL	CG2	C	21.249	0.3	2
400	1	38	VAL	N	N	126.665	0.13	1
401	1	39	THR	H	H	9.83	0.05	1
402	1	39	THR	HA	H	4.792	0.05	1
403	1	39	THR	HB	H	4.2	0.05	1
404	1	39	THR	HG21	H	1.052	0.05	1
405	1	39	THR	HG22	H	1.052	0.05	1
406	1	39	THR	HG23	H	1.052	0.05	1
407	1	39	THR	C	C	174.43	0.3	1
408	1	39	THR	CA	C	62.091	0.3	1
409	1	39	THR	CB	C	68.427	0.3	1
410	1	39	THR	CG2	C	22.097	0.3	1
411	1	39	THR	N	N	124.026	0.13	1
412	1	40	LEU	H	H	9.117	0.05	1
413	1	40	LEU	HA	H	5.025	0.05	1
414	1	40	LEU	HB2	H	1.59	0.05	2
415	1	40	LEU	HB3	H	1.333	0.05	2
416	1	40	LEU	HG	H	1.575	0.05	1
417	1	40	LEU	HD11	H	0.944	0.05	2
418	1	40	LEU	HD12	H	0.944	0.05	2
419	1	40	LEU	HD13	H	0.944	0.05	2
420	1	40	LEU	HD21	H	0.814	0.05	2
421	1	40	LEU	HD22	H	0.814	0.05	2
422	1	40	LEU	HD23	H	0.814	0.05	2
423	1	40	LEU	C	C	176.533	0.3	1
424	1	40	LEU	CA	C	52.606	0.3	1
425	1	40	LEU	CB	C	46.748	0.3	1
426	1	40	LEU	CG	C	27.005	0.3	1
427	1	40	LEU	CD1	C	25.032	0.3	2
428	1	40	LEU	CD2	C	27.151	0.3	2
429	1	40	LEU	N	N	127.381	0.13	1
430	1	41	SER	H	H	9.422	0.05	1
431	1	41	SER	HA	H	3.904	0.05	1
432	1	41	SER	HB2	H	4.008	0.05	2
433	1	41	SER	HB3	H	4.015	0.05	2
434	1	41	SER	C	C	174.76	0.3	1
435	1	41	SER	CA	C	60.944	0.3	1
436	1	41	SER	CB	C	62.013	0.3	1
437	1	41	SER	N	N	115.831	0.13	1
438	1	42	ALA	H	H	7.409	0.05	1
439	1	42	ALA	HA	H	4.829	0.05	1
440	1	42	ALA	HB1	H	1.581	0.05	1
441	1	42	ALA	HB2	H	1.581	0.05	1
442	1	42	ALA	HB3	H	1.581	0.05	1
443	1	42	ALA	C	C	176.12	0.3	1
444	1	42	ALA	CA	C	52.12	0.3	1
445	1	42	ALA	CB	C	22.493	0.3	1
446	1	42	ALA	N	N	119.814	0.13	1
447	1	43	THR	H	H	7.568	0.05	1
448	1	43	THR	HA	H	4.547	0.05	1
449	1	43	THR	HB	H	4.55	0.05	1
450	1	43	THR	HG21	H	0.937	0.05	1
451	1	43	THR	HG22	H	0.937	0.05	1
452	1	43	THR	HG23	H	0.937	0.05	1
453	1	43	THR	C	C	174.196	0.3	1
454	1	43	THR	CA	C	59.381	0.3	1
455	1	43	THR	CB	C	68.975	0.3	1
456	1	43	THR	CG2	C	21.032	0.3	1
457	1	43	THR	N	N	102.837	0.13	1
458	1	44	THR	H	H	7.271	0.05	1
459	1	44	THR	HA	H	3.853	0.05	1
460	1	44	THR	HB	H	3.909	0.05	1
461	1	44	THR	HG21	H	1.25	0.05	1
462	1	44	THR	HG22	H	1.25	0.05	1
463	1	44	THR	HG23	H	1.25	0.05	1
464	1	44	THR	C	C	174.384	0.3	1
465	1	44	THR	CA	C	63.749	0.3	1
466	1	44	THR	CB	C	69.453	0.3	1
467	1	44	THR	CG2	C	21.43	0.3	1
468	1	44	THR	N	N	116.428	0.13	1
469	1	45	GLY	H	H	8.783	0.05	1
470	1	45	GLY	HA2	H	4.152	0.05	2
471	1	45	GLY	HA3	H	3.683	0.05	2
472	1	45	GLY	C	C	174.081	0.3	1
473	1	45	GLY	CA	C	45.347	0.3	1
474	1	45	GLY	N	N	113.827	0.13	1
475	1	46	MET	H	H	7.901	0.05	1
476	1	46	MET	HA	H	4.68	0.05	1
477	1	46	MET	HB2	H	2.035	0.05	2
478	1	46	MET	HB3	H	1.744	0.05	2
479	1	46	MET	HG2	H	2.305	0.05	2
480	1	46	MET	HG3	H	2.299	0.05	2
481	1	46	MET	C	C	174.969	0.3	1
482	1	46	MET	CA	C	55.931	0.3	1
483	1	46	MET	CB	C	35.58	0.3	1
484	1	46	MET	CG	C	33.398	0.3	1
485	1	46	MET	N	N	118.601	0.13	1
486	1	47	LYS	H	H	9.029	0.05	1
487	1	47	LYS	HA	H	4.57	0.05	1
488	1	47	LYS	HB2	H	1.739	0.05	2
489	1	47	LYS	HB3	H	1.81	0.05	2
490	1	47	LYS	HG2	H	1.192	0.05	2
491	1	47	LYS	HG3	H	1.574	0.05	2
492	1	47	LYS	HD2	H	1.627	0.05	2
493	1	47	LYS	HD3	H	1.673	0.05	2
494	1	47	LYS	HE2	H	3.015	0.05	2
495	1	47	LYS	HE3	H	3.047	0.05	2
496	1	47	LYS	C	C	174.74	0.3	1
497	1	47	LYS	CA	C	54.55	0.3	1
498	1	47	LYS	CB	C	36.136	0.3	1
499	1	47	LYS	CG	C	23.006	0.3	1
500	1	47	LYS	CD	C	29.039	0.3	1
501	1	47	LYS	CE	C	42.11	0.3	1
502	1	47	LYS	N	N	120.243	0.13	1
503	1	48	ARG	H	H	8.368	0.05	1
504	1	48	ARG	HA	H	3.701	0.05	1
505	1	48	ARG	HB2	H	1.72	0.05	2
506	1	48	ARG	HB3	H	1.785	0.05	2
507	1	48	ARG	HG2	H	1.861	0.05	2
508	1	48	ARG	HG3	H	1.507	0.05	2
509	1	48	ARG	HD2	H	3.254	0.05	2
510	1	48	ARG	HD3	H	3.371	0.05	2
511	1	48	ARG	C	C	176.742	0.3	1
512	1	48	ARG	CA	C	58.027	0.3	1
513	1	48	ARG	CB	C	29.959	0.3	1
514	1	48	ARG	CG	C	27.073	0.3	1
515	1	48	ARG	CD	C	43.786	0.3	1
516	1	48	ARG	N	N	119.826	0.13	1
517	1	49	GLY	HA2	H	4.536	0.05	2
518	1	49	GLY	HA3	H	3.657	0.05	2
519	1	49	GLY	C	C	174.915	0.3	1
520	1	49	GLY	CA	C	44.878	0.3	1
521	1	50	ASP	H	H	8.045	0.05	1
522	1	50	ASP	HA	H	4.701	0.05	1
523	1	50	ASP	HB2	H	2.554	0.05	2
524	1	50	ASP	HB3	H	2.755	0.05	2
525	1	50	ASP	C	C	174.63	0.3	1
526	1	50	ASP	CA	C	55.878	0.3	1
527	1	50	ASP	CB	C	41.482	0.3	1
528	1	50	ASP	N	N	121.824	0.13	1
529	1	51	LYS	H	H	8.583	0.05	1
530	1	51	LYS	HA	H	5.427	0.05	1
531	1	51	LYS	HB2	H	1.632	0.05	1
532	1	51	LYS	HB3	H	1.853	0.05	1
533	1	51	LYS	HG2	H	1.603	0.05	2
534	1	51	LYS	HG3	H	1.471	0.05	2
535	1	51	LYS	HD2	H	1.69	0.05	2
536	1	51	LYS	HD3	H	1.622	0.05	2
537	1	51	LYS	HE2	H	2.999	0.05	2
538	1	51	LYS	HE3	H	2.998	0.05	2
539	1	51	LYS	C	C	175.557	0.3	1
540	1	51	LYS	CA	C	54.372	0.3	1
541	1	51	LYS	CB	C	34.694	0.3	1
542	1	51	LYS	CG	C	25.339	0.3	1
543	1	51	LYS	CD	C	29.072	0.3	1
544	1	51	LYS	CE	C	42.284	0.3	1
545	1	51	LYS	N	N	119.522	0.13	1
546	1	52	ILE	H	H	9.103	0.05	1
547	1	52	ILE	HA	H	5.514	0.05	1
548	1	52	ILE	HB	H	1.514	0.05	1
549	1	52	ILE	HG12	H	0.72	0.05	2
550	1	52	ILE	HG13	H	1.055	0.05	2
551	1	52	ILE	HG21	H	0.71	0.05	1
552	1	52	ILE	HG22	H	0.71	0.05	1
553	1	52	ILE	HG23	H	0.71	0.05	1
554	1	52	ILE	HD11	H	0.484	0.05	1
555	1	52	ILE	HD12	H	0.484	0.05	1
556	1	52	ILE	HD13	H	0.484	0.05	1
557	1	52	ILE	C	C	173.541	0.3	1
558	1	52	ILE	CA	C	58.337	0.3	1
559	1	52	ILE	CB	C	42.639	0.3	1
560	1	52	ILE	CG1	C	25.222	0.3	1
561	1	52	ILE	CG2	C	17.631	0.3	1
562	1	52	ILE	CD1	C	14.146	0.3	1
563	1	52	ILE	N	N	115.791	0.13	1
564	1	53	SER	H	H	8.542	0.05	1
565	1	53	SER	HA	H	4.909	0.05	1
566	1	53	SER	HB2	H	3.817	0.05	2
567	1	53	SER	HB3	H	3.698	0.05	2
568	1	53	SER	C	C	171.051	0.3	1
569	1	53	SER	CA	C	56.405	0.3	1
570	1	53	SER	CB	C	67.739	0.3	1
571	1	53	SER	N	N	114.965	0.13	1
572	1	54	PHE	H	H	10.284	0.05	1
573	1	54	PHE	HA	H	5.097	0.05	1
574	1	54	PHE	HB2	H	2.784	0.05	2
575	1	54	PHE	HB3	H	3.152	0.05	2
576	1	54	PHE	HD1	H	6.979	0.05	3
577	1	54	PHE	HD2	H	6.979	0.05	3
578	1	54	PHE	HE1	H	6.453	0.05	3
579	1	54	PHE	HE2	H	6.453	0.05	3
580	1	54	PHE	HZ	H	6.618	0.05	1
581	1	54	PHE	C	C	175.897	0.3	1
582	1	54	PHE	CA	C	55.902	0.3	1
583	1	54	PHE	CB	C	40.884	0.3	1
584	1	54	PHE	CD1	C	130.514	0.3	3
585	1	54	PHE	CD2	C	130.514	0.3	3
586	1	54	PHE	CE1	C	126.974	0.3	3
587	1	54	PHE	CE2	C	126.974	0.3	3
588	1	54	PHE	CZ	C	127.207	0.3	1
589	1	54	PHE	N	N	123.139	0.13	1
590	1	55	ALA	H	H	8.284	0.05	1
591	1	55	ALA	HA	H	4.258	0.05	1
592	1	55	ALA	HB1	H	1.474	0.05	1
593	1	55	ALA	HB2	H	1.474	0.05	1
594	1	55	ALA	HB3	H	1.474	0.05	1
595	1	55	ALA	C	C	177.864	0.3	1
596	1	55	ALA	CA	C	54.015	0.3	1
597	1	55	ALA	CB	C	19.125	0.3	1
598	1	55	ALA	N	N	125.203	0.13	1
599	1	56	GLY	H	H	8.656	0.05	1
600	1	56	GLY	HA2	H	3.587	0.05	2
601	1	56	GLY	HA3	H	4.381	0.05	2
602	1	56	GLY	C	C	174.347	0.3	1
603	1	56	GLY	CA	C	45.319	0.3	1
604	1	56	GLY	N	N	112.223	0.13	1
605	1	57	VAL	H	H	8.313	0.05	1
606	1	57	VAL	HA	H	4.569	0.05	1
607	1	57	VAL	HB	H	2.486	0.05	1
608	1	57	VAL	HG11	H	1.073	0.05	2
609	1	57	VAL	HG12	H	1.073	0.05	2
610	1	57	VAL	HG13	H	1.073	0.05	2
611	1	57	VAL	HG21	H	0.766	0.05	2
612	1	57	VAL	HG22	H	0.766	0.05	2
613	1	57	VAL	HG23	H	0.766	0.05	2
614	1	57	VAL	C	C	175.283	0.3	1
615	1	57	VAL	CA	C	62.797	0.3	1
616	1	57	VAL	CB	C	31.196	0.3	1
617	1	57	VAL	CG1	C	20.362	0.3	2
618	1	57	VAL	CG2	C	21.574	0.3	2
619	1	57	VAL	N	N	123.958	0.13	1
620	1	58	LYS	H	H	9.196	0.05	1
621	1	58	LYS	HA	H	4.522	0.05	1
622	1	58	LYS	HB2	H	1.843	0.05	1
623	1	58	LYS	HB3	H	1.617	0.05	1
624	1	58	LYS	HG2	H	1.319	0.05	2
625	1	58	LYS	HG3	H	1.482	0.05	2
626	1	58	LYS	HD2	H	1.587	0.05	2
627	1	58	LYS	HD3	H	1.464	0.05	2
628	1	58	LYS	HE2	H	2.822	0.05	2
629	1	58	LYS	HE3	H	3.008	0.05	2
630	1	58	LYS	C	C	175.989	0.3	1
631	1	58	LYS	CA	C	54.918	0.3	1
632	1	58	LYS	CB	C	36.221	0.3	1
633	1	58	LYS	CG	C	25.478	0.3	1
634	1	58	LYS	CD	C	28.976	0.3	1
635	1	58	LYS	CE	C	43.099	0.3	1
636	1	58	LYS	N	N	127.489	0.13	1
637	1	59	PHE	H	H	9.219	0.05	1
638	1	59	PHE	HA	H	5.539	0.05	1
639	1	59	PHE	HB2	H	2.851	0.05	1
640	1	59	PHE	HB3	H	3.426	0.05	1
641	1	59	PHE	HD1	H	7.489	0.05	3
642	1	59	PHE	HD2	H	7.489	0.05	3
643	1	59	PHE	HE1	H	7.109	0.05	3
644	1	59	PHE	HE2	H	7.109	0.05	3
645	1	59	PHE	HZ	H	6.584	0.05	1
646	1	59	PHE	C	C	177.541	0.3	1
647	1	59	PHE	CA	C	57.028	0.3	1
648	1	59	PHE	CB	C	38.984	0.3	1
649	1	59	PHE	CD1	C	130.211	0.3	3
650	1	59	PHE	CD2	C	130.211	0.3	3
651	1	59	PHE	CE1	C	130.366	0.3	3
652	1	59	PHE	CE2	C	130.366	0.3	3
653	1	59	PHE	N	N	119.349	0.13	1
654	1	60	LEU	H	H	8.452	0.05	1
655	1	60	LEU	HA	H	4.267	0.05	1
656	1	60	LEU	HB2	H	1.484	0.05	2
657	1	60	LEU	HB3	H	1.671	0.05	2
658	1	60	LEU	HG	H	1.301	0.05	1
659	1	60	LEU	HD11	H	0.848	0.05	2
660	1	60	LEU	HD12	H	0.848	0.05	2
661	1	60	LEU	HD13	H	0.848	0.05	2
662	1	60	LEU	HD21	H	0.826	0.05	2
663	1	60	LEU	HD22	H	0.826	0.05	2
664	1	60	LEU	HD23	H	0.826	0.05	2
665	1	60	LEU	C	C	176.555	0.3	1
666	1	60	LEU	CA	C	56.116	0.3	1
667	1	60	LEU	CB	C	41.928	0.3	1
668	1	60	LEU	CG	C	27.299	0.3	1
669	1	60	LEU	CD1	C	25.908	0.3	2
670	1	60	LEU	CD2	C	22.104	0.3	2
671	1	60	LEU	N	N	124.703	0.13	1
672	1	61	GLY	H	H	8.357	0.05	1
673	1	61	GLY	HA2	H	3.991	0.05	1
674	1	61	GLY	HA3	H	3.991	0.05	1
675	1	61	GLY	C	C	174.346	0.3	1
676	1	61	GLY	CA	C	45.711	0.3	1
677	1	61	GLY	N	N	109.108	0.13	1
678	1	62	GLN	HA	H	4.347	0.05	1
679	1	62	GLN	HB2	H	2.232	0.05	2
680	1	62	GLN	HB3	H	2.232	0.05	2
681	1	62	GLN	HG2	H	2.476	0.05	2
682	1	62	GLN	HG3	H	2.455	0.05	2
683	1	62	GLN	C	C	177.152	0.3	1
684	1	62	GLN	CA	C	57.063	0.3	1
685	1	62	GLN	CB	C	29.162	0.3	1
686	1	62	GLN	CG	C	34.609	0.3	1
687	1	63	MET	H	H	8.062	0.05	1
688	1	63	MET	HA	H	4.372	0.05	1
689	1	63	MET	HB2	H	2.198	0.05	2
690	1	63	MET	HB3	H	2.078	0.05	2
691	1	63	MET	HG2	H	2.641	0.05	2
692	1	63	MET	HG3	H	2.494	0.05	2
693	1	63	MET	C	C	176.306	0.3	1
694	1	63	MET	CA	C	57.062	0.3	1
695	1	63	MET	CB	C	33.504	0.3	1
696	1	63	MET	CG	C	32.061	0.3	1
697	1	63	MET	N	N	119.419	0.13	1
698	1	64	ALA	H	H	7.945	0.05	1
699	1	64	ALA	HB1	H	1.42	0.05	1
700	1	64	ALA	HB2	H	1.42	0.05	1
701	1	64	ALA	HB3	H	1.42	0.05	1
702	1	64	ALA	C	C	177.645	0.3	1
703	1	64	ALA	CA	C	53.08	0.3	1
704	1	64	ALA	CB	C	19.26	0.3	1
705	1	64	ALA	N	N	120.965	0.13	1
706	1	65	LYS	H	H	7.757	0.05	1
707	1	65	LYS	HA	H	4.26	0.05	1
708	1	65	LYS	HB2	H	1.923	0.05	2
709	1	65	LYS	HB3	H	1.829	0.05	2
710	1	65	LYS	HG2	H	1.503	0.05	2
711	1	65	LYS	HG3	H	1.434	0.05	2
712	1	65	LYS	HD2	H	1.693	0.05	2
713	1	65	LYS	HD3	H	1.696	0.05	2
714	1	65	LYS	HE2	H	3.002	0.05	2
715	1	65	LYS	HE3	H	3.003	0.05	2
716	1	65	LYS	C	C	176.115	0.3	1
717	1	65	LYS	CA	C	56.481	0.3	1
718	1	65	LYS	CB	C	32.575	0.3	1
719	1	65	LYS	CG	C	24.829	0.3	1
720	1	65	LYS	CD	C	28.849	0.3	1
721	1	65	LYS	CE	C	42.124	0.3	1
722	1	65	LYS	N	N	116.273	0.13	1
723	1	66	ASN	H	H	8.126	0.05	1
724	1	66	ASN	HA	H	4.683	0.05	1
725	1	66	ASN	HB2	H	2.841	0.05	1
726	1	66	ASN	HB3	H	2.841	0.05	1
727	1	66	ASN	C	C	174.506	0.3	1
728	1	66	ASN	CA	C	53.361	0.3	1
729	1	66	ASN	CB	C	38.997	0.3	1
730	1	66	ASN	N	N	116.339	0.13	1
731	1	67	VAL	H	H	8.09	0.05	1
732	1	67	VAL	HA	H	4.143	0.05	1
733	1	67	VAL	HB	H	2.129	0.05	1
734	1	67	VAL	HG11	H	0.98	0.05	2
735	1	67	VAL	HG12	H	0.98	0.05	2
736	1	67	VAL	HG13	H	0.98	0.05	2
737	1	67	VAL	HG21	H	0.984	0.05	2
738	1	67	VAL	HG22	H	0.984	0.05	2
739	1	67	VAL	HG23	H	0.984	0.05	2
740	1	67	VAL	C	C	176.004	0.3	1
741	1	67	VAL	CA	C	63.117	0.3	1
742	1	67	VAL	CB	C	32.576	0.3	1
743	1	67	VAL	CG1	C	20.633	0.3	2
744	1	67	VAL	CG2	C	21.288	0.3	2
745	1	67	VAL	N	N	120.04	0.13	1
746	1	68	LEU	H	H	8.129	0.05	1
747	1	68	LEU	HA	H	4.439	0.05	1
748	1	68	LEU	HB2	H	1.644	0.05	2
749	1	68	LEU	HB3	H	1.692	0.05	2
750	1	68	LEU	HG	H	1.59	0.05	1
751	1	68	LEU	HD11	H	0.946	0.05	2
752	1	68	LEU	HD12	H	0.946	0.05	2
753	1	68	LEU	HD13	H	0.946	0.05	2
754	1	68	LEU	HD21	H	0.886	0.05	2
755	1	68	LEU	HD22	H	0.886	0.05	2
756	1	68	LEU	HD23	H	0.886	0.05	2
757	1	68	LEU	C	C	176.339	0.3	1
758	1	68	LEU	CA	C	54.484	0.3	1
759	1	68	LEU	CB	C	41.419	0.3	1
760	1	68	LEU	CG	C	26.9	0.3	1
761	1	68	LEU	CD1	C	25.025	0.3	2
762	1	68	LEU	CD2	C	23.352	0.3	2
763	1	68	LEU	N	N	124.226	0.13	1
764	1	69	ALA	H	H	8.002	0.05	1
765	1	69	ALA	HA	H	4.249	0.05	1
766	1	69	ALA	HB1	H	1.414	0.05	1
767	1	69	ALA	HB2	H	1.414	0.05	1
768	1	69	ALA	HB3	H	1.414	0.05	1
769	1	69	ALA	C	C	177.626	0.3	1
770	1	69	ALA	CA	C	52.634	0.3	1
771	1	69	ALA	CB	C	19.423	0.3	1
772	1	69	ALA	N	N	124.232	0.13	1
773	1	70	GLN	H	H	8.272	0.05	1
774	1	70	GLN	HA	H	4.302	0.05	1
775	1	70	GLN	HB2	H	2.17	0.05	1
776	1	70	GLN	HB3	H	2.001	0.05	1
777	1	70	GLN	HG2	H	2.458	0.05	2
778	1	70	GLN	HG3	H	2.455	0.05	2
779	1	70	GLN	C	C	175.149	0.3	1
780	1	70	GLN	CA	C	55.136	0.3	1
781	1	70	GLN	CB	C	30.011	0.3	1
782	1	70	GLN	CG	C	33.905	0.3	1
783	1	70	GLN	N	N	120.148	0.13	1
784	1	71	ASP	H	H	8.42	0.05	1
785	1	71	ASP	HA	H	4.709	0.05	1
786	1	71	ASP	HB2	H	2.431	0.05	1
787	1	71	ASP	HB3	H	2.911	0.05	1
788	1	71	ASP	C	C	176.388	0.3	1
789	1	71	ASP	CA	C	55.289	0.3	1
790	1	71	ASP	CB	C	41.006	0.3	1
791	1	71	ASP	N	N	121.207	0.13	1
792	1	72	ALA	H	H	9.631	0.05	1
793	1	72	ALA	HA	H	3.678	0.05	1
794	1	72	ALA	HB1	H	0.195	0.05	1
795	1	72	ALA	HB2	H	0.195	0.05	1
796	1	72	ALA	HB3	H	0.195	0.05	1
797	1	72	ALA	C	C	177.115	0.3	1
798	1	72	ALA	CA	C	52.732	0.3	1
799	1	72	ALA	CB	C	17.513	0.3	1
800	1	72	ALA	N	N	126.037	0.13	1
801	1	73	THR	H	H	7.067	0.05	1
802	1	73	THR	HA	H	4.71	0.05	1
803	1	73	THR	HB	H	3.954	0.05	1
804	1	73	THR	HG21	H	1.146	0.05	1
805	1	73	THR	HG22	H	1.146	0.05	1
806	1	73	THR	HG23	H	1.146	0.05	1
807	1	73	THR	C	C	172.547	0.3	1
808	1	73	THR	CA	C	60.869	0.3	1
809	1	73	THR	CB	C	70.49	0.3	1
810	1	73	THR	CG2	C	22.072	0.3	1
811	1	73	THR	N	N	114.05	0.13	1
812	1	74	PHE	H	H	9.414	0.05	1
813	1	74	PHE	HA	H	4.946	0.05	1
814	1	74	PHE	HB2	H	2.744	0.05	1
815	1	74	PHE	HB3	H	2.977	0.05	1
816	1	74	PHE	HD1	H	7.425	0.05	3
817	1	74	PHE	HD2	H	7.425	0.05	3
818	1	74	PHE	HE1	H	7.279	0.05	3
819	1	74	PHE	HE2	H	7.279	0.05	3
820	1	74	PHE	HZ	H	6.801	0.05	1
821	1	74	PHE	C	C	175.181	0.3	1
822	1	74	PHE	CA	C	56.683	0.3	1
823	1	74	PHE	CB	C	42.268	0.3	1
824	1	74	PHE	CD1	C	130.447	0.3	3
825	1	74	PHE	CD2	C	130.447	0.3	3
826	1	74	PHE	CE1	C	130.947	0.3	3
827	1	74	PHE	CE2	C	130.947	0.3	3
828	1	74	PHE	CZ	C	131.547	0.3	1
829	1	74	PHE	N	N	123.544	0.13	1
830	1	75	SER	H	H	8.969	0.05	1
831	1	75	SER	HA	H	5.335	0.05	1
832	1	75	SER	HB2	H	3.757	0.05	2
833	1	75	SER	HB3	H	3.758	0.05	2
834	1	75	SER	C	C	174.416	0.3	1
835	1	75	SER	CA	C	58.215	0.3	1
836	1	75	SER	CB	C	64.675	0.3	1
837	1	75	SER	N	N	115.755	0.13	1
838	1	76	VAL	H	H	9.131	0.05	1
839	1	76	VAL	HA	H	4.039	0.05	1
840	1	76	VAL	HB	H	2.302	0.05	1
841	1	76	VAL	HG11	H	0.879	0.05	2
842	1	76	VAL	HG12	H	0.879	0.05	2
843	1	76	VAL	HG13	H	0.879	0.05	2
844	1	76	VAL	HG21	H	0.626	0.05	2
845	1	76	VAL	HG22	H	0.626	0.05	2
846	1	76	VAL	HG23	H	0.626	0.05	2
847	1	76	VAL	C	C	176.32	0.3	1
848	1	76	VAL	CA	C	63.521	0.3	1
849	1	76	VAL	CB	C	31.456	0.3	1
850	1	76	VAL	CG1	C	21.629	0.3	2
851	1	76	VAL	CG2	C	22.529	0.3	2
852	1	76	VAL	N	N	123.984	0.13	1
853	1	77	VAL	H	H	9.435	0.05	1
854	1	77	VAL	HA	H	3.85	0.05	1
855	1	77	VAL	HB	H	1.689	0.05	1
856	1	77	VAL	HG21	H	0.795	0.05	1
857	1	77	VAL	HG22	H	0.795	0.05	1
858	1	77	VAL	HG23	H	0.795	0.05	1
859	1	77	VAL	C	C	175.981	0.3	1
860	1	77	VAL	CA	C	64.07	0.3	1
861	1	77	VAL	CB	C	32.794	0.3	1
862	1	77	VAL	CG2	C	20.93	0.3	1
863	1	77	VAL	N	N	132.732	0.13	1
864	1	78	ARG	H	H	7.392	0.05	1
865	1	78	ARG	HA	H	4.363	0.05	1
866	1	78	ARG	HB2	H	1.706	0.05	2
867	1	78	ARG	HB3	H	1.847	0.05	2
868	1	78	ARG	HG2	H	1.299	0.05	2
869	1	78	ARG	HG3	H	1.386	0.05	2
870	1	78	ARG	HD2	H	3.012	0.05	2
871	1	78	ARG	HD3	H	3.162	0.05	2
872	1	78	ARG	C	C	174.14	0.3	1
873	1	78	ARG	CA	C	55.94	0.3	1
874	1	78	ARG	CB	C	33.873	0.3	1
875	1	78	ARG	CG	C	27.326	0.3	1
876	1	78	ARG	CD	C	43.602	0.3	1
877	1	78	ARG	N	N	113.751	0.13	1
878	1	79	VAL	H	H	9.252	0.05	1
879	1	79	VAL	HA	H	4.128	0.05	1
880	1	79	VAL	HB	H	2.093	0.05	1
881	1	79	VAL	HG11	H	0.958	0.05	2
882	1	79	VAL	HG12	H	0.958	0.05	2
883	1	79	VAL	HG13	H	0.958	0.05	2
884	1	79	VAL	HG21	H	0.768	0.05	2
885	1	79	VAL	HG22	H	0.768	0.05	2
886	1	79	VAL	HG23	H	0.768	0.05	2
887	1	79	VAL	C	C	175.561	0.3	1
888	1	79	VAL	CA	C	63.378	0.3	1
889	1	79	VAL	CB	C	30.837	0.3	1
890	1	79	VAL	CG1	C	21.804	0.3	2
891	1	79	VAL	CG2	C	20.692	0.3	2
892	1	79	VAL	N	N	126.67	0.13	1
893	1	80	VAL	H	H	8.094	0.05	1
894	1	80	VAL	HA	H	3.518	0.05	1
895	1	80	VAL	HB	H	1.729	0.05	1
896	1	80	VAL	HG11	H	0.852	0.05	2
897	1	80	VAL	HG12	H	0.852	0.05	2
898	1	80	VAL	HG13	H	0.852	0.05	2
899	1	80	VAL	HG21	H	0.808	0.05	2
900	1	80	VAL	HG22	H	0.808	0.05	2
901	1	80	VAL	HG23	H	0.808	0.05	2
902	1	80	VAL	C	C	175.714	0.3	1
903	1	80	VAL	CA	C	65.885	0.3	1
904	1	80	VAL	CB	C	33.069	0.3	1
905	1	80	VAL	CG1	C	20.564	0.3	2
906	1	80	VAL	CG2	C	21.554	0.3	2
907	1	80	VAL	N	N	130.077	0.13	1
908	1	81	ASP	H	H	8.083	0.05	1
909	1	81	ASP	HA	H	4.545	0.05	1
910	1	81	ASP	HB2	H	3.223	0.05	2
911	1	81	ASP	HB3	H	3.195	0.05	2
912	1	81	ASP	C	C	176.144	0.3	1
913	1	81	ASP	CA	C	53.525	0.3	1
914	1	81	ASP	CB	C	39.328	0.3	1
915	1	81	ASP	N	N	115.04	0.13	1
916	1	82	GLY	H	H	8.67	0.05	1
917	1	82	GLY	HA2	H	3.948	0.05	2
918	1	82	GLY	HA3	H	4.033	0.05	2
919	1	82	GLY	C	C	174.568	0.3	1
920	1	82	GLY	CA	C	47.148	0.3	1
921	1	82	GLY	N	N	103.911	0.13	1
922	1	83	THR	H	H	8.454	0.05	1
923	1	83	THR	HA	H	4.373	0.05	1
924	1	83	THR	HB	H	4.661	0.05	1
925	1	83	THR	HG21	H	1.076	0.05	1
926	1	83	THR	HG22	H	1.076	0.05	1
927	1	83	THR	HG23	H	1.076	0.05	1
928	1	83	THR	C	C	172.662	0.3	1
929	1	83	THR	CA	C	61.069	0.3	1
930	1	83	THR	CB	C	71.642	0.3	1
931	1	83	THR	CG2	C	22.616	0.3	1
932	1	83	THR	N	N	106.441	0.13	1
933	1	84	HIS	H	H	7.722	0.05	1
934	1	84	HIS	HA	H	6.006	0.05	1
935	1	84	HIS	HB2	H	2.693	0.05	1
936	1	84	HIS	HB3	H	2.823	0.05	1
937	1	84	HIS	HD2	H	7.165	0.05	1
938	1	84	HIS	HE1	H	8.351	0.05	1
939	1	84	HIS	C	C	174.159	0.3	1
940	1	84	HIS	CA	C	55.882	0.3	1
941	1	84	HIS	CB	C	30.896	0.3	1
942	1	84	HIS	CD2	C	116.845	0.3	1
943	1	84	HIS	CE1	C	137.364	0.3	1
944	1	84	HIS	N	N	117.307	0.13	1
945	1	85	VAL	H	H	8.769	0.05	1
946	1	85	VAL	HA	H	4.933	0.05	1
947	1	85	VAL	HB	H	2.09	0.05	1
948	1	85	VAL	HG11	H	0.94	0.05	2
949	1	85	VAL	HG12	H	0.94	0.05	2
950	1	85	VAL	HG13	H	0.94	0.05	2
951	1	85	VAL	HG21	H	1.043	0.05	2
952	1	85	VAL	HG22	H	1.043	0.05	2
953	1	85	VAL	HG23	H	1.043	0.05	2
954	1	85	VAL	C	C	172.016	0.3	1
955	1	85	VAL	CA	C	59.35	0.3	1
956	1	85	VAL	CB	C	35.852	0.3	1
957	1	85	VAL	CG1	C	21.422	0.3	2
958	1	85	VAL	CG2	C	22.192	0.3	2
959	1	85	VAL	N	N	117.339	0.13	1
960	1	86	GLU	H	H	9.011	0.05	1
961	1	86	GLU	HA	H	5.492	0.05	1
962	1	86	GLU	HB2	H	1.888	0.05	1
963	1	86	GLU	HB3	H	1.681	0.05	1
964	1	86	GLU	HG2	H	2.007	0.05	2
965	1	86	GLU	HG3	H	2.048	0.05	2
966	1	86	GLU	C	C	176.359	0.3	1
967	1	86	GLU	CA	C	54.887	0.3	1
968	1	86	GLU	CB	C	32.57	0.3	1
969	1	86	GLU	CG	C	36.761	0.3	1
970	1	86	GLU	N	N	125.438	0.13	1
971	1	87	ILE	H	H	9.417	0.05	1
972	1	87	ILE	HA	H	5.785	0.05	1
973	1	87	ILE	HB	H	1.944	0.05	1
974	1	87	ILE	HG12	H	1.401	0.05	2
975	1	87	ILE	HG13	H	0.953	0.05	2
976	1	87	ILE	HG21	H	0.862	0.05	1
977	1	87	ILE	HG22	H	0.862	0.05	1
978	1	87	ILE	HG23	H	0.862	0.05	1
979	1	87	ILE	HD11	H	0.41	0.05	1
980	1	87	ILE	HD12	H	0.41	0.05	1
981	1	87	ILE	HD13	H	0.41	0.05	1
982	1	87	ILE	C	C	173.812	0.3	1
983	1	87	ILE	CA	C	59.11	0.3	1
984	1	87	ILE	CB	C	43.253	0.3	1
985	1	87	ILE	CG1	C	24.816	0.3	1
986	1	87	ILE	CG2	C	18.087	0.3	1
987	1	87	ILE	CD1	C	14.112	0.3	1
988	1	87	ILE	N	N	119.222	0.13	1
989	1	88	THR	H	H	8.471	0.05	1
990	1	88	THR	HA	H	5.158	0.05	1
991	1	88	THR	HB	H	4.107	0.05	1
992	1	88	THR	HG21	H	1.18	0.05	1
993	1	88	THR	HG22	H	1.18	0.05	1
994	1	88	THR	HG23	H	1.18	0.05	1
995	1	88	THR	C	C	172.187	0.3	1
996	1	88	THR	CA	C	57.94	0.3	1
997	1	88	THR	CB	C	72.573	0.3	1
998	1	88	THR	CG2	C	19.392	0.3	1
999	1	88	THR	N	N	113.592	0.13	1
1000	1	89	PRO	HA	H	5.169	0.05	1
1001	1	89	PRO	HB2	H	2.044	0.05	2
1002	1	89	PRO	HB3	H	2.437	0.05	2
1003	1	89	PRO	HG2	H	1.701	0.05	2
1004	1	89	PRO	HG3	H	1.943	0.05	2
1005	1	89	PRO	HD2	H	3.623	0.05	2
1006	1	89	PRO	HD3	H	4.058	0.05	2
1007	1	89	PRO	C	C	174.189	0.3	1
1008	1	89	PRO	CA	C	63.023	0.3	1
1009	1	89	PRO	CB	C	35.021	0.3	1
1010	1	89	PRO	CG	C	24.642	0.3	1
1011	1	89	PRO	CD	C	50.285	0.3	1
1012	1	90	LYS	H	H	7.72	0.05	1
1013	1	90	LYS	HA	H	4.056	0.05	1
1014	1	90	LYS	HB2	H	1.583	0.05	2
1015	1	90	LYS	HB3	H	1.497	0.05	2
1016	1	90	LYS	HG2	H	0.943	0.05	2
1017	1	90	LYS	HG3	H	1.064	0.05	2
1018	1	90	LYS	HD2	H	1.649	0.05	2
1019	1	90	LYS	HD3	H	1.482	0.05	2
1020	1	90	LYS	HE2	H	3.008	0.05	2
1021	1	90	LYS	HE3	H	3.008	0.05	2
1022	1	90	LYS	C	C	175.58	0.3	1
1023	1	90	LYS	CA	C	53.949	0.3	1
1024	1	90	LYS	CB	C	33.143	0.3	1
1025	1	90	LYS	CG	C	23.647	0.3	1
1026	1	90	LYS	CD	C	29.656	0.3	1
1027	1	90	LYS	CE	C	41.479	0.3	1
1028	1	90	LYS	N	N	117.631	0.13	1
1029	1	91	PRO	HA	H	5.05	0.05	1
1030	1	91	PRO	HB2	H	2.064	0.05	2
1031	1	91	PRO	HB3	H	2.071	0.05	2
1032	1	91	PRO	HG2	H	2.058	0.05	2
1033	1	91	PRO	HG3	H	1.394	0.05	2
1034	1	91	PRO	HD2	H	2.868	0.05	2
1035	1	91	PRO	HD3	H	3.758	0.05	2
1036	1	91	PRO	C	C	175.013	0.3	1
1037	1	91	PRO	CA	C	62.3	0.3	1
1038	1	91	PRO	CB	C	30.657	0.3	1
1039	1	91	PRO	CG	C	26.39	0.3	1
1040	1	91	PRO	CD	C	49.757	0.3	1
1041	1	92	VAL	H	H	9.67	0.05	1
1042	1	92	VAL	HA	H	4.162	0.05	1
1043	1	92	VAL	HB	H	2.11	0.05	1
1044	1	92	VAL	HG11	H	0.849	0.05	2
1045	1	92	VAL	HG12	H	0.849	0.05	2
1046	1	92	VAL	HG13	H	0.849	0.05	2
1047	1	92	VAL	HG21	H	0.733	0.05	2
1048	1	92	VAL	HG22	H	0.733	0.05	2
1049	1	92	VAL	HG23	H	0.733	0.05	2
1050	1	92	VAL	C	C	174.579	0.3	1
1051	1	92	VAL	CA	C	62.518	0.3	1
1052	1	92	VAL	CB	C	33.418	0.3	1
1053	1	92	VAL	CG2	C	20.081	0.3	1
1054	1	92	VAL	N	N	130.408	0.13	1
1055	1	93	ALA	H	H	8.945	0.05	1
1056	1	93	ALA	HA	H	4.612	0.05	1
1057	1	93	ALA	HB1	H	1.279	0.05	1
1058	1	93	ALA	HB2	H	1.279	0.05	1
1059	1	93	ALA	HB3	H	1.279	0.05	1
1060	1	93	ALA	C	C	177.23	0.3	1
1061	1	93	ALA	CA	C	51.708	0.3	1
1062	1	93	ALA	CB	C	21.919	0.3	1
1063	1	93	ALA	N	N	131.619	0.13	1
1064	1	94	LEU	H	H	8.661	0.05	1
1065	1	94	LEU	HA	H	3.909	0.05	1
1066	1	94	LEU	HB2	H	1.964	0.05	2
1067	1	94	LEU	HB3	H	1.616	0.05	2
1068	1	94	LEU	HG	H	1.733	0.05	1
1069	1	94	LEU	HD11	H	0.956	0.05	2
1070	1	94	LEU	HD12	H	0.956	0.05	2
1071	1	94	LEU	HD13	H	0.956	0.05	2
1072	1	94	LEU	HD21	H	0.962	0.05	2
1073	1	94	LEU	HD22	H	0.962	0.05	2
1074	1	94	LEU	HD23	H	0.962	0.05	2
1075	1	94	LEU	C	C	176.848	0.3	1
1076	1	94	LEU	CA	C	56.834	0.3	1
1077	1	94	LEU	CB	C	43.424	0.3	1
1078	1	94	LEU	CG	C	26.554	0.3	1
1079	1	94	LEU	CD1	C	25.91	0.3	2
1080	1	94	LEU	CD2	C	23.641	0.3	2
1081	1	94	LEU	N	N	121.75	0.13	1
1082	1	95	ASP	H	H	7.352	0.05	1
1083	1	95	ASP	HA	H	4.426	0.05	1
1084	1	95	ASP	HB2	H	2.634	0.05	1
1085	1	95	ASP	HB3	H	3.154	0.05	1
1086	1	95	ASP	C	C	176.559	0.3	1
1087	1	95	ASP	CA	C	52.788	0.3	1
1088	1	95	ASP	CB	C	40.11	0.3	1
1089	1	95	ASP	N	N	113.763	0.13	1
1090	1	96	ASP	H	H	7.073	0.05	1
1091	1	96	ASP	HA	H	4.62	0.05	1
1092	1	96	ASP	HB2	H	2.646	0.05	1
1093	1	96	ASP	HB3	H	3.337	0.05	1
1094	1	96	ASP	C	C	178.389	0.3	1
1095	1	96	ASP	CA	C	53.896	0.3	1
1096	1	96	ASP	CB	C	40.778	0.3	1
1097	1	96	ASP	N	N	118.077	0.13	1
1098	1	97	VAL	H	H	8.236	0.05	1
1099	1	97	VAL	HA	H	4.074	0.05	1
1100	1	97	VAL	HB	H	2.379	0.05	1
1101	1	97	VAL	HG11	H	1.083	0.05	2
1102	1	97	VAL	HG12	H	1.083	0.05	2
1103	1	97	VAL	HG13	H	1.083	0.05	2
1104	1	97	VAL	HG21	H	1.002	0.05	2
1105	1	97	VAL	HG22	H	1.002	0.05	2
1106	1	97	VAL	HG23	H	1.002	0.05	2
1107	1	97	VAL	C	C	176.311	0.3	1
1108	1	97	VAL	CA	C	63.393	0.3	1
1109	1	97	VAL	CB	C	31.478	0.3	1
1110	1	97	VAL	CG1	C	21.227	0.3	2
1111	1	97	VAL	CG2	C	18.912	0.3	2
1112	1	97	VAL	N	N	124.922	0.13	1
1113	1	98	SER	H	H	8.787	0.05	1
1114	1	98	SER	HA	H	4.378	0.05	1
1115	1	98	SER	HB2	H	3.978	0.05	1
1116	1	98	SER	HB3	H	3.799	0.05	1
1117	1	98	SER	C	C	175.188	0.3	1
1118	1	98	SER	CA	C	59.597	0.3	1
1119	1	98	SER	CB	C	64.114	0.3	1
1120	1	98	SER	N	N	117.235	0.13	1
1121	1	99	LEU	H	H	7.06	0.05	1
1122	1	99	LEU	HA	H	4.481	0.05	1
1123	1	99	LEU	HB2	H	1.476	0.05	1
1124	1	99	LEU	HB3	H	1.809	0.05	1
1125	1	99	LEU	HG	H	1.804	0.05	1
1126	1	99	LEU	HD11	H	0.782	0.05	2
1127	1	99	LEU	HD12	H	0.782	0.05	2
1128	1	99	LEU	HD13	H	0.782	0.05	2
1129	1	99	LEU	HD21	H	1.019	0.05	2
1130	1	99	LEU	HD22	H	1.019	0.05	2
1131	1	99	LEU	HD23	H	1.019	0.05	2
1132	1	99	LEU	C	C	177.323	0.3	1
1133	1	99	LEU	CA	C	54.425	0.3	1
1134	1	99	LEU	CB	C	42.133	0.3	1
1135	1	99	LEU	CG	C	26.523	0.3	1
1136	1	99	LEU	CD1	C	22.921	0.3	2
1137	1	99	LEU	CD2	C	26.904	0.3	2
1138	1	99	LEU	N	N	121.181	0.13	1
1139	1	100	SER	H	H	8.866	0.05	1
1140	1	100	SER	HA	H	4.808	0.05	1
1141	1	100	SER	HB2	H	4.455	0.05	2
1142	1	100	SER	HB3	H	3.988	0.05	2
1143	1	100	SER	C	C	173.394	0.3	1
1144	1	100	SER	CA	C	56.54	0.3	1
1145	1	100	SER	CB	C	62.846	0.3	1
1146	1	100	SER	N	N	120.188	0.13	1
1147	1	101	PRO	HA	H	4.156	0.05	1
1148	1	101	PRO	HB2	H	2.415	0.05	2
1149	1	101	PRO	HB3	H	1.958	0.05	2
1150	1	101	PRO	HG2	H	2.051	0.05	2
1151	1	101	PRO	HG3	H	2.283	0.05	2
1152	1	101	PRO	HD2	H	3.946	0.05	2
1153	1	101	PRO	HD3	H	3.945	0.05	2
1154	1	101	PRO	C	C	179.438	0.3	1
1155	1	101	PRO	CA	C	66.541	0.3	1
1156	1	101	PRO	CB	C	31.688	0.3	1
1157	1	101	PRO	CG	C	28.3	0.3	1
1158	1	101	PRO	CD	C	50.017	0.3	1
1159	1	102	GLU	H	H	8.666	0.05	1
1160	1	102	GLU	HA	H	4.081	0.05	1
1161	1	102	GLU	HB2	H	2.038	0.05	2
1162	1	102	GLU	HB3	H	2.078	0.05	2
1163	1	102	GLU	HG2	H	2.438	0.05	2
1164	1	102	GLU	HG3	H	2.329	0.05	2
1165	1	102	GLU	C	C	179.006	0.3	1
1166	1	102	GLU	CA	C	59.837	0.3	1
1167	1	102	GLU	CB	C	29.14	0.3	1
1168	1	102	GLU	CG	C	37.098	0.3	1
1169	1	102	GLU	N	N	116.201	0.13	1
1170	1	103	GLN	H	H	7.699	0.05	1
1171	1	103	GLN	HA	H	4.164	0.05	1
1172	1	103	GLN	HB2	H	2.589	0.05	2
1173	1	103	GLN	HB3	H	1.762	0.05	2
1174	1	103	GLN	HG2	H	2.595	0.05	2
1175	1	103	GLN	HG3	H	2.313	0.05	2
1176	1	103	GLN	HE21	H	6.863	0.05	1
1177	1	103	GLN	HE22	H	7.591	0.05	1
1178	1	103	GLN	C	C	178.303	0.3	1
1179	1	103	GLN	CA	C	58.133	0.3	1
1180	1	103	GLN	CB	C	30.332	0.3	1
1181	1	103	GLN	CG	C	34.655	0.3	1
1182	1	103	GLN	N	N	117.309	0.13	1
1183	1	103	GLN	NE2	N	110.858	0.13	1
1184	1	104	ARG	H	H	8.5	0.05	1
1185	1	104	ARG	HA	H	3.793	0.05	1
1186	1	104	ARG	HB2	H	1.863	0.05	2
1187	1	104	ARG	HB3	H	1.864	0.05	2
1188	1	104	ARG	HG2	H	1.797	0.05	2
1189	1	104	ARG	HG3	H	1.815	0.05	2
1190	1	104	ARG	HD2	H	3.244	0.05	2
1191	1	104	ARG	HD3	H	3.377	0.05	2
1192	1	104	ARG	C	C	177.731	0.3	1
1193	1	104	ARG	CA	C	59.341	0.3	1
1194	1	104	ARG	CB	C	29.996	0.3	1
1195	1	104	ARG	CG	C	28.581	0.3	1
1196	1	104	ARG	CD	C	43.362	0.3	1
1197	1	104	ARG	N	N	119.479	0.13	1
1198	1	105	ALA	H	H	7.222	0.05	1
1199	1	105	ALA	HA	H	4.032	0.05	1
1200	1	105	ALA	HB1	H	1.177	0.05	1
1201	1	105	ALA	HB2	H	1.177	0.05	1
1202	1	105	ALA	HB3	H	1.177	0.05	1
1203	1	105	ALA	C	C	178.016	0.3	1
1204	1	105	ALA	CA	C	54.122	0.3	1
1205	1	105	ALA	CB	C	18.309	0.3	1
1206	1	105	ALA	N	N	119.978	0.13	1
1207	1	106	TYR	H	H	7.663	0.05	1
1208	1	106	TYR	HA	H	4.402	0.05	1
1209	1	106	TYR	HB2	H	2.886	0.05	1
1210	1	106	TYR	HB3	H	3.399	0.05	1
1211	1	106	TYR	HD1	H	7.29	0.05	3
1212	1	106	TYR	HD2	H	7.29	0.05	3
1213	1	106	TYR	HE1	H	6.821	0.05	3
1214	1	106	TYR	HE2	H	6.821	0.05	3
1215	1	106	TYR	C	C	175.226	0.3	1
1216	1	106	TYR	CA	C	57.704	0.3	1
1217	1	106	TYR	CB	C	38.016	0.3	1
1218	1	106	TYR	CE1	C	118.479	0.3	3
1219	1	106	TYR	CE2	C	118.479	0.3	3
1220	1	106	TYR	N	N	114.712	0.13	1
1221	1	107	ALA	H	H	7.57	0.05	1
1222	1	107	ALA	HA	H	3.988	0.05	1
1223	1	107	ALA	HB1	H	1.396	0.05	1
1224	1	107	ALA	HB2	H	1.396	0.05	1
1225	1	107	ALA	HB3	H	1.396	0.05	1
1226	1	107	ALA	C	C	176.932	0.3	1
1227	1	107	ALA	CA	C	53.728	0.3	1
1228	1	107	ALA	CB	C	17.994	0.3	1
1229	1	107	ALA	N	N	122.089	0.13	1
1230	1	108	ASN	H	H	9.776	0.05	1
1231	1	108	ASN	HA	H	5.02	0.05	1
1232	1	108	ASN	HB2	H	3.259	0.05	2
1233	1	108	ASN	HB3	H	3.026	0.05	2
1234	1	108	ASN	HD21	H	7.208	0.05	1
1235	1	108	ASN	HD22	H	7.871	0.05	1
1236	1	108	ASN	C	C	176.353	0.3	1
1237	1	108	ASN	CA	C	52.755	0.3	1
1238	1	108	ASN	CB	C	39.383	0.3	1
1239	1	108	ASN	N	N	118.012	0.13	1
1240	1	108	ASN	ND2	N	106.346	0.13	1
1241	1	109	VAL	H	H	8.454	0.05	1
1242	1	109	VAL	HA	H	5.958	0.05	1
1243	1	109	VAL	HB	H	2.53	0.05	1
1244	1	109	VAL	HG11	H	0.972	0.05	2
1245	1	109	VAL	HG12	H	0.972	0.05	2
1246	1	109	VAL	HG13	H	0.972	0.05	2
1247	1	109	VAL	HG21	H	0.815	0.05	2
1248	1	109	VAL	HG22	H	0.815	0.05	2
1249	1	109	VAL	HG23	H	0.815	0.05	2
1250	1	109	VAL	C	C	174.991	0.3	1
1251	1	109	VAL	CA	C	58.972	0.3	1
1252	1	109	VAL	CB	C	36.921	0.3	1
1253	1	109	VAL	CG1	C	22.294	0.3	2
1254	1	109	VAL	CG2	C	18.743	0.3	2
1255	1	109	VAL	N	N	116.798	0.13	1
1256	1	110	ASN	H	H	9.478	0.05	1
1257	1	110	ASN	HA	H	4.239	0.05	1
1258	1	110	ASN	HB2	H	2.837	0.05	2
1259	1	110	ASN	HB3	H	2.988	0.05	2
1260	1	110	ASN	HD21	H	7.1	0.05	1
1261	1	110	ASN	HD22	H	8.116	0.05	1
1262	1	110	ASN	C	C	174.388	0.3	1
1263	1	110	ASN	CA	C	56.704	0.3	1
1264	1	110	ASN	CB	C	36.704	0.3	1
1265	1	110	ASN	N	N	118.452	0.13	1
1266	1	110	ASN	ND2	N	114.209	0.13	1
1267	1	111	THR	H	H	7.488	0.05	1
1268	1	111	THR	HA	H	5.414	0.05	1
1269	1	111	THR	HB	H	3.796	0.05	1
1270	1	111	THR	HG21	H	1.108	0.05	1
1271	1	111	THR	HG22	H	1.108	0.05	1
1272	1	111	THR	HG23	H	1.108	0.05	1
1273	1	111	THR	C	C	170.532	0.3	1
1274	1	111	THR	CA	C	59.85	0.3	1
1275	1	111	THR	CB	C	71.195	0.3	1
1276	1	111	THR	CG2	C	17.049	0.3	1
1277	1	111	THR	N	N	115.158	0.13	1
1278	1	112	SER	H	H	6.927	0.05	1
1279	1	112	SER	HA	H	4.443	0.05	1
1280	1	112	SER	HB2	H	4.094	0.05	1
1281	1	112	SER	HB3	H	3.693	0.05	1
1282	1	112	SER	C	C	173.725	0.3	1
1283	1	112	SER	CA	C	56.912	0.3	1
1284	1	112	SER	CB	C	64.361	0.3	1
1285	1	112	SER	N	N	113.049	0.13	1
1286	1	113	LEU	H	H	8.011	0.05	1
1287	1	113	LEU	HA	H	4.186	0.05	1
1288	1	113	LEU	HB2	H	1.878	0.05	1
1289	1	113	LEU	HB3	H	1.2	0.05	1
1290	1	113	LEU	HG	H	1.39	0.05	1
1291	1	113	LEU	HD11	H	0.333	0.05	2
1292	1	113	LEU	HD12	H	0.333	0.05	2
1293	1	113	LEU	HD13	H	0.333	0.05	2
1294	1	113	LEU	HD21	H	-0.037	0.05	2
1295	1	113	LEU	HD22	H	-0.037	0.05	2
1296	1	113	LEU	HD23	H	-0.037	0.05	2
1297	1	113	LEU	C	C	176.138	0.3	1
1298	1	113	LEU	CA	C	55.579	0.3	1
1299	1	113	LEU	CB	C	40.889	0.3	1
1300	1	113	LEU	CG	C	27.57	0.3	1
1301	1	113	LEU	CD1	C	25.256	0.3	2
1302	1	113	LEU	CD2	C	23.355	0.3	2
1303	1	113	LEU	N	N	117.211	0.13	1
1304	1	114	ALA	H	H	8.162	0.05	1
1305	1	114	ALA	HA	H	4.473	0.05	1
1306	1	114	ALA	HB1	H	1.386	0.05	1
1307	1	114	ALA	HB2	H	1.386	0.05	1
1308	1	114	ALA	HB3	H	1.386	0.05	1
1309	1	114	ALA	C	C	175.93	0.3	1
1310	1	114	ALA	CA	C	49.936	0.3	1
1311	1	114	ALA	CB	C	21.591	0.3	1
1312	1	114	ALA	N	N	130.084	0.13	1
1313	1	115	ASP	H	H	8.261	0.05	1
1314	1	115	ASP	HA	H	3.87	0.05	1
1315	1	115	ASP	HB2	H	2.525	0.05	2
1316	1	115	ASP	HB3	H	2.478	0.05	2
1317	1	115	ASP	C	C	176.905	0.3	1
1318	1	115	ASP	CA	C	56.327	0.3	1
1319	1	115	ASP	CB	C	42.063	0.3	1
1320	1	115	ASP	N	N	117.804	0.13	1
1321	1	116	ALA	H	H	8.633	0.05	1
1322	1	116	ALA	HA	H	3.888	0.05	1
1323	1	116	ALA	HB1	H	1.573	0.05	1
1324	1	116	ALA	HB2	H	1.573	0.05	1
1325	1	116	ALA	HB3	H	1.573	0.05	1
1326	1	116	ALA	C	C	175.844	0.3	1
1327	1	116	ALA	CA	C	54.235	0.3	1
1328	1	116	ALA	CB	C	17.145	0.3	1
1329	1	116	ALA	N	N	123.09	0.13	1
1330	1	117	MET	H	H	7.609	0.05	1
1331	1	117	MET	HA	H	4.19	0.05	1
1332	1	117	MET	HB2	H	2.147	0.05	1
1333	1	117	MET	HB3	H	2.147	0.05	1
1334	1	117	MET	HG2	H	2.82	0.05	1
1335	1	117	MET	HG3	H	2.819	0.05	1
1336	1	117	MET	C	C	176.106	0.3	1
1337	1	117	MET	CA	C	57.522	0.3	1
1338	1	117	MET	CB	C	35.982	0.3	1
1339	1	117	MET	CG	C	33.144	0.3	1
1340	1	117	MET	N	N	120.309	0.13	1
1341	1	118	ALA	H	H	8.589	0.05	1
1342	1	118	ALA	HA	H	4.265	0.05	1
1343	1	118	ALA	HB1	H	1.462	0.05	1
1344	1	118	ALA	HB2	H	1.462	0.05	1
1345	1	118	ALA	HB3	H	1.462	0.05	1
1346	1	118	ALA	C	C	176.376	0.3	1
1347	1	118	ALA	CA	C	53.739	0.3	1
1348	1	118	ALA	CB	C	19.487	0.3	1
1349	1	118	ALA	N	N	126.972	0.13	1
1350	1	119	VAL	H	H	7.714	0.05	1
1351	1	119	VAL	HA	H	4.733	0.05	1
1352	1	119	VAL	HB	H	1.674	0.05	1
1353	1	119	VAL	HG11	H	0.529	0.05	2
1354	1	119	VAL	HG12	H	0.529	0.05	2
1355	1	119	VAL	HG13	H	0.529	0.05	2
1356	1	119	VAL	HG21	H	0.98	0.05	2
1357	1	119	VAL	HG22	H	0.98	0.05	2
1358	1	119	VAL	HG23	H	0.98	0.05	2
1359	1	119	VAL	C	C	175.076	0.3	1
1360	1	119	VAL	CA	C	60.584	0.3	1
1361	1	119	VAL	CB	C	33.099	0.3	1
1362	1	119	VAL	CG1	C	20.946	0.3	2
1363	1	119	VAL	CG2	C	22.69	0.3	2
1364	1	119	VAL	N	N	121.103	0.13	1
1365	1	120	ASN	H	H	8.869	0.05	1
1366	1	120	ASN	HA	H	5.068	0.05	1
1367	1	120	ASN	HB2	H	2.521	0.05	1
1368	1	120	ASN	HB3	H	2.609	0.05	1
1369	1	120	ASN	HD21	H	6.741	0.05	1
1370	1	120	ASN	HD22	H	7.425	0.05	1
1371	1	120	ASN	C	C	173.755	0.3	1
1372	1	120	ASN	CA	C	51.859	0.3	1
1373	1	120	ASN	CB	C	41.195	0.3	1
1374	1	120	ASN	N	N	126.068	0.13	1
1375	1	120	ASN	ND2	N	112.591	0.13	1
1376	1	121	ILE	H	H	8.385	0.05	1
1377	1	121	ILE	HA	H	4.561	0.05	1
1378	1	121	ILE	HB	H	1.724	0.05	1
1379	1	121	ILE	HG12	H	0.971	0.05	2
1380	1	121	ILE	HG13	H	1.508	0.05	2
1381	1	121	ILE	HG21	H	0.916	0.05	1
1382	1	121	ILE	HG22	H	0.916	0.05	1
1383	1	121	ILE	HG23	H	0.916	0.05	1
1384	1	121	ILE	HD11	H	0.83	0.05	1
1385	1	121	ILE	HD12	H	0.83	0.05	1
1386	1	121	ILE	HD13	H	0.83	0.05	1
1387	1	121	ILE	C	C	175.901	0.3	1
1388	1	121	ILE	CA	C	60.801	0.3	1
1389	1	121	ILE	CB	C	39.05	0.3	1
1390	1	121	ILE	CG1	C	27.949	0.3	1
1391	1	121	ILE	CG2	C	17.776	0.3	1
1392	1	121	ILE	CD1	C	13.741	0.3	1
1393	1	121	ILE	N	N	122.721	0.13	1
1394	1	122	LEU	H	H	8.879	0.05	1
1395	1	122	LEU	HA	H	4.435	0.05	1
1396	1	122	LEU	HB2	H	1.585	0.05	2
1397	1	122	LEU	HB3	H	1.58	0.05	2
1398	1	122	LEU	HG	H	1.55	0.05	1
1399	1	122	LEU	HD11	H	0.801	0.05	2
1400	1	122	LEU	HD12	H	0.801	0.05	2
1401	1	122	LEU	HD13	H	0.801	0.05	2
1402	1	122	LEU	HD21	H	0.809	0.05	2
1403	1	122	LEU	HD22	H	0.809	0.05	2
1404	1	122	LEU	HD23	H	0.809	0.05	2
1405	1	122	LEU	C	C	176.441	0.3	1
1406	1	122	LEU	CA	C	55.152	0.3	1
1407	1	122	LEU	CB	C	42.434	0.3	1
1408	1	122	LEU	CG	C	27.865	0.3	1
1409	1	122	LEU	CD1	C	24.166	0.3	2
1410	1	122	LEU	CD2	C	25.201	0.3	2
1411	1	122	LEU	N	N	129.303	0.13	1
1412	1	123	ASN	H	H	8.46	0.05	1
1413	1	123	ASN	HA	H	4.826	0.05	1
1414	1	123	ASN	HB2	H	2.803	0.05	2
1415	1	123	ASN	HB3	H	2.735	0.05	2
1416	1	123	ASN	C	C	174.207	0.3	1
1417	1	123	ASN	CA	C	53.318	0.3	1
1418	1	123	ASN	CB	C	39.093	0.3	1
1419	1	123	ASN	N	N	120.564	0.13	1
1420	1	124	VAL	H	H	7.673	0.05	1
1421	1	124	VAL	HA	H	4.094	0.05	1
1422	1	124	VAL	HB	H	2.129	0.05	1
1423	1	124	VAL	HG11	H	0.92	0.05	2
1424	1	124	VAL	HG12	H	0.92	0.05	2
1425	1	124	VAL	HG13	H	0.92	0.05	2
1426	1	124	VAL	HG21	H	0.932	0.05	2
1427	1	124	VAL	HG22	H	0.932	0.05	2
1428	1	124	VAL	HG23	H	0.932	0.05	2
1429	1	124	VAL	C	C	180.816	0.3	1
1430	1	124	VAL	CA	C	63.499	0.3	1
1431	1	124	VAL	CB	C	33.396	0.3	1
1432	1	124	VAL	CG1	C	21.633	0.3	2
1433	1	124	VAL	CG2	C	20.117	0.3	2
1434	1	124	VAL	N	N	123.58	0.13	1

LACS Plot; CA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.13 ppm, Outliers: 1 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: -0.13 ppm, Outliers: 1 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: 0.0 ppm, Outliers: 1 Detail

LACS Plot; CO

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	na	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	na	indirect	0.1013291

Referencing offset: 0.55 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 30 models in PDB: 2M5S, Strand ID: A Detail

Release date

2012-07-02

Citation

NMR assignments for the telokin-like domain of bacteriophage P22 coat protein
Rizzo, A.A., Fraser, L.C.R., Sheftic, S.R., Suhanovsky, M.M., Teschke, C.M., Alexandrescu, A.T.
Biomol. NMR Assign. (2013), 7, 257-260, PubMed 22987227 , DOI 10.1007/s12104-012-9422-x , Abstract

Related entities 1. TL-domain, : 1 : 6 : 1 entities Detail

Interaction partners 1. TL-domain, : 1 interactors Detail

More details for 1 interactors identified by 1 citations

Experiments performed 18 experiments Detail

1 2D 1H-15N HSQC

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
7	TL-domain	[U-15N]	1.5 mM
8	sodium phosphate	natural abundance	20 mM
9	sodium azide	natural abundance	0.2 % w/v

2 2D 1H-13C HSQC

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 99.8% D2O/0.2% H2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
4	TL-domain	[U-13C; U-15N]	1.5 mM
5	sodium phosphate	natural abundance	20 mM
6	sodium azide	natural abundance	0.2 % w/v

3 2D DQF-COSY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 99.8% D2O/0.2% H2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
10	TL-domain	natural abundance	1.5 mM
11	sodium phosphate	natural abundance	20 mM
12	sodium azide	natural abundance	0.2 % w/v

4 2D DQF-TOCSY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 99.8% D2O/0.2% H2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
10	TL-domain	natural abundance	1.5 mM
11	sodium phosphate	natural abundance	20 mM
12	sodium azide	natural abundance	0.2 % w/v

5 3D C(CO)NH

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

6 3D HNCO

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

7 3D HNCA

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

8 3D HNCACB

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

9 3D HN(CO)CA

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

10 3D H(CCO)NH

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

11 3D HCCH-TOCSY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 99.8% D2O/0.2% H2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
4	TL-domain	[U-13C; U-15N]	1.5 mM
5	sodium phosphate	natural abundance	20 mM
6	sodium azide	natural abundance	0.2 % w/v

12 3D HNHA

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
7	TL-domain	[U-15N]	1.5 mM
8	sodium phosphate	natural abundance	20 mM
9	sodium azide	natural abundance	0.2 % w/v

13 3D 1H-15N NOESY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
7	TL-domain	[U-15N]	1.5 mM
8	sodium phosphate	natural abundance	20 mM
9	sodium azide	natural abundance	0.2 % w/v

14 3D 1H-15N NOESY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
7	TL-domain	[U-15N]	1.5 mM
8	sodium phosphate	natural abundance	20 mM
9	sodium azide	natural abundance	0.2 % w/v

15 3D HNHB

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
7	TL-domain	[U-15N]	1.5 mM
8	sodium phosphate	natural abundance	20 mM
9	sodium azide	natural abundance	0.2 % w/v

16 3D HN(CA)CO

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
1	TL-domain	[U-13C; U-15N]	1.5 mM
2	sodium phosphate	natural abundance	20 mM
3	sodium azide	natural abundance	0.2 % w/v

17 2D H-H NOESY (50ms)

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 99.8% D2O/0.2% H2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
10	TL-domain	natural abundance	1.5 mM
11	sodium phosphate	natural abundance	20 mM
12	sodium azide	natural abundance	0.2 % w/v

18 3D CCH-TOCSY

Instrument

Varian Inova - 600 MHz

Sample

State isotropic, Solvent system 99.8% D2O/0.2% H2O, Pressure 1 atm, Temperature 310 K, pH 6.00

#	Name	Isotope labeling	Concentration
4	TL-domain	[U-13C; U-15N]	1.5 mM
5	sodium phosphate	natural abundance	20 mM
6	sodium azide	natural abundance	0.2 % w/v

NMR combined restraints 6 contents Detail

Properties

Input source #1: NMR data (NEF) - Assigned chemical shifts, Distance restraints, Dihedral angle restraints	combined_18566_2m5s.nef
Input source #2: Coordindates	2m5s.cif
Diamagnetism of the molecular assembly	True (excluding Oxygen atoms)
Whether the assembly has a disulfide bond	None
Whether the assembly has a other bond	None
Whether the assembly contains a cyclic polymer	None
Overall data processing status	Warning

Disulfide bonds

None

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

None

Non-standard residues

None

Sequence alignments

Entity_assembly_ID (NMR): A vs Auth_asym_ID (model): A

--220-------230-------240-------250-------260-------270-------280-------290-------300-------310-----
HHHHHHGSTATGITVSGAQSFKPVAWQLDNDGNKVNVDNRFATVTLSATTGMKRGDKISFAGVKFLGQMAKNVLAQDATFSVVRVVDGTHVEITPKPVAL
||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
HHHHHHGSTATGITVSGAQSFKPVAWQLDNDGNKVNVDNRFATVTLSATTGMKRGDKISFAGVKFLGQMAKNVLAQDATFSVVRVVDGTHVEITPKPVAL
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100

--320-------330-------340-----
DDVSLSPEQRAYANVNTSLADAMAVNILNV
||||||||||||||||||||||||||||||
DDVSLSPEQRAYANVNTSLADAMAVNILNV
-------110-------120-------130

Chain assignments

Entity_assembly_ID (NMR)	Auth_asym_ID (model)	Length	Unmapped	Conflict	Sequence coverage (%)
A	A	130	0	0	100.0

Content subtype: combined_18566_2m5s.nef

#	Content subtype	Saveframe	Status	# of rows (sets)	Experiment type	Sequence coverage (%)
1	Assigned chemical shifts	TL-domain_shifts	Warning	1268		94.6 (chain: A, length: 130)
1	Distance restraints	CNS/XPLOR_distance_constraints_5	OK	4199 (1)	noe	92.3 (chain: A, length: 130)
2	Distance restraints	CNS/XPLOR_distance_constraints_2	Warning	52 (1)	hbond	27.7 (chain: A, length: 130)
1	Dihedral angle restraints	CNS/XPLOR_dihedral_3	Warning	15 (15)	.	11.5 (chain: A, length: 130)
2	Dihedral angle restraints	CNS/XPLOR_dihedral_4	OK	152 (152)	.	78.5 (chain: A, length: 130)

Assigned chemical shifts

Saveframe: TL-domain_shifts
- Status: Warning
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 130, Sequence coverage: 94.6%
- Total number of assignments
  - ¹H chemical shifts: 638
  - ¹³C chemical shifts: 511
  - ¹⁵N chemical shifts: 119
- Completeness of assignments
  - Entity_assemble_ID: A
- Peptide bond of PRO
- Tautomeric state of HIS
- Rotameric state of ILE , LEU, and VAL
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: A

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	723	638	88.2
¹³C chemical shifts	560	511	91.2
¹⁵N chemical shifts	145	119	82.1

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	265	241	90.9
¹³C chemical shifts	260	243	93.5
¹⁵N chemical shifts	126	114	90.5

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	458	397	86.7
¹³C chemical shifts	300	268	89.3
¹⁵N chemical shifts	19	5	26.3

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	87	83	95.4
¹³C chemical shifts	87	82	94.3

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	49	35	71.4
¹³C chemical shifts	48	27	56.2
¹⁵N chemical shifts	1	1	100.0

Distance restraints

Saveframe: CNS/XPLOR_distance_constraints_5
- Status: OK
- Experiment type: noe
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 130, Sequence coverage: 92.3%
- Total number of restraints: 4184
- Weight of restraints: 1.0 (4184)
- Potential type of restraints: square-well-parabolic (4184)
- Range of distance target values: 1.4, 8.49 (Å)
- Histogram of distance target values
- Histogram of discrepancy in distance target values
- Distance restraints per residue
  - Chain_ID: A
- Distance restraints on contact map
- Saveframe: CNS/XPLOR_distance_constraints_2
  - Status: Warning
  - Experiment type: hbond
  - Sequence coverage of experimental data
    - Entity_assembly_ID: A, Chain length: 130, Sequence coverage: 27.7%
  - Total number of restraints: 52
  - Weight of restraints: 1.0 (52)
  - Potential type of restraints: square-well-parabolic (52)
  - Range of distance target values: 2.21, 3.22 (Å)
  - Histogram of distance target values
  - Distance restraints per residue
    - Chain_ID: A
  - Distance restraints on contact map

Dihedral angle restraints

Saveframe: CNS/XPLOR_dihedral_3
- Status: Warning
- Experiment type: .
- Sequence coverage of experimental data
  - Entity_assembly_ID: A, Chain length: 130, Sequence coverage: 11.5%
- Total number of restraints: 15
- Total number of restraints per polymer type: 15
- Weight of restraints: 1.0 (15)
- Potential type of restraints: square-well-parabolic (15)
- Dihedral angle restraints per residue
- Saveframe: CNS/XPLOR_dihedral_4
  - Status: OK
  - Experiment type: .
  - Sequence coverage of experimental data
    - Entity_assembly_ID: A, Chain length: 130, Sequence coverage: 78.5%
  - Total number of restraints: 152
  - Total number of restraints per polymer type: 152
  - Weight of restraints: 1.0 (152)
  - Potential type of restraints: square-well-parabolic (152)
  - Plot of Phi-Psi angle restraints
  - Dihedral angle restraints per residue
    - Chain_ID: A

Keywords D-loop, capsid, extra-density domain, procapsid, virus assembly

Search

Query history

Resources

Search for primary databases

Search for subsidiary databases

Display

Hits per page

Statistics

Query Changes will take effect after "OK" button is selected.

Maximum hits

Default conjunction operator

Omni-box

Search filter

Sequence search (BLAST)

E-value

Query sequence coverage

Miscellaneous

The number of previewed publications

Completeness of assigned chemical shift

Sequence chart about top aligned regions

Sequence chart about interacting regions

Hit context with highlight

Link destinations for BMRB, PDB and EMDB

Found 1 Document (0.785 seconds)

BMRB: 18566

Chemical shift reference

Chemical shift reference

Chemical shift reference

Chemical shift reference

Related entities 1. TL-domain, : 1 : 6 : 1 entities Detail

Interaction partners 1. TL-domain, : 1 interactors Detail

Experiments performed 18 experiments Detail

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

NMR combined restraints 6 contents Detail