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BMRB: 34889

8RJX

Solution structure of osmoregulator OsmY from E. coli.

Authors

Iyer, A., Luo, Y., le Paige, U.B.A., van Ingen, H.

Assembly

Osmotically-inducible protein Y

Entity

1. Osmotically-inducible protein Y (polymer, Thiol state: not present), 182 monomers, 19154.90 Da Detail

ENNAQTTNES AGQKVDSSMN KVGNFMDDSA ITAKVKAALV DHDNIKSTDI SVKTDQKVVT LSGFVESQAQ AEEAVKVAKG VEGVTSVSDK LHVRDAKEGS VKGYAGDTAT TSEIKAKLLA DDIVPSRHVK VETTDGVVQL SGTVDSQAQS DRAESIAKAV DGVKSVKNDL KTKGGGHHHH HH

Formula weight

19154.9 Da

Source organism

Escherichia coli

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 1089, ¹³C: 463, ¹⁵N: 167 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	1	GLU	HA	H	4.383	0.020	1
2	1	1	GLU	HB2	H	2.047	0.020	2
3	1	1	GLU	HB3	H	2.185	0.020	2
4	1	1	GLU	HG2	H	2.368	0.020	2
5	1	1	GLU	HG3	H	2.423	0.020	2
6	1	1	GLU	CA	C	57.901	0.400	1
7	1	1	GLU	CB	C	30.916	0.400	1
8	1	1	GLU	CG	C	36.709	0.400	1
9	1	2	ASN	H	H	8.828	0.020	1
10	1	2	ASN	HB2	H	2.761	0.020	2
11	1	2	ASN	HB3	H	2.761	0.020	2
12	1	2	ASN	HD21	H	7.303	0.020	2
13	1	2	ASN	CB	C	38.870	0.400	1
14	1	2	ASN	N	N	117.216	0.400	1
15	1	3	ASN	H	H	8.193	0.020	1
16	1	3	ASN	HA	H	4.683	0.020	1
17	1	3	ASN	HB2	H	2.780	0.020	2
18	1	3	ASN	HB3	H	2.784	0.020	2
19	1	3	ASN	CA	C	53.346	0.400	1
20	1	3	ASN	CB	C	39.088	0.400	1
21	1	3	ASN	N	N	121.899	0.400	1
22	1	4	ALA	H	H	8.279	0.020	1
23	1	4	ALA	HA	H	4.297	0.020	1
24	1	4	ALA	HB1	H	1.390	0.020	1
25	1	4	ALA	HB2	H	1.390	0.020	1
26	1	4	ALA	HB3	H	1.390	0.020	1
27	1	4	ALA	CA	C	52.877	0.400	1
28	1	4	ALA	CB	C	19.316	0.400	1
29	1	5	GLN	H	H	8.385	0.020	1
30	1	5	GLN	HA	H	4.371	0.020	1
31	1	5	GLN	HB2	H	2.045	0.020	2
32	1	5	GLN	HB3	H	2.067	0.020	2
33	1	5	GLN	HG3	H	2.545	0.020	2
34	1	5	GLN	HE21	H	7.278	0.020	2
35	1	5	GLN	HE22	H	7.611	0.020	2
36	1	5	GLN	CA	C	56.123	0.400	1
37	1	5	GLN	CB	C	29.436	0.400	1
38	1	5	GLN	N	N	118.890	0.400	1
39	1	5	GLN	NE2	N	113.561	0.400	1
40	1	6	THR	H	H	8.215	0.020	1
41	1	6	THR	HA	H	4.293	0.020	1
42	1	6	THR	HB	H	3.875	0.020	1
43	1	6	THR	HG21	H	0.811	0.020	1
44	1	6	THR	HG22	H	0.811	0.020	1
45	1	6	THR	HG23	H	0.811	0.020	1
46	1	6	THR	CA	C	61.952	0.400	1
47	1	6	THR	CB	C	69.651	0.400	1
48	1	6	THR	N	N	115.110	0.400	1
49	1	7	THR	H	H	8.200	0.020	1
50	1	7	THR	HA	H	3.752	0.020	1
51	1	7	THR	HB	H	4.298	0.020	1
52	1	7	THR	HG1	H	2.075	0.020	1
53	1	7	THR	CA	C	61.728	0.400	1
54	1	7	THR	CG2	C	23.175	0.400	1
55	1	7	THR	N	N	115.796	0.400	1
56	1	8	ASN	H	H	8.506	0.020	1
57	1	8	ASN	HA	H	4.721	0.020	1
58	1	8	ASN	HB2	H	2.782	0.020	2
59	1	8	ASN	HB3	H	2.782	0.020	2
60	1	8	ASN	HD21	H	6.954	0.020	2
61	1	8	ASN	HD22	H	7.879	0.020	2
62	1	8	ASN	CA	C	53.411	0.400	1
63	1	8	ASN	CB	C	39.087	0.400	1
64	1	8	ASN	ND2	N	113.500	0.400	1
65	1	9	GLU	H	H	8.483	0.020	1
66	1	9	GLU	HA	H	4.252	0.020	1
67	1	9	GLU	HB2	H	1.976	0.020	2
68	1	9	GLU	HB3	H	1.975	0.020	2
69	1	9	GLU	HG2	H	2.265	0.020	2
70	1	9	GLU	HG3	H	2.268	0.020	2
71	1	9	GLU	CA	C	56.966	0.400	1
72	1	9	GLU	CB	C	30.071	0.400	1
73	1	9	GLU	CG	C	36.194	0.400	1
74	1	10	SER	H	H	8.325	0.020	1
75	1	10	SER	HA	H	4.422	0.020	1
76	1	10	SER	HB2	H	3.861	0.020	2
77	1	10	SER	HB3	H	3.866	0.020	2
78	1	10	SER	HG	H	4.775	0.020	1
79	1	10	SER	CA	C	58.704	0.400	1
80	1	10	SER	CB	C	63.553	0.400	1
81	1	10	SER	N	N	116.596	0.400	1
82	1	11	ALA	H	H	8.282	0.020	1
83	1	11	ALA	HA	H	4.308	0.020	1
84	1	11	ALA	HB1	H	1.404	0.020	1
85	1	11	ALA	HB2	H	1.404	0.020	1
86	1	11	ALA	HB3	H	1.404	0.020	1
87	1	11	ALA	CA	C	52.883	0.400	1
88	1	11	ALA	CB	C	19.191	0.400	1
89	1	11	ALA	N	N	125.563	0.400	1
90	1	12	GLY	H	H	8.285	0.020	1
91	1	12	GLY	HA2	H	3.931	0.020	2
92	1	12	GLY	HA3	H	3.933	0.020	2
93	1	12	GLY	CA	C	45.347	0.400	1
94	1	13	GLN	H	H	8.103	0.020	1
95	1	13	GLN	HA	H	4.320	0.020	1
96	1	13	GLN	HB2	H	2.008	0.020	2
97	1	13	GLN	HB3	H	2.011	0.020	2
98	1	13	GLN	CA	C	55.812	0.400	1
99	1	13	GLN	CB	C	29.422	0.400	1
100	1	13	GLN	N	N	119.696	0.400	1
101	1	14	LYS	H	H	8.381	0.020	1
102	1	14	LYS	HA	H	4.339	0.020	1
103	1	14	LYS	HB2	H	1.750	0.020	2
104	1	14	LYS	HB3	H	1.763	0.020	2
105	1	14	LYS	HG2	H	1.165	0.020	2
106	1	14	LYS	HG3	H	1.249	0.020	2
107	1	14	LYS	HD2	H	1.491	0.020	2
108	1	14	LYS	HE2	H	3.040	0.020	2
109	1	14	LYS	HE3	H	3.041	0.020	2
110	1	14	LYS	CA	C	56.389	0.400	1
111	1	14	LYS	CB	C	33.044	0.400	1
112	1	14	LYS	CD	C	29.344	0.400	1
113	1	14	LYS	CE	C	43.131	0.400	1
114	1	14	LYS	N	N	122.899	0.400	1
115	1	15	VAL	H	H	8.221	0.020	1
116	1	15	VAL	HA	H	4.128	0.020	1
117	1	15	VAL	HB	H	2.054	0.020	1
118	1	15	VAL	HG11	H	0.922	0.020	2
119	1	15	VAL	HG12	H	0.922	0.020	2
120	1	15	VAL	HG13	H	0.922	0.020	2
121	1	15	VAL	HG21	H	0.925	0.020	2
122	1	15	VAL	HG22	H	0.925	0.020	2
123	1	15	VAL	HG23	H	0.925	0.020	2
124	1	15	VAL	CA	C	62.339	0.400	1
125	1	15	VAL	CB	C	32.788	0.400	1
126	1	15	VAL	CG2	C	23.678	0.400	2
127	1	15	VAL	N	N	121.667	0.400	1
128	1	16	ASP	H	H	8.431	0.020	1
129	1	16	ASP	HA	H	4.655	0.020	1
130	1	16	ASP	HB2	H	2.682	0.020	2
131	1	16	ASP	HB3	H	2.683	0.020	2
132	1	16	ASP	CA	C	54.159	0.400	1
133	1	16	ASP	CB	C	41.360	0.400	1
134	1	16	ASP	N	N	124.696	0.400	1
135	1	17	SER	H	H	8.429	0.020	1
136	1	17	SER	HA	H	4.425	0.020	1
137	1	17	SER	HB2	H	3.906	0.020	2
138	1	17	SER	HB3	H	3.911	0.020	2
139	1	17	SER	CA	C	58.765	0.400	1
140	1	17	SER	CB	C	63.680	0.400	1
141	1	17	SER	N	N	118.156	0.400	1
142	1	18	SER	H	H	8.499	0.020	1
143	1	18	SER	HA	H	4.353	0.020	1
144	1	18	SER	HB2	H	3.912	0.020	2
145	1	18	SER	HB3	H	3.922	0.020	2
146	1	18	SER	CB	C	63.662	0.400	1
147	1	18	SER	N	N	118.147	0.400	1
148	1	19	MET	H	H	8.107	0.020	1
149	1	19	MET	HA	H	4.444	0.020	1
150	1	19	MET	HB2	H	2.025	0.020	2
151	1	19	MET	HB3	H	2.030	0.020	2
152	1	19	MET	HE1	H	1.267	0.020	1
153	1	19	MET	HE2	H	1.267	0.020	1
154	1	19	MET	HE3	H	1.267	0.020	1
155	1	19	MET	CA	C	55.844	0.400	1
156	1	19	MET	CB	C	32.553	0.400	1
157	1	19	MET	CE	C	17.674	0.400	1
158	1	20	ASN	H	H	8.225	0.020	1
159	1	20	ASN	HA	H	4.068	0.020	1
160	1	20	ASN	HB2	H	2.971	0.020	2
161	1	20	ASN	CA	C	53.476	0.400	1
162	1	20	ASN	CB	C	38.448	0.400	1
163	1	21	LYS	H	H	8.102	0.020	1
164	1	21	LYS	HA	H	4.334	0.020	1
165	1	21	LYS	HB2	H	1.752	0.020	2
166	1	21	LYS	HB3	H	1.756	0.020	2
167	1	21	LYS	HE3	H	3.029	0.020	2
168	1	21	LYS	CA	C	56.397	0.400	1
169	1	21	LYS	CB	C	33.016	0.400	1
170	1	21	LYS	CG	C	25.033	0.400	1
171	1	21	LYS	N	N	111.813	0.400	1
172	1	22	VAL	H	H	8.097	0.020	1
173	1	22	VAL	HA	H	4.130	0.020	1
174	1	22	VAL	HB	H	2.094	0.020	1
175	1	22	VAL	HG11	H	0.783	0.020	2
176	1	22	VAL	HG12	H	0.783	0.020	2
177	1	22	VAL	HG13	H	0.783	0.020	2
178	1	22	VAL	HG21	H	0.783	0.020	2
179	1	22	VAL	HG22	H	0.783	0.020	2
180	1	22	VAL	HG23	H	0.783	0.020	2
181	1	22	VAL	CA	C	62.419	0.400	1
182	1	22	VAL	CB	C	32.708	0.400	1
183	1	22	VAL	CG1	C	17.688	0.400	2
184	1	22	VAL	CG2	C	23.600	0.400	2
185	1	22	VAL	N	N	120.634	0.400	1
186	1	23	GLY	H	H	8.394	0.020	1
187	1	23	GLY	HA2	H	3.897	0.020	2
188	1	23	GLY	HA3	H	3.897	0.020	2
189	1	23	GLY	CA	C	45.244	0.400	1
190	1	23	GLY	N	N	111.935	0.400	1
191	1	24	ASN	H	H	8.295	0.020	1
192	1	24	ASN	HA	H	4.637	0.020	1
193	1	24	ASN	HB2	H	2.693	0.020	2
194	1	24	ASN	HB3	H	2.698	0.020	2
195	1	24	ASN	HD21	H	7.148	0.020	2
196	1	24	ASN	HD22	H	7.151	0.020	2
197	1	24	ASN	N	N	118.962	0.400	1
198	1	25	PHE	H	H	8.238	0.020	1
199	1	25	PHE	HA	H	4.580	0.020	1
200	1	25	PHE	HB2	H	3.090	0.020	2
201	1	25	PHE	HB3	H	3.161	0.020	2
202	1	25	PHE	HD1	H	7.252	0.020	1
203	1	25	PHE	HD2	H	7.261	0.020	1
204	1	25	PHE	HE1	H	7.336	0.020	1
205	1	25	PHE	HE2	H	7.338	0.020	1
206	1	25	PHE	CA	C	58.362	0.400	1
207	1	25	PHE	CB	C	39.276	0.400	1
208	1	26	MET	H	H	8.161	0.020	1
209	1	26	MET	HA	H	4.383	0.020	1
210	1	26	MET	HB2	H	1.970	0.020	2
211	1	26	MET	HB3	H	1.973	0.020	2
212	1	26	MET	HG2	H	2.414	0.020	2
213	1	26	MET	HG3	H	2.508	0.020	2
214	1	26	MET	HE1	H	0.764	0.020	1
215	1	26	MET	HE2	H	0.764	0.020	1
216	1	26	MET	HE3	H	0.764	0.020	1
217	1	26	MET	CA	C	55.921	0.400	1
218	1	26	MET	CB	C	32.893	0.400	1
219	1	26	MET	CG	C	32.089	0.400	1
220	1	26	MET	N	N	121.824	0.400	1
221	1	27	ASP	H	H	7.990	0.020	1
222	1	27	ASP	HA	H	4.599	0.020	1
223	1	27	ASP	HB2	H	2.720	0.020	2
224	1	27	ASP	HB3	H	2.899	0.020	2
225	1	27	ASP	CA	C	54.118	0.400	1
226	1	27	ASP	CB	C	41.533	0.400	1
227	1	27	ASP	N	N	121.499	0.400	1
228	1	28	ASP	H	H	8.343	0.020	1
229	1	28	ASP	HA	H	4.376	0.020	1
230	1	28	ASP	HB2	H	2.625	0.020	2
231	1	28	ASP	HB3	H	2.660	0.020	2
232	1	28	ASP	CA	C	58.137	0.400	1
233	1	28	ASP	CB	C	40.530	0.400	1
234	1	28	ASP	N	N	121.198	0.400	1
235	1	29	SER	H	H	8.335	0.020	1
236	1	29	SER	HA	H	3.956	0.020	1
237	1	29	SER	HB2	H	3.958	0.020	2
238	1	29	SER	HB3	H	3.967	0.020	2
239	1	29	SER	HG	H	4.772	0.020	1
240	1	29	SER	CB	C	62.632	0.400	1
241	1	29	SER	N	N	114.943	0.400	1
242	1	30	ALA	H	H	7.946	0.020	1
243	1	30	ALA	HA	H	4.237	0.020	1
244	1	30	ALA	HB1	H	1.577	0.020	1
245	1	30	ALA	HB2	H	1.577	0.020	1
246	1	30	ALA	HB3	H	1.577	0.020	1
247	1	30	ALA	CA	C	54.799	0.400	1
248	1	30	ALA	CB	C	18.540	0.400	1
249	1	30	ALA	N	N	126.997	0.400	1
250	1	31	ILE	H	H	8.026	0.020	1
251	1	31	ILE	HA	H	3.540	0.020	1
252	1	31	ILE	HB	H	2.053	0.020	1
253	1	31	ILE	HG12	H	1.049	0.020	2
254	1	31	ILE	HG13	H	1.755	0.020	2
255	1	31	ILE	HG21	H	0.754	0.020	1
256	1	31	ILE	HG22	H	0.754	0.020	1
257	1	31	ILE	HG23	H	0.754	0.020	1
258	1	31	ILE	HD11	H	0.770	0.020	1
259	1	31	ILE	HD12	H	0.770	0.020	1
260	1	31	ILE	HD13	H	0.770	0.020	1
261	1	31	ILE	CA	C	65.790	0.400	1
262	1	31	ILE	CB	C	37.386	0.400	1
263	1	31	ILE	CG1	C	29.585	0.400	1
264	1	31	ILE	CG2	C	13.582	0.400	1
265	1	31	ILE	CD1	C	13.583	0.400	1
266	1	31	ILE	N	N	120.891	0.400	1
267	1	32	THR	H	H	8.430	0.020	1
268	1	32	THR	HA	H	3.465	0.020	1
269	1	32	THR	HB	H	4.365	0.020	1
270	1	32	THR	HG1	H	4.369	0.020	1
271	1	32	THR	CA	C	67.080	0.400	1
272	1	32	THR	CB	C	68.504	0.400	1
273	1	32	THR	CG2	C	22.563	0.400	1
274	1	32	THR	N	N	118.157	0.400	1
275	1	33	ALA	H	H	7.697	0.020	1
276	1	33	ALA	HA	H	4.061	0.020	1
277	1	33	ALA	HB1	H	1.526	0.020	1
278	1	33	ALA	HB2	H	1.526	0.020	1
279	1	33	ALA	HB3	H	1.526	0.020	1
280	1	33	ALA	CA	C	55.435	0.400	1
281	1	33	ALA	CB	C	17.974	0.400	1
282	1	33	ALA	N	N	121.152	0.400	1
283	1	34	LYS	H	H	8.026	0.020	1
284	1	34	LYS	HA	H	4.113	0.020	1
285	1	34	LYS	HB2	H	1.938	0.020	2
286	1	34	LYS	HB3	H	1.965	0.020	2
287	1	34	LYS	HG2	H	1.520	0.020	2
288	1	34	LYS	HG3	H	1.715	0.020	2
289	1	34	LYS	HD2	H	1.883	0.020	2
290	1	34	LYS	HD3	H	2.039	0.020	2
291	1	34	LYS	HE2	H	2.968	0.020	2
292	1	34	LYS	CA	C	59.554	0.400	1
293	1	34	LYS	CG	C	25.883	0.400	1
294	1	34	LYS	CE	C	44.227	0.400	1
295	1	34	LYS	N	N	120.103	0.400	1
296	1	35	VAL	H	H	9.015	0.020	1
297	1	35	VAL	HA	H	3.600	0.020	1
298	1	35	VAL	HB	H	2.165	0.020	1
299	1	35	VAL	CA	C	66.907	0.400	1
300	1	35	VAL	CB	C	31.456	0.400	1
301	1	35	VAL	CG1	C	22.701	0.400	2
302	1	35	VAL	CG2	C	22.944	0.400	2
303	1	35	VAL	N	N	121.940	0.400	1
304	1	36	LYS	H	H	8.579	0.020	1
305	1	36	LYS	HA	H	3.800	0.020	1
306	1	36	LYS	HB2	H	1.874	0.020	2
307	1	36	LYS	HB3	H	1.877	0.020	2
308	1	36	LYS	HD2	H	1.790	0.020	2
309	1	36	LYS	HD3	H	1.934	0.020	2
310	1	36	LYS	HE2	H	2.971	0.020	2
311	1	36	LYS	HE3	H	3.034	0.020	2
312	1	36	LYS	CA	C	60.692	0.400	1
313	1	36	LYS	CB	C	31.963	0.400	1
314	1	36	LYS	CD	C	32.207	0.400	1
315	1	36	LYS	CE	C	41.663	0.400	1
316	1	36	LYS	N	N	118.140	0.400	1
317	1	37	ALA	H	H	7.797	0.020	1
318	1	37	ALA	HA	H	4.090	0.020	1
319	1	37	ALA	HB1	H	1.478	0.020	1
320	1	37	ALA	HB2	H	1.478	0.020	1
321	1	37	ALA	HB3	H	1.478	0.020	1
322	1	37	ALA	CA	C	54.833	0.400	1
323	1	37	ALA	CB	C	18.086	0.400	1
324	1	37	ALA	N	N	119.021	0.400	1
325	1	38	ALA	H	H	7.907	0.020	1
326	1	38	ALA	HA	H	4.228	0.020	1
327	1	38	ALA	HB1	H	1.383	0.020	1
328	1	38	ALA	HB2	H	1.383	0.020	1
329	1	38	ALA	HB3	H	1.383	0.020	1
330	1	38	ALA	CA	C	54.707	0.400	1
331	1	38	ALA	CB	C	18.075	0.400	1
332	1	38	ALA	N	N	120.859	0.400	1
333	1	39	LEU	H	H	8.163	0.020	1
334	1	39	LEU	HA	H	4.024	0.020	1
335	1	39	LEU	HB2	H	1.247	0.020	2
336	1	39	LEU	HB3	H	2.095	0.020	2
337	1	39	LEU	HG	H	1.917	0.020	1
338	1	39	LEU	HD11	H	0.640	0.020	2
339	1	39	LEU	HD12	H	0.640	0.020	2
340	1	39	LEU	HD13	H	0.640	0.020	2
341	1	39	LEU	HD21	H	0.718	0.020	2
342	1	39	LEU	HD22	H	0.718	0.020	2
343	1	39	LEU	HD23	H	0.718	0.020	2
344	1	39	LEU	CA	C	58.037	0.400	1
345	1	39	LEU	CB	C	41.956	0.400	1
346	1	39	LEU	CG	C	26.369	0.400	1
347	1	39	LEU	CD2	C	26.861	0.400	2
348	1	39	LEU	N	N	117.875	0.400	1
349	1	40	VAL	H	H	7.853	0.020	1
350	1	40	VAL	HA	H	3.738	0.020	1
351	1	40	VAL	HB	H	2.193	0.020	1
352	1	40	VAL	HG11	H	0.976	0.020	2
353	1	40	VAL	HG12	H	0.976	0.020	2
354	1	40	VAL	HG13	H	0.976	0.020	2
355	1	40	VAL	HG21	H	1.075	0.020	2
356	1	40	VAL	HG22	H	1.075	0.020	2
357	1	40	VAL	HG23	H	1.075	0.020	2
358	1	40	VAL	CA	C	65.581	0.400	1
359	1	40	VAL	CB	C	31.699	0.400	1
360	1	40	VAL	CG1	C	21.289	0.400	2
361	1	40	VAL	CG2	C	22.887	0.400	2
362	1	40	VAL	N	N	118.646	0.400	1
363	1	41	ASP	H	H	7.778	0.020	1
364	1	41	ASP	HA	H	4.518	0.020	1
365	1	41	ASP	HB2	H	2.686	0.020	2
366	1	41	ASP	HB3	H	2.691	0.020	2
367	1	41	ASP	CA	C	55.574	0.400	1
368	1	41	ASP	CB	C	41.323	0.400	1
369	1	41	ASP	N	N	118.421	0.400	1
370	1	42	HIS	H	H	7.488	0.020	1
371	1	42	HIS	HA	H	4.422	0.020	1
372	1	42	HIS	HB2	H	3.144	0.020	2
373	1	42	HIS	HB3	H	3.243	0.020	2
374	1	42	HIS	HD1	H	7.864	0.020	1
375	1	42	HIS	HD2	H	7.151	0.020	1
376	1	42	HIS	HE1	H	8.224	0.020	1
377	1	42	HIS	CA	C	57.306	0.400	1
378	1	42	HIS	CB	C	30.170	0.400	1
379	1	42	HIS	N	N	120.332	0.400	1
380	1	43	ASP	H	H	8.262	0.020	1
381	1	43	ASP	HA	H	4.402	0.020	1
382	1	43	ASP	HB2	H	2.626	0.020	2
383	1	43	ASP	HB3	H	2.629	0.020	2
384	1	43	ASP	CA	C	56.041	0.400	1
385	1	43	ASP	CB	C	41.187	0.400	1
386	1	43	ASP	N	N	124.032	0.400	1
387	1	44	ASN	H	H	9.349	0.020	1
388	1	44	ASN	HA	H	4.760	0.020	1
389	1	44	ASN	HB2	H	2.779	0.020	2
390	1	44	ASN	HB3	H	2.879	0.020	2
391	1	44	ASN	HD21	H	6.952	0.020	2
392	1	44	ASN	HD22	H	7.874	0.020	2
393	1	44	ASN	CA	C	53.930	0.400	1
394	1	44	ASN	CB	C	39.071	0.400	1
395	1	44	ASN	N	N	116.617	0.400	1
396	1	44	ASN	ND2	N	113.503	0.400	1
397	1	45	ILE	H	H	7.862	0.020	1
398	1	45	ILE	HA	H	4.124	0.020	1
399	1	45	ILE	HB	H	1.901	0.020	1
400	1	45	ILE	HG12	H	0.848	0.020	2
401	1	45	ILE	HG13	H	1.423	0.020	2
402	1	45	ILE	HG21	H	0.723	0.020	1
403	1	45	ILE	HG22	H	0.723	0.020	1
404	1	45	ILE	HG23	H	0.723	0.020	1
405	1	45	ILE	HD11	H	0.556	0.020	1
406	1	45	ILE	HD12	H	0.556	0.020	1
407	1	45	ILE	HD13	H	0.556	0.020	1
408	1	45	ILE	CA	C	60.954	0.400	1
409	1	45	ILE	CB	C	39.785	0.400	1
410	1	45	ILE	CG1	C	27.426	0.400	1
411	1	45	ILE	CD1	C	13.808	0.400	1
412	1	45	ILE	N	N	118.584	0.400	1
413	1	46	LYS	H	H	8.429	0.020	1
414	1	46	LYS	HA	H	4.621	0.020	1
415	1	46	LYS	HB2	H	1.906	0.020	2
416	1	46	LYS	HB3	H	2.014	0.020	2
417	1	46	LYS	HG2	H	1.429	0.020	2
418	1	46	LYS	HG3	H	1.525	0.020	2
419	1	46	LYS	HD2	H	1.719	0.020	2
420	1	46	LYS	HD3	H	2.013	0.020	2
421	1	46	LYS	HE2	H	2.997	0.020	2
422	1	46	LYS	HE3	H	3.001	0.020	2
423	1	46	LYS	CA	C	55.895	0.400	1
424	1	46	LYS	CB	C	31.035	0.400	1
425	1	46	LYS	CG	C	24.886	0.400	1
426	1	46	LYS	CD	C	29.351	0.400	1
427	1	46	LYS	CE	C	41.453	0.400	1
428	1	46	LYS	N	N	126.921	0.400	1
429	1	47	SER	H	H	8.429	0.020	1
430	1	47	SER	HA	H	4.278	0.020	1
431	1	47	SER	HB2	H	3.600	0.020	2
432	1	47	SER	HB3	H	4.101	0.020	2
433	1	47	SER	CA	C	59.350	0.400	1
434	1	47	SER	CB	C	64.002	0.400	1
435	1	48	THR	H	H	7.738	0.020	1
436	1	48	THR	HA	H	4.094	0.020	1
437	1	48	THR	HB	H	4.170	0.020	1
438	1	48	THR	HG1	H	4.759	0.020	1
439	1	48	THR	CA	C	64.177	0.400	1
440	1	48	THR	CB	C	69.337	0.400	1
441	1	48	THR	N	N	114.763	0.400	1
442	1	49	ASP	H	H	8.299	0.020	1
443	1	49	ASP	HA	H	5.031	0.020	1
444	1	49	ASP	HB2	H	2.533	0.020	2
445	1	49	ASP	HB3	H	3.123	0.020	2
446	1	49	ASP	CA	C	54.010	0.400	1
447	1	49	ASP	CB	C	41.972	0.400	1
448	1	49	ASP	N	N	118.979	0.400	1
449	1	50	ILE	H	H	7.616	0.020	1
450	1	50	ILE	HA	H	4.482	0.020	1
451	1	50	ILE	HB	H	1.740	0.020	1
452	1	50	ILE	HG12	H	0.713	0.020	2
453	1	50	ILE	HG13	H	1.653	0.020	2
454	1	50	ILE	HG21	H	0.382	0.020	1
455	1	50	ILE	HG22	H	0.382	0.020	1
456	1	50	ILE	HG23	H	0.382	0.020	1
457	1	50	ILE	HD11	H	0.634	0.020	1
458	1	50	ILE	HD12	H	0.634	0.020	1
459	1	50	ILE	HD13	H	0.634	0.020	1
460	1	50	ILE	CA	C	61.620	0.400	1
461	1	50	ILE	CB	C	39.519	0.400	1
462	1	50	ILE	CG1	C	26.930	0.400	1
463	1	50	ILE	CD1	C	13.845	0.400	1
464	1	50	ILE	N	N	121.711	0.400	1
465	1	51	SER	H	H	9.269	0.020	1
466	1	51	SER	HA	H	4.752	0.020	1
467	1	51	SER	HB2	H	3.674	0.020	2
468	1	51	SER	HB3	H	3.679	0.020	2
469	1	51	SER	CA	C	57.182	0.400	1
470	1	51	SER	CB	C	64.189	0.400	1
471	1	51	SER	N	N	124.783	0.400	1
472	1	52	VAL	H	H	8.242	0.020	1
473	1	52	VAL	HA	H	4.586	0.020	1
474	1	52	VAL	HB	H	1.788	0.020	1
475	1	52	VAL	HG11	H	0.734	0.020	2
476	1	52	VAL	HG12	H	0.734	0.020	2
477	1	52	VAL	HG13	H	0.734	0.020	2
478	1	52	VAL	HG21	H	0.734	0.020	2
479	1	52	VAL	HG22	H	0.734	0.020	2
480	1	52	VAL	HG23	H	0.734	0.020	2
481	1	52	VAL	CA	C	61.232	0.400	1
482	1	52	VAL	CB	C	34.556	0.400	1
483	1	52	VAL	CG2	C	22.607	0.400	2
484	1	52	VAL	N	N	124.156	0.400	1
485	1	53	LYS	H	H	8.157	0.020	1
486	1	53	LYS	HA	H	4.571	0.020	1
487	1	53	LYS	HB2	H	1.719	0.020	2
488	1	53	LYS	HB3	H	1.737	0.020	2
489	1	53	LYS	HG2	H	1.375	0.020	2
490	1	53	LYS	HG3	H	1.376	0.020	2
491	1	53	LYS	HE2	H	2.419	0.020	2
492	1	53	LYS	HE3	H	2.941	0.020	2
493	1	53	LYS	CA	C	55.501	0.400	1
494	1	53	LYS	CB	C	36.362	0.400	1
495	1	53	LYS	CG	C	24.664	0.400	1
496	1	53	LYS	CE	C	43.615	0.400	1
497	1	53	LYS	N	N	126.297	0.400	1
498	1	54	THR	H	H	7.895	0.020	1
499	1	54	THR	HA	H	5.073	0.020	1
500	1	54	THR	HB	H	3.705	0.020	1
501	1	54	THR	HG1	H	8.433	0.020	1
502	1	54	THR	HG21	H	0.873	0.020	1
503	1	54	THR	HG22	H	0.873	0.020	1
504	1	54	THR	HG23	H	0.873	0.020	1
505	1	54	THR	CA	C	62.361	0.400	1
506	1	54	THR	CB	C	69.003	0.400	1
507	1	54	THR	CG2	C	21.219	0.400	1
508	1	54	THR	N	N	120.337	0.400	1
509	1	55	ASP	H	H	8.409	0.020	1
510	1	55	ASP	HA	H	4.848	0.020	1
511	1	55	ASP	HB2	H	2.416	0.020	2
512	1	55	ASP	HB3	H	2.569	0.020	2
513	1	55	ASP	CA	C	53.178	0.400	1
514	1	55	ASP	CB	C	43.720	0.400	1
515	1	55	ASP	N	N	124.720	0.400	1
516	1	56	GLN	H	H	10.923	0.020	1
517	1	56	GLN	HA	H	3.971	0.020	1
518	1	56	GLN	HB2	H	2.111	0.020	2
519	1	56	GLN	HB3	H	2.136	0.020	2
520	1	56	GLN	HG2	H	2.259	0.020	2
521	1	56	GLN	HG3	H	2.389	0.020	2
522	1	56	GLN	HE21	H	6.826	0.020	2
523	1	56	GLN	HE22	H	7.667	0.020	2
524	1	56	GLN	CA	C	56.308	0.400	1
525	1	56	GLN	CB	C	26.410	0.400	1
526	1	56	GLN	CG	C	34.283	0.400	1
527	1	56	GLN	N	N	130.842	0.400	1
528	1	56	GLN	NE2	N	113.113	0.400	1
529	1	57	LYS	H	H	8.470	0.020	1
530	1	57	LYS	HA	H	3.280	0.020	1
531	1	57	LYS	HB2	H	2.317	0.020	2
532	1	57	LYS	HB3	H	2.485	0.020	2
533	1	57	LYS	HG2	H	1.215	0.020	2
534	1	57	LYS	HG3	H	1.333	0.020	2
535	1	57	LYS	HD2	H	1.629	0.020	2
536	1	57	LYS	HD3	H	1.767	0.020	2
537	1	57	LYS	HE2	H	2.496	0.020	2
538	1	57	LYS	HE3	H	2.974	0.020	2
539	1	57	LYS	CA	C	59.240	0.400	1
540	1	57	LYS	CB	C	29.340	0.400	1
541	1	57	LYS	CG	C	25.657	0.400	1
542	1	57	LYS	CD	C	28.890	0.400	1
543	1	57	LYS	CE	C	41.469	0.400	1
544	1	58	VAL	H	H	7.582	0.020	1
545	1	58	VAL	HA	H	4.444	0.020	1
546	1	58	VAL	HB	H	2.192	0.020	1
547	1	58	VAL	HG11	H	0.655	0.020	2
548	1	58	VAL	HG12	H	0.655	0.020	2
549	1	58	VAL	HG13	H	0.655	0.020	2
550	1	58	VAL	HG21	H	1.228	0.020	2
551	1	58	VAL	HG22	H	1.228	0.020	2
552	1	58	VAL	HG23	H	1.228	0.020	2
553	1	58	VAL	CA	C	61.904	0.400	1
554	1	58	VAL	CB	C	31.706	0.400	1
555	1	58	VAL	CG1	C	20.054	0.400	2
556	1	58	VAL	CG2	C	22.191	0.400	2
557	1	58	VAL	N	N	120.233	0.400	1
558	1	59	VAL	H	H	8.591	0.020	1
559	1	59	VAL	HA	H	4.656	0.020	1
560	1	59	VAL	HB	H	1.932	0.020	1
561	1	59	VAL	CA	C	60.960	0.400	1
562	1	59	VAL	CB	C	34.078	0.400	1
563	1	59	VAL	N	N	132.782	0.400	1
564	1	60	THR	H	H	9.753	0.020	1
565	1	60	THR	HA	H	5.090	0.020	1
566	1	60	THR	HB	H	3.874	0.020	1
567	1	60	THR	HG1	H	4.770	0.020	1
568	1	60	THR	HG21	H	0.998	0.020	1
569	1	60	THR	HG22	H	0.998	0.020	1
570	1	60	THR	HG23	H	0.998	0.020	1
571	1	60	THR	CA	C	62.485	0.400	1
572	1	60	THR	CB	C	69.654	0.400	1
573	1	60	THR	CG2	C	21.076	0.400	1
574	1	60	THR	N	N	124.804	0.400	1
575	1	61	LEU	H	H	8.214	0.020	1
576	1	61	LEU	HA	H	5.102	0.020	1
577	1	61	LEU	HB2	H	1.046	0.020	2
578	1	61	LEU	HB3	H	1.757	0.020	2
579	1	61	LEU	HG	H	0.690	0.020	1
580	1	61	LEU	HD11	H	0.690	0.020	2
581	1	61	LEU	HD12	H	0.690	0.020	2
582	1	61	LEU	HD13	H	0.690	0.020	2
583	1	61	LEU	HD21	H	0.680	0.020	2
584	1	61	LEU	HD22	H	0.680	0.020	2
585	1	61	LEU	HD23	H	0.680	0.020	2
586	1	61	LEU	CA	C	52.434	0.400	1
587	1	61	LEU	CB	C	43.123	0.400	1
588	1	61	LEU	CD1	C	24.563	0.400	2
589	1	61	LEU	N	N	127.524	0.400	1
590	1	62	SER	H	H	8.739	0.020	1
591	1	62	SER	HA	H	4.496	0.020	1
592	1	62	SER	HB2	H	3.548	0.020	2
593	1	62	SER	HB3	H	3.791	0.020	2
594	1	62	SER	HG	H	8.538	0.020	1
595	1	62	SER	CA	C	56.349	0.400	1
596	1	62	SER	CB	C	65.659	0.400	1
597	1	62	SER	N	N	116.755	0.400	1
598	1	63	GLY	H	H	8.013	0.020	1
599	1	63	GLY	HA2	H	3.354	0.020	2
600	1	63	GLY	HA3	H	5.125	0.020	2
601	1	63	GLY	CA	C	43.627	0.400	1
602	1	63	GLY	N	N	108.746	0.400	1
603	1	64	PHE	H	H	7.839	0.020	1
604	1	64	PHE	HA	H	5.824	0.020	1
605	1	64	PHE	HB2	H	2.757	0.020	2
606	1	64	PHE	HB3	H	2.952	0.020	2
607	1	64	PHE	HD1	H	7.148	0.020	1
608	1	64	PHE	HD2	H	7.150	0.020	1
609	1	64	PHE	HE1	H	7.254	0.020	1
610	1	64	PHE	HE2	H	7.258	0.020	1
611	1	64	PHE	HZ	H	6.859	0.020	1
612	1	64	PHE	CA	C	56.564	0.400	1
613	1	64	PHE	CB	C	43.551	0.400	1
614	1	64	PHE	N	N	119.124	0.400	1
615	1	65	VAL	H	H	8.472	0.020	1
616	1	65	VAL	HA	H	4.731	0.020	1
617	1	65	VAL	HB	H	2.495	0.020	1
618	1	65	VAL	HG11	H	0.726	0.020	2
619	1	65	VAL	HG12	H	0.726	0.020	2
620	1	65	VAL	HG13	H	0.726	0.020	2
621	1	65	VAL	HG21	H	0.846	0.020	2
622	1	65	VAL	HG22	H	0.846	0.020	2
623	1	65	VAL	HG23	H	0.846	0.020	2
624	1	65	VAL	CA	C	59.043	0.400	1
625	1	65	VAL	CB	C	36.185	0.400	1
626	1	65	VAL	CG1	C	19.455	0.400	2
627	1	65	VAL	CG2	C	23.578	0.400	2
628	1	65	VAL	N	N	111.029	0.400	1
629	1	66	GLU	H	H	8.825	0.020	1
630	1	66	GLU	HA	H	4.378	0.020	1
631	1	66	GLU	HB2	H	2.128	0.020	2
632	1	66	GLU	HB3	H	2.130	0.020	2
633	1	66	GLU	HG2	H	2.409	0.020	2
634	1	66	GLU	HG3	H	2.461	0.020	2
635	1	66	GLU	CA	C	57.914	0.400	1
636	1	66	GLU	CG	C	36.616	0.400	1
637	1	66	GLU	N	N	117.215	0.400	1
638	1	67	SER	H	H	7.313	0.020	1
639	1	67	SER	HA	H	4.722	0.020	1
640	1	67	SER	HB2	H	3.957	0.020	2
641	1	67	SER	HB3	H	4.236	0.020	2
642	1	67	SER	CB	C	66.620	0.400	1
643	1	67	SER	N	N	107.907	0.400	1
644	1	68	GLN	H	H	9.319	0.020	1
645	1	68	GLN	HA	H	3.943	0.020	1
646	1	68	GLN	HB2	H	2.110	0.020	2
647	1	68	GLN	HB3	H	2.122	0.020	2
648	1	68	GLN	HG2	H	2.422	0.020	2
649	1	68	GLN	HG3	H	2.422	0.020	2
650	1	68	GLN	HE21	H	6.989	0.020	2
651	1	68	GLN	HE22	H	7.669	0.020	2
652	1	68	GLN	CA	C	58.523	0.400	1
653	1	68	GLN	CG	C	33.386	0.400	1
654	1	68	GLN	N	N	123.485	0.400	1
655	1	68	GLN	NE2	N	113.020	0.400	1
656	1	69	ALA	H	H	8.408	0.020	1
657	1	69	ALA	HA	H	4.160	0.020	1
658	1	69	ALA	HB1	H	1.435	0.020	1
659	1	69	ALA	HB2	H	1.435	0.020	1
660	1	69	ALA	HB3	H	1.435	0.020	1
661	1	69	ALA	CA	C	55.120	0.400	1
662	1	69	ALA	CB	C	18.024	0.400	1
663	1	69	ALA	N	N	121.186	0.400	1
664	1	70	GLN	H	H	7.716	0.020	1
665	1	70	GLN	HA	H	3.999	0.020	1
666	1	70	GLN	HB2	H	2.127	0.020	2
667	1	70	GLN	HB3	H	2.235	0.020	2
668	1	70	GLN	HG2	H	2.430	0.020	2
669	1	70	GLN	HG3	H	2.545	0.020	2
670	1	70	GLN	HE21	H	7.276	0.020	2
671	1	70	GLN	HE22	H	7.613	0.020	2
672	1	70	GLN	CA	C	59.206	0.400	1
673	1	70	GLN	CB	C	29.449	0.400	1
674	1	70	GLN	CG	C	35.309	0.400	1
675	1	70	GLN	N	N	117.269	0.400	1
676	1	70	GLN	NE2	N	113.602	0.400	1
677	1	71	ALA	H	H	7.466	0.020	1
678	1	71	ALA	HA	H	3.864	0.020	1
679	1	71	ALA	HB1	H	1.443	0.020	1
680	1	71	ALA	HB2	H	1.443	0.020	1
681	1	71	ALA	HB3	H	1.443	0.020	1
682	1	71	ALA	CA	C	55.388	0.400	1
683	1	71	ALA	CB	C	17.866	0.400	1
684	1	71	ALA	N	N	121.941	0.400	1
685	1	72	GLU	H	H	8.099	0.020	1
686	1	72	GLU	HA	H	3.816	0.020	1
687	1	72	GLU	HB2	H	2.043	0.020	2
688	1	72	GLU	HB3	H	2.045	0.020	2
689	1	72	GLU	HG2	H	2.232	0.020	2
690	1	72	GLU	HG3	H	2.474	0.020	2
691	1	72	GLU	CA	C	59.221	0.400	1
692	1	72	GLU	CB	C	29.376	0.400	1
693	1	72	GLU	CG	C	36.599	0.400	1
694	1	72	GLU	N	N	116.598	0.400	1
695	1	73	GLU	H	H	8.035	0.020	1
696	1	73	GLU	HA	H	4.000	0.020	1
697	1	73	GLU	HB2	H	1.774	0.020	2
698	1	73	GLU	HB3	H	1.808	0.020	2
699	1	73	GLU	HG2	H	2.230	0.020	2
700	1	73	GLU	HG3	H	2.433	0.020	2
701	1	73	GLU	CA	C	59.110	0.400	1
702	1	73	GLU	CB	C	29.571	0.400	1
703	1	73	GLU	CG	C	35.501	0.400	1
704	1	73	GLU	N	N	120.097	0.400	1
705	1	74	ALA	H	H	8.222	0.020	1
706	1	74	ALA	HA	H	3.648	0.020	1
707	1	74	ALA	HB1	H	1.265	0.020	1
708	1	74	ALA	HB2	H	1.265	0.020	1
709	1	74	ALA	HB3	H	1.265	0.020	1
710	1	74	ALA	CA	C	55.398	0.400	1
711	1	74	ALA	CB	C	17.614	0.400	1
712	1	74	ALA	N	N	121.563	0.400	1
713	1	75	VAL	H	H	7.788	0.020	1
714	1	75	VAL	HA	H	3.341	0.020	1
715	1	75	VAL	HB	H	2.044	0.020	1
716	1	75	VAL	HG21	H	0.963	0.020	2
717	1	75	VAL	HG22	H	0.963	0.020	2
718	1	75	VAL	HG23	H	0.963	0.020	2
719	1	75	VAL	CA	C	67.087	0.400	1
720	1	75	VAL	CB	C	31.761	0.400	1
721	1	75	VAL	CG1	C	22.949	0.400	2
722	1	75	VAL	CG2	C	23.122	0.400	2
723	1	75	VAL	N	N	116.810	0.400	1
724	1	76	LYS	H	H	7.615	0.020	1
725	1	76	LYS	HA	H	3.779	0.020	1
726	1	76	LYS	HB2	H	1.896	0.020	2
727	1	76	LYS	HB3	H	1.897	0.020	2
728	1	76	LYS	HG2	H	1.315	0.020	2
729	1	76	LYS	HD2	H	1.319	0.020	2
730	1	76	LYS	HD3	H	1.548	0.020	2
731	1	76	LYS	HE2	H	2.893	0.020	2
732	1	76	LYS	CA	C	60.177	0.400	1
733	1	76	LYS	CB	C	32.403	0.400	1
734	1	76	LYS	CG	C	25.268	0.400	1
735	1	76	LYS	CE	C	42.062	0.400	1
736	1	76	LYS	N	N	119.219	0.400	1
737	1	77	VAL	H	H	8.295	0.020	1
738	1	77	VAL	HA	H	3.468	0.020	1
739	1	77	VAL	HB	H	1.927	0.020	1
740	1	77	VAL	HG11	H	0.653	0.020	2
741	1	77	VAL	HG12	H	0.653	0.020	2
742	1	77	VAL	HG13	H	0.653	0.020	2
743	1	77	VAL	HG21	H	0.650	0.020	2
744	1	77	VAL	HG22	H	0.650	0.020	2
745	1	77	VAL	HG23	H	0.650	0.020	2
746	1	77	VAL	CA	C	65.990	0.400	1
747	1	77	VAL	CG1	C	22.246	0.400	2
748	1	77	VAL	CG2	C	22.646	0.400	2
749	1	77	VAL	N	N	119.973	0.400	1
750	1	78	ALA	H	H	8.059	0.020	1
751	1	78	ALA	HA	H	3.928	0.020	1
752	1	78	ALA	HB1	H	1.390	0.020	1
753	1	78	ALA	HB2	H	1.390	0.020	1
754	1	78	ALA	HB3	H	1.390	0.020	1
755	1	78	ALA	CA	C	55.520	0.400	1
756	1	78	ALA	CB	C	19.238	0.400	1
757	1	78	ALA	N	N	121.528	0.400	1
758	1	79	LYS	H	H	8.271	0.020	1
759	1	79	LYS	HA	H	3.746	0.020	1
760	1	79	LYS	HB2	H	1.804	0.020	2
761	1	79	LYS	HB3	H	1.804	0.020	2
762	1	79	LYS	HG2	H	1.398	0.020	2
763	1	79	LYS	HG3	H	1.567	0.020	2
764	1	79	LYS	HD2	H	1.569	0.020	2
765	1	79	LYS	HD3	H	1.573	0.020	2
766	1	79	LYS	HE2	H	2.873	0.020	2
767	1	79	LYS	CA	C	58.183	0.400	1
768	1	79	LYS	CB	C	32.952	0.400	1
769	1	79	LYS	CG	C	25.970	0.400	1
770	1	79	LYS	CE	C	41.514	0.400	1
771	1	79	LYS	N	N	113.301	0.400	1
772	1	80	GLY	H	H	7.427	0.020	1
773	1	80	GLY	HA2	H	3.704	0.020	2
774	1	80	GLY	HA3	H	4.126	0.020	2
775	1	80	GLY	CA	C	45.002	0.400	1
776	1	80	GLY	N	N	103.532	0.400	1
777	1	81	VAL	H	H	7.158	0.020	1
778	1	81	VAL	HA	H	3.776	0.020	1
779	1	81	VAL	HB	H	2.148	0.020	1
780	1	81	VAL	HG11	H	0.961	0.020	2
781	1	81	VAL	HG12	H	0.961	0.020	2
782	1	81	VAL	HG13	H	0.961	0.020	2
783	1	81	VAL	HG21	H	0.968	0.020	2
784	1	81	VAL	HG22	H	0.968	0.020	2
785	1	81	VAL	HG23	H	0.968	0.020	2
786	1	81	VAL	CA	C	63.335	0.400	1
787	1	81	VAL	CB	C	31.413	0.400	1
788	1	81	VAL	CG1	C	21.983	0.400	2
789	1	81	VAL	CG2	C	23.029	0.400	2
790	1	81	VAL	N	N	123.881	0.400	1
791	1	82	GLU	H	H	8.512	0.020	1
792	1	82	GLU	HA	H	3.922	0.020	1
793	1	82	GLU	HB2	H	1.910	0.020	2
794	1	82	GLU	HB3	H	1.910	0.020	2
795	1	82	GLU	HG2	H	2.202	0.020	2
796	1	82	GLU	HG3	H	2.282	0.020	2
797	1	82	GLU	CA	C	58.420	0.400	1
798	1	82	GLU	CG	C	36.117	0.400	1
799	1	82	GLU	N	N	129.979	0.400	1
800	1	83	GLY	H	H	8.482	0.020	1
801	1	83	GLY	HA2	H	3.458	0.020	2
802	1	83	GLY	HA3	H	4.306	0.020	2
803	1	83	GLY	CA	C	44.688	0.400	1
804	1	83	GLY	N	N	112.417	0.400	1
805	1	84	VAL	H	H	7.367	0.020	1
806	1	84	VAL	HA	H	3.820	0.020	1
807	1	84	VAL	HB	H	2.114	0.020	1
808	1	84	VAL	HG11	H	1.049	0.020	2
809	1	84	VAL	HG12	H	1.049	0.020	2
810	1	84	VAL	HG13	H	1.049	0.020	2
811	1	84	VAL	HG21	H	0.838	0.020	2
812	1	84	VAL	HG22	H	0.838	0.020	2
813	1	84	VAL	HG23	H	0.838	0.020	2
814	1	84	VAL	CA	C	64.114	0.400	1
815	1	84	VAL	CB	C	32.659	0.400	1
816	1	84	VAL	CG1	C	23.427	0.400	2
817	1	84	VAL	CG2	C	23.639	0.400	2
818	1	84	VAL	N	N	120.202	0.400	1
819	1	85	THR	H	H	9.076	0.020	1
820	1	85	THR	HA	H	4.371	0.020	1
821	1	85	THR	HB	H	4.075	0.020	1
822	1	85	THR	HG1	H	7.482	0.020	1
823	1	85	THR	CA	C	63.897	0.400	1
824	1	85	THR	CB	C	69.231	0.400	1
825	1	85	THR	CG2	C	21.979	0.400	1
826	1	85	THR	N	N	123.332	0.400	1
827	1	86	SER	H	H	7.483	0.020	1
828	1	86	SER	HA	H	4.487	0.020	1
829	1	86	SER	HB2	H	3.821	0.020	2
830	1	86	SER	HB3	H	3.824	0.020	2
831	1	86	SER	HG	H	4.774	0.020	1
832	1	86	SER	CA	C	57.492	0.400	1
833	1	86	SER	CB	C	64.166	0.400	1
834	1	86	SER	N	N	113.914	0.400	1
835	1	87	VAL	H	H	8.369	0.020	1
836	1	87	VAL	HA	H	5.136	0.020	1
837	1	87	VAL	HB	H	1.807	0.020	1
838	1	87	VAL	HG11	H	0.841	0.020	2
839	1	87	VAL	HG12	H	0.841	0.020	2
840	1	87	VAL	HG13	H	0.841	0.020	2
841	1	87	VAL	HG21	H	0.809	0.020	2
842	1	87	VAL	HG22	H	0.809	0.020	2
843	1	87	VAL	HG23	H	0.809	0.020	2
844	1	87	VAL	CA	C	60.070	0.400	1
845	1	87	VAL	CB	C	34.746	0.400	1
846	1	87	VAL	CG1	C	21.250	0.400	2
847	1	87	VAL	CG2	C	22.455	0.400	2
848	1	87	VAL	N	N	120.533	0.400	1
849	1	88	SER	H	H	9.708	0.020	1
850	1	88	SER	HA	H	4.577	0.020	1
851	1	88	SER	HB2	H	3.637	0.020	2
852	1	88	SER	HB3	H	3.865	0.020	2
853	1	88	SER	HG	H	4.579	0.020	1
854	1	88	SER	CA	C	56.339	0.400	1
855	1	88	SER	CB	C	63.473	0.400	1
856	1	88	SER	N	N	124.486	0.400	1
857	1	89	ASP	H	H	8.688	0.020	1
858	1	89	ASP	HA	H	4.416	0.020	1
859	1	89	ASP	HB2	H	2.367	0.020	2
860	1	89	ASP	HB3	H	2.913	0.020	2
861	1	89	ASP	CA	C	53.678	0.400	1
862	1	89	ASP	CB	C	41.482	0.400	1
863	1	89	ASP	N	N	127.255	0.400	1
864	1	90	LYS	H	H	8.531	0.020	1
865	1	90	LYS	HA	H	4.577	0.020	1
866	1	90	LYS	HB2	H	1.509	0.020	2
867	1	90	LYS	HB3	H	2.019	0.020	2
868	1	90	LYS	HG2	H	1.172	0.020	2
869	1	90	LYS	HG3	H	1.265	0.020	2
870	1	90	LYS	HD2	H	1.509	0.020	2
871	1	90	LYS	HD3	H	2.020	0.020	2
872	1	90	LYS	HE2	H	2.862	0.020	2
873	1	90	LYS	HE3	H	2.908	0.020	2
874	1	90	LYS	CA	C	54.013	0.400	1
875	1	90	LYS	CB	C	31.086	0.400	1
876	1	90	LYS	CG	C	24.779	0.400	1
877	1	90	LYS	CD	C	31.063	0.400	1
878	1	90	LYS	CE	C	42.151	0.400	1
879	1	90	LYS	N	N	128.625	0.400	1
880	1	91	LEU	H	H	8.528	0.020	1
881	1	91	LEU	HA	H	4.046	0.020	1
882	1	91	LEU	HB2	H	0.783	0.020	2
883	1	91	LEU	HB3	H	2.083	0.020	2
884	1	91	LEU	HD11	H	0.382	0.020	2
885	1	91	LEU	HD12	H	0.382	0.020	2
886	1	91	LEU	HD13	H	0.382	0.020	2
887	1	91	LEU	HD21	H	0.708	0.020	2
888	1	91	LEU	HD22	H	0.708	0.020	2
889	1	91	LEU	HD23	H	0.708	0.020	2
890	1	91	LEU	CA	C	55.230	0.400	1
891	1	91	LEU	CB	C	42.296	0.400	1
892	1	91	LEU	CD1	C	24.343	0.400	2
893	1	91	LEU	CD2	C	25.915	0.400	2
894	1	91	LEU	N	N	121.731	0.400	1
895	1	92	HIS	H	H	8.563	0.020	1
896	1	92	HIS	HA	H	4.732	0.020	1
897	1	92	HIS	HB2	H	2.642	0.020	2
898	1	92	HIS	HB3	H	3.009	0.020	2
899	1	92	HIS	HD1	H	8.533	0.020	1
900	1	92	HIS	HD2	H	6.849	0.020	1
901	1	92	HIS	HE1	H	7.151	0.020	1
902	1	92	HIS	CA	C	54.690	0.400	1
903	1	92	HIS	CB	C	32.394	0.400	1
904	1	92	HIS	N	N	121.752	0.400	1
905	1	93	VAL	H	H	8.511	0.020	1
906	1	93	VAL	HA	H	4.257	0.020	1
907	1	93	VAL	HB	H	1.880	0.020	1
908	1	93	VAL	HG11	H	0.730	0.020	2
909	1	93	VAL	HG12	H	0.730	0.020	2
910	1	93	VAL	HG13	H	0.730	0.020	2
911	1	93	VAL	HG21	H	0.743	0.020	2
912	1	93	VAL	HG22	H	0.743	0.020	2
913	1	93	VAL	HG23	H	0.743	0.020	2
914	1	93	VAL	CA	C	61.770	0.400	1
915	1	93	VAL	CB	C	31.940	0.400	1
916	1	93	VAL	CG1	C	21.261	0.400	2
917	1	93	VAL	CG2	C	21.410	0.400	2
918	1	93	VAL	N	N	123.901	0.400	1
919	1	94	ARG	H	H	8.699	0.020	1
920	1	94	ARG	HA	H	4.258	0.020	1
921	1	94	ARG	HB2	H	1.718	0.020	2
922	1	94	ARG	HB3	H	1.737	0.020	2
923	1	94	ARG	HG2	H	1.698	0.020	2
924	1	94	ARG	HG3	H	1.782	0.020	2
925	1	94	ARG	HD2	H	2.948	0.020	2
926	1	94	ARG	HD3	H	2.949	0.020	2
927	1	94	ARG	CA	C	56.903	0.400	1
928	1	94	ARG	CD	C	43.485	0.400	1
929	1	94	ARG	N	N	128.425	0.400	1
930	1	95	ASP	H	H	8.397	0.020	1
931	1	95	ASP	HA	H	4.600	0.020	1
932	1	95	ASP	HB2	H	2.671	0.020	2
933	1	95	ASP	HB3	H	2.679	0.020	2
934	1	95	ASP	CA	C	54.137	0.400	1
935	1	95	ASP	CB	C	41.471	0.400	1
936	1	95	ASP	N	N	122.632	0.400	1
937	1	96	ALA	H	H	8.331	0.020	1
938	1	96	ALA	HA	H	4.265	0.020	1
939	1	96	ALA	HB1	H	1.403	0.020	1
940	1	96	ALA	HB2	H	1.403	0.020	1
941	1	96	ALA	HB3	H	1.403	0.020	1
942	1	96	ALA	CA	C	52.862	0.400	1
943	1	96	ALA	CB	C	19.224	0.400	1
944	1	96	ALA	N	N	125.487	0.400	1
945	1	97	LYS	H	H	8.404	0.020	1
946	1	97	LYS	HA	H	4.257	0.020	1
947	1	97	LYS	HB2	H	1.806	0.020	2
948	1	97	LYS	HB3	H	1.816	0.020	2
949	1	97	LYS	HG2	H	0.708	0.020	2
950	1	97	LYS	HD2	H	2.040	0.020	2
951	1	97	LYS	HD3	H	2.179	0.020	2
952	1	97	LYS	CA	C	56.839	0.400	1
953	1	97	LYS	CB	C	32.870	0.400	1
954	1	97	LYS	CD	C	27.859	0.400	1
955	1	97	LYS	CE	C	43.473	0.400	1
956	1	97	LYS	N	N	120.039	0.400	1
957	1	98	GLU	H	H	8.356	0.020	1
958	1	98	GLU	HA	H	4.252	0.020	1
959	1	98	GLU	HB2	H	1.981	0.020	2
960	1	98	GLU	HB3	H	1.984	0.020	2
961	1	98	GLU	CA	C	56.915	0.400	1
962	1	98	GLU	N	N	121.782	0.400	1
963	1	99	GLY	H	H	8.409	0.020	1
964	1	99	GLY	HA2	H	3.962	0.020	2
965	1	99	GLY	HA3	H	3.966	0.020	2
966	1	99	GLY	CA	C	45.387	0.400	1
967	1	100	SER	H	H	8.162	0.020	1
968	1	100	SER	HA	H	4.458	0.020	1
969	1	100	SER	HB2	H	3.851	0.020	2
970	1	100	SER	HB3	H	3.853	0.020	2
971	1	100	SER	HG	H	4.772	0.020	1
972	1	100	SER	CA	C	58.364	0.400	1
973	1	100	SER	CB	C	63.930	0.400	1
974	1	101	VAL	H	H	8.179	0.020	1
975	1	101	VAL	HA	H	4.130	0.020	1
976	1	101	VAL	HB	H	2.075	0.020	1
977	1	101	VAL	CA	C	62.371	0.400	1
978	1	101	VAL	CB	C	32.706	0.400	1
979	1	101	VAL	N	N	121.949	0.400	1
980	1	102	LYS	H	H	8.414	0.020	1
981	1	102	LYS	HA	H	4.258	0.020	1
982	1	102	LYS	HB2	H	1.750	0.020	2
983	1	102	LYS	HB3	H	1.780	0.020	2
984	1	102	LYS	HG2	H	1.493	0.020	2
985	1	102	LYS	HG3	H	1.583	0.020	2
986	1	102	LYS	HD2	H	1.698	0.020	2
987	1	102	LYS	HD3	H	1.778	0.020	2
988	1	102	LYS	HE2	H	2.853	0.020	2
989	1	102	LYS	HE3	H	2.933	0.020	2
990	1	102	LYS	CA	C	56.763	0.400	1
991	1	102	LYS	CB	C	32.947	0.400	1
992	1	102	LYS	CG	C	27.198	0.400	1
993	1	102	LYS	CD	C	31.485	0.400	1
994	1	102	LYS	CE	C	43.360	0.400	1
995	1	102	LYS	N	N	125.621	0.400	1
996	1	103	GLY	H	H	8.407	0.020	1
997	1	103	GLY	HA2	H	3.893	0.020	2
998	1	103	GLY	HA3	H	3.970	0.020	2
999	1	103	GLY	CA	C	45.345	0.400	1
1000	1	104	TYR	H	H	8.274	0.020	1
1001	1	104	TYR	HA	H	4.701	0.020	1
1002	1	104	TYR	HB2	H	2.859	0.020	2
1003	1	104	TYR	HB3	H	3.170	0.020	2
1004	1	104	TYR	HD1	H	7.251	0.020	1
1005	1	104	TYR	HD2	H	7.257	0.020	1
1006	1	104	TYR	HE1	H	6.839	0.020	1
1007	1	104	TYR	HE2	H	6.851	0.020	1
1008	1	104	TYR	CB	C	39.114	0.400	1
1009	1	104	TYR	N	N	121.357	0.400	1
1010	1	105	ALA	H	H	8.920	0.020	1
1011	1	105	ALA	HA	H	4.077	0.020	1
1012	1	105	ALA	HB1	H	1.278	0.020	1
1013	1	105	ALA	HB2	H	1.278	0.020	1
1014	1	105	ALA	HB3	H	1.278	0.020	1
1015	1	105	ALA	CA	C	53.389	0.400	1
1016	1	105	ALA	CB	C	19.208	0.400	1
1017	1	105	ALA	N	N	129.787	0.400	1
1018	1	106	GLY	H	H	7.839	0.020	1
1019	1	106	GLY	HA2	H	3.546	0.020	2
1020	1	106	GLY	HA3	H	4.355	0.020	2
1021	1	106	GLY	CA	C	44.257	0.400	1
1022	1	106	GLY	N	N	119.122	0.400	1
1023	1	107	ASP	H	H	7.616	0.020	1
1024	1	107	ASP	HA	H	5.029	0.020	1
1025	1	107	ASP	HB2	H	2.537	0.020	2
1026	1	107	ASP	HB3	H	3.121	0.020	2
1027	1	107	ASP	CA	C	54.032	0.400	1
1028	1	107	ASP	CB	C	41.967	0.400	1
1029	1	107	ASP	N	N	121.719	0.400	1
1030	1	108	THR	HA	H	3.963	0.020	1
1031	1	108	THR	HB	H	4.142	0.020	1
1032	1	108	THR	HG21	H	1.283	0.020	1
1033	1	108	THR	HG22	H	1.283	0.020	1
1034	1	108	THR	HG23	H	1.283	0.020	1
1035	1	108	THR	CA	C	66.747	0.400	1
1036	1	108	THR	CB	C	68.312	0.400	1
1037	1	108	THR	CG2	C	22.122	0.400	1
1038	1	109	ALA	H	H	8.291	0.020	1
1039	1	109	ALA	HA	H	4.093	0.020	1
1040	1	109	ALA	HB1	H	1.293	0.020	1
1041	1	109	ALA	HB2	H	1.293	0.020	1
1042	1	109	ALA	HB3	H	1.293	0.020	1
1043	1	109	ALA	CA	C	54.958	0.400	1
1044	1	109	ALA	CB	C	18.183	0.400	1
1045	1	109	ALA	N	N	125.519	0.400	1
1046	1	110	THR	H	H	7.958	0.020	1
1047	1	110	THR	HA	H	3.821	0.020	1
1048	1	110	THR	HB	H	4.353	0.020	1
1049	1	110	THR	HG1	H	4.995	0.020	1
1050	1	110	THR	HG21	H	1.184	0.020	1
1051	1	110	THR	HG22	H	1.184	0.020	1
1052	1	110	THR	HG23	H	1.184	0.020	1
1053	1	110	THR	CA	C	67.509	0.400	1
1054	1	110	THR	CB	C	68.499	0.400	1
1055	1	110	THR	CG2	C	22.428	0.400	1
1056	1	110	THR	N	N	118.171	0.400	1
1057	1	111	THR	H	H	8.423	0.020	1
1058	1	111	THR	HA	H	3.572	0.020	1
1059	1	111	THR	HB	H	4.372	0.020	1
1060	1	111	THR	HG1	H	5.941	0.020	1
1061	1	111	THR	HG21	H	1.137	0.020	1
1062	1	111	THR	HG22	H	1.137	0.020	1
1063	1	111	THR	HG23	H	1.137	0.020	1
1064	1	111	THR	CA	C	67.232	0.400	1
1065	1	111	THR	CB	C	68.501	0.400	1
1066	1	111	THR	CG2	C	22.961	0.400	1
1067	1	111	THR	N	N	119.707	0.400	1
1068	1	112	SER	H	H	8.199	0.020	1
1069	1	112	SER	HA	H	3.966	0.020	1
1070	1	112	SER	HG	H	3.820	0.020	1
1071	1	112	SER	CA	C	62.705	0.400	1
1072	1	112	SER	CB	C	64.302	0.400	1
1073	1	112	SER	N	N	115.798	0.400	1
1074	1	113	GLU	H	H	8.190	0.020	1
1075	1	113	GLU	HA	H	4.208	0.020	1
1076	1	113	GLU	HB2	H	2.128	0.020	2
1077	1	113	GLU	HB3	H	2.128	0.020	2
1078	1	113	GLU	HG2	H	2.220	0.020	2
1079	1	113	GLU	HG3	H	2.302	0.020	2
1080	1	113	GLU	CA	C	59.361	0.400	1
1081	1	113	GLU	CB	C	29.411	0.400	1
1082	1	113	GLU	CG	C	35.997	0.400	1
1083	1	113	GLU	N	N	124.104	0.400	1
1084	1	114	ILE	H	H	8.386	0.020	1
1085	1	114	ILE	HA	H	3.412	0.020	1
1086	1	114	ILE	HB	H	1.882	0.020	1
1087	1	114	ILE	HG12	H	0.861	0.020	2
1088	1	114	ILE	HG13	H	2.132	0.020	2
1089	1	114	ILE	HG21	H	0.812	0.020	1
1090	1	114	ILE	HG22	H	0.812	0.020	1
1091	1	114	ILE	HG23	H	0.812	0.020	1
1092	1	114	ILE	HD11	H	0.787	0.020	1
1093	1	114	ILE	HD12	H	0.787	0.020	1
1094	1	114	ILE	HD13	H	0.787	0.020	1
1095	1	114	ILE	CA	C	66.585	0.400	1
1096	1	114	ILE	CB	C	38.052	0.400	1
1097	1	114	ILE	CG1	C	31.406	0.400	1
1098	1	114	ILE	CD1	C	17.780	0.400	1
1099	1	114	ILE	N	N	118.890	0.400	1
1100	1	115	LYS	H	H	8.685	0.020	1
1101	1	115	LYS	HA	H	3.760	0.020	1
1102	1	115	LYS	HB2	H	1.872	0.020	2
1103	1	115	LYS	HB3	H	1.883	0.020	2
1104	1	115	LYS	HG2	H	1.421	0.020	2
1105	1	115	LYS	HG3	H	1.731	0.020	2
1106	1	115	LYS	HE3	H	3.045	0.020	2
1107	1	115	LYS	CA	C	61.071	0.400	1
1108	1	115	LYS	CB	C	32.010	0.400	1
1109	1	115	LYS	CG	C	25.900	0.400	1
1110	1	115	LYS	CE	C	41.572	0.400	1
1111	1	115	LYS	N	N	117.669	0.400	1
1112	1	116	ALA	H	H	8.020	0.020	1
1113	1	116	ALA	HA	H	4.146	0.020	1
1114	1	116	ALA	HB1	H	1.536	0.020	1
1115	1	116	ALA	HB2	H	1.536	0.020	1
1116	1	116	ALA	HB3	H	1.536	0.020	1
1117	1	116	ALA	CA	C	55.290	0.400	1
1118	1	116	ALA	CB	C	17.962	0.400	1
1119	1	116	ALA	N	N	121.800	0.400	1
1120	1	117	LYS	H	H	8.233	0.020	1
1121	1	117	LYS	HA	H	4.061	0.020	1
1122	1	117	LYS	HB2	H	1.776	0.020	2
1123	1	117	LYS	HB3	H	1.808	0.020	2
1124	1	117	LYS	HG2	H	1.473	0.020	2
1125	1	117	LYS	HG3	H	1.688	0.020	2
1126	1	117	LYS	HD2	H	1.491	0.020	2
1127	1	117	LYS	HE2	H	2.976	0.020	2
1128	1	117	LYS	CA	C	59.157	0.400	1
1129	1	117	LYS	CB	C	33.040	0.400	1
1130	1	117	LYS	CG	C	26.050	0.400	1
1131	1	117	LYS	CD	C	28.988	0.400	1
1132	1	117	LYS	CE	C	41.429	0.400	1
1133	1	117	LYS	N	N	120.098	0.400	1
1134	1	118	LEU	H	H	8.802	0.020	1
1135	1	118	LEU	HA	H	3.984	0.020	1
1136	1	118	LEU	HB2	H	1.092	0.020	2
1137	1	118	LEU	HB3	H	2.031	0.020	2
1138	1	118	LEU	HG	H	2.090	0.020	1
1139	1	118	LEU	HD11	H	0.747	0.020	2
1140	1	118	LEU	HD12	H	0.747	0.020	2
1141	1	118	LEU	HD13	H	0.747	0.020	2
1142	1	118	LEU	HD21	H	0.712	0.020	2
1143	1	118	LEU	HD22	H	0.712	0.020	2
1144	1	118	LEU	HD23	H	0.712	0.020	2
1145	1	118	LEU	CA	C	58.006	0.400	1
1146	1	118	LEU	CB	C	41.437	0.400	1
1147	1	118	LEU	CG	C	25.928	0.400	1
1148	1	118	LEU	CD1	C	21.489	0.400	2
1149	1	118	LEU	CD2	C	26.973	0.400	2
1150	1	118	LEU	N	N	120.204	0.400	1
1151	1	119	LEU	H	H	7.891	0.020	1
1152	1	119	LEU	HA	H	4.140	0.020	1
1153	1	119	LEU	HB2	H	1.687	0.020	2
1154	1	119	LEU	HB3	H	1.848	0.020	2
1155	1	119	LEU	HD21	H	0.911	0.020	2
1156	1	119	LEU	HD22	H	0.911	0.020	2
1157	1	119	LEU	HD23	H	0.911	0.020	2
1158	1	119	LEU	CA	C	57.793	0.400	1
1159	1	119	LEU	CB	C	42.041	0.400	1
1160	1	119	LEU	CD1	C	23.768	0.400	2
1161	1	119	LEU	N	N	120.201	0.400	1
1162	1	120	ALA	H	H	7.336	0.020	1
1163	1	120	ALA	HA	H	4.182	0.020	1
1164	1	120	ALA	HB1	H	1.462	0.020	1
1165	1	120	ALA	HB2	H	1.462	0.020	1
1166	1	120	ALA	HB3	H	1.462	0.020	1
1167	1	120	ALA	CA	C	52.835	0.400	1
1168	1	120	ALA	CB	C	19.209	0.400	1
1169	1	120	ALA	N	N	118.000	0.400	1
1170	1	121	ASP	H	H	7.253	0.020	1
1171	1	121	ASP	HA	H	4.419	0.020	1
1172	1	121	ASP	HB2	H	2.695	0.020	2
1173	1	121	ASP	HB3	H	2.700	0.020	2
1174	1	121	ASP	CA	C	55.872	0.400	1
1175	1	121	ASP	CB	C	45.041	0.400	1
1176	1	121	ASP	N	N	119.348	0.400	1
1177	1	122	ASP	H	H	8.546	0.020	1
1178	1	122	ASP	HA	H	4.464	0.020	1
1179	1	122	ASP	HB2	H	2.690	0.020	2
1180	1	122	ASP	HB3	H	2.706	0.020	2
1181	1	122	ASP	CA	C	55.866	0.400	1
1182	1	122	ASP	CB	C	40.755	0.400	1
1183	1	122	ASP	N	N	119.716	0.400	1
1184	1	123	ILE	H	H	8.574	0.020	1
1185	1	123	ILE	HA	H	4.525	0.020	1
1186	1	123	ILE	HB	H	2.048	0.020	1
1187	1	123	ILE	HG12	H	1.281	0.020	2
1188	1	123	ILE	HG13	H	1.368	0.020	2
1189	1	123	ILE	HG21	H	0.834	0.020	1
1190	1	123	ILE	HG22	H	0.834	0.020	1
1191	1	123	ILE	HG23	H	0.834	0.020	1
1192	1	123	ILE	HD11	H	0.722	0.020	1
1193	1	123	ILE	HD12	H	0.722	0.020	1
1194	1	123	ILE	HD13	H	0.722	0.020	1
1195	1	123	ILE	CA	C	61.773	0.400	1
1196	1	123	ILE	CB	C	40.021	0.400	1
1197	1	123	ILE	CG1	C	27.056	0.400	1
1198	1	123	ILE	CG2	C	17.330	0.400	1
1199	1	123	ILE	CD1	C	12.793	0.400	1
1200	1	123	ILE	N	N	116.968	0.400	1
1201	1	124	VAL	H	H	9.262	0.020	1
1202	1	124	VAL	HA	H	3.732	0.020	1
1203	1	124	VAL	HB	H	2.133	0.020	1
1204	1	124	VAL	HG11	H	0.828	0.020	2
1205	1	124	VAL	HG12	H	0.828	0.020	2
1206	1	124	VAL	HG13	H	0.828	0.020	2
1207	1	124	VAL	HG21	H	1.075	0.020	2
1208	1	124	VAL	HG22	H	1.075	0.020	2
1209	1	124	VAL	HG23	H	1.075	0.020	2
1210	1	124	VAL	CA	C	62.386	0.400	1
1211	1	124	VAL	CB	C	32.856	0.400	1
1212	1	124	VAL	CG2	C	22.899	0.400	2
1213	1	124	VAL	N	N	125.025	0.400	1
1214	1	125	PRO	HA	H	4.937	0.020	1
1215	1	125	PRO	HB2	H	2.098	0.020	2
1216	1	125	PRO	HB3	H	2.192	0.020	2
1217	1	125	PRO	HG2	H	2.190	0.020	2
1218	1	125	PRO	HG3	H	2.322	0.020	2
1219	1	125	PRO	HD2	H	3.321	0.020	2
1220	1	125	PRO	HD3	H	4.097	0.020	2
1221	1	125	PRO	CA	C	61.569	0.400	1
1222	1	125	PRO	CB	C	29.167	0.400	1
1223	1	125	PRO	CG	C	27.636	0.400	1
1224	1	125	PRO	CD	C	50.157	0.400	1
1225	1	126	SER	H	H	8.246	0.020	1
1226	1	126	SER	HA	H	3.749	0.020	1
1227	1	126	SER	HB2	H	3.555	0.020	2
1228	1	126	SER	HB3	H	3.991	0.020	2
1229	1	126	SER	HG	H	7.898	0.020	1
1230	1	126	SER	CA	C	61.713	0.400	1
1231	1	126	SER	CB	C	63.251	0.400	1
1232	1	126	SER	N	N	121.691	0.400	1
1233	1	127	ARG	H	H	8.522	0.020	1
1234	1	127	ARG	HA	H	4.079	0.020	1
1235	1	127	ARG	HB2	H	1.581	0.020	2
1236	1	127	ARG	HB3	H	1.584	0.020	2
1237	1	127	ARG	HG2	H	1.161	0.020	2
1238	1	127	ARG	HG3	H	1.243	0.020	2
1239	1	127	ARG	HD3	H	3.029	0.020	2
1240	1	127	ARG	CA	C	58.467	0.400	1
1241	1	127	ARG	CB	C	29.374	0.400	1
1242	1	127	ARG	CG	C	26.809	0.400	1
1243	1	127	ARG	CD	C	42.987	0.400	1
1244	1	128	HIS	H	H	7.919	0.020	1
1245	1	128	HIS	HA	H	4.812	0.020	1
1246	1	128	HIS	HB2	H	2.985	0.020	2
1247	1	128	HIS	HB3	H	3.657	0.020	2
1248	1	128	HIS	HD1	H	7.908	0.020	1
1249	1	128	HIS	HE1	H	6.935	0.020	1
1250	1	128	HIS	CA	C	55.573	0.400	1
1251	1	128	HIS	CB	C	31.344	0.400	1
1252	1	128	HIS	N	N	115.725	0.400	1
1253	1	129	VAL	H	H	7.296	0.020	1
1254	1	129	VAL	HA	H	4.305	0.020	1
1255	1	129	VAL	HB	H	1.907	0.020	1
1256	1	129	VAL	HG11	H	0.722	0.020	2
1257	1	129	VAL	HG12	H	0.722	0.020	2
1258	1	129	VAL	HG13	H	0.722	0.020	2
1259	1	129	VAL	HG21	H	0.579	0.020	2
1260	1	129	VAL	HG22	H	0.579	0.020	2
1261	1	129	VAL	HG23	H	0.579	0.020	2
1262	1	129	VAL	CA	C	62.066	0.400	1
1263	1	129	VAL	CB	C	32.888	0.400	1
1264	1	129	VAL	CG1	C	21.277	0.400	2
1265	1	129	VAL	CG2	C	23.924	0.400	2
1266	1	129	VAL	N	N	119.940	0.400	1
1267	1	130	LYS	H	H	9.467	0.020	1
1268	1	130	LYS	HA	H	4.527	0.020	1
1269	1	130	LYS	HB2	H	1.652	0.020	2
1270	1	130	LYS	HB3	H	1.776	0.020	2
1271	1	130	LYS	HG2	H	1.264	0.020	2
1272	1	130	LYS	HG3	H	1.359	0.020	2
1273	1	130	LYS	HD2	H	1.651	0.020	2
1274	1	130	LYS	HD3	H	1.774	0.020	2
1275	1	130	LYS	HE2	H	2.863	0.020	2
1276	1	130	LYS	CA	C	55.325	0.400	1
1277	1	130	LYS	CB	C	33.110	0.400	1
1278	1	130	LYS	CG	C	24.878	0.400	1
1279	1	130	LYS	CE	C	43.303	0.400	1
1280	1	130	LYS	N	N	130.529	0.400	1
1281	1	131	VAL	H	H	8.095	0.020	1
1282	1	131	VAL	HA	H	4.588	0.020	1
1283	1	131	VAL	HB	H	1.796	0.020	1
1284	1	131	VAL	HG11	H	0.864	0.020	2
1285	1	131	VAL	HG12	H	0.864	0.020	2
1286	1	131	VAL	HG13	H	0.864	0.020	2
1287	1	131	VAL	HG21	H	0.707	0.020	2
1288	1	131	VAL	HG22	H	0.707	0.020	2
1289	1	131	VAL	HG23	H	0.707	0.020	2
1290	1	131	VAL	CA	C	61.227	0.400	1
1291	1	131	VAL	CB	C	34.539	0.400	1
1292	1	131	VAL	CG1	C	22.106	0.400	2
1293	1	131	VAL	CG2	C	24.398	0.400	2
1294	1	131	VAL	N	N	123.571	0.400	1
1295	1	132	GLU	H	H	8.283	0.020	1
1296	1	132	GLU	HA	H	4.612	0.020	1
1297	1	132	GLU	HB2	H	1.929	0.020	2
1298	1	132	GLU	HB3	H	1.938	0.020	2
1299	1	132	GLU	HG2	H	1.877	0.020	2
1300	1	132	GLU	HG3	H	2.011	0.020	2
1301	1	132	GLU	CA	C	55.639	0.400	1
1302	1	132	GLU	CB	C	34.080	0.400	1
1303	1	132	GLU	CG	C	34.229	0.400	1
1304	1	132	GLU	N	N	125.554	0.400	1
1305	1	133	THR	H	H	8.102	0.020	1
1306	1	133	THR	HA	H	5.011	0.020	1
1307	1	133	THR	HB	H	3.801	0.020	1
1308	1	133	THR	HG1	H	4.770	0.020	1
1309	1	133	THR	HG21	H	1.021	0.020	1
1310	1	133	THR	HG22	H	1.021	0.020	1
1311	1	133	THR	HG23	H	1.021	0.020	1
1312	1	133	THR	CA	C	62.671	0.400	1
1313	1	133	THR	CB	C	69.300	0.400	1
1314	1	133	THR	CG2	C	21.704	0.400	1
1315	1	133	THR	N	N	122.148	0.400	1
1316	1	134	THR	H	H	8.654	0.020	1
1317	1	134	THR	HA	H	4.466	0.020	1
1318	1	134	THR	HB	H	3.927	0.020	1
1319	1	134	THR	HG21	H	1.177	0.020	1
1320	1	134	THR	HG22	H	1.177	0.020	1
1321	1	134	THR	HG23	H	1.177	0.020	1
1322	1	134	THR	CA	C	61.201	0.400	1
1323	1	134	THR	CB	C	70.646	0.400	1
1324	1	134	THR	CG2	C	21.498	0.400	1
1325	1	134	THR	N	N	121.022	0.400	1
1326	1	135	ASP	H	H	11.282	0.020	1
1327	1	135	ASP	HA	H	4.381	0.020	1
1328	1	135	ASP	HB2	H	2.528	0.020	2
1329	1	135	ASP	HB3	H	2.903	0.020	2
1330	1	135	ASP	CA	C	54.746	0.400	1
1331	1	135	ASP	CB	C	39.655	0.400	1
1332	1	135	ASP	N	N	135.750	0.400	1
1333	1	136	GLY	H	H	7.990	0.020	1
1334	1	136	GLY	HA2	H	3.603	0.020	2
1335	1	136	GLY	HA3	H	3.993	0.020	2
1336	1	136	GLY	CA	C	45.573	0.400	1
1337	1	136	GLY	N	N	101.562	0.400	1
1338	1	137	VAL	H	H	7.814	0.020	1
1339	1	137	VAL	HA	H	4.453	0.020	1
1340	1	137	VAL	HB	H	2.183	0.020	1
1341	1	137	VAL	HG11	H	0.730	0.020	2
1342	1	137	VAL	HG12	H	0.730	0.020	2
1343	1	137	VAL	HG13	H	0.730	0.020	2
1344	1	137	VAL	HG21	H	0.869	0.020	2
1345	1	137	VAL	HG22	H	0.869	0.020	2
1346	1	137	VAL	HG23	H	0.869	0.020	2
1347	1	137	VAL	CA	C	61.947	0.400	1
1348	1	137	VAL	CB	C	31.551	0.400	1
1349	1	137	VAL	CG1	C	20.280	0.400	2
1350	1	137	VAL	CG2	C	21.279	0.400	2
1351	1	137	VAL	N	N	121.852	0.400	1
1352	1	138	VAL	H	H	8.612	0.020	1
1353	1	138	VAL	HA	H	4.589	0.020	1
1354	1	138	VAL	HB	H	1.980	0.020	1
1355	1	138	VAL	HG11	H	0.802	0.020	2
1356	1	138	VAL	HG12	H	0.802	0.020	2
1357	1	138	VAL	HG13	H	0.802	0.020	2
1358	1	138	VAL	HG21	H	1.039	0.020	2
1359	1	138	VAL	HG22	H	1.039	0.020	2
1360	1	138	VAL	HG23	H	1.039	0.020	2
1361	1	138	VAL	CA	C	61.230	0.400	1
1362	1	138	VAL	CB	C	33.993	0.400	1
1363	1	138	VAL	CG2	C	23.436	0.400	2
1364	1	138	VAL	N	N	131.196	0.400	1
1365	1	139	GLN	H	H	9.588	0.020	1
1366	1	139	GLN	HA	H	5.237	0.020	1
1367	1	139	GLN	HB2	H	1.898	0.020	2
1368	1	139	GLN	HB3	H	2.154	0.020	2
1369	1	139	GLN	HG2	H	2.188	0.020	2
1370	1	139	GLN	HG3	H	2.189	0.020	2
1371	1	139	GLN	HE21	H	6.977	0.020	2
1372	1	139	GLN	HE22	H	7.466	0.020	2
1373	1	139	GLN	CA	C	54.251	0.400	1
1374	1	139	GLN	CB	C	31.354	0.400	1
1375	1	139	GLN	CG	C	34.084	0.400	1
1376	1	139	GLN	N	N	128.026	0.400	1
1377	1	139	GLN	NE2	N	112.792	0.400	1
1378	1	140	LEU	H	H	8.546	0.020	1
1379	1	140	LEU	HA	H	5.422	0.020	1
1380	1	140	LEU	HB2	H	1.061	0.020	2
1381	1	140	LEU	HB3	H	1.889	0.020	2
1382	1	140	LEU	HG	H	1.484	0.020	1
1383	1	140	LEU	HD11	H	0.593	0.020	2
1384	1	140	LEU	HD12	H	0.593	0.020	2
1385	1	140	LEU	HD13	H	0.593	0.020	2
1386	1	140	LEU	HD21	H	0.592	0.020	2
1387	1	140	LEU	HD22	H	0.592	0.020	2
1388	1	140	LEU	HD23	H	0.592	0.020	2
1389	1	140	LEU	CA	C	52.569	0.400	1
1390	1	140	LEU	CB	C	44.198	0.400	1
1391	1	140	LEU	CG	C	26.281	0.400	1
1392	1	140	LEU	CD1	C	25.591	0.400	2
1393	1	140	LEU	CD2	C	25.597	0.400	2
1394	1	140	LEU	N	N	126.257	0.400	1
1395	1	141	SER	H	H	8.878	0.020	1
1396	1	141	SER	HA	H	4.452	0.020	1
1397	1	141	SER	HB2	H	3.859	0.020	2
1398	1	141	SER	HB3	H	3.861	0.020	2
1399	1	141	SER	HG	H	4.451	0.020	1
1400	1	141	SER	CA	C	57.547	0.400	1
1401	1	141	SER	CB	C	65.661	0.400	1
1402	1	141	SER	N	N	115.969	0.400	1
1403	1	142	GLY	H	H	8.818	0.020	1
1404	1	142	GLY	HA2	H	3.745	0.020	2
1405	1	142	GLY	HA3	H	5.356	0.020	2
1406	1	142	GLY	CA	C	43.462	0.400	1
1407	1	142	GLY	N	N	109.211	0.400	1
1408	1	143	THR	H	H	7.841	0.020	1
1409	1	143	THR	HA	H	5.223	0.020	1
1410	1	143	THR	HB	H	3.816	0.020	1
1411	1	143	THR	HG21	H	0.693	0.020	1
1412	1	143	THR	HG22	H	0.693	0.020	1
1413	1	143	THR	HG23	H	0.693	0.020	1
1414	1	143	THR	CA	C	60.942	0.400	1
1415	1	143	THR	CB	C	71.457	0.400	1
1416	1	143	THR	CG2	C	21.381	0.400	1
1417	1	143	THR	N	N	115.110	0.400	1
1418	1	144	VAL	H	H	8.558	0.020	1
1419	1	144	VAL	HA	H	4.646	0.020	1
1420	1	144	VAL	HB	H	2.691	0.020	1
1421	1	144	VAL	HG11	H	0.702	0.020	2
1422	1	144	VAL	HG12	H	0.702	0.020	2
1423	1	144	VAL	HG13	H	0.702	0.020	2
1424	1	144	VAL	HG21	H	0.734	0.020	2
1425	1	144	VAL	HG22	H	0.734	0.020	2
1426	1	144	VAL	HG23	H	0.734	0.020	2
1427	1	144	VAL	CA	C	58.824	0.400	1
1428	1	144	VAL	CB	C	33.371	0.400	1
1429	1	144	VAL	CG1	C	19.086	0.400	2
1430	1	144	VAL	CG2	C	23.016	0.400	2
1431	1	144	VAL	N	N	115.351	0.400	1
1432	1	145	ASP	H	H	8.362	0.020	1
1433	1	145	ASP	HA	H	4.599	0.020	1
1434	1	145	ASP	HB2	H	2.673	0.020	2
1435	1	145	ASP	HB3	H	2.729	0.020	2
1436	1	145	ASP	CA	C	57.335	0.400	1
1437	1	145	ASP	CB	C	41.452	0.400	1
1438	1	145	ASP	N	N	118.188	0.400	1
1439	1	146	SER	H	H	7.675	0.020	1
1440	1	146	SER	HA	H	4.910	0.020	1
1441	1	146	SER	HB2	H	3.731	0.020	2
1442	1	146	SER	HB3	H	4.177	0.020	2
1443	1	146	SER	CA	C	55.889	0.400	1
1444	1	146	SER	CB	C	67.469	0.400	1
1445	1	146	SER	N	N	110.455	0.400	1
1446	1	147	GLN	H	H	7.500	0.020	1
1447	1	147	GLN	HA	H	3.746	0.020	1
1448	1	147	GLN	HB2	H	2.124	0.020	2
1449	1	147	GLN	HB3	H	2.124	0.020	2
1450	1	147	GLN	HG2	H	2.404	0.020	2
1451	1	147	GLN	HG3	H	2.407	0.020	2
1452	1	147	GLN	HE21	H	6.782	0.020	2
1453	1	147	GLN	HE22	H	7.853	0.020	2
1454	1	147	GLN	CA	C	58.052	0.400	1
1455	1	147	GLN	CG	C	33.254	0.400	1
1456	1	147	GLN	N	N	116.333	0.400	1
1457	1	147	GLN	NE2	N	115.103	0.400	1
1458	1	148	ALA	H	H	8.422	0.020	1
1459	1	148	ALA	HA	H	4.152	0.020	1
1460	1	148	ALA	HB1	H	1.370	0.020	1
1461	1	148	ALA	HB2	H	1.370	0.020	1
1462	1	148	ALA	HB3	H	1.370	0.020	1
1463	1	148	ALA	CA	C	55.206	0.400	1
1464	1	148	ALA	CB	C	17.950	0.400	1
1465	1	148	ALA	N	N	120.306	0.400	1
1466	1	149	GLN	H	H	7.501	0.020	1
1467	1	149	GLN	HA	H	3.788	0.020	1
1468	1	149	GLN	HB2	H	1.623	0.020	2
1469	1	149	GLN	HB3	H	2.615	0.020	2
1470	1	149	GLN	HG2	H	2.406	0.020	2
1471	1	149	GLN	HG3	H	2.476	0.020	2
1472	1	149	GLN	HE21	H	7.155	0.020	2
1473	1	149	GLN	HE22	H	7.408	0.020	2
1474	1	149	GLN	CA	C	58.747	0.400	1
1475	1	149	GLN	CB	C	28.602	0.400	1
1476	1	149	GLN	CG	C	33.356	0.400	1
1477	1	149	GLN	N	N	116.333	0.400	1
1478	1	149	GLN	NE2	N	109.660	0.400	1
1479	1	150	SER	H	H	7.230	0.020	1
1480	1	150	SER	HA	H	4.055	0.020	1
1481	1	150	SER	HB2	H	3.547	0.020	2
1482	1	150	SER	HB3	H	4.057	0.020	2
1483	1	150	SER	CA	C	60.154	0.400	1
1484	1	150	SER	CB	C	62.595	0.400	1
1485	1	150	SER	N	N	114.005	0.400	1
1486	1	151	ASP	H	H	8.819	0.020	1
1487	1	151	ASP	HA	H	4.270	0.020	1
1488	1	151	ASP	HB2	H	2.664	0.020	2
1489	1	151	ASP	HB3	H	2.667	0.020	2
1490	1	151	ASP	CA	C	57.017	0.400	1
1491	1	151	ASP	CB	C	40.158	0.400	1
1492	1	151	ASP	N	N	118.234	0.400	1
1493	1	152	ARG	H	H	7.829	0.020	1
1494	1	152	ARG	HA	H	4.186	0.020	1
1495	1	152	ARG	HB2	H	1.817	0.020	2
1496	1	152	ARG	HB3	H	1.950	0.020	2
1497	1	152	ARG	HG2	H	1.283	0.020	2
1498	1	152	ARG	HG3	H	1.363	0.020	2
1499	1	152	ARG	HD2	H	3.068	0.020	2
1500	1	152	ARG	HD3	H	3.418	0.020	2
1501	1	152	ARG	CA	C	57.438	0.400	1
1502	1	152	ARG	CB	C	28.344	0.400	1
1503	1	152	ARG	CG	C	27.051	0.400	1
1504	1	152	ARG	CD	C	41.362	0.400	1
1505	1	152	ARG	N	N	120.778	0.400	1
1506	1	153	ALA	H	H	8.040	0.020	1
1507	1	153	ALA	HA	H	3.795	0.020	1
1508	1	153	ALA	HB1	H	1.346	0.020	1
1509	1	153	ALA	HB2	H	1.346	0.020	1
1510	1	153	ALA	HB3	H	1.346	0.020	1
1511	1	153	ALA	CA	C	55.255	0.400	1
1512	1	153	ALA	CB	C	17.626	0.400	1
1513	1	153	ALA	N	N	121.242	0.400	1
1514	1	154	GLU	H	H	7.992	0.020	1
1515	1	154	GLU	HA	H	3.692	0.020	1
1516	1	154	GLU	HB2	H	2.128	0.020	2
1517	1	154	GLU	HB3	H	2.134	0.020	2
1518	1	154	GLU	HG2	H	2.032	0.020	2
1519	1	154	GLU	HG3	H	2.227	0.020	2
1520	1	154	GLU	CA	C	60.130	0.400	1
1521	1	154	GLU	CB	C	29.479	0.400	1
1522	1	154	GLU	CG	C	36.147	0.400	1
1523	1	154	GLU	N	N	116.663	0.400	1
1524	1	155	SER	H	H	8.162	0.020	1
1525	1	155	SER	HA	H	3.999	0.020	1
1526	1	155	SER	HB2	H	3.967	0.020	2
1527	1	155	SER	HB3	H	4.031	0.020	2
1528	1	155	SER	HG	H	4.773	0.020	1
1529	1	155	SER	CB	C	62.783	0.400	1
1530	1	155	SER	N	N	114.844	0.400	1
1531	1	156	ILE	H	H	8.227	0.020	1
1532	1	156	ILE	HA	H	3.637	0.020	1
1533	1	156	ILE	HB	H	1.836	0.020	1
1534	1	156	ILE	HG13	H	2.041	0.020	2
1535	1	156	ILE	HG21	H	0.804	0.020	1
1536	1	156	ILE	HG22	H	0.804	0.020	1
1537	1	156	ILE	HG23	H	0.804	0.020	1
1538	1	156	ILE	HD11	H	0.820	0.020	1
1539	1	156	ILE	HD12	H	0.820	0.020	1
1540	1	156	ILE	HD13	H	0.820	0.020	1
1541	1	156	ILE	CA	C	65.056	0.400	1
1542	1	156	ILE	CB	C	37.999	0.400	1
1543	1	156	ILE	CG1	C	26.846	0.400	1
1544	1	156	ILE	CG2	C	14.859	0.400	1
1545	1	156	ILE	CD1	C	14.845	0.400	1
1546	1	156	ILE	N	N	122.922	0.400	1
1547	1	157	ALA	H	H	7.881	0.020	1
1548	1	157	ALA	HA	H	3.931	0.020	1
1549	1	157	ALA	HB1	H	1.434	0.020	1
1550	1	157	ALA	HB2	H	1.434	0.020	1
1551	1	157	ALA	HB3	H	1.434	0.020	1
1552	1	157	ALA	CA	C	55.418	0.400	1
1553	1	157	ALA	CB	C	19.175	0.400	1
1554	1	157	ALA	N	N	120.168	0.400	1
1555	1	158	LYS	H	H	8.103	0.020	1
1556	1	158	LYS	HA	H	3.762	0.020	1
1557	1	158	LYS	HB2	H	1.823	0.020	2
1558	1	158	LYS	HB3	H	1.829	0.020	2
1559	1	158	LYS	HG2	H	1.465	0.020	2
1560	1	158	LYS	HG3	H	1.573	0.020	2
1561	1	158	LYS	HD2	H	1.673	0.020	2
1562	1	158	LYS	HD3	H	2.132	0.020	2
1563	1	158	LYS	HE3	H	2.973	0.020	2
1564	1	158	LYS	CA	C	58.213	0.400	1
1565	1	158	LYS	CB	C	33.058	0.400	1
1566	1	158	LYS	CG	C	26.063	0.400	1
1567	1	158	LYS	CD	C	29.439	0.400	1
1568	1	158	LYS	N	N	111.813	0.400	1
1569	1	159	ALA	H	H	7.115	0.020	1
1570	1	159	ALA	HA	H	4.331	0.020	1
1571	1	159	ALA	HB1	H	1.499	0.020	1
1572	1	159	ALA	HB2	H	1.499	0.020	1
1573	1	159	ALA	HB3	H	1.499	0.020	1
1574	1	159	ALA	CA	C	52.015	0.400	1
1575	1	159	ALA	CB	C	19.187	0.400	1
1576	1	159	ALA	N	N	117.991	0.400	1
1577	1	160	VAL	H	H	7.124	0.020	1
1578	1	160	VAL	HA	H	3.825	0.020	1
1579	1	160	VAL	HB	H	2.132	0.020	1
1580	1	160	VAL	HG11	H	1.069	0.020	2
1581	1	160	VAL	HG12	H	1.069	0.020	2
1582	1	160	VAL	HG13	H	1.069	0.020	2
1583	1	160	VAL	HG21	H	1.075	0.020	2
1584	1	160	VAL	HG22	H	1.075	0.020	2
1585	1	160	VAL	HG23	H	1.075	0.020	2
1586	1	160	VAL	CA	C	63.975	0.400	1
1587	1	160	VAL	CB	C	31.468	0.400	1
1588	1	160	VAL	CG1	C	21.604	0.400	2
1589	1	160	VAL	CG2	C	21.624	0.400	2
1590	1	160	VAL	N	N	122.705	0.400	1
1591	1	161	ASP	H	H	8.655	0.020	1
1592	1	161	ASP	HA	H	4.322	0.020	1
1593	1	161	ASP	HB2	H	2.605	0.020	2
1594	1	161	ASP	HB3	H	2.626	0.020	2
1595	1	161	ASP	CA	C	56.422	0.400	1
1596	1	161	ASP	CB	C	41.309	0.400	1
1597	1	161	ASP	N	N	128.649	0.400	1
1598	1	162	GLY	H	H	8.581	0.020	1
1599	1	162	GLY	HA2	H	3.582	0.020	2
1600	1	162	GLY	HA3	H	4.320	0.020	2
1601	1	162	GLY	CA	C	45.296	0.400	1
1602	1	162	GLY	N	N	111.264	0.400	1
1603	1	163	VAL	H	H	7.457	0.020	1
1604	1	163	VAL	HA	H	3.910	0.020	1
1605	1	163	VAL	HB	H	2.127	0.020	1
1606	1	163	VAL	CA	C	64.198	0.400	1
1607	1	163	VAL	CB	C	31.964	0.400	1
1608	1	163	VAL	CG2	C	23.535	0.400	2
1609	1	163	VAL	N	N	120.410	0.400	1
1610	1	164	LYS	H	H	9.573	0.020	1
1611	1	164	LYS	HA	H	4.178	0.020	1
1612	1	164	LYS	HB2	H	1.528	0.020	2
1613	1	164	LYS	HB3	H	1.815	0.020	2
1614	1	164	LYS	HG2	H	1.349	0.020	2
1615	1	164	LYS	HG3	H	1.465	0.020	2
1616	1	164	LYS	HE2	H	2.904	0.020	2
1617	1	164	LYS	HE3	H	2.903	0.020	2
1618	1	164	LYS	CA	C	57.824	0.400	1
1619	1	164	LYS	CB	C	34.475	0.400	1
1620	1	164	LYS	CG	C	25.280	0.400	1
1621	1	164	LYS	CE	C	39.665	0.400	1
1622	1	164	LYS	N	N	130.974	0.400	1
1623	1	165	SER	H	H	7.485	0.020	1
1624	1	165	SER	HA	H	4.450	0.020	1
1625	1	165	SER	HB2	H	3.821	0.020	2
1626	1	165	SER	HB3	H	3.844	0.020	2
1627	1	165	SER	CA	C	57.386	0.400	1
1628	1	165	SER	CB	C	64.068	0.400	1
1629	1	165	SER	N	N	109.900	0.400	1
1630	1	166	VAL	H	H	8.553	0.020	1
1631	1	166	VAL	HA	H	4.873	0.020	1
1632	1	166	VAL	HB	H	1.896	0.020	1
1633	1	166	VAL	HG11	H	0.734	0.020	2
1634	1	166	VAL	HG12	H	0.734	0.020	2
1635	1	166	VAL	HG13	H	0.734	0.020	2
1636	1	166	VAL	HG21	H	0.802	0.020	2
1637	1	166	VAL	HG22	H	0.802	0.020	2
1638	1	166	VAL	HG23	H	0.802	0.020	2
1639	1	166	VAL	CA	C	60.521	0.400	1
1640	1	166	VAL	CB	C	34.720	0.400	1
1641	1	166	VAL	CG1	C	21.242	0.400	2
1642	1	166	VAL	CG2	C	21.725	0.400	2
1643	1	166	VAL	N	N	120.200	0.400	1
1644	1	167	LYS	H	H	9.720	0.020	1
1645	1	167	LYS	HA	H	4.417	0.020	1
1646	1	167	LYS	HB2	H	1.590	0.020	2
1647	1	167	LYS	HB3	H	1.854	0.020	2
1648	1	167	LYS	HG2	H	1.269	0.020	2
1649	1	167	LYS	HG3	H	1.348	0.020	2
1650	1	167	LYS	HD2	H	1.592	0.020	2
1651	1	167	LYS	HD3	H	1.591	0.020	2
1652	1	167	LYS	CA	C	54.784	0.400	1
1653	1	167	LYS	CB	C	32.646	0.400	1
1654	1	167	LYS	CG	C	24.552	0.400	1
1655	1	167	LYS	N	N	131.087	0.400	1
1656	1	168	ASN	H	H	8.979	0.020	1
1657	1	168	ASN	HA	H	4.682	0.020	1
1658	1	168	ASN	HB2	H	2.150	0.020	2
1659	1	168	ASN	HB3	H	3.258	0.020	2
1660	1	168	ASN	HD21	H	6.565	0.020	2
1661	1	168	ASN	HD22	H	7.889	0.020	2
1662	1	168	ASN	CA	C	52.087	0.400	1
1663	1	168	ASN	CB	C	38.041	0.400	1
1664	1	168	ASN	N	N	123.857	0.400	1
1665	1	168	ASN	ND2	N	108.109	0.400	1
1666	1	169	ASP	H	H	8.547	0.020	1
1667	1	169	ASP	HA	H	5.074	0.020	1
1668	1	169	ASP	HB2	H	2.512	0.020	2
1669	1	169	ASP	HB3	H	3.020	0.020	2
1670	1	169	ASP	CA	C	53.455	0.400	1
1671	1	169	ASP	CB	C	41.232	0.400	1
1672	1	169	ASP	N	N	126.300	0.400	1
1673	1	170	LEU	H	H	8.401	0.020	1
1674	1	170	LEU	HA	H	4.234	0.020	1
1675	1	170	LEU	HB2	H	0.883	0.020	2
1676	1	170	LEU	HB3	H	2.167	0.020	2
1677	1	170	LEU	HD11	H	0.820	0.020	2
1678	1	170	LEU	HD12	H	0.820	0.020	2
1679	1	170	LEU	HD13	H	0.820	0.020	2
1680	1	170	LEU	HD21	H	0.820	0.020	2
1681	1	170	LEU	HD22	H	0.820	0.020	2
1682	1	170	LEU	HD23	H	0.820	0.020	2
1683	1	170	LEU	CB	C	41.297	0.400	1
1684	1	170	LEU	CD1	C	25.942	0.400	2
1685	1	170	LEU	CD2	C	25.959	0.400	2
1686	1	170	LEU	N	N	121.645	0.400	1
1687	1	171	LYS	H	H	8.776	0.020	1
1688	1	171	LYS	HA	H	4.686	0.020	1
1689	1	171	LYS	HB2	H	1.873	0.020	2
1690	1	171	LYS	HB3	H	1.873	0.020	2
1691	1	171	LYS	HG2	H	1.024	0.020	2
1692	1	171	LYS	HG3	H	1.026	0.020	2
1693	1	171	LYS	HD2	H	1.516	0.020	2
1694	1	171	LYS	HD3	H	1.540	0.020	2
1695	1	171	LYS	HE3	H	2.996	0.020	2
1696	1	171	LYS	CA	C	54.159	0.400	1
1697	1	171	LYS	CB	C	34.285	0.400	1
1698	1	171	LYS	CG	C	21.800	0.400	1
1699	1	171	LYS	CE	C	41.235	0.400	1
1700	1	171	LYS	N	N	123.244	0.400	1
1701	1	172	THR	H	H	8.277	0.020	1
1702	1	172	THR	HA	H	4.938	0.020	1
1703	1	172	THR	HB	H	3.996	0.020	1
1704	1	172	THR	HG1	H	4.774	0.020	1
1705	1	172	THR	CA	C	59.656	0.400	1
1706	1	172	THR	CB	C	70.246	0.400	1
1707	1	172	THR	CG2	C	19.067	0.400	1
1708	1	172	THR	N	N	111.302	0.400	1
1709	1	173	LYS	H	H	8.064	0.020	1
1710	1	173	LYS	HA	H	4.236	0.020	1
1711	1	173	LYS	HB2	H	1.804	0.020	2
1712	1	173	LYS	HB3	H	1.880	0.020	2
1713	1	173	LYS	HG3	H	1.440	0.020	2
1714	1	173	LYS	HD2	H	1.427	0.020	2
1715	1	173	LYS	HE2	H	2.673	0.020	2
1716	1	173	LYS	CA	C	57.167	0.400	1
1717	1	173	LYS	CB	C	33.292	0.400	1
1718	1	173	LYS	CE	C	41.441	0.400	1
1719	1	173	LYS	N	N	122.655	0.400	1

Release date

2024-01-29

Citation

The Structure and Function of the Bacterial Osmotically Inducible Protein Y
Iyer, A., Frallicciardi, J., le Paige, U.B.A., Narasimhan, S., Luo, Y., Alvarez Sieiro, P., Syga, L., van den Brekel, F., Minh Tran, B., Tjoe, R., Schuurman-Wolters, G., Stuart, M., Baldus, M., van Ingen, H., Poolman, B.
J. Mol. Biol. (2024), 436, 168668-168668, PubMed 38908784 , DOI 10.1016/j.jmb.2024.168668 , Abstract

Related entities 1. Osmotically-inducible protein Y, : 1 : 2 : 4 entities Detail

Experiments performed 5 experiments Detail

1 3D 1H-13C NOESY aliphatic

Instrument

Bruker AVANCE III HD - 900 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7.4, Details 0.73 mM [U-100% 13C; U-100% 15N] Osmotically-inducible protein Y (OsmY), 50 mM NA KPi, 100 mM NA NaCl, 90% H2O/10% D2O

#	Name	Isotope labeling	Concentration
1	Osmotically-inducible protein Y (OsmY)	[U-100% 13C; U-100% 15N]	0.73 mM
2	KPi	NA	50 mM
3	NaCl	NA	100 mM

2 3D 1H-15N NOESY

Instrument

Bruker AVANCE III HD - 900 MHz

Sample

#	Name	Isotope labeling	Concentration
1	Osmotically-inducible protein Y (OsmY)	[U-100% 13C; U-100% 15N]	0.73 mM
2	KPi	NA	50 mM
3	NaCl	NA	100 mM

3 3D HNCA

Instrument

Bruker AVANCE III - 600 MHz

Sample

#	Name	Isotope labeling	Concentration
1	Osmotically-inducible protein Y (OsmY)	[U-100% 13C; U-100% 15N]	0.73 mM
2	KPi	NA	50 mM
3	NaCl	NA	100 mM

4 3D HNCACB

Instrument

Bruker AVANCE III - 600 MHz

Sample

#	Name	Isotope labeling	Concentration
1	Osmotically-inducible protein Y (OsmY)	[U-100% 13C; U-100% 15N]	0.73 mM
2	KPi	NA	50 mM
3	NaCl	NA	100 mM

5 3D CBCA(CO)NH

Instrument

Bruker AVANCE III - 600 MHz

Sample

#	Name	Isotope labeling	Concentration
1	Osmotically-inducible protein Y (OsmY)	[U-100% 13C; U-100% 15N]	0.73 mM
2	KPi	NA	50 mM
3	NaCl	NA	100 mM

Chemical shift validation 3 contents Detail

Properties

Input source #1: Assigned chemical shifts - Assigned chemical shifts	bmr34889_3.str
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

Content subtype: bmr34889_3.str

#	Content subtype	Saveframe	Status	# of rows	Experiment type	Sequence coverage (%)
1	Assigned chemical shifts	assigned_chemical_shifts_1	Warning	1719		95.1 (chain: 1, length: 182)
1	Chemical shift references	chem_shift_reference_1	OK	3		No information

Assigned chemical shifts

Saveframe: assigned_chemical_shifts_1

Status: Warning

Sequence coverage of experimental data

Entity_assembly_ID: 1, Chain length: 182, Sequence coverage: 95.1%

--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100
ENNAQTTNESAGQKVDSSMNKVGNFMDDSAITAKVKAALVDHDNIKSTDISVKTDQKVVTLSGFVESQAQAEEAVKVAKGVEGVTSVSDKLHVRDAKEGS
||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
ENNAQTTNESAGQKVDSSMNKVGNFMDDSAITAKVKAALVDHDNIKSTDISVKTDQKVVTLSGFVESQAQAEEAVKVAKGVEGVTSVSDKLHVRDAKEGS
--------10--------20--------30--------40--------50--------60--------70--------80--------90-------100

-------110-------120-------130-------140-------150-------160-------170-------180--
VKGYAGDTATTSEIKAKLLADDIVPSRHVKVETTDGVVQLSGTVDSQAQSDRAESIAKAVDGVKSVKNDLKTKGGGHHHHHH
|||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||         
VKGYAGDTATTSEIKAKLLADDIVPSRHVKVETTDGVVQLSGTVDSQAQSDRAESIAKAVDGVKSVKNDLKTK         
-------110-------120-------130-------140-------150-------160-------170---

Total number of assignments
- ¹H chemical shifts: 1089
- ¹³C chemical shifts: 463
- ¹⁵N chemical shifts: 167

Completeness of assignments

Entity_assemble_ID: 1

Excluded Atom_ID in statistics

Comp_index_ID	Comp_ID	Atom_ID	CS value (ppm)
7	THR	HG1	2.075
10	SER	HG	4.775
29	SER	HG	4.772
32	THR	HG1	4.369
42	HIS	HD1	7.864
48	THR	HG1	4.759
54	THR	HG1	8.433
60	THR	HG1	4.77
62	SER	HG	8.538
85	THR	HG1	7.482
86	SER	HG	4.774
88	SER	HG	4.579
92	HIS	HD1	8.533
100	SER	HG	4.772
110	THR	HG1	4.995
111	THR	HG1	5.941
112	SER	HG	3.82
126	SER	HG	7.898
128	HIS	HD1	7.908
133	THR	HG1	4.77
141	SER	HG	4.451
155	SER	HG	4.773
172	THR	HG1	4.774

All atoms

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	1000	878	87.8
¹³C chemical shifts	755	463	61.3
¹⁵N chemical shifts	196	167	85.2

Backbone atoms

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	377	353	93.6
¹³C chemical shifts	364	165	45.3
¹⁵N chemical shifts	181	157	86.7

Side chain atoms

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	623	525	84.3
¹³C chemical shifts	391	298	76.2
¹⁵N chemical shifts	15	10	66.7

Methyl group atoms

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	109	94	86.2
¹³C chemical shifts	109	91	83.5

Aromatic group atoms

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	32	18	56.2
¹³C chemical shifts	32	0	0.0

Peptide bond of PRO
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: 1

Keywords TRANSPORT PROTEIN, osmoregulatory protein bacterial protein

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Found 1 Document (0.464 seconds)

BMRB: 34889

Related entities 1. Osmotically-inducible protein Y, : 1 : 2 : 4 entities Detail

Experiments performed 5 experiments Detail

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Chemical shift validation 3 contents Detail