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BMRB: 25263

6MNT

NMR assignments of the CUS-3 phage coat protein insertion domain.

Authors

Tripler, T.N., Maciejewski, M.W., Teschke, C.M., Alexandrescu, A.T.

Assembly

CUS-3id

Entity

1. CUS-3id (polymer, Thiol state: not present), 126 monomers, 13255.59 × 2 Da Detail

MASGSTESLT VSGQPEHKVE AKDSNGMPVD NRQGTITVSA SGLQVGDAFT IAGVNSVHQI TKDTTGQPQV FRVLAVSGTT VTISPKILPV ENTDVASRPY ANVDAKPAES AAITILNKLE HHHHHH

Total weight

26511.18 Da

Max. entity weight

13255.59 Da

Source organism

Bacteriophage sp.

Exptl. method

solution NMR

Refine. method

molecular dynamics

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 742, ¹³C: 461, ¹⁵N: 119 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	4	GLY	H	H	8.581	0.008	1
2	1	4	GLY	HA2	H	4.032	0.008	2
3	1	4	GLY	HA3	H	3.897	0.008	2
4	1	4	GLY	C	C	172.149	0.16	1
5	1	4	GLY	CA	C	44.936	0.16	1
6	1	4	GLY	N	N	110.848	0.055	1
7	1	5	SER	H	H	8.289	0.008	1
8	1	5	SER	HA	H	4.629	0.008	1
9	1	5	SER	HB2	H	3.950	0.008	2
10	1	5	SER	HB3	H	3.952	0.008	2
11	1	5	SER	C	C	173.068	0.16	1
12	1	5	SER	CA	C	57.651	0.16	1
13	1	5	SER	CB	C	63.542	0.16	1
14	1	5	SER	N	N	115.298	0.055	1
15	1	6	THR	H	H	8.322	0.008	1
16	1	6	THR	HA	H	4.415	0.008	1
17	1	6	THR	HB	H	4.346	0.008	1
18	1	6	THR	HG21	H	1.226	0.008	1
19	1	6	THR	HG22	H	1.226	0.008	1
20	1	6	THR	HG23	H	1.226	0.008	1
21	1	6	THR	C	C	172.552	0.16	1
22	1	6	THR	CA	C	61.573	0.16	1
23	1	6	THR	CB	C	69.043	0.16	1
24	1	6	THR	CG2	C	20.827	0.16	1
25	1	6	THR	N	N	115.320	0.055	1
26	1	7	GLU	H	H	8.405	0.008	1
27	1	7	GLU	HA	H	4.413	0.008	1
28	1	7	GLU	HB2	H	1.972	0.008	2
29	1	7	GLU	HB3	H	1.955	0.008	2
30	1	7	GLU	HG2	H	2.323	0.008	2
31	1	7	GLU	HG3	H	2.338	0.008	2
32	1	7	GLU	C	C	174.288	0.16	1
33	1	7	GLU	CA	C	56.074	0.16	1
34	1	7	GLU	CB	C	29.918	0.16	1
35	1	7	GLU	CG	C	35.557	0.16	1
36	1	7	GLU	N	N	122.674	0.055	1
37	1	8	SER	H	H	8.305	0.008	1
38	1	8	SER	HA	H	4.563	0.008	1
39	1	8	SER	HB2	H	3.932	0.008	2
40	1	8	SER	HB3	H	3.944	0.008	2
41	1	8	SER	C	C	171.754	0.16	1
42	1	8	SER	CA	C	57.726	0.16	1
43	1	8	SER	CB	C	63.382	0.16	1
44	1	8	SER	N	N	116.754	0.055	1
45	1	9	LEU	H	H	8.679	0.008	1
46	1	9	LEU	HA	H	4.360	0.008	1
47	1	9	LEU	HB2	H	1.640	0.008	2
48	1	9	LEU	HB3	H	1.492	0.008	2
49	1	9	LEU	HG	H	1.639	0.008	1
50	1	9	LEU	HD11	H	0.817	0.008	2
51	1	9	LEU	HD12	H	0.817	0.008	2
52	1	9	LEU	HD13	H	0.817	0.008	2
53	1	9	LEU	HD21	H	0.788	0.008	2
54	1	9	LEU	HD22	H	0.788	0.008	2
55	1	9	LEU	HD23	H	0.788	0.008	2
56	1	9	LEU	C	C	174.102	0.16	1
57	1	9	LEU	CA	C	54.706	0.16	1
58	1	9	LEU	CB	C	43.328	0.16	1
59	1	9	LEU	CG	C	26.770	0.16	1
60	1	9	LEU	CD1	C	24.353	0.16	2
61	1	9	LEU	CD2	C	22.905	0.16	2
62	1	9	LEU	N	N	125.354	0.055	1
63	1	10	THR	H	H	8.784	0.008	1
64	1	10	THR	HA	H	5.186	0.008	1
65	1	10	THR	HB	H	3.760	0.008	1
66	1	10	THR	HG21	H	0.998	0.008	1
67	1	10	THR	HG22	H	0.998	0.008	1
68	1	10	THR	HG23	H	0.998	0.008	1
69	1	10	THR	C	C	171.243	0.16	1
70	1	10	THR	CA	C	58.809	0.16	1
71	1	10	THR	CB	C	72.375	0.16	1
72	1	10	THR	CG2	C	20.905	0.16	1
73	1	10	THR	N	N	114.189	0.055	1
74	1	11	VAL	H	H	8.716	0.008	1
75	1	11	VAL	HA	H	4.514	0.008	1
76	1	11	VAL	HB	H	2.024	0.008	1
77	1	11	VAL	HG11	H	0.852	0.008	2
78	1	11	VAL	HG12	H	0.852	0.008	2
79	1	11	VAL	HG13	H	0.852	0.008	2
80	1	11	VAL	HG21	H	1.081	0.008	2
81	1	11	VAL	HG22	H	1.081	0.008	2
82	1	11	VAL	HG23	H	1.081	0.008	2
83	1	11	VAL	C	C	174.104	0.16	1
84	1	11	VAL	CA	C	60.793	0.16	1
85	1	11	VAL	CB	C	33.002	0.16	1
86	1	11	VAL	CG1	C	21.647	0.16	2
87	1	11	VAL	CG2	C	22.785	0.16	2
88	1	11	VAL	N	N	117.800	0.055	1
89	1	12	SER	H	H	8.662	0.008	1
90	1	12	SER	HA	H	5.033	0.008	1
91	1	12	SER	HB2	H	3.734	0.008	2
92	1	12	SER	HB3	H	3.525	0.008	2
93	1	12	SER	C	C	172.982	0.16	1
94	1	12	SER	CA	C	56.369	0.16	1
95	1	12	SER	CB	C	63.960	0.16	1
96	1	12	SER	N	N	125.116	0.055	1
97	1	13	GLY	H	H	10.150	0.008	1
98	1	13	GLY	HA2	H	3.827	0.008	2
99	1	13	GLY	HA3	H	3.991	0.008	2
100	1	13	GLY	C	C	172.590	0.16	1
101	1	13	GLY	CA	C	45.559	0.16	1
102	1	13	GLY	N	N	113.190	0.055	1
103	1	14	GLN	H	H	9.062	0.008	1
104	1	14	GLN	HA	H	3.914	0.008	1
105	1	14	GLN	HB2	H	1.810	0.008	2
106	1	14	GLN	HB3	H	1.854	0.008	2
107	1	14	GLN	HG2	H	2.068	0.008	2
108	1	14	GLN	HG3	H	2.060	0.008	2
109	1	14	GLN	HE21	H	6.687	0.008	1
110	1	14	GLN	HE22	H	6.856	0.008	1
111	1	14	GLN	C	C	169.702	0.16	1
112	1	14	GLN	CA	C	55.461	0.16	1
113	1	14	GLN	CB	C	29.278	0.16	1
114	1	14	GLN	CG	C	34.115	0.16	1
115	1	14	GLN	N	N	115.657	0.055	1
116	1	14	GLN	NE2	N	113.170	0.055	1
117	1	15	PRO	HA	H	4.200	0.008	1
118	1	15	PRO	HB2	H	1.341	0.008	1
119	1	15	PRO	HB3	H	1.341	0.008	1
120	1	15	PRO	HG2	H	1.779	0.008	2
121	1	15	PRO	HG3	H	1.783	0.008	2
122	1	15	PRO	HD2	H	3.984	0.008	1
123	1	15	PRO	HD3	H	3.984	0.008	1
124	1	15	PRO	C	C	172.373	0.16	1
125	1	15	PRO	CA	C	62.921	0.16	1
126	1	15	PRO	CB	C	31.922	0.16	1
127	1	15	PRO	CG	C	27.457	0.16	1
128	1	15	PRO	CD	C	49.973	0.16	1
129	1	16	GLU	H	H	7.256	0.008	1
130	1	16	GLU	HA	H	4.145	0.008	1
131	1	16	GLU	HB2	H	2.034	0.008	2
132	1	16	GLU	HB3	H	2.022	0.008	2
133	1	16	GLU	HG2	H	2.217	0.008	2
134	1	16	GLU	HG3	H	2.220	0.008	2
135	1	16	GLU	C	C	173.474	0.16	1
136	1	16	GLU	CA	C	54.488	0.16	1
137	1	16	GLU	CB	C	32.134	0.16	1
138	1	16	GLU	CG	C	34.612	0.16	1
139	1	16	GLU	N	N	111.818	0.055	1
140	1	17	HIS	H	H	8.822	0.008	1
141	1	17	HIS	HA	H	5.055	0.008	1
142	1	17	HIS	HB2	H	3.428	0.008	2
143	1	17	HIS	HB3	H	3.420	0.008	2
144	1	17	HIS	HD1	H	7.167	0.008	1
145	1	17	HIS	HD2	H	7.167	0.008	1
146	1	17	HIS	HE1	H	8.002	0.008	1
147	1	17	HIS	HE2	H	8.002	0.008	1
148	1	17	HIS	C	C	169.571	0.16	1
149	1	17	HIS	CA	C	55.920	0.16	1
150	1	17	HIS	CB	C	33.473	0.16	1
151	1	17	HIS	N	N	124.024	0.055	1
152	1	18	LYS	H	H	8.484	0.008	1
153	1	18	LYS	HA	H	4.831	0.008	1
154	1	18	LYS	HB2	H	1.691	0.008	1
155	1	18	LYS	HB3	H	1.691	0.008	1
156	1	18	LYS	HG2	H	1.207	0.008	1
157	1	18	LYS	HG3	H	1.207	0.008	1
158	1	18	LYS	HD2	H	1.640	0.008	1
159	1	18	LYS	HD3	H	1.640	0.008	1
160	1	18	LYS	HE2	H	2.971	0.008	1
161	1	18	LYS	HE3	H	2.971	0.008	1
162	1	18	LYS	C	C	173.558	0.16	1
163	1	18	LYS	CA	C	53.907	0.16	1
164	1	18	LYS	CB	C	35.320	0.16	1
165	1	18	LYS	CG	C	23.320	0.16	1
166	1	18	LYS	CD	C	28.835	0.16	1
167	1	18	LYS	CE	C	41.539	0.16	1
168	1	18	LYS	N	N	113.993	0.055	1
169	1	19	VAL	H	H	8.702	0.008	1
170	1	19	VAL	HA	H	3.911	0.008	1
171	1	19	VAL	HB	H	1.763	0.008	1
172	1	19	VAL	HG11	H	0.465	0.008	2
173	1	19	VAL	HG12	H	0.465	0.008	2
174	1	19	VAL	HG13	H	0.465	0.008	2
175	1	19	VAL	HG21	H	0.793	0.008	2
176	1	19	VAL	HG22	H	0.793	0.008	2
177	1	19	VAL	HG23	H	0.793	0.008	2
178	1	19	VAL	C	C	173.523	0.16	1
179	1	19	VAL	CA	C	62.454	0.16	1
180	1	19	VAL	CB	C	31.449	0.16	1
181	1	19	VAL	CG1	C	20.503	0.16	2
182	1	19	VAL	CG2	C	21.260	0.16	2
183	1	19	VAL	N	N	120.375	0.055	1
184	1	20	GLU	H	H	8.431	0.008	1
185	1	20	GLU	HA	H	4.537	0.008	1
186	1	20	GLU	HB2	H	1.878	0.008	2
187	1	20	GLU	HB3	H	1.851	0.008	2
188	1	20	GLU	HG2	H	2.181	0.008	2
189	1	20	GLU	HG3	H	2.185	0.008	2
190	1	20	GLU	C	C	173.275	0.16	1
191	1	20	GLU	CA	C	54.848	0.16	1
192	1	20	GLU	CB	C	31.795	0.16	1
193	1	20	GLU	CG	C	36.251	0.16	1
194	1	20	GLU	N	N	125.742	0.055	1
195	1	21	ALA	H	H	8.537	0.008	1
196	1	21	ALA	HA	H	4.415	0.008	1
197	1	21	ALA	HB1	H	1.401	0.008	1
198	1	21	ALA	HB2	H	1.401	0.008	1
199	1	21	ALA	HB3	H	1.401	0.008	1
200	1	21	ALA	C	C	175.255	0.16	1
201	1	21	ALA	CA	C	52.508	0.16	1
202	1	21	ALA	CB	C	19.414	0.16	1
203	1	21	ALA	N	N	123.043	0.055	1
204	1	22	LYS	H	H	8.012	0.008	1
205	1	22	LYS	HA	H	4.879	0.008	1
206	1	22	LYS	HB2	H	1.721	0.008	1
207	1	22	LYS	HB3	H	1.721	0.008	1
208	1	22	LYS	HG2	H	1.392	0.008	1
209	1	22	LYS	HG3	H	1.392	0.008	1
210	1	22	LYS	HD2	H	1.580	0.008	1
211	1	22	LYS	HD3	H	1.580	0.008	1
212	1	22	LYS	HE2	H	2.995	0.008	1
213	1	22	LYS	HE3	H	2.995	0.008	1
214	1	22	LYS	C	C	173.727	0.16	1
215	1	22	LYS	CA	C	54.467	0.16	1
216	1	22	LYS	CB	C	35.321	0.16	1
217	1	22	LYS	CG	C	24.206	0.16	1
218	1	22	LYS	CD	C	28.648	0.16	1
219	1	22	LYS	CE	C	41.435	0.16	1
220	1	22	LYS	N	N	117.064	0.055	1
221	1	23	ASP	H	H	8.679	0.008	1
222	1	23	ASP	HA	H	4.726	0.008	1
223	1	23	ASP	HB2	H	3.243	0.008	2
224	1	23	ASP	HB3	H	3.259	0.008	2
225	1	23	ASP	C	C	176.403	0.16	1
226	1	23	ASP	CA	C	52.203	0.16	1
227	1	23	ASP	CB	C	40.947	0.16	1
228	1	23	ASP	N	N	121.408	0.055	1
229	1	24	SER	H	H	8.486	0.008	1
230	1	24	SER	HA	H	4.283	0.008	1
231	1	24	SER	HB2	H	3.960	0.008	1
232	1	24	SER	HB3	H	3.960	0.008	1
233	1	24	SER	C	C	173.082	0.16	1
234	1	24	SER	CA	C	60.216	0.16	1
235	1	24	SER	CB	C	62.516	0.16	1
236	1	24	SER	N	N	113.799	0.055	1
237	1	25	ASN	H	H	8.381	0.008	1
238	1	25	ASN	HA	H	4.956	0.008	1
239	1	25	ASN	HB2	H	2.876	0.008	2
240	1	25	ASN	HB3	H	2.880	0.008	2
241	1	25	ASN	HD21	H	7.032	0.008	1
242	1	25	ASN	HD22	H	7.617	0.008	1
243	1	25	ASN	C	C	173.414	0.16	1
244	1	25	ASN	CA	C	52.672	0.16	1
245	1	25	ASN	CB	C	38.918	0.16	1
246	1	25	ASN	N	N	118.927	0.055	1
247	1	25	ASN	ND2	N	111.191	0.055	1
248	1	26	GLY	H	H	8.274	0.008	1
249	1	26	GLY	HA2	H	4.472	0.008	1
250	1	26	GLY	HA3	H	4.472	0.008	1
251	1	26	GLY	C	C	172.016	0.16	1
252	1	26	GLY	CA	C	45.365	0.16	1
253	1	26	GLY	N	N	107.879	0.055	1
254	1	27	MET	H	H	8.370	0.008	1
255	1	27	MET	HA	H	4.970	0.008	1
256	1	27	MET	HB2	H	2.280	0.008	2
257	1	27	MET	HB3	H	2.288	0.008	2
258	1	27	MET	HG2	H	2.493	0.008	2
259	1	27	MET	HG3	H	2.485	0.008	2
260	1	27	MET	C	C	171.949	0.16	1
261	1	27	MET	CA	C	52.268	0.16	1
262	1	27	MET	CB	C	30.956	0.16	1
263	1	27	MET	CG	C	31.892	0.16	1
264	1	27	MET	N	N	121.310	0.055	1
265	1	28	PRO	HA	H	4.590	0.008	1
266	1	28	PRO	HB2	H	2.247	0.008	2
267	1	28	PRO	HB3	H	2.244	0.008	2
268	1	28	PRO	HG2	H	1.941	0.008	1
269	1	28	PRO	HG3	H	1.941	0.008	1
270	1	28	PRO	HD2	H	3.733	0.008	1
271	1	28	PRO	HD3	H	3.733	0.008	1
272	1	28	PRO	C	C	174.892	0.16	1
273	1	28	PRO	CA	C	62.780	0.16	1
274	1	28	PRO	CB	C	31.677	0.16	1
275	1	28	PRO	CG	C	27.354	0.16	1
276	1	28	PRO	CD	C	50.125	0.16	1
277	1	29	VAL	H	H	7.865	0.008	1
278	1	29	VAL	HA	H	4.134	0.008	1
279	1	29	VAL	HB	H	1.874	0.008	1
280	1	29	VAL	HG11	H	0.843	0.008	2
281	1	29	VAL	HG12	H	0.843	0.008	2
282	1	29	VAL	HG13	H	0.843	0.008	2
283	1	29	VAL	HG21	H	0.896	0.008	2
284	1	29	VAL	HG22	H	0.896	0.008	2
285	1	29	VAL	HG23	H	0.896	0.008	2
286	1	29	VAL	C	C	173.086	0.16	1
287	1	29	VAL	CA	C	61.038	0.16	1
288	1	29	VAL	CB	C	33.375	0.16	1
289	1	29	VAL	CG1	C	20.741	0.16	2
290	1	29	VAL	CG2	C	21.696	0.16	2
291	1	29	VAL	N	N	122.197	0.055	1
292	1	30	ASP	H	H	8.682	0.008	1
293	1	30	ASP	HA	H	4.762	0.008	1
294	1	30	ASP	HB2	H	2.755	0.008	2
295	1	30	ASP	HB3	H	2.767	0.008	2
296	1	30	ASP	C	C	174.295	0.16	1
297	1	30	ASP	CA	C	52.787	0.16	1
298	1	30	ASP	CB	C	40.608	0.16	1
299	1	30	ASP	N	N	125.447	0.055	1
300	1	31	ASN	H	H	8.616	0.008	1
301	1	31	ASN	HA	H	4.685	0.008	1
302	1	31	ASN	HB2	H	2.894	0.008	1
303	1	31	ASN	HB3	H	2.894	0.008	1
304	1	31	ASN	HD21	H	7.787	0.008	1
305	1	31	ASN	HD22	H	7.911	0.008	1
306	1	31	ASN	C	C	172.847	0.16	1
307	1	31	ASN	CA	C	54.099	0.16	1
308	1	31	ASN	CB	C	38.426	0.16	1
309	1	31	ASN	N	N	120.731	0.055	1
310	1	31	ASN	ND2	N	110.895	0.055	1
311	1	32	ARG	H	H	8.401	0.008	1
312	1	32	ARG	HA	H	4.338	0.008	1
313	1	32	ARG	HB2	H	1.943	0.008	1
314	1	32	ARG	HB3	H	1.943	0.008	1
315	1	32	ARG	HG2	H	1.663	0.008	1
316	1	32	ARG	HG3	H	1.663	0.008	1
317	1	32	ARG	HD2	H	3.259	0.008	1
318	1	32	ARG	HD3	H	3.259	0.008	1
319	1	32	ARG	C	C	173.165	0.16	1
320	1	32	ARG	CA	C	57.040	0.16	1
321	1	32	ARG	CB	C	30.105	0.16	1
322	1	32	ARG	CG	C	26.466	0.16	1
323	1	32	ARG	CD	C	42.751	0.16	1
324	1	32	ARG	N	N	120.815	0.055	1
325	1	33	GLN	H	H	7.491	0.008	1
326	1	33	GLN	HA	H	5.708	0.008	1
327	1	33	GLN	HB2	H	1.757	0.008	2
328	1	33	GLN	HB3	H	1.746	0.008	2
329	1	33	GLN	HG2	H	2.111	0.008	2
330	1	33	GLN	HG3	H	2.139	0.008	2
331	1	33	GLN	HE21	H	6.619	0.008	1
332	1	33	GLN	HE22	H	7.427	0.008	1
333	1	33	GLN	C	C	171.906	0.16	1
334	1	33	GLN	CA	C	52.802	0.16	1
335	1	33	GLN	CB	C	32.050	0.16	1
336	1	33	GLN	CG	C	33.026	0.16	1
337	1	33	GLN	N	N	112.820	0.055	1
338	1	33	GLN	NE2	N	110.540	0.055	1
339	1	34	GLY	H	H	8.581	0.008	1
340	1	34	GLY	HA2	H	3.908	0.008	2
341	1	34	GLY	HA3	H	4.042	0.008	2
342	1	34	GLY	C	C	169.545	0.16	1
343	1	34	GLY	CA	C	43.299	0.16	1
344	1	34	GLY	N	N	105.834	0.055	1
345	1	35	THR	H	H	8.393	0.008	1
346	1	35	THR	HA	H	5.727	0.008	1
347	1	35	THR	HB	H	4.029	0.008	1
348	1	35	THR	C	C	174.249	0.16	1
349	1	35	THR	CA	C	60.375	0.16	1
350	1	35	THR	CB	C	70.908	0.16	1
351	1	35	THR	CG2	C	21.523	0.16	1
352	1	35	THR	N	N	111.476	0.055	1
353	1	36	ILE	H	H	9.344	0.008	1
354	1	36	ILE	HA	H	4.802	0.008	1
355	1	36	ILE	HB	H	2.046	0.008	1
356	1	36	ILE	HG12	H	1.411	0.008	2
357	1	36	ILE	HG13	H	1.403	0.008	2
358	1	36	ILE	HG21	H	0.925	0.008	1
359	1	36	ILE	HG22	H	0.925	0.008	1
360	1	36	ILE	HG23	H	0.925	0.008	1
361	1	36	ILE	HD11	H	0.734	0.008	1
362	1	36	ILE	HD12	H	0.734	0.008	1
363	1	36	ILE	HD13	H	0.734	0.008	1
364	1	36	ILE	C	C	171.098	0.16	1
365	1	36	ILE	CA	C	59.785	0.16	1
366	1	36	ILE	CB	C	42.242	0.16	1
367	1	36	ILE	CG1	C	25.157	0.16	1
368	1	36	ILE	CG2	C	18.349	0.16	1
369	1	36	ILE	CD1	C	13.266	0.16	1
370	1	36	ILE	N	N	118.025	0.055	1
371	1	37	THR	H	H	9.916	0.008	1
372	1	37	THR	HA	H	5.307	0.008	1
373	1	37	THR	HB	H	3.985	0.008	1
374	1	37	THR	HG21	H	1.248	0.008	1
375	1	37	THR	HG22	H	1.248	0.008	1
376	1	37	THR	HG23	H	1.248	0.008	1
377	1	37	THR	C	C	172.084	0.16	1
378	1	37	THR	CA	C	61.209	0.16	1
379	1	37	THR	CB	C	70.008	0.16	1
380	1	37	THR	CG2	C	21.263	0.16	1
381	1	37	THR	N	N	119.270	0.055	1
382	1	38	VAL	H	H	8.614	0.008	1
383	1	38	VAL	HA	H	5.286	0.008	1
384	1	38	VAL	HB	H	2.227	0.008	1
385	1	38	VAL	HG11	H	0.759	0.008	2
386	1	38	VAL	HG12	H	0.759	0.008	2
387	1	38	VAL	HG13	H	0.759	0.008	2
388	1	38	VAL	HG21	H	0.933	0.008	2
389	1	38	VAL	HG22	H	0.933	0.008	2
390	1	38	VAL	HG23	H	0.933	0.008	2
391	1	38	VAL	C	C	175.031	0.16	1
392	1	38	VAL	CA	C	58.499	0.16	1
393	1	38	VAL	CB	C	34.154	0.16	1
394	1	38	VAL	CG2	C	21.630	0.16	1
395	1	38	VAL	N	N	117.412	0.055	1
396	1	39	SER	H	H	8.742	0.008	1
397	1	39	SER	HA	H	3.966	0.008	1
398	1	39	SER	HB2	H	3.926	0.008	1
399	1	39	SER	HB3	H	3.926	0.008	1
400	1	39	SER	C	C	172.536	0.16	1
401	1	39	SER	CA	C	60.119	0.16	1
402	1	39	SER	CB	C	62.954	0.16	1
403	1	39	SER	N	N	112.706	0.055	1
404	1	40	ALA	H	H	7.365	0.008	1
405	1	40	ALA	HA	H	4.467	0.008	1
406	1	40	ALA	HB1	H	1.404	0.008	1
407	1	40	ALA	HB2	H	1.404	0.008	1
408	1	40	ALA	HB3	H	1.404	0.008	1
409	1	40	ALA	C	C	173.155	0.16	1
410	1	40	ALA	CA	C	50.757	0.16	1
411	1	40	ALA	CB	C	21.667	0.16	1
412	1	40	ALA	N	N	121.280	0.055	1
413	1	41	SER	H	H	8.169	0.008	1
414	1	41	SER	HA	H	4.579	0.008	1
415	1	41	SER	HB2	H	3.964	0.008	2
416	1	41	SER	HB3	H	3.932	0.008	2
417	1	41	SER	C	C	171.520	0.16	1
418	1	41	SER	CA	C	58.247	0.16	1
419	1	41	SER	CB	C	63.136	0.16	1
420	1	41	SER	N	N	112.431	0.055	1
421	1	42	GLY	H	H	8.723	0.008	1
422	1	42	GLY	HA2	H	3.593	0.008	1
423	1	42	GLY	HA3	H	3.593	0.008	1
424	1	42	GLY	C	C	172.900	0.16	1
425	1	42	GLY	CA	C	45.614	0.16	1
426	1	42	GLY	N	N	108.700	0.055	1
427	1	43	LEU	H	H	8.754	0.008	1
428	1	43	LEU	HA	H	4.444	0.008	1
429	1	43	LEU	HB2	H	1.739	0.008	1
430	1	43	LEU	HB3	H	1.739	0.008	1
431	1	43	LEU	HG	H	1.479	0.008	1
432	1	43	LEU	HD11	H	0.631	0.008	2
433	1	43	LEU	HD12	H	0.631	0.008	2
434	1	43	LEU	HD13	H	0.631	0.008	2
435	1	43	LEU	HD21	H	0.444	0.008	2
436	1	43	LEU	HD22	H	0.444	0.008	2
437	1	43	LEU	HD23	H	0.444	0.008	2
438	1	43	LEU	C	C	174.169	0.16	1
439	1	43	LEU	CA	C	55.306	0.16	1
440	1	43	LEU	CB	C	42.296	0.16	1
441	1	43	LEU	CG	C	26.837	0.16	1
442	1	43	LEU	CD1	C	22.837	0.16	2
443	1	43	LEU	CD2	C	25.641	0.16	2
444	1	43	LEU	N	N	122.492	0.055	1
445	1	44	GLN	H	H	9.097	0.008	1
446	1	44	GLN	HA	H	4.699	0.008	1
447	1	44	GLN	HB2	H	2.071	0.008	2
448	1	44	GLN	HB3	H	2.096	0.008	2
449	1	44	GLN	HG2	H	2.344	0.008	2
450	1	44	GLN	HG3	H	2.382	0.008	2
451	1	44	GLN	HE21	H	6.789	0.008	1
452	1	44	GLN	HE22	H	7.602	0.008	1
453	1	44	GLN	C	C	173.386	0.16	1
454	1	44	GLN	CA	C	52.948	0.16	1
455	1	44	GLN	CB	C	31.957	0.16	1
456	1	44	GLN	CG	C	33.217	0.16	1
457	1	44	GLN	N	N	119.367	0.055	1
458	1	44	GLN	NE2	N	112.236	0.055	1
459	1	45	VAL	H	H	8.602	0.008	1
460	1	45	VAL	HA	H	3.204	0.008	1
461	1	45	VAL	HB	H	1.911	0.008	1
462	1	45	VAL	HG21	H	1.063	0.008	1
463	1	45	VAL	HG22	H	1.063	0.008	1
464	1	45	VAL	HG23	H	1.063	0.008	1
465	1	45	VAL	C	C	175.386	0.16	1
466	1	45	VAL	CA	C	65.814	0.16	1
467	1	45	VAL	CB	C	30.813	0.16	1
468	1	45	VAL	CG1	C	20.657	0.16	2
469	1	45	VAL	CG2	C	22.576	0.16	2
470	1	45	VAL	N	N	121.229	0.055	1
471	1	46	GLY	H	H	8.804	0.008	1
472	1	46	GLY	HA2	H	4.341	0.008	1
473	1	46	GLY	HA3	H	4.341	0.008	1
474	1	46	GLY	C	C	173.006	0.16	1
475	1	46	GLY	CA	C	44.330	0.16	1
476	1	46	GLY	N	N	116.232	0.055	1
477	1	47	ASP	H	H	8.459	0.008	1
478	1	47	ASP	HA	H	4.673	0.008	1
479	1	47	ASP	HB2	H	2.532	0.008	2
480	1	47	ASP	HB3	H	2.967	0.008	2
481	1	47	ASP	C	C	174.100	0.16	1
482	1	47	ASP	CA	C	55.475	0.16	1
483	1	47	ASP	CB	C	41.406	0.16	1
484	1	47	ASP	N	N	122.891	0.055	1
485	1	48	ALA	H	H	8.843	0.008	1
486	1	48	ALA	HA	H	5.766	0.008	1
487	1	48	ALA	HB1	H	1.317	0.008	1
488	1	48	ALA	HB2	H	1.317	0.008	1
489	1	48	ALA	HB3	H	1.317	0.008	1
490	1	48	ALA	C	C	174.422	0.16	1
491	1	48	ALA	CA	C	49.163	0.16	1
492	1	48	ALA	CB	C	20.948	0.16	1
493	1	48	ALA	N	N	123.105	0.055	1
494	1	49	PHE	H	H	9.520	0.008	1
495	1	49	PHE	HA	H	5.899	0.008	1
496	1	49	PHE	HB2	H	2.778	0.008	2
497	1	49	PHE	HB3	H	2.806	0.008	2
498	1	49	PHE	HD1	H	6.997	0.008	3
499	1	49	PHE	HD2	H	6.997	0.008	3
500	1	49	PHE	HE1	H	6.822	0.008	3
501	1	49	PHE	HE2	H	6.822	0.008	3
502	1	49	PHE	HZ	H	6.908	0.008	1
503	1	49	PHE	C	C	170.156	0.16	1
504	1	49	PHE	CA	C	55.455	0.16	1
505	1	49	PHE	CB	C	42.726	0.16	1
506	1	49	PHE	N	N	117.929	0.055	1
507	1	50	THR	H	H	9.192	0.008	1
508	1	50	THR	HA	H	5.092	0.008	1
509	1	50	THR	HB	H	4.506	0.008	1
510	1	50	THR	C	C	171.313	0.16	1
511	1	50	THR	CA	C	58.787	0.16	1
512	1	50	THR	CB	C	70.932	0.16	1
513	1	50	THR	CG2	C	21.344	0.16	1
514	1	50	THR	N	N	108.998	0.055	1
515	1	51	ILE	H	H	10.983	0.008	1
516	1	51	ILE	HA	H	4.624	0.008	1
517	1	51	ILE	HB	H	1.660	0.008	1
518	1	51	ILE	HG12	H	0.929	0.008	2
519	1	51	ILE	HG13	H	0.878	0.008	2
520	1	51	ILE	HG21	H	0.979	0.008	1
521	1	51	ILE	HG22	H	0.979	0.008	1
522	1	51	ILE	HG23	H	0.979	0.008	1
523	1	51	ILE	HD11	H	0.574	0.008	1
524	1	51	ILE	HD12	H	0.574	0.008	1
525	1	51	ILE	HD13	H	0.574	0.008	1
526	1	51	ILE	C	C	173.958	0.16	1
527	1	51	ILE	CA	C	60.015	0.16	1
528	1	51	ILE	CB	C	40.234	0.16	1
529	1	51	ILE	CG1	C	26.766	0.16	1
530	1	51	ILE	CG2	C	18.673	0.16	1
531	1	51	ILE	CD1	C	13.339	0.16	1
532	1	51	ILE	N	N	122.678	0.055	1
533	1	52	ALA	H	H	8.672	0.008	1
534	1	52	ALA	HA	H	4.127	0.008	1
535	1	52	ALA	HB1	H	1.508	0.008	1
536	1	52	ALA	HB2	H	1.508	0.008	1
537	1	52	ALA	HB3	H	1.508	0.008	1
538	1	52	ALA	C	C	176.283	0.16	1
539	1	52	ALA	CA	C	53.555	0.16	1
540	1	52	ALA	CB	C	18.779	0.16	1
541	1	52	ALA	N	N	130.176	0.055	1
542	1	53	GLY	H	H	8.464	0.008	1
543	1	53	GLY	HA2	H	4.490	0.008	2
544	1	53	GLY	HA3	H	4.533	0.008	2
545	1	53	GLY	C	C	172.056	0.16	1
546	1	53	GLY	CA	C	45.638	0.16	1
547	1	53	GLY	N	N	108.375	0.055	1
548	1	54	VAL	H	H	7.852	0.008	1
549	1	54	VAL	HA	H	4.594	0.008	1
550	1	54	VAL	HB	H	2.503	0.008	1
551	1	54	VAL	HG11	H	1.214	0.008	2
552	1	54	VAL	HG12	H	1.214	0.008	2
553	1	54	VAL	HG13	H	1.214	0.008	2
554	1	54	VAL	HG21	H	0.794	0.008	2
555	1	54	VAL	HG22	H	0.794	0.008	2
556	1	54	VAL	HG23	H	0.794	0.008	2
557	1	54	VAL	C	C	173.030	0.16	1
558	1	54	VAL	CA	C	61.655	0.16	1
559	1	54	VAL	CB	C	31.157	0.16	1
560	1	54	VAL	CG1	C	19.972	0.16	2
561	1	54	VAL	CG2	C	20.579	0.16	2
562	1	54	VAL	N	N	122.762	0.055	1
563	1	55	ASN	H	H	9.581	0.008	1
564	1	55	ASN	HA	H	5.406	0.008	1
565	1	55	ASN	HB2	H	2.669	0.008	1
566	1	55	ASN	HB3	H	2.669	0.008	1
567	1	55	ASN	HD21	H	6.506	0.008	1
568	1	55	ASN	HD22	H	7.853	0.008	1
569	1	55	ASN	C	C	173.020	0.16	1
570	1	55	ASN	CA	C	51.647	0.16	1
571	1	55	ASN	CB	C	39.734	0.16	1
572	1	55	ASN	N	N	128.010	0.055	1
573	1	55	ASN	ND2	N	112.911	0.055	1
574	1	56	SER	H	H	8.552	0.008	1
575	1	56	SER	HA	H	4.927	0.008	1
576	1	56	SER	HB2	H	3.939	0.008	2
577	1	56	SER	HB3	H	3.965	0.008	2
578	1	56	SER	C	C	172.588	0.16	1
579	1	56	SER	CA	C	57.849	0.16	1
580	1	56	SER	CB	C	64.329	0.16	1
581	1	56	SER	N	N	113.734	0.055	1
582	1	57	VAL	H	H	7.177	0.008	1
583	1	57	VAL	HA	H	5.023	0.008	1
584	1	57	VAL	HB	H	1.674	0.008	1
585	1	57	VAL	HG11	H	0.611	0.008	2
586	1	57	VAL	HG12	H	0.611	0.008	2
587	1	57	VAL	HG13	H	0.611	0.008	2
588	1	57	VAL	HG21	H	0.347	0.008	2
589	1	57	VAL	HG22	H	0.347	0.008	2
590	1	57	VAL	HG23	H	0.347	0.008	2
591	1	57	VAL	C	C	173.867	0.16	1
592	1	57	VAL	CA	C	57.842	0.16	1
593	1	57	VAL	CB	C	33.781	0.16	1
594	1	57	VAL	CG1	C	20.118	0.16	2
595	1	57	VAL	CG2	C	17.089	0.16	2
596	1	57	VAL	N	N	110.904	0.055	1
597	1	58	HIS	H	H	8.740	0.008	1
598	1	58	HIS	HA	H	4.260	0.008	1
599	1	58	HIS	HB2	H	3.423	0.008	2
600	1	58	HIS	HB3	H	3.406	0.008	2
601	1	58	HIS	HD1	H	7.244	0.008	1
602	1	58	HIS	HD2	H	7.240	0.008	1
603	1	58	HIS	HE1	H	8.487	0.008	1
604	1	58	HIS	HE2	H	8.387	0.008	1
605	1	58	HIS	C	C	175.611	0.16	1
606	1	58	HIS	CA	C	57.296	0.16	1
607	1	58	HIS	CB	C	30.362	0.16	1
608	1	58	HIS	N	N	122.508	0.055	1
609	1	59	GLN	H	H	8.783	0.008	1
610	1	59	GLN	HA	H	4.075	0.008	1
611	1	59	GLN	HB2	H	2.137	0.008	1
612	1	59	GLN	HB3	H	2.137	0.008	1
613	1	59	GLN	HG2	H	2.500	0.008	2
614	1	59	GLN	HG3	H	2.503	0.008	2
615	1	59	GLN	HE21	H	6.821	0.008	1
616	1	59	GLN	HE22	H	7.610	0.008	1
617	1	59	GLN	C	C	175.255	0.16	1
618	1	59	GLN	CA	C	58.686	0.16	1
619	1	59	GLN	CB	C	28.737	0.16	1
620	1	59	GLN	CG	C	33.305	0.16	1
621	1	59	GLN	N	N	124.414	0.055	1
622	1	59	GLN	NE2	N	111.633	0.055	1
623	1	60	ILE	H	H	9.172	0.008	1
624	1	60	ILE	HA	H	4.205	0.008	1
625	1	60	ILE	HB	H	2.228	0.008	1
626	1	60	ILE	HG12	H	1.374	0.008	2
627	1	60	ILE	HG13	H	1.384	0.008	2
628	1	60	ILE	HG21	H	0.986	0.008	1
629	1	60	ILE	HG22	H	0.986	0.008	1
630	1	60	ILE	HG23	H	0.986	0.008	1
631	1	60	ILE	HD11	H	0.948	0.008	1
632	1	60	ILE	HD12	H	0.948	0.008	1
633	1	60	ILE	HD13	H	0.948	0.008	1
634	1	60	ILE	C	C	176.045	0.16	1
635	1	60	ILE	CA	C	62.486	0.16	1
636	1	60	ILE	CB	C	37.504	0.16	1
637	1	60	ILE	CG1	C	26.992	0.16	1
638	1	60	ILE	CG2	C	16.744	0.16	1
639	1	60	ILE	CD1	C	10.990	0.16	1
640	1	60	ILE	N	N	117.869	0.055	1
641	1	61	THR	H	H	8.297	0.008	1
642	1	61	THR	HA	H	4.099	0.008	1
643	1	61	THR	HB	H	4.291	0.008	1
644	1	61	THR	HG21	H	1.159	0.008	1
645	1	61	THR	HG22	H	1.159	0.008	1
646	1	61	THR	HG23	H	1.159	0.008	1
647	1	61	THR	C	C	173.954	0.16	1
648	1	61	THR	CA	C	62.528	0.16	1
649	1	61	THR	CB	C	69.029	0.16	1
650	1	61	THR	CG2	C	20.436	0.16	1
651	1	61	THR	N	N	109.967	0.055	1
652	1	62	LYS	H	H	7.935	0.008	1
653	1	62	LYS	HA	H	3.964	0.008	1
654	1	62	LYS	HB2	H	1.980	0.008	2
655	1	62	LYS	HB3	H	2.303	0.008	2
656	1	62	LYS	HG2	H	1.523	0.008	1
657	1	62	LYS	HG3	H	1.523	0.008	1
658	1	62	LYS	HD2	H	1.778	0.008	1
659	1	62	LYS	HD3	H	1.778	0.008	1
660	1	62	LYS	HE2	H	2.972	0.008	1
661	1	62	LYS	HE3	H	2.972	0.008	1
662	1	62	LYS	C	C	172.662	0.16	1
663	1	62	LYS	CA	C	55.909	0.16	1
664	1	62	LYS	CB	C	28.591	0.16	1
665	1	62	LYS	CG	C	23.709	0.16	1
666	1	62	LYS	CD	C	27.600	0.16	1
667	1	62	LYS	CE	C	42.640	0.16	1
668	1	62	LYS	N	N	112.062	0.055	1
669	1	63	ASP	H	H	8.065	0.008	1
670	1	63	ASP	HA	H	4.756	0.008	1
671	1	63	ASP	HB2	H	2.542	0.008	1
672	1	63	ASP	HB3	H	2.542	0.008	1
673	1	63	ASP	C	C	175.051	0.16	1
674	1	63	ASP	CA	C	53.133	0.16	1
675	1	63	ASP	CB	C	40.683	0.16	1
676	1	63	ASP	N	N	117.089	0.055	1
677	1	64	THR	H	H	8.644	0.008	1
678	1	64	THR	HA	H	4.486	0.008	1
679	1	64	THR	HB	H	4.032	0.008	1
680	1	64	THR	HG21	H	1.095	0.008	1
681	1	64	THR	HG22	H	1.095	0.008	1
682	1	64	THR	HG23	H	1.095	0.008	1
683	1	64	THR	C	C	172.537	0.16	1
684	1	64	THR	CA	C	61.681	0.16	1
685	1	64	THR	CB	C	68.591	0.16	1
686	1	64	THR	CG2	C	20.897	0.16	1
687	1	64	THR	N	N	115.682	0.055	1
688	1	65	THR	H	H	8.511	0.008	1
689	1	65	THR	HA	H	4.569	0.008	1
690	1	65	THR	HB	H	4.325	0.008	1
691	1	65	THR	HG21	H	1.226	0.008	1
692	1	65	THR	HG22	H	1.226	0.008	1
693	1	65	THR	HG23	H	1.226	0.008	1
694	1	65	THR	C	C	175.107	0.16	1
695	1	65	THR	CA	C	61.560	0.16	1
696	1	65	THR	CB	C	69.973	0.16	1
697	1	65	THR	CG2	C	19.970	0.16	1
698	1	65	THR	N	N	115.071	0.055	1
699	1	66	GLY	H	H	8.705	0.008	1
700	1	66	GLY	HA2	H	3.780	0.008	2
701	1	66	GLY	HA3	H	3.910	0.008	2
702	1	66	GLY	C	C	170.651	0.16	1
703	1	66	GLY	CA	C	44.995	0.16	1
704	1	66	GLY	N	N	109.881	0.055	1
705	1	67	GLN	H	H	8.154	0.008	1
706	1	67	GLN	HA	H	4.888	0.008	1
707	1	67	GLN	HB2	H	2.019	0.008	1
708	1	67	GLN	HB3	H	2.019	0.008	1
709	1	67	GLN	HG2	H	2.322	0.008	1
710	1	67	GLN	HG3	H	2.322	0.008	1
711	1	67	GLN	HE21	H	6.843	0.008	1
712	1	67	GLN	HE22	H	7.481	0.008	1
713	1	67	GLN	C	C	170.592	0.16	1
714	1	67	GLN	CA	C	51.459	0.16	1
715	1	67	GLN	CB	C	29.434	0.16	1
716	1	67	GLN	CG	C	32.444	0.16	1
717	1	67	GLN	N	N	119.182	0.055	1
718	1	67	GLN	NE2	N	112.268	0.055	1
719	1	68	PRO	HA	H	4.587	0.008	1
720	1	68	PRO	HB2	H	1.892	0.008	1
721	1	68	PRO	HB3	H	1.892	0.008	1
722	1	68	PRO	HD2	H	3.981	0.008	2
723	1	68	PRO	HD3	H	3.964	0.008	2
724	1	68	PRO	C	C	175.756	0.16	1
725	1	68	PRO	CA	C	62.490	0.16	1
726	1	68	PRO	CB	C	32.013	0.16	1
727	1	68	PRO	CG	C	27.309	0.16	1
728	1	68	PRO	CD	C	50.139	0.16	1
729	1	69	GLN	H	H	8.073	0.008	1
730	1	69	GLN	HA	H	3.990	0.008	1
731	1	69	GLN	HB2	H	1.765	0.008	1
732	1	69	GLN	HB3	H	1.765	0.008	1
733	1	69	GLN	HG2	H	1.770	0.008	1
734	1	69	GLN	HG3	H	1.770	0.008	1
735	1	69	GLN	HE21	H	6.946	0.008	1
736	1	69	GLN	HE22	H	7.928	0.008	1
737	1	69	GLN	C	C	171.988	0.16	1
738	1	69	GLN	CA	C	54.168	0.16	1
739	1	69	GLN	CB	C	28.307	0.16	1
740	1	69	GLN	CG	C	32.400	0.16	1
741	1	69	GLN	N	N	124.341	0.055	1
742	1	69	GLN	NE2	N	112.077	0.055	1
743	1	70	VAL	H	H	8.046	0.008	1
744	1	70	VAL	HA	H	4.304	0.008	1
745	1	70	VAL	HB	H	1.752	0.008	1
746	1	70	VAL	HG21	H	0.465	0.008	1
747	1	70	VAL	HG22	H	0.465	0.008	1
748	1	70	VAL	HG23	H	0.465	0.008	1
749	1	70	VAL	C	C	173.700	0.16	1
750	1	70	VAL	CA	C	62.095	0.16	1
751	1	70	VAL	CB	C	31.530	0.16	1
752	1	70	VAL	CG1	C	20.483	0.16	2
753	1	70	VAL	CG2	C	21.255	0.16	2
754	1	70	VAL	N	N	126.903	0.055	1
755	1	71	PHE	H	H	9.182	0.008	1
756	1	71	PHE	HA	H	5.055	0.008	1
757	1	71	PHE	HB3	H	2.269	0.008	1
758	1	71	PHE	HD1	H	7.026	0.008	3
759	1	71	PHE	HD2	H	7.026	0.008	3
760	1	71	PHE	HE1	H	7.186	0.008	3
761	1	71	PHE	HE2	H	7.186	0.008	3
762	1	71	PHE	HZ	H	6.759	0.008	1
763	1	71	PHE	C	C	171.983	0.16	1
764	1	71	PHE	CA	C	56.087	0.16	1
765	1	71	PHE	CB	C	42.203	0.16	1
766	1	71	PHE	N	N	128.903	0.055	1
767	1	72	ARG	H	H	9.010	0.008	1
768	1	72	ARG	HA	H	5.505	0.008	1
769	1	72	ARG	HB2	H	1.751	0.008	1
770	1	72	ARG	HB3	H	1.751	0.008	1
771	1	72	ARG	HG2	H	1.668	0.008	1
772	1	72	ARG	HG3	H	1.668	0.008	1
773	1	72	ARG	HD2	H	3.214	0.008	1
774	1	72	ARG	HD3	H	3.214	0.008	1
775	1	72	ARG	C	C	174.368	0.16	1
776	1	72	ARG	CA	C	53.100	0.16	1
777	1	72	ARG	CB	C	32.877	0.16	1
778	1	72	ARG	CG	C	27.126	0.16	1
779	1	72	ARG	CD	C	41.931	0.16	1
780	1	72	ARG	N	N	117.709	0.055	1
781	1	73	VAL	H	H	8.711	0.008	1
782	1	73	VAL	HA	H	4.227	0.008	1
783	1	73	VAL	HB	H	2.429	0.008	1
784	1	73	VAL	HG11	H	0.761	0.008	2
785	1	73	VAL	HG12	H	0.761	0.008	2
786	1	73	VAL	HG13	H	0.761	0.008	2
787	1	73	VAL	HG21	H	1.221	0.008	2
788	1	73	VAL	HG22	H	1.221	0.008	2
789	1	73	VAL	HG23	H	1.221	0.008	2
790	1	73	VAL	C	C	174.971	0.16	1
791	1	73	VAL	CA	C	62.507	0.16	1
792	1	73	VAL	CB	C	31.542	0.16	1
793	1	73	VAL	CG1	C	22.797	0.16	2
794	1	73	VAL	CG2	C	23.438	0.16	2
795	1	73	VAL	N	N	121.141	0.055	1
796	1	74	LEU	H	H	9.510	0.008	1
797	1	74	LEU	HA	H	4.354	0.008	1
798	1	74	LEU	HB2	H	1.644	0.008	1
799	1	74	LEU	HB3	H	1.644	0.008	1
800	1	74	LEU	HG	H	1.568	0.008	1
801	1	74	LEU	HD11	H	0.759	0.008	2
802	1	74	LEU	HD12	H	0.759	0.008	2
803	1	74	LEU	HD13	H	0.759	0.008	2
804	1	74	LEU	HD21	H	0.766	0.008	2
805	1	74	LEU	HD22	H	0.766	0.008	2
806	1	74	LEU	HD23	H	0.766	0.008	2
807	1	74	LEU	C	C	174.744	0.16	1
808	1	74	LEU	CA	C	54.982	0.16	1
809	1	74	LEU	CB	C	42.749	0.16	1
810	1	74	LEU	CG	C	26.750	0.16	1
811	1	74	LEU	CD1	C	24.386	0.16	2
812	1	74	LEU	CD2	C	22.934	0.16	2
813	1	74	LEU	N	N	130.160	0.055	1
814	1	75	ALA	H	H	7.814	0.008	1
815	1	75	ALA	HA	H	4.466	0.008	1
816	1	75	ALA	HB1	H	1.345	0.008	1
817	1	75	ALA	HB2	H	1.345	0.008	1
818	1	75	ALA	HB3	H	1.345	0.008	1
819	1	75	ALA	C	C	172.275	0.16	1
820	1	75	ALA	CA	C	51.864	0.16	1
821	1	75	ALA	CB	C	20.392	0.16	1
822	1	75	ALA	N	N	118.816	0.055	1
823	1	76	VAL	H	H	8.653	0.008	1
824	1	76	VAL	HA	H	4.600	0.008	1
825	1	76	VAL	HB	H	2.000	0.008	1
826	1	76	VAL	HG11	H	0.892	0.008	2
827	1	76	VAL	HG12	H	0.892	0.008	2
828	1	76	VAL	HG13	H	0.892	0.008	2
829	1	76	VAL	HG21	H	0.923	0.008	2
830	1	76	VAL	HG22	H	0.923	0.008	2
831	1	76	VAL	HG23	H	0.923	0.008	2
832	1	76	VAL	C	C	172.306	0.16	1
833	1	76	VAL	CA	C	61.240	0.16	1
834	1	76	VAL	CB	C	35.011	0.16	1
835	1	76	VAL	CG1	C	20.571	0.16	2
836	1	76	VAL	CG2	C	20.938	0.16	2
837	1	76	VAL	N	N	118.278	0.055	1
838	1	77	SER	H	H	8.387	0.008	1
839	1	77	SER	HA	H	4.610	0.008	1
840	1	77	SER	HB2	H	3.978	0.008	2
841	1	77	SER	HB3	H	4.012	0.008	2
842	1	77	SER	C	C	172.799	0.16	1
843	1	77	SER	CA	C	56.021	0.16	1
844	1	77	SER	CB	C	62.883	0.16	1
845	1	77	SER	N	N	122.326	0.055	1
846	1	78	GLY	H	H	9.203	0.008	1
847	1	78	GLY	HA3	H	4.209	0.008	1
848	1	78	GLY	C	C	172.765	0.16	1
849	1	78	GLY	CA	C	46.997	0.16	1
850	1	78	GLY	N	N	118.362	0.055	1
851	1	79	THR	H	H	8.503	0.008	1
852	1	79	THR	HA	H	4.079	0.008	1
853	1	79	THR	HB	H	5.091	0.008	1
854	1	79	THR	C	C	171.390	0.16	1
855	1	79	THR	CA	C	61.015	0.16	1
856	1	79	THR	CB	C	67.819	0.16	1
857	1	79	THR	CG2	C	20.537	0.16	1
858	1	79	THR	N	N	116.527	0.055	1
859	1	80	THR	H	H	8.328	0.008	1
860	1	80	THR	HA	H	4.913	0.008	1
861	1	80	THR	HB	H	4.383	0.008	1
862	1	80	THR	C	C	172.050	0.16	1
863	1	80	THR	CA	C	62.377	0.16	1
864	1	80	THR	CB	C	68.523	0.16	1
865	1	80	THR	CG2	C	20.935	0.16	1
866	1	80	THR	N	N	118.369	0.055	1
867	1	81	VAL	H	H	9.486	0.008	1
868	1	81	VAL	HA	H	4.545	0.008	1
869	1	81	VAL	HB	H	1.913	0.008	1
870	1	81	VAL	HG21	H	1.015	0.008	1
871	1	81	VAL	HG22	H	1.015	0.008	1
872	1	81	VAL	HG23	H	1.015	0.008	1
873	1	81	VAL	C	C	172.729	0.16	1
874	1	81	VAL	CA	C	60.552	0.16	1
875	1	81	VAL	CB	C	34.118	0.16	1
876	1	81	VAL	CG1	C	21.480	0.16	2
877	1	81	VAL	CG2	C	23.012	0.16	2
878	1	81	VAL	N	N	129.307	0.055	1
879	1	82	THR	H	H	9.055	0.008	1
880	1	82	THR	HA	H	4.867	0.008	1
881	1	82	THR	HB	H	4.346	0.008	1
882	1	82	THR	C	C	172.252	0.16	1
883	1	82	THR	CA	C	62.075	0.16	1
884	1	82	THR	CB	C	67.947	0.16	1
885	1	82	THR	CG2	C	20.987	0.16	1
886	1	82	THR	N	N	124.448	0.055	1
887	1	83	ILE	H	H	9.505	0.008	1
888	1	83	ILE	HA	H	5.913	0.008	1
889	1	83	ILE	HB	H	1.968	0.008	1
890	1	83	ILE	HG12	H	1.685	0.008	1
891	1	83	ILE	HG21	H	1.065	0.008	1
892	1	83	ILE	HG22	H	1.065	0.008	1
893	1	83	ILE	HG23	H	1.065	0.008	1
894	1	83	ILE	HD11	H	0.654	0.008	1
895	1	83	ILE	HD12	H	0.654	0.008	1
896	1	83	ILE	HD13	H	0.654	0.008	1
897	1	83	ILE	C	C	171.620	0.16	1
898	1	83	ILE	CA	C	58.363	0.16	1
899	1	83	ILE	CB	C	42.732	0.16	1
900	1	83	ILE	CG1	C	23.398	0.16	1
901	1	83	ILE	CG2	C	18.008	0.16	1
902	1	83	ILE	CD1	C	14.222	0.16	1
903	1	83	ILE	N	N	122.260	0.055	1
904	1	84	SER	H	H	8.431	0.008	1
905	1	84	SER	HA	H	5.143	0.008	1
906	1	84	SER	HB2	H	3.888	0.008	2
907	1	84	SER	HB3	H	3.894	0.008	2
908	1	84	SER	C	C	172.515	0.16	1
909	1	84	SER	CA	C	54.413	0.16	1
910	1	84	SER	CB	C	66.742	0.16	1
911	1	84	SER	N	N	111.102	0.055	1
912	1	85	PRO	HA	H	4.967	0.008	1
913	1	85	PRO	HB2	H	2.336	0.008	1
914	1	85	PRO	HB3	H	2.336	0.008	1
915	1	85	PRO	HG2	H	1.696	0.008	1
916	1	85	PRO	HG3	H	1.696	0.008	1
917	1	85	PRO	HD2	H	3.742	0.008	1
918	1	85	PRO	HD3	H	3.742	0.008	1
919	1	85	PRO	C	C	172.533	0.16	1
920	1	85	PRO	CA	C	62.721	0.16	1
921	1	85	PRO	CB	C	34.810	0.16	1
922	1	85	PRO	CG	C	23.730	0.16	1
923	1	85	PRO	CD	C	49.467	0.16	1
924	1	86	LYS	H	H	7.678	0.008	1
925	1	86	LYS	HA	H	4.021	0.008	1
926	1	86	LYS	HB2	H	1.639	0.008	1
927	1	86	LYS	HB3	H	1.639	0.008	1
928	1	86	LYS	HG2	H	1.185	0.008	1
929	1	86	LYS	HG3	H	1.185	0.008	1
930	1	86	LYS	HD2	H	1.392	0.008	1
931	1	86	LYS	HD3	H	1.392	0.008	1
932	1	86	LYS	HE2	H	3.250	0.008	1
933	1	86	LYS	HE3	H	3.250	0.008	1
934	1	86	LYS	C	C	174.002	0.16	1
935	1	86	LYS	CA	C	56.884	0.16	1
936	1	86	LYS	CB	C	35.176	0.16	1
937	1	86	LYS	CG	C	27.131	0.16	1
938	1	86	LYS	CD	C	30.055	0.16	1
939	1	86	LYS	CE	C	42.388	0.16	1
940	1	86	LYS	N	N	109.775	0.055	1
941	1	87	ILE	H	H	11.096	0.008	1
942	1	87	ILE	HA	H	3.976	0.008	1
943	1	87	ILE	HB	H	1.626	0.008	1
944	1	87	ILE	HG12	H	0.820	0.008	2
945	1	87	ILE	HG13	H	0.781	0.008	2
946	1	87	ILE	HG21	H	0.658	0.008	1
947	1	87	ILE	HG22	H	0.658	0.008	1
948	1	87	ILE	HG23	H	0.658	0.008	1
949	1	87	ILE	HD11	H	0.456	0.008	1
950	1	87	ILE	HD12	H	0.456	0.008	1
951	1	87	ILE	HD13	H	0.456	0.008	1
952	1	87	ILE	C	C	172.716	0.16	1
953	1	87	ILE	CA	C	61.550	0.16	1
954	1	87	ILE	CB	C	37.184	0.16	1
955	1	87	ILE	CG1	C	28.165	0.16	1
956	1	87	ILE	CG2	C	17.853	0.16	1
957	1	87	ILE	CD1	C	13.094	0.16	1
958	1	87	ILE	N	N	121.645	0.055	1
959	1	88	LEU	H	H	8.430	0.008	1
960	1	88	LEU	HA	H	5.085	0.008	1
961	1	88	LEU	HB2	H	1.699	0.008	2
962	1	88	LEU	HB3	H	1.696	0.008	2
963	1	88	LEU	HG	H	0.915	0.008	1
964	1	88	LEU	HD11	H	0.743	0.008	1
965	1	88	LEU	HD12	H	0.743	0.008	1
966	1	88	LEU	HD13	H	0.743	0.008	1
967	1	88	LEU	C	C	171.807	0.16	1
968	1	88	LEU	CA	C	50.635	0.16	1
969	1	88	LEU	CB	C	41.185	0.16	1
970	1	88	LEU	CG	C	25.881	0.16	1
971	1	88	LEU	CD1	C	23.384	0.16	2
972	1	88	LEU	CD2	C	23.288	0.16	2
973	1	88	LEU	N	N	128.344	0.055	1
974	1	89	PRO	HA	H	5.063	0.008	1
975	1	89	PRO	HB2	H	2.198	0.008	1
976	1	89	PRO	HB3	H	2.198	0.008	1
977	1	89	PRO	HG2	H	1.524	0.008	1
978	1	89	PRO	HG3	H	1.524	0.008	1
979	1	89	PRO	HD2	H	4.211	0.008	1
980	1	89	PRO	HD3	H	4.211	0.008	1
981	1	89	PRO	C	C	177.763	0.16	1
982	1	89	PRO	CB	C	33.127	0.16	1
983	1	89	PRO	CG	C	28.224	0.16	1
984	1	89	PRO	CD	C	50.676	0.16	1
985	1	90	VAL	H	H	7.751	0.008	1
986	1	90	VAL	HA	H	3.795	0.008	1
987	1	90	VAL	HB	H	2.189	0.008	1
988	1	90	VAL	HG11	H	1.344	0.008	2
989	1	90	VAL	HG12	H	1.344	0.008	2
990	1	90	VAL	HG13	H	1.344	0.008	2
991	1	90	VAL	HG21	H	1.137	0.008	2
992	1	90	VAL	HG22	H	1.137	0.008	2
993	1	90	VAL	HG23	H	1.137	0.008	2
994	1	90	VAL	C	C	174.937	0.16	1
995	1	90	VAL	CA	C	66.207	0.16	1
996	1	90	VAL	CB	C	31.991	0.16	1
997	1	90	VAL	CG1	C	20.970	0.16	2
998	1	90	VAL	CG2	C	22.853	0.16	2
999	1	90	VAL	N	N	122.910	0.055	1
1000	1	91	GLU	H	H	8.586	0.008	1
1001	1	91	GLU	HA	H	4.647	0.008	1
1002	1	91	GLU	HB2	H	2.218	0.008	2
1003	1	91	GLU	HB3	H	2.230	0.008	2
1004	1	91	GLU	HG2	H	2.290	0.008	2
1005	1	91	GLU	HG3	H	2.311	0.008	2
1006	1	91	GLU	C	C	174.109	0.16	1
1007	1	91	GLU	CA	C	53.130	0.16	1
1008	1	91	GLU	CB	C	27.249	0.16	1
1009	1	91	GLU	CG	C	36.013	0.16	1
1010	1	91	GLU	N	N	116.639	0.055	1
1011	1	92	ASN	H	H	6.454	0.008	1
1012	1	92	ASN	HA	H	4.617	0.008	1
1013	1	92	ASN	HB2	H	2.890	0.008	2
1014	1	92	ASN	HB3	H	2.912	0.008	2
1015	1	92	ASN	HD21	H	7.092	0.008	1
1016	1	92	ASN	HD22	H	7.687	0.008	1
1017	1	92	ASN	C	C	174.561	0.16	1
1018	1	92	ASN	CA	C	53.188	0.16	1
1019	1	92	ASN	CB	C	37.668	0.16	1
1020	1	92	ASN	N	N	118.861	0.055	1
1021	1	92	ASN	ND2	N	112.569	0.055	1
1022	1	93	THR	H	H	9.004	0.008	1
1023	1	93	THR	HA	H	3.975	0.008	1
1024	1	93	THR	HB	H	4.135	0.008	1
1025	1	93	THR	C	C	173.689	0.16	1
1026	1	93	THR	CA	C	65.987	0.16	1
1027	1	93	THR	CB	C	68.364	0.16	1
1028	1	93	THR	CG2	C	21.658	0.16	1
1029	1	93	THR	N	N	125.939	0.055	1
1030	1	94	ASP	H	H	8.880	0.008	1
1031	1	94	ASP	HA	H	4.836	0.008	1
1032	1	94	ASP	HB2	H	2.679	0.008	2
1033	1	94	ASP	HB3	H	2.672	0.008	2
1034	1	94	ASP	C	C	173.402	0.16	1
1035	1	94	ASP	CA	C	53.272	0.16	1
1036	1	94	ASP	CB	C	41.874	0.16	1
1037	1	94	ASP	N	N	119.407	0.055	1
1038	1	95	VAL	H	H	8.430	0.008	1
1039	1	95	VAL	HA	H	3.473	0.008	1
1040	1	95	VAL	HB	H	2.153	0.008	1
1041	1	95	VAL	HG11	H	1.025	0.008	2
1042	1	95	VAL	HG12	H	1.025	0.008	2
1043	1	95	VAL	HG13	H	1.025	0.008	2
1044	1	95	VAL	HG21	H	1.104	0.008	2
1045	1	95	VAL	HG22	H	1.104	0.008	2
1046	1	95	VAL	HG23	H	1.104	0.008	2
1047	1	95	VAL	C	C	177.642	0.16	1
1048	1	95	VAL	CA	C	66.712	0.16	1
1049	1	95	VAL	CB	C	31.050	0.16	1
1050	1	95	VAL	CG1	C	21.599	0.16	2
1051	1	95	VAL	CG2	C	20.628	0.16	2
1052	1	95	VAL	N	N	130.147	0.055	1
1053	1	96	ALA	H	H	8.536	0.008	1
1054	1	96	ALA	HA	H	4.284	0.008	1
1055	1	96	ALA	HB1	H	1.609	0.008	1
1056	1	96	ALA	HB2	H	1.609	0.008	1
1057	1	96	ALA	HB3	H	1.609	0.008	1
1058	1	96	ALA	C	C	176.949	0.16	1
1059	1	96	ALA	CA	C	54.021	0.16	1
1060	1	96	ALA	CB	C	18.051	0.16	1
1061	1	96	ALA	N	N	123.109	0.055	1
1062	1	97	SER	H	H	7.761	0.008	1
1063	1	97	SER	HA	H	4.794	0.008	1
1064	1	97	SER	HB3	H	4.299	0.008	1
1065	1	97	SER	C	C	175.362	0.16	1
1066	1	97	SER	CA	C	60.605	0.16	1
1067	1	97	SER	CB	C	64.341	0.16	1
1068	1	97	SER	N	N	110.701	0.055	1
1069	1	98	ARG	H	H	8.300	0.008	1
1070	1	98	ARG	HA	H	4.049	0.008	1
1071	1	98	ARG	HB2	H	2.160	0.008	1
1072	1	98	ARG	HB3	H	2.160	0.008	1
1073	1	98	ARG	HG2	H	2.209	0.008	1
1074	1	98	ARG	HG3	H	2.209	0.008	1
1075	1	98	ARG	HD2	H	3.551	0.008	1
1076	1	98	ARG	HD3	H	3.551	0.008	1
1077	1	98	ARG	C	C	173.802	0.16	1
1078	1	98	ARG	CA	C	62.505	0.16	1
1079	1	98	ARG	CB	C	27.240	0.16	1
1080	1	98	ARG	CG	C	29.427	0.16	1
1081	1	98	ARG	CD	C	43.278	0.16	1
1082	1	98	ARG	N	N	125.013	0.055	1
1083	1	99	PRO	HA	H	4.427	0.008	1
1084	1	99	PRO	HB2	H	2.229	0.008	2
1085	1	99	PRO	HB3	H	2.264	0.008	2
1086	1	99	PRO	HG2	H	1.968	0.008	2
1087	1	99	PRO	HG3	H	1.951	0.008	2
1088	1	99	PRO	HD2	H	3.632	0.008	2
1089	1	99	PRO	HD3	H	3.591	0.008	2
1090	1	99	PRO	C	C	174.459	0.16	1
1091	1	99	PRO	CA	C	64.948	0.16	1
1092	1	99	PRO	CB	C	30.548	0.16	1
1093	1	99	PRO	CG	C	27.694	0.16	1
1094	1	99	PRO	CD	C	50.794	0.16	1
1095	1	100	TYR	H	H	7.065	0.008	1
1096	1	100	TYR	HA	H	4.676	0.008	1
1097	1	100	TYR	HB2	H	2.748	0.008	2
1098	1	100	TYR	HB3	H	2.718	0.008	2
1099	1	100	TYR	HD1	H	7.173	0.008	3
1100	1	100	TYR	HD2	H	7.173	0.008	3
1101	1	100	TYR	HE1	H	6.992	0.008	3
1102	1	100	TYR	HE2	H	6.992	0.008	3
1103	1	100	TYR	C	C	172.553	0.16	1
1104	1	100	TYR	CA	C	55.812	0.16	1
1105	1	100	TYR	CB	C	38.107	0.16	1
1106	1	100	TYR	N	N	114.698	0.055	1
1107	1	101	ALA	H	H	7.340	0.008	1
1108	1	101	ALA	HA	H	4.250	0.008	1
1109	1	101	ALA	HB1	H	1.418	0.008	1
1110	1	101	ALA	HB2	H	1.418	0.008	1
1111	1	101	ALA	HB3	H	1.418	0.008	1
1112	1	101	ALA	C	C	175.411	0.16	1
1113	1	101	ALA	CA	C	53.018	0.16	1
1114	1	101	ALA	CB	C	20.186	0.16	1
1115	1	101	ALA	N	N	118.506	0.055	1
1116	1	102	ASN	H	H	10.017	0.008	1
1117	1	102	ASN	HA	H	4.736	0.008	1
1118	1	102	ASN	HB2	H	2.780	0.008	2
1119	1	102	ASN	HB3	H	2.802	0.008	2
1120	1	102	ASN	HD21	H	7.259	0.008	1
1121	1	102	ASN	HD22	H	8.114	0.008	1
1122	1	102	ASN	C	C	173.945	0.16	1
1123	1	102	ASN	CA	C	51.703	0.16	1
1124	1	102	ASN	CB	C	39.123	0.16	1
1125	1	102	ASN	N	N	118.137	0.055	1
1126	1	102	ASN	ND2	N	107.095	0.055	1
1127	1	103	VAL	H	H	7.734	0.008	1
1128	1	103	VAL	HA	H	5.757	0.008	1
1129	1	103	VAL	HB	H	2.433	0.008	1
1130	1	103	VAL	HG11	H	0.906	0.008	2
1131	1	103	VAL	HG12	H	0.906	0.008	2
1132	1	103	VAL	HG13	H	0.906	0.008	2
1133	1	103	VAL	HG21	H	0.882	0.008	2
1134	1	103	VAL	HG22	H	0.882	0.008	2
1135	1	103	VAL	HG23	H	0.882	0.008	2
1136	1	103	VAL	C	C	173.326	0.16	1
1137	1	103	VAL	CA	C	57.958	0.16	1
1138	1	103	VAL	CB	C	36.619	0.16	1
1139	1	103	VAL	CG1	C	17.554	0.16	2
1140	1	103	VAL	CG2	C	21.259	0.16	2
1141	1	103	VAL	N	N	115.175	0.055	1
1142	1	104	ASP	H	H	9.473	0.008	1
1143	1	104	ASP	HA	H	4.180	0.008	1
1144	1	104	ASP	HB2	H	2.892	0.008	2
1145	1	104	ASP	HB3	H	2.884	0.008	2
1146	1	104	ASP	C	C	175.342	0.16	1
1147	1	104	ASP	CA	C	55.497	0.16	1
1148	1	104	ASP	CB	C	38.860	0.16	1
1149	1	104	ASP	N	N	120.681	0.055	1
1150	1	105	ALA	H	H	8.214	0.008	1
1151	1	105	ALA	HA	H	4.556	0.008	1
1152	1	105	ALA	HB1	H	1.383	0.008	1
1153	1	105	ALA	HB2	H	1.383	0.008	1
1154	1	105	ALA	HB3	H	1.383	0.008	1
1155	1	105	ALA	C	C	171.945	0.16	1
1156	1	105	ALA	CA	C	51.262	0.16	1
1157	1	105	ALA	CB	C	21.606	0.16	1
1158	1	105	ALA	N	N	125.676	0.055	1
1159	1	106	LYS	H	H	7.984	0.008	1
1160	1	106	LYS	HA	H	4.329	0.008	1
1161	1	106	LYS	HB2	H	2.208	0.008	1
1162	1	106	LYS	HB3	H	2.208	0.008	1
1163	1	106	LYS	HG2	H	1.283	0.008	1
1164	1	106	LYS	HG3	H	1.283	0.008	1
1165	1	106	LYS	HD2	H	1.668	0.008	1
1166	1	106	LYS	HD3	H	1.668	0.008	1
1167	1	106	LYS	HE2	H	2.939	0.008	1
1168	1	106	LYS	HE3	H	2.939	0.008	1
1169	1	106	LYS	C	C	171.443	0.16	1
1170	1	106	LYS	CA	C	53.030	0.16	1
1171	1	106	LYS	CB	C	30.489	0.16	1
1172	1	106	LYS	CG	C	23.040	0.16	1
1173	1	106	LYS	CD	C	29.265	0.16	1
1174	1	106	LYS	CE	C	41.631	0.16	1
1175	1	106	LYS	N	N	115.672	0.055	1
1176	1	107	PRO	HA	H	4.924	0.008	1
1177	1	107	PRO	HB2	H	2.249	0.008	1
1178	1	107	PRO	HB3	H	2.249	0.008	1
1179	1	107	PRO	HG2	H	2.136	0.008	1
1180	1	107	PRO	HG3	H	2.136	0.008	1
1181	1	107	PRO	HD2	H	3.727	0.008	1
1182	1	107	PRO	HD3	H	3.727	0.008	1
1183	1	107	PRO	C	C	174.169	0.16	1
1184	1	107	PRO	CA	C	62.462	0.16	1
1185	1	107	PRO	CB	C	31.556	0.16	1
1186	1	107	PRO	CG	C	27.116	0.16	1
1187	1	107	PRO	CD	C	50.383	0.16	1
1188	1	108	ALA	H	H	8.620	0.008	1
1189	1	108	ALA	HA	H	4.210	0.008	1
1190	1	108	ALA	HB1	H	1.623	0.008	1
1191	1	108	ALA	HB2	H	1.623	0.008	1
1192	1	108	ALA	HB3	H	1.623	0.008	1
1193	1	108	ALA	C	C	176.138	0.16	1
1194	1	108	ALA	CA	C	51.022	0.16	1
1195	1	108	ALA	CB	C	18.853	0.16	1
1196	1	108	ALA	N	N	124.170	0.055	1
1197	1	109	GLU	H	H	8.881	0.008	1
1198	1	109	GLU	HA	H	4.281	0.008	1
1199	1	109	GLU	HB2	H	2.009	0.008	2
1200	1	109	GLU	HB3	H	1.987	0.008	2
1201	1	109	GLU	HG2	H	2.390	0.008	2
1202	1	109	GLU	HG3	H	2.427	0.008	2
1203	1	109	GLU	C	C	175.116	0.16	1
1204	1	109	GLU	CA	C	57.205	0.16	1
1205	1	109	GLU	CB	C	28.819	0.16	1
1206	1	109	GLU	CG	C	35.562	0.16	1
1207	1	109	GLU	N	N	122.433	0.055	1
1208	1	110	SER	H	H	8.301	0.008	1
1209	1	110	SER	HA	H	4.157	0.008	1
1210	1	110	SER	HB2	H	4.093	0.008	1
1211	1	110	SER	HB3	H	4.093	0.008	1
1212	1	110	SER	C	C	171.237	0.16	1
1213	1	110	SER	CA	C	58.269	0.16	1
1214	1	110	SER	CB	C	61.029	0.16	1
1215	1	110	SER	N	N	117.973	0.055	1
1216	1	111	ALA	H	H	7.083	0.008	1
1217	1	111	ALA	HA	H	4.230	0.008	1
1218	1	111	ALA	HB1	H	1.552	0.008	1
1219	1	111	ALA	HB2	H	1.552	0.008	1
1220	1	111	ALA	HB3	H	1.552	0.008	1
1221	1	111	ALA	C	C	175.663	0.16	1
1222	1	111	ALA	CA	C	52.216	0.16	1
1223	1	111	ALA	CB	C	19.792	0.16	1
1224	1	111	ALA	N	N	120.815	0.055	1
1225	1	112	ALA	H	H	8.505	0.008	1
1226	1	112	ALA	HA	H	4.399	0.008	1
1227	1	112	ALA	HB1	H	1.479	0.008	1
1228	1	112	ALA	HB2	H	1.479	0.008	1
1229	1	112	ALA	HB3	H	1.479	0.008	1
1230	1	112	ALA	C	C	176.283	0.16	1
1231	1	112	ALA	CA	C	53.200	0.16	1
1232	1	112	ALA	CB	C	19.396	0.16	1
1233	1	112	ALA	N	N	124.187	0.055	1
1234	1	113	ILE	H	H	8.281	0.008	1
1235	1	113	ILE	HA	H	4.973	0.008	1
1236	1	113	ILE	HB	H	1.471	0.008	1
1237	1	113	ILE	HG12	H	0.850	0.008	1
1238	1	113	ILE	HG13	H	0.850	0.008	1
1239	1	113	ILE	HG21	H	0.611	0.008	1
1240	1	113	ILE	HG22	H	0.611	0.008	1
1241	1	113	ILE	HG23	H	0.611	0.008	1
1242	1	113	ILE	HD11	H	0.355	0.008	1
1243	1	113	ILE	HD12	H	0.355	0.008	1
1244	1	113	ILE	HD13	H	0.355	0.008	1
1245	1	113	ILE	C	C	174.354	0.16	1
1246	1	113	ILE	CA	C	59.963	0.16	1
1247	1	113	ILE	CB	C	39.506	0.16	1
1248	1	113	ILE	CG1	C	28.155	0.16	1
1249	1	113	ILE	CG2	C	16.874	0.16	1
1250	1	113	ILE	CD1	C	13.645	0.16	1
1251	1	113	ILE	N	N	123.926	0.055	1
1252	1	114	THR	H	H	8.977	0.008	1
1253	1	114	THR	HA	H	4.546	0.008	1
1254	1	114	THR	HB	H	4.155	0.008	1
1255	1	114	THR	C	C	171.262	0.16	1
1256	1	114	THR	CA	C	61.662	0.16	1
1257	1	114	THR	CB	C	69.950	0.16	1
1258	1	114	THR	CG2	C	20.774	0.16	1
1259	1	114	THR	N	N	124.950	0.055	1
1260	1	115	ILE	H	H	8.975	0.008	1
1261	1	115	ILE	HA	H	4.035	0.008	1
1262	1	115	ILE	HB	H	1.715	0.008	1
1263	1	115	ILE	HG12	H	1.767	0.008	2
1264	1	115	ILE	HG13	H	1.791	0.008	2
1265	1	115	ILE	HG21	H	1.094	0.008	1
1266	1	115	ILE	HG22	H	1.094	0.008	1
1267	1	115	ILE	HG23	H	1.094	0.008	1
1268	1	115	ILE	HD11	H	0.894	0.008	1
1269	1	115	ILE	HD12	H	0.894	0.008	1
1270	1	115	ILE	HD13	H	0.894	0.008	1
1271	1	115	ILE	C	C	174.565	0.16	1
1272	1	115	ILE	CA	C	61.572	0.16	1
1273	1	115	ILE	CB	C	37.606	0.16	1
1274	1	115	ILE	CG1	C	28.470	0.16	1
1275	1	115	ILE	CG2	C	17.189	0.16	1
1276	1	115	ILE	CD1	C	13.260	0.16	1
1277	1	115	ILE	N	N	127.807	0.055	1
1278	1	116	LEU	H	H	9.145	0.008	1
1279	1	116	LEU	HA	H	4.375	0.008	1
1280	1	116	LEU	HB2	H	1.631	0.008	1
1281	1	116	LEU	HB3	H	1.631	0.008	1
1282	1	116	LEU	HG	H	1.614	0.008	1
1283	1	116	LEU	HD11	H	0.849	0.008	1
1284	1	116	LEU	HD12	H	0.849	0.008	1
1285	1	116	LEU	HD13	H	0.849	0.008	1
1286	1	116	LEU	HD21	H	0.849	0.008	1
1287	1	116	LEU	HD22	H	0.849	0.008	1
1288	1	116	LEU	HD23	H	0.849	0.008	1
1289	1	116	LEU	C	C	175.394	0.16	1
1290	1	116	LEU	CA	C	55.017	0.16	1
1291	1	116	LEU	CB	C	41.519	0.16	1
1292	1	116	LEU	CG	C	25.538	0.16	1
1293	1	116	LEU	CD1	C	22.005	0.16	1
1294	1	116	LEU	CD2	C	22.005	0.16	1
1295	1	116	LEU	N	N	128.953	0.055	1
1296	1	117	ASN	H	H	8.583	0.008	1
1297	1	117	ASN	HA	H	4.771	0.008	1
1298	1	117	ASN	HB2	H	2.905	0.008	1
1299	1	117	ASN	HB3	H	2.905	0.008	1
1300	1	117	ASN	HD21	H	6.930	0.008	1
1301	1	117	ASN	HD22	H	7.824	0.008	1
1302	1	117	ASN	C	C	173.223	0.16	1
1303	1	117	ASN	CA	C	53.110	0.16	1
1304	1	117	ASN	CB	C	38.236	0.16	1
1305	1	117	ASN	N	N	117.662	0.055	1
1306	1	117	ASN	ND2	N	113.983	0.055	1
1307	1	118	LYS	H	H	8.248	0.008	1
1308	1	118	LYS	HA	H	4.387	0.008	1
1309	1	118	LYS	HB2	H	1.913	0.008	1
1310	1	118	LYS	HB3	H	1.913	0.008	1
1311	1	118	LYS	HG2	H	1.499	0.008	1
1312	1	118	LYS	HG3	H	1.499	0.008	1
1313	1	118	LYS	HD2	H	1.769	0.008	1
1314	1	118	LYS	HD3	H	1.769	0.008	1
1315	1	118	LYS	HE2	H	3.073	0.008	1
1316	1	118	LYS	HE3	H	3.073	0.008	1
1317	1	118	LYS	C	C	174.563	0.16	1
1318	1	118	LYS	CA	C	55.979	0.16	1
1319	1	118	LYS	CB	C	32.550	0.16	1
1320	1	118	LYS	CG	C	24.212	0.16	1
1321	1	118	LYS	CD	C	28.468	0.16	1
1322	1	118	LYS	CE	C	41.328	0.16	1

LACS Plot; CA

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

Referencing offset: 0.34 ppm, Outliers: 3 Detail

LACS Plot; CB

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

Referencing offset: 0.34 ppm, Outliers: 3 Detail

LACS Plot; HA

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

Referencing offset: -0.1 ppm, Outliers: 4 Detail

LACS Plot; CO

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

Referencing offset: 2.35 ppm, Outliers: 3 Detail

Protein Blocks Logo

Calculated from 25 models in PDB: 6MNT, Strand ID: A Detail

Release date

2015-08-06

Citation

NMR assignments for the insertion domain of bacteriophage CUS-3 coat protein
Tripler, T.N., Maciejewski, M.W., Teschke, C.M., Alexandrescu, A.T.
Biomol. NMR Assign. (2015), 9, 333-336, PubMed 25694158 , DOI 10.1007/s12104-015-9604-4 , Abstract

Related entities 1. CUS-3id, : 1 : 8 entities Detail

Experiments performed 12 experiments Detail

1 2D 1H-15N HSQC

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6

#	Name	Isotope labeling	Concentration
1	insertion domain	[U-100% 15N]	1.9 mM
2	insertion domain	[U-100% 13C; U-100% 15N]	1.9 mM
3	H2O	natural abundance	90 %
4	D2O	natural abundance	10 %

2 3D HNCACB

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6

#	Name	Isotope labeling	Concentration
1	insertion domain	[U-100% 15N]	1.9 mM
2	insertion domain	[U-100% 13C; U-100% 15N]	1.9 mM
3	H2O	natural abundance	90 %
4	D2O	natural abundance	10 %

3 3D HN(CO)CA

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6

#	Name	Isotope labeling	Concentration
1	insertion domain	[U-100% 15N]	1.9 mM
2	insertion domain	[U-100% 13C; U-100% 15N]	1.9 mM
3	H2O	natural abundance	90 %
4	D2O	natural abundance	10 %

4 3D HBHA(CO)NH

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6

#	Name	Isotope labeling	Concentration
1	insertion domain	[U-100% 15N]	1.9 mM
2	insertion domain	[U-100% 13C; U-100% 15N]	1.9 mM
3	H2O	natural abundance	90 %
4	D2O	natural abundance	10 %

5 3D HNCO

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6

#	Name	Isotope labeling	Concentration
1	insertion domain	[U-100% 15N]	1.9 mM
2	insertion domain	[U-100% 13C; U-100% 15N]	1.9 mM
3	H2O	natural abundance	90 %
4	D2O	natural abundance	10 %

6 3D HNCACO

Instrument

Varian INOVA - 800 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 6

#	Name	Isotope labeling	Concentration
1	insertion domain	[U-100% 15N]	1.9 mM
2	insertion domain	[U-100% 13C; U-100% 15N]	1.9 mM
3	H2O	natural abundance	90 %
4	D2O	natural abundance	10 %

7 3D HCCH-TOCSY