BMRB: 31108

Solution structure of ACKR3-targeting nanobody VUN701

Authors

Schlimgen, R.R., Peterson, F.C., Volkman, B.F.

Assembly

ACKR3-targeting nanobody VUN701

Entity

1. ACKR3-targeting nanobody VUN701 (polymer), 124 monomers, 13304.42 Da Detail

GSGSQVQLVE SGGGLVQAGG SLRLSCAASG STFSLHLMGW YRQAPGKQRE VVATSGSGGD TNYADSVKGR FTISRDNDKN TVDLQMNNLK PEDTADYYCR AQQKIGRDTF RDYWGQGTQV TVSS

Formula weight

13304.42 Da

Source organism

Lama glama

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 772, ¹³C: 470, ¹⁵N: 139 assignments Detail

Download

• NMR-STAR v3.1 (partial)
• BMRB/XML (partial)
• CSV
• TSV

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	1	GLY	C	C	175.804	0.000
2	1	2	SER	H	H	7.387	0.000
3	1	2	SER	N	N	111.724	0.000
4	1	3	GLY	HA2	H	4.057	0.002
5	1	3	GLY	HA3	H	3.884	0.002
6	1	3	GLY	C	C	174.302	0.000
7	1	3	GLY	CA	C	45.503	0.000
8	1	4	SER	H	H	8.293	0.000
9	1	4	SER	C	C	174.583	0.000
10	1	4	SER	N	N	115.604	0.000
11	1	5	GLN	H	H	8.513	0.022
12	1	5	GLN	HA	H	4.361	0.012
13	1	5	GLN	HB2	H	2.112	0.000
14	1	5	GLN	HB3	H	2.053	0.000
15	1	5	GLN	HG2	H	2.428	0.008
16	1	5	GLN	HG3	H	2.413	0.002
17	1	5	GLN	HE21	H	6.817	0.006
18	1	5	GLN	HE22	H	7.656	0.005
19	1	5	GLN	C	C	175.100	0.000
20	1	5	GLN	CA	C	56.617	0.000
21	1	5	GLN	CB	C	30.045	0.000
22	1	5	GLN	CG	C	34.213	0.000
23	1	5	GLN	N	N	121.836	0.111
24	1	5	GLN	NE2	N	112.305	0.000
25	1	6	VAL	H	H	6.648	0.006
26	1	6	VAL	HA	H	4.106	0.000
27	1	6	VAL	HB	H	2.045	0.000
28	1	6	VAL	HG11	H	0.928	0.000
29	1	6	VAL	HG12	H	0.928	0.000
30	1	6	VAL	HG13	H	0.928	0.000
31	1	6	VAL	HG21	H	0.951	0.012
32	1	6	VAL	HG22	H	0.951	0.012
33	1	6	VAL	HG23	H	0.951	0.012
34	1	6	VAL	C	C	174.475	0.000
35	1	6	VAL	CA	C	62.584	0.000
36	1	6	VAL	CB	C	32.767	0.000
37	1	6	VAL	CG1	C	20.826	0.000
38	1	6	VAL	CG2	C	21.800	0.000
39	1	6	VAL	N	N	121.126	0.000
40	1	7	GLN	H	H	8.305	0.000
41	1	7	GLN	HA	H	4.495	0.000
42	1	7	GLN	HB2	H	1.981	0.010
43	1	7	GLN	HB3	H	1.837	0.007
44	1	7	GLN	HG2	H	2.229	0.009
45	1	7	GLN	HG3	H	2.229	0.009
46	1	7	GLN	HE21	H	6.813	0.007
47	1	7	GLN	HE22	H	7.397	0.006
48	1	7	GLN	C	C	174.342	0.000
49	1	7	GLN	CA	C	54.450	0.000
50	1	7	GLN	CB	C	31.611	0.000
51	1	7	GLN	CG	C	34.098	0.000
52	1	7	GLN	N	N	124.929	0.000
53	1	7	GLN	NE2	N	111.726	0.000
54	1	8	LEU	H	H	8.601	0.000
55	1	8	LEU	HA	H	5.150	0.006
56	1	8	LEU	HB2	H	1.445	0.003
57	1	8	LEU	HB3	H	1.092	0.010
58	1	8	LEU	HG	H	1.293	0.000
59	1	8	LEU	HD11	H	0.505	0.007
60	1	8	LEU	HD12	H	0.505	0.007
61	1	8	LEU	HD13	H	0.505	0.007
62	1	8	LEU	HD21	H	0.525	0.015
63	1	8	LEU	HD22	H	0.525	0.015
64	1	8	LEU	HD23	H	0.525	0.015
65	1	8	LEU	C	C	176.448	0.000
66	1	8	LEU	CA	C	53.458	0.000
67	1	8	LEU	CB	C	44.078	0.000
68	1	8	LEU	CG	C	26.908	0.000
69	1	8	LEU	CD1	C	23.841	0.000
70	1	8	LEU	CD2	C	26.329	0.000
71	1	8	LEU	N	N	123.597	0.000
72	1	9	VAL	H	H	8.530	0.002
73	1	9	VAL	HA	H	4.394	0.003
74	1	9	VAL	HB	H	2.015	0.002
75	1	9	VAL	HG11	H	0.989	0.005
76	1	9	VAL	HG12	H	0.989	0.005
77	1	9	VAL	HG13	H	0.989	0.005
78	1	9	VAL	HG21	H	0.974	0.002
79	1	9	VAL	HG22	H	0.974	0.002
80	1	9	VAL	HG23	H	0.974	0.002
81	1	9	VAL	C	C	176.368	0.113
82	1	9	VAL	CA	C	62.294	0.000
83	1	9	VAL	CB	C	35.011	0.000
84	1	9	VAL	CG1	C	21.466	0.000
85	1	9	VAL	CG2	C	21.193	0.000
86	1	9	VAL	N	N	121.771	0.106
87	1	10	GLU	H	H	9.393	0.000
88	1	10	GLU	HA	H	5.447	0.000
89	1	10	GLU	HB2	H	2.214	0.000
90	1	10	GLU	HB3	H	2.282	0.003
91	1	10	GLU	HG2	H	2.599	0.009
92	1	10	GLU	HG3	H	2.201	0.001
93	1	10	GLU	C	C	176.270	0.000
94	1	10	GLU	CA	C	56.500	0.000
95	1	10	GLU	CB	C	32.103	0.000
96	1	10	GLU	CG	C	37.965	0.000
97	1	10	GLU	N	N	130.190	0.000
98	1	11	SER	H	H	9.583	0.006
99	1	11	SER	HA	H	4.880	0.003
100	1	11	SER	HB2	H	3.921	0.003
101	1	11	SER	HB3	H	3.921	0.003
102	1	11	SER	C	C	173.610	0.000
103	1	11	SER	CA	C	57.975	0.000
104	1	11	SER	CB	C	66.021	0.000
105	1	11	SER	N	N	115.702	0.000
106	1	12	GLY	H	H	8.544	0.004
107	1	12	GLY	HA2	H	4.705	0.003
108	1	12	GLY	HA3	H	3.730	0.000
109	1	12	GLY	C	C	174.395	0.000
110	1	12	GLY	CA	C	44.838	0.000
111	1	12	GLY	N	N	107.312	0.000
112	1	13	GLY	H	H	7.801	0.004
113	1	13	GLY	HA2	H	4.000	0.001
114	1	13	GLY	HA3	H	3.439	0.005
115	1	13	GLY	C	C	172.946	0.000
116	1	13	GLY	CA	C	45.343	0.000
117	1	13	GLY	N	N	105.297	0.000
118	1	14	GLY	H	H	7.683	0.002
119	1	14	GLY	HA2	H	4.287	0.003
120	1	14	GLY	HA3	H	3.847	0.006
121	1	14	GLY	C	C	170.774	0.000
122	1	14	GLY	CA	C	44.960	0.000
123	1	14	GLY	N	N	107.154	0.000
124	1	15	LEU	H	H	8.063	0.012
125	1	15	LEU	HA	H	5.271	0.008
126	1	15	LEU	HB2	H	1.636	0.000
127	1	15	LEU	HB3	H	1.478	0.000
128	1	15	LEU	HG	H	1.466	0.000
129	1	15	LEU	HD11	H	0.850	0.004
130	1	15	LEU	HD12	H	0.850	0.004
131	1	15	LEU	HD13	H	0.850	0.004
132	1	15	LEU	HD21	H	0.849	0.000
133	1	15	LEU	HD22	H	0.849	0.000
134	1	15	LEU	HD23	H	0.849	0.000
135	1	15	LEU	C	C	176.788	0.000
136	1	15	LEU	CA	C	54.351	0.000
137	1	15	LEU	CB	C	43.877	0.000
138	1	15	LEU	CG	C	27.948	0.000
139	1	15	LEU	CD1	C	24.876	0.000
140	1	15	LEU	CD2	C	25.000	0.000
141	1	15	LEU	N	N	122.619	0.000
142	1	16	VAL	H	H	8.946	0.007
143	1	16	VAL	HA	H	4.493	0.006
144	1	16	VAL	HB	H	1.919	0.012
145	1	16	VAL	HG11	H	0.808	0.001
146	1	16	VAL	HG12	H	0.808	0.001
147	1	16	VAL	HG13	H	0.808	0.001
148	1	16	VAL	HG21	H	0.859	0.009
149	1	16	VAL	HG22	H	0.859	0.009
150	1	16	VAL	HG23	H	0.859	0.009
151	1	16	VAL	C	C	172.959	0.000
152	1	16	VAL	CA	C	59.792	0.000
153	1	16	VAL	CB	C	35.951	0.000
154	1	16	VAL	CG1	C	21.797	0.000
155	1	16	VAL	CG2	C	21.413	0.000
156	1	16	VAL	N	N	124.285	0.000
157	1	17	GLN	H	H	8.175	0.007
158	1	17	GLN	HA	H	4.571	0.006
159	1	17	GLN	HB2	H	1.940	0.000
160	1	17	GLN	HB3	H	2.019	0.006
161	1	17	GLN	HG2	H	2.419	0.005
162	1	17	GLN	HG3	H	2.401	0.000
163	1	17	GLN	HE21	H	6.934	0.002
164	1	17	GLN	HE22	H	7.580	0.010
165	1	17	GLN	C	C	176.086	0.000
166	1	17	GLN	CA	C	55.208	0.000
167	1	17	GLN	CB	C	30.292	0.000
168	1	17	GLN	CG	C	34.213	0.000
169	1	17	GLN	N	N	123.216	0.000
170	1	17	GLN	NE2	N	112.249	0.000
171	1	18	ALA	H	H	8.314	0.001
172	1	18	ALA	HA	H	3.662	0.004
173	1	18	ALA	HB1	H	1.384	0.002
174	1	18	ALA	HB2	H	1.384	0.002
175	1	18	ALA	HB3	H	1.384	0.002
176	1	18	ALA	C	C	178.424	0.000
177	1	18	ALA	CA	C	54.050	0.000
178	1	18	ALA	CB	C	18.196	0.000
179	1	18	ALA	N	N	124.492	0.000
180	1	19	GLY	H	H	9.722	0.002
181	1	19	GLY	HA2	H	4.453	0.002
182	1	19	GLY	HA3	H	3.769	0.014
183	1	19	GLY	C	C	175.618	0.000
184	1	19	GLY	CA	C	44.752	0.000
185	1	19	GLY	N	N	113.344	0.000
186	1	20	GLY	H	H	8.529	0.002
187	1	20	GLY	HA2	H	4.356	0.001
188	1	20	GLY	HA3	H	3.778	0.002
189	1	20	GLY	C	C	170.778	0.000
190	1	20	GLY	CA	C	44.815	0.000
191	1	20	GLY	N	N	109.389	0.000
192	1	21	SER	H	H	7.922	0.001
193	1	21	SER	HA	H	5.584	0.006
194	1	21	SER	HB2	H	3.815	0.006
195	1	21	SER	HB3	H	3.668	0.015
196	1	21	SER	C	C	172.919	0.000
197	1	21	SER	CA	C	56.759	0.000
198	1	21	SER	CB	C	67.765	0.000
199	1	21	SER	N	N	110.027	0.000
200	1	22	LEU	H	H	8.533	0.007
201	1	22	LEU	HA	H	4.346	0.000
202	1	22	LEU	HB2	H	1.255	0.011
203	1	22	LEU	HB3	H	1.255	0.011
204	1	22	LEU	HG	H	1.239	0.000
205	1	22	LEU	HD11	H	0.650	0.008
206	1	22	LEU	HD12	H	0.650	0.008
207	1	22	LEU	HD13	H	0.650	0.008
208	1	22	LEU	HD21	H	0.656	0.000
209	1	22	LEU	HD22	H	0.656	0.000
210	1	22	LEU	HD23	H	0.656	0.000
211	1	22	LEU	C	C	173.477	0.000
212	1	22	LEU	CA	C	54.663	0.000
213	1	22	LEU	CB	C	48.017	0.000
214	1	22	LEU	CG	C	26.977	0.000
215	1	22	LEU	CD1	C	24.671	0.000
216	1	22	LEU	CD2	C	25.386	0.000
217	1	22	LEU	N	N	121.804	0.107
218	1	23	ARG	H	H	8.046	0.009
219	1	23	ARG	HA	H	5.037	0.007
220	1	23	ARG	HB2	H	1.630	0.000
221	1	23	ARG	HB3	H	1.614	0.000
222	1	23	ARG	HG2	H	1.132	0.014
223	1	23	ARG	HG3	H	1.178	0.000
224	1	23	ARG	HD2	H	3.107	0.000
225	1	23	ARG	HD3	H	3.073	0.000
226	1	23	ARG	HE	H	7.707	0.000
227	1	23	ARG	C	C	175.499	0.000
228	1	23	ARG	CA	C	54.398	0.000
229	1	23	ARG	CB	C	32.804	0.000
230	1	23	ARG	CG	C	28.696	0.000
231	1	23	ARG	CD	C	43.703	0.000
232	1	23	ARG	N	N	122.619	0.000
233	1	23	ARG	NE	N	85.421	0.000
234	1	24	LEU	H	H	8.535	0.001
235	1	24	LEU	HA	H	4.871	0.000
236	1	24	LEU	HB2	H	0.848	0.004
237	1	24	LEU	HB3	H	0.515	0.005
238	1	24	LEU	HG	H	1.060	0.000
239	1	24	LEU	HD11	H	-0.277	0.011
240	1	24	LEU	HD12	H	-0.277	0.011
241	1	24	LEU	HD13	H	-0.277	0.011
242	1	24	LEU	HD21	H	0.186	0.007
243	1	24	LEU	HD22	H	0.186	0.007
244	1	24	LEU	HD23	H	0.186	0.007
245	1	24	LEU	C	C	176.828	0.000
246	1	24	LEU	CA	C	52.848	0.000
247	1	24	LEU	CB	C	43.961	0.000
248	1	24	LEU	CG	C	26.300	0.000
249	1	24	LEU	CD1	C	25.937	0.000
250	1	24	LEU	CD2	C	21.855	0.000
251	1	24	LEU	N	N	126.845	0.000
252	1	25	SER	H	H	8.739	0.003
253	1	25	SER	HA	H	5.496	0.001
254	1	25	SER	HB2	H	3.564	0.006
255	1	25	SER	HB3	H	3.564	0.006
256	1	25	SER	C	C	172.946	0.000
257	1	25	SER	CA	C	57.679	0.000
258	1	25	SER	CB	C	65.885	0.000
259	1	25	SER	N	N	114.149	0.000
260	1	26	CYS	H	H	8.734	0.008
261	1	26	CYS	HA	H	5.495	0.000
262	1	26	CYS	HB2	H	3.088	0.012
263	1	26	CYS	HB3	H	3.335	0.006
264	1	26	CYS	C	C	171.355	0.000
265	1	26	CYS	CA	C	52.911	0.000
266	1	26	CYS	CB	C	41.097	0.000
267	1	26	CYS	N	N	126.928	0.000
268	1	27	ALA	H	H	8.547	0.001
269	1	27	ALA	HA	H	4.963	0.016
270	1	27	ALA	HB1	H	1.381	0.006
271	1	27	ALA	HB2	H	1.381	0.006
272	1	27	ALA	HB3	H	1.381	0.006
273	1	27	ALA	C	C	176.270	0.000
274	1	27	ALA	CA	C	50.761	0.000
275	1	27	ALA	CB	C	21.825	0.000
276	1	27	ALA	N	N	128.494	0.000
277	1	28	ALA	H	H	8.427	0.005
278	1	28	ALA	HA	H	5.360	0.000
279	1	28	ALA	HB1	H	1.074	0.001
280	1	28	ALA	HB2	H	1.074	0.001
281	1	28	ALA	HB3	H	1.074	0.001
282	1	28	ALA	C	C	177.041	0.000
283	1	28	ALA	CA	C	50.251	0.000
284	1	28	ALA	CB	C	21.320	0.000
285	1	28	ALA	N	N	125.353	0.065
286	1	29	SER	H	H	8.828	0.001
287	1	29	SER	HA	H	4.558	0.002
288	1	29	SER	HB2	H	3.918	0.001
289	1	29	SER	HB3	H	3.775	0.002
290	1	29	SER	C	C	173.664	0.000
291	1	29	SER	CA	C	57.759	0.000
292	1	29	SER	CB	C	65.393	0.000
293	1	29	SER	N	N	117.369	0.000
294	1	30	GLY	H	H	8.440	0.004
295	1	30	GLY	HA2	H	4.388	0.007
296	1	30	GLY	HA3	H	3.711	0.000
297	1	30	GLY	C	C	174.036	0.000
298	1	30	GLY	CA	C	45.080	0.000
299	1	30	GLY	N	N	108.877	0.000
300	1	31	SER	H	H	8.074	0.002
301	1	31	SER	C	C	175.377	0.000
302	1	31	SER	N	N	115.423	0.000
303	1	32	THR	HA	H	4.019	0.000
304	1	32	THR	HB	H	4.214	0.000
305	1	32	THR	HG21	H	0.939	0.006
306	1	32	THR	HG22	H	0.939	0.006
307	1	32	THR	HG23	H	0.939	0.006
308	1	32	THR	C	C	174.395	0.000
309	1	32	THR	CA	C	62.551	0.000
310	1	32	THR	CB	C	68.734	0.000
311	1	32	THR	CG2	C	21.744	0.000
312	1	33	PHE	H	H	7.550	0.005
313	1	33	PHE	HA	H	4.670	0.000
314	1	33	PHE	HB2	H	3.181	0.000
315	1	33	PHE	HB3	H	2.969	0.006
316	1	33	PHE	HD1	H	7.205	0.001
317	1	33	PHE	HD2	H	7.205	0.001
318	1	33	PHE	HE1	H	7.311	0.006
319	1	33	PHE	HE2	H	7.311	0.006
320	1	33	PHE	HZ	H	7.079	0.005
321	1	33	PHE	C	C	175.738	0.000
322	1	33	PHE	CA	C	57.244	0.000
323	1	33	PHE	CB	C	40.336	0.000
324	1	33	PHE	CD1	C	132.210	0.000
325	1	33	PHE	CE1	C	131.833	0.000
326	1	33	PHE	CZ	C	130.278	0.000
327	1	33	PHE	N	N	119.744	0.130
328	1	34	SER	H	H	8.496	0.000
329	1	34	SER	HA	H	4.546	0.000
330	1	34	SER	HB2	H	3.925	0.000
331	1	34	SER	HB3	H	3.925	0.000
332	1	34	SER	C	C	174.910	0.000
333	1	34	SER	CA	C	58.472	0.000
334	1	34	SER	CB	C	63.700	0.000
335	1	34	SER	N	N	115.128	0.000
336	1	35	LEU	H	H	8.546	0.000
337	1	35	LEU	HA	H	4.650	0.009
338	1	35	LEU	HB2	H	1.795	0.012
339	1	35	LEU	HB3	H	1.204	0.000
340	1	35	LEU	HG	H	1.638	0.000
341	1	35	LEU	HD11	H	0.725	0.003
342	1	35	LEU	HD12	H	0.725	0.003
343	1	35	LEU	HD13	H	0.725	0.003
344	1	35	LEU	HD21	H	0.727	0.016
345	1	35	LEU	HD22	H	0.727	0.016
346	1	35	LEU	HD23	H	0.727	0.016
347	1	35	LEU	C	C	176.921	0.000
348	1	35	LEU	CA	C	54.616	0.000
349	1	35	LEU	CB	C	41.003	0.000
350	1	35	LEU	CG	C	27.300	0.000
351	1	35	LEU	CD1	C	25.937	0.000
352	1	35	LEU	CD2	C	23.345	0.000
353	1	35	LEU	N	N	124.080	0.000
354	1	36	HIS	H	H	8.502	0.003
355	1	36	HIS	HA	H	4.546	0.006
356	1	36	HIS	HB2	H	3.262	0.003
357	1	36	HIS	HB3	H	3.128	0.016
358	1	36	HIS	HD2	H	7.062	0.004
359	1	36	HIS	HE1	H	7.802	0.001
360	1	36	HIS	C	C	175.033	0.000
361	1	36	HIS	CA	C	59.056	0.000
362	1	36	HIS	CB	C	32.480	0.000
363	1	36	HIS	CD2	C	119.361	0.000
364	1	36	HIS	CE1	C	138.985	0.000
365	1	36	HIS	N	N	126.226	0.000
366	1	37	LEU	H	H	7.713	0.006
367	1	37	LEU	HA	H	4.686	0.003
368	1	37	LEU	HB2	H	1.498	0.007
369	1	37	LEU	HB3	H	1.450	0.007
370	1	37	LEU	HG	H	1.331	0.006
371	1	37	LEU	HD11	H	0.745	0.000
372	1	37	LEU	HD12	H	0.745	0.000
373	1	37	LEU	HD13	H	0.745	0.000
374	1	37	LEU	HD21	H	0.496	0.014
375	1	37	LEU	HD22	H	0.496	0.014
376	1	37	LEU	HD23	H	0.496	0.014
377	1	37	LEU	C	C	175.538	0.000
378	1	37	LEU	CA	C	55.139	0.000
379	1	37	LEU	CB	C	45.916	0.000
380	1	37	LEU	CG	C	27.300	0.000
381	1	37	LEU	CD1	C	25.386	0.000
382	1	37	LEU	CD2	C	24.387	0.000
383	1	37	LEU	N	N	118.664	0.000
384	1	38	MET	H	H	8.254	0.002
385	1	38	MET	HA	H	5.287	0.009
386	1	38	MET	HB2	H	2.102	0.006
387	1	38	MET	HB3	H	1.515	0.009
388	1	38	MET	HG2	H	2.319	0.000
389	1	38	MET	HG3	H	2.253	0.000
390	1	38	MET	C	C	175.219	0.000
391	1	38	MET	CA	C	55.228	0.000
392	1	38	MET	CB	C	39.396	0.000
393	1	38	MET	CG	C	33.772	0.000
394	1	38	MET	N	N	121.303	0.000
395	1	39	GLY	H	H	9.073	0.002
396	1	39	GLY	HA2	H	4.462	0.005
397	1	39	GLY	HA3	H	4.082	0.003
398	1	39	GLY	C	C	182.174	0.000
399	1	39	GLY	CA	C	46.717	0.000
400	1	39	GLY	N	N	107.362	0.000
401	1	40	TRP	H	H	9.354	0.003
402	1	40	TRP	HA	H	5.760	0.007
403	1	40	TRP	HB2	H	2.854	0.005
404	1	40	TRP	HB3	H	3.274	0.013
405	1	40	TRP	HD1	H	6.736	0.003
406	1	40	TRP	HE1	H	7.983	0.004
407	1	40	TRP	HE3	H	7.738	0.002
408	1	40	TRP	HZ2	H	7.211	0.005
409	1	40	TRP	HZ3	H	7.009	0.000
410	1	40	TRP	HH2	H	7.085	0.012
411	1	40	TRP	C	C	174.501	0.000
412	1	40	TRP	CA	C	56.427	0.000
413	1	40	TRP	CB	C	34.385	0.000
414	1	40	TRP	CD1	C	124.089	0.000
415	1	40	TRP	CE3	C	120.579	0.000
416	1	40	TRP	CZ2	C	115.424	0.000
417	1	40	TRP	CZ3	C	122.794	0.000
418	1	40	TRP	CH2	C	124.358	0.000
419	1	40	TRP	N	N	116.639	0.000
420	1	40	TRP	NE1	N	122.265	0.000
421	1	41	TYR	H	H	10.183	0.002
422	1	41	TYR	HA	H	5.187	0.005
423	1	41	TYR	HB2	H	3.172	0.002
424	1	41	TYR	HB3	H	2.940	0.010
425	1	41	TYR	HD1	H	6.986	0.008
426	1	41	TYR	HD2	H	6.986	0.008
427	1	41	TYR	HE1	H	6.484	0.007
428	1	41	TYR	HE2	H	6.484	0.007
429	1	41	TYR	C	C	174.554	0.000
430	1	41	TYR	CA	C	56.923	0.000
431	1	41	TYR	CB	C	43.379	0.000
432	1	41	TYR	CD1	C	133.043	0.000
433	1	41	TYR	CE1	C	118.558	0.000
434	1	41	TYR	N	N	124.650	0.000
435	1	42	ARG	H	H	9.883	0.004
436	1	42	ARG	HA	H	5.853	0.005
437	1	42	ARG	HB2	H	0.793	0.016
438	1	42	ARG	HB3	H	0.793	0.016
439	1	42	ARG	HG2	H	1.331	0.000
440	1	42	ARG	HG3	H	1.290	0.000
441	1	42	ARG	HD2	H	2.614	0.000
442	1	42	ARG	HD3	H	2.614	0.000
443	1	42	ARG	HE	H	7.732	0.000
444	1	42	ARG	C	C	173.664	0.000
445	1	42	ARG	CA	C	54.400	0.000
446	1	42	ARG	CB	C	32.633	0.000
447	1	42	ARG	CG	C	24.393	0.000
448	1	42	ARG	CD	C	45.247	0.000
449	1	42	ARG	N	N	116.686	0.000
450	1	42	ARG	NE	N	84.298	0.000
451	1	43	GLN	H	H	9.399	0.001
452	1	43	GLN	HA	H	4.780	0.004
453	1	43	GLN	HB2	H	2.355	0.000
454	1	43	GLN	HB3	H	1.623	0.014
455	1	43	GLN	HG2	H	2.320	0.001
456	1	43	GLN	HG3	H	2.122	0.017
457	1	43	GLN	HE21	H	6.773	0.002
458	1	43	GLN	HE22	H	7.700	0.008
459	1	43	GLN	C	C	174.344	0.000
460	1	43	GLN	CA	C	55.248	0.000
461	1	43	GLN	CB	C	33.024	0.000
462	1	43	GLN	CG	C	33.603	0.162
463	1	43	GLN	N	N	121.814	0.000
464	1	43	GLN	NE2	N	111.749	0.000
465	1	44	ALA	H	H	9.295	0.000
466	1	44	ALA	C	C	174.446	0.000
467	1	44	ALA	N	N	135.108	0.000
468	1	45	PRO	HA	H	4.333	0.007
469	1	45	PRO	HB2	H	2.307	0.000
470	1	45	PRO	HB3	H	1.930	0.000
471	1	45	PRO	HG2	H	2.142	0.000
472	1	45	PRO	HG3	H	2.016	0.000
473	1	45	PRO	HD2	H	3.640	0.010
474	1	45	PRO	HD3	H	3.845	0.007
475	1	45	PRO	C	C	178.424	0.000
476	1	45	PRO	CA	C	64.601	0.000
477	1	45	PRO	CB	C	31.566	0.000
478	1	45	PRO	CG	C	28.255	0.000
479	1	45	PRO	CD	C	50.931	0.000
480	1	46	GLY	H	H	8.787	0.004
481	1	46	GLY	HA2	H	4.135	0.007
482	1	46	GLY	HA3	H	3.755	0.005
483	1	46	GLY	C	C	174.169	0.000
484	1	46	GLY	CA	C	45.905	0.000
485	1	46	GLY	N	N	112.675	0.000
486	1	47	LYS	H	H	8.055	0.006
487	1	47	LYS	HA	H	4.771	0.015
488	1	47	LYS	HB2	H	2.043	0.020
489	1	47	LYS	HB3	H	1.918	0.000
490	1	47	LYS	HG2	H	1.434	0.001
491	1	47	LYS	HG3	H	1.295	0.000
492	1	47	LYS	HD2	H	1.672	0.006
493	1	47	LYS	HD3	H	1.672	0.006
494	1	47	LYS	HE2	H	3.007	0.002
495	1	47	LYS	HE3	H	3.007	0.002
496	1	47	LYS	C	C	176.084	0.000
497	1	47	LYS	CA	C	54.528	0.000
498	1	47	LYS	CB	C	35.415	0.000
499	1	47	LYS	CG	C	25.165	0.000
500	1	47	LYS	CD	C	29.027	0.000
501	1	47	LYS	CE	C	42.599	0.000
502	1	47	LYS	N	N	120.122	0.000
503	1	48	GLN	H	H	8.264	0.006
504	1	48	GLN	HA	H	4.350	0.001
505	1	48	GLN	HB2	H	2.131	0.001
506	1	48	GLN	HB3	H	1.971	0.000
507	1	48	GLN	HG2	H	2.447	0.011
508	1	48	GLN	HG3	H	2.447	0.011
509	1	48	GLN	HE21	H	6.901	0.005
510	1	48	GLN	HE22	H	7.622	0.008
511	1	48	GLN	C	C	176.243	0.000
512	1	48	GLN	CA	C	55.101	0.000
513	1	48	GLN	CB	C	29.788	0.000
514	1	48	GLN	CG	C	34.213	0.000
515	1	48	GLN	N	N	117.738	0.000
516	1	48	GLN	NE2	N	113.038	0.000
517	1	49	ARG	H	H	8.658	0.001
518	1	49	ARG	HA	H	4.520	0.013
519	1	49	ARG	HB2	H	1.614	0.000
520	1	49	ARG	HB3	H	1.614	0.000
521	1	49	ARG	HG2	H	1.610	0.000
522	1	49	ARG	HG3	H	1.342	0.016
523	1	49	ARG	HD2	H	2.350	0.000
524	1	49	ARG	HD3	H	2.350	0.000
525	1	49	ARG	C	C	175.764	0.000
526	1	49	ARG	CA	C	57.325	0.000
527	1	49	ARG	CB	C	30.313	0.000
528	1	49	ARG	CG	C	27.262	0.000
529	1	49	ARG	CD	C	43.261	0.000
530	1	49	ARG	N	N	123.096	0.000
531	1	50	GLU	H	H	9.492	0.000
532	1	50	GLU	HA	H	5.109	0.004
533	1	50	GLU	HB2	H	2.063	0.000
534	1	50	GLU	HB3	H	2.153	0.006
535	1	50	GLU	HG2	H	2.424	0.015
536	1	50	GLU	HG3	H	2.150	0.000
537	1	50	GLU	C	C	175.126	0.000
538	1	50	GLU	CA	C	53.934	0.000
539	1	50	GLU	CB	C	33.573	0.000
540	1	50	GLU	CG	C	35.393	0.000
541	1	50	GLU	N	N	125.298	0.000
542	1	51	VAL	H	H	8.640	0.000
543	1	51	VAL	HA	H	3.155	0.005
544	1	51	VAL	HB	H	1.849	0.005
545	1	51	VAL	HG11	H	0.486	0.009
546	1	51	VAL	HG12	H	0.486	0.009
547	1	51	VAL	HG13	H	0.486	0.009
548	1	51	VAL	HG21	H	0.755	0.009
549	1	51	VAL	HG22	H	0.755	0.009
550	1	51	VAL	HG23	H	0.755	0.009
551	1	51	VAL	C	C	173.371	0.000
552	1	51	VAL	CA	C	63.204	0.000
553	1	51	VAL	CB	C	32.577	0.000
554	1	51	VAL	CG1	C	23.400	0.000
555	1	51	VAL	CG2	C	19.317	0.000
556	1	51	VAL	N	N	123.623	0.000
557	1	52	VAL	H	H	8.263	0.004
558	1	52	VAL	HA	H	4.146	0.003
559	1	52	VAL	HB	H	2.067	0.013
560	1	52	VAL	HG11	H	1.319	0.000
561	1	52	VAL	HG12	H	1.319	0.000
562	1	52	VAL	HG13	H	1.319	0.000
563	1	52	VAL	HG21	H	0.989	0.004
564	1	52	VAL	HG22	H	0.989	0.004
565	1	52	VAL	HG23	H	0.989	0.004
566	1	52	VAL	C	C	174.501	0.000
567	1	52	VAL	CA	C	64.115	0.000
568	1	52	VAL	CB	C	33.836	0.000
569	1	52	VAL	CG1	C	23.740	0.000
570	1	52	VAL	CG2	C	21.797	0.000
571	1	52	VAL	N	N	123.846	0.000
572	1	53	ALA	H	H	7.979	0.006
573	1	53	ALA	HA	H	5.276	0.005
574	1	53	ALA	HB1	H	1.333	0.006
575	1	53	ALA	HB2	H	1.333	0.006
576	1	53	ALA	HB3	H	1.333	0.006
577	1	53	ALA	C	C	175.392	0.000
578	1	53	ALA	CA	C	51.575	0.000
579	1	53	ALA	CB	C	23.826	0.000
580	1	53	ALA	N	N	117.006	0.000
581	1	54	THR	H	H	8.887	0.003
582	1	54	THR	HA	H	4.870	0.010
583	1	54	THR	HB	H	3.994	0.003
584	1	54	THR	HG21	H	0.934	0.007
585	1	54	THR	HG22	H	0.934	0.007
586	1	54	THR	HG23	H	0.934	0.007
587	1	54	THR	C	C	172.547	0.000
588	1	54	THR	CA	C	60.599	0.000
589	1	54	THR	CB	C	72.552	0.000
590	1	54	THR	CG2	C	21.744	0.000
591	1	54	THR	N	N	110.217	0.000
592	1	55	SER	H	H	8.725	0.000
593	1	55	SER	HA	H	5.141	0.005
594	1	55	SER	HB2	H	3.561	0.000
595	1	55	SER	HB3	H	3.518	0.005
596	1	55	SER	C	C	175.432	0.000
597	1	55	SER	CA	C	56.799	0.000
598	1	55	SER	CB	C	65.259	0.000
599	1	55	SER	N	N	113.567	0.000
600	1	56	GLY	H	H	8.774	0.000
601	1	56	GLY	HA2	H	4.780	0.019
602	1	56	GLY	HA3	H	4.105	0.006
603	1	56	GLY	C	C	175.645	0.000
604	1	56	GLY	CA	C	44.694	0.000
605	1	56	GLY	N	N	117.031	0.000
606	1	57	SER	H	H	8.625	0.000
607	1	57	SER	HA	H	5.154	0.005
608	1	57	SER	HB2	H	3.925	0.000
609	1	57	SER	HB3	H	3.925	0.000
610	1	57	SER	C	C	176.080	0.000
611	1	57	SER	CA	C	60.895	0.000
612	1	57	SER	CB	C	62.984	0.000
613	1	57	SER	N	N	118.439	0.000
614	1	58	GLY	H	H	8.924	0.006
615	1	58	GLY	HA2	H	4.267	0.000
616	1	58	GLY	HA3	H	3.839	0.002
617	1	58	GLY	C	C	175.153	0.000
618	1	58	GLY	CA	C	45.319	0.000
619	1	58	GLY	N	N	110.431	0.000
620	1	59	GLY	H	H	7.920	0.002
621	1	59	GLY	HA2	H	4.341	0.002
622	1	59	GLY	HA3	H	3.722	0.000
623	1	59	GLY	C	C	174.129	0.000
624	1	59	GLY	CA	C	45.436	0.000
625	1	59	GLY	N	N	107.375	0.000
626	1	60	ASP	H	H	8.767	0.002
627	1	60	ASP	HA	H	4.625	0.008
628	1	60	ASP	HB2	H	2.626	0.011
629	1	60	ASP	HB3	H	2.560	0.000
630	1	60	ASP	C	C	176.469	0.000
631	1	60	ASP	CA	C	54.252	0.000
632	1	60	ASP	CB	C	40.202	0.000
633	1	60	ASP	N	N	119.192	0.000
634	1	61	THR	H	H	8.588	0.008
635	1	61	THR	HA	H	5.182	0.001
636	1	61	THR	HB	H	3.904	0.006
637	1	61	THR	HG21	H	1.194	0.004
638	1	61	THR	HG22	H	1.194	0.004
639	1	61	THR	HG23	H	1.194	0.004
640	1	61	THR	C	C	173.642	0.000
641	1	61	THR	CA	C	60.379	0.000
642	1	61	THR	CB	C	72.597	0.000
643	1	61	THR	CG2	C	22.517	0.000
644	1	61	THR	N	N	117.190	0.000
645	1	62	ASN	H	H	8.045	0.007
646	1	62	ASN	HA	H	4.971	0.002
647	1	62	ASN	HB2	H	2.520	0.013
648	1	62	ASN	HB3	H	2.520	0.013
649	1	62	ASN	HD21	H	6.905	0.004
650	1	62	ASN	HD22	H	7.302	0.006
651	1	62	ASN	C	C	172.972	0.000
652	1	62	ASN	CA	C	52.915	0.000
653	1	62	ASN	CB	C	42.887	0.000
654	1	62	ASN	N	N	120.122	0.000
655	1	62	ASN	ND2	N	113.269	0.000
656	1	63	TYR	H	H	8.620	0.000
657	1	63	TYR	HA	H	5.026	0.011
658	1	63	TYR	HB2	H	3.000	0.003
659	1	63	TYR	HB3	H	2.552	0.000
660	1	63	TYR	HD1	H	7.114	0.005
661	1	63	TYR	HD2	H	7.114	0.005
662	1	63	TYR	HE1	H	6.727	0.003
663	1	63	TYR	HE2	H	6.727	0.003
664	1	63	TYR	C	C	176.044	0.000
665	1	63	TYR	CA	C	57.387	0.000
666	1	63	TYR	CB	C	42.862	0.000
667	1	63	TYR	CD1	C	133.020	0.000
668	1	63	TYR	CE1	C	118.039	0.000
669	1	63	TYR	N	N	119.002	0.000
670	1	64	ALA	H	H	8.310	0.003
671	1	64	ALA	HA	H	4.352	0.007
672	1	64	ALA	HB1	H	1.605	0.004
673	1	64	ALA	HB2	H	1.605	0.004
674	1	64	ALA	HB3	H	1.605	0.004
675	1	64	ALA	C	C	179.328	0.000
676	1	64	ALA	CA	C	52.444	0.000
677	1	64	ALA	CB	C	19.540	0.000
678	1	64	ALA	N	N	124.492	0.000
679	1	65	ASP	H	H	9.001	0.000
680	1	65	ASP	HA	H	4.270	0.000
681	1	65	ASP	HB2	H	2.703	0.005
682	1	65	ASP	HB3	H	2.703	0.005
683	1	65	ASP	C	C	178.504	0.000
684	1	65	ASP	CA	C	58.271	0.000
685	1	65	ASP	CB	C	40.685	0.000
686	1	65	ASP	N	N	123.438	0.000
687	1	66	SER	H	H	8.221	0.012
688	1	66	SER	HA	H	4.201	0.010
689	1	66	SER	HB2	H	3.868	0.010
690	1	66	SER	HB3	H	3.868	0.010
691	1	66	SER	C	C	175.804	0.000
692	1	66	SER	CA	C	60.037	0.000
693	1	66	SER	CB	C	63.380	0.000
694	1	66	SER	N	N	110.259	0.000
695	1	67	VAL	H	H	7.367	0.013
696	1	67	VAL	HA	H	4.152	0.008
697	1	67	VAL	HB	H	1.193	0.005
698	1	67	VAL	HG11	H	0.324	0.008
699	1	67	VAL	HG12	H	0.324	0.008
700	1	67	VAL	HG13	H	0.324	0.008
701	1	67	VAL	HG21	H	1.045	0.008
702	1	67	VAL	HG22	H	1.045	0.008
703	1	67	VAL	HG23	H	1.045	0.008
704	1	67	VAL	C	C	175.432	0.000
705	1	67	VAL	CA	C	60.447	0.000
706	1	67	VAL	CB	C	31.681	0.000
707	1	67	VAL	CG1	C	20.641	0.000
708	1	67	VAL	CG2	C	19.616	0.000
709	1	67	VAL	N	N	111.922	0.114
710	1	68	LYS	H	H	7.245	0.004
711	1	68	LYS	HA	H	3.708	0.008
712	1	68	LYS	HB2	H	1.786	0.010
713	1	68	LYS	HB3	H	1.786	0.010
714	1	68	LYS	HG2	H	1.458	0.005
715	1	68	LYS	HG3	H	1.374	0.000
716	1	68	LYS	HD2	H	1.776	0.000
717	1	68	LYS	HD3	H	1.776	0.000
718	1	68	LYS	HE2	H	3.038	0.000
719	1	68	LYS	HE3	H	3.079	0.000
720	1	68	LYS	C	C	177.693	0.000
721	1	68	LYS	CA	C	58.620	0.000
722	1	68	LYS	CB	C	32.480	0.000
723	1	68	LYS	CG	C	25.358	0.000
724	1	68	LYS	CD	C	29.890	0.000
725	1	68	LYS	CE	C	42.514	0.000
726	1	68	LYS	N	N	125.374	0.000
727	1	69	GLY	H	H	9.183	0.010
728	1	69	GLY	HA2	H	4.299	0.010
729	1	69	GLY	HA3	H	3.573	0.000
730	1	69	GLY	C	C	174.089	0.000
731	1	69	GLY	CA	C	45.637	0.000
732	1	69	GLY	N	N	115.726	0.000
733	1	70	ARG	H	H	7.751	0.003
734	1	70	ARG	HA	H	4.643	0.000
735	1	70	ARG	HB2	H	1.647	0.010
736	1	70	ARG	HB3	H	1.647	0.010
737	1	70	ARG	HG2	H	1.497	0.004
738	1	70	ARG	HG3	H	1.497	0.004
739	1	70	ARG	HD2	H	3.450	0.000
740	1	70	ARG	HD3	H	3.345	0.007
741	1	70	ARG	HE	H	6.776	0.000
742	1	70	ARG	C	C	175.818	0.000
743	1	70	ARG	CA	C	57.657	0.000
744	1	70	ARG	CB	C	31.253	0.000
745	1	70	ARG	CG	C	28.806	0.000
746	1	70	ARG	CD	C	43.482	0.000
747	1	70	ARG	N	N	117.429	0.136
748	1	70	ARG	NE	N	81.660	0.000
749	1	71	PHE	H	H	7.687	0.002
750	1	71	PHE	HA	H	6.118	0.011
751	1	71	PHE	HB2	H	2.983	0.008
752	1	71	PHE	HB3	H	2.983	0.008
753	1	71	PHE	HD1	H	7.071	0.004
754	1	71	PHE	HD2	H	7.071	0.004
755	1	71	PHE	HE1	H	7.183	0.119
756	1	71	PHE	HE2	H	7.183	0.119
757	1	71	PHE	HZ	H	6.781	0.004
758	1	71	PHE	C	C	174.980	0.000
759	1	71	PHE	CA	C	52.493	0.000
760	1	71	PHE	CB	C	39.620	0.000
761	1	71	PHE	CD1	C	129.087	0.000
762	1	71	PHE	CE1	C	131.339	0.000
763	1	71	PHE	CZ	C	130.656	0.000
764	1	71	PHE	N	N	119.308	0.000
765	1	72	THR	H	H	8.844	0.002
766	1	72	THR	HA	H	5.128	0.005
767	1	72	THR	HB	H	3.908	0.000
768	1	72	THR	HG21	H	1.200	0.007
769	1	72	THR	HG22	H	1.200	0.007
770	1	72	THR	HG23	H	1.200	0.007
771	1	72	THR	C	C	173.887	0.000
772	1	72	THR	CA	C	61.325	0.000
773	1	72	THR	CB	C	72.694	0.000
774	1	72	THR	CG2	C	22.121	0.000
775	1	72	THR	N	N	112.588	0.000
776	1	73	ILE	H	H	9.240	0.003
777	1	73	ILE	HA	H	5.647	0.005
778	1	73	ILE	HB	H	1.548	0.012
779	1	73	ILE	HG12	H	2.012	0.000
780	1	73	ILE	HG13	H	1.071	0.002
781	1	73	ILE	HD11	H	0.892	0.016
782	1	73	ILE	HD12	H	0.892	0.016
783	1	73	ILE	HD13	H	0.892	0.016
784	1	73	ILE	C	C	172.440	0.000
785	1	73	ILE	CA	C	58.486	0.000
786	1	73	ILE	CB	C	41.813	0.000
787	1	73	ILE	CG1	C	30.020	0.000
788	1	73	ILE	CD1	C	15.345	0.000
789	1	73	ILE	N	N	129.606	0.000
790	1	74	SER	H	H	8.699	0.003
791	1	74	SER	HA	H	4.761	0.010
792	1	74	SER	HB2	H	3.799	0.000
793	1	74	SER	HB3	H	3.799	0.000
794	1	74	SER	C	C	172.537	0.000
795	1	74	SER	CA	C	57.347	0.000
796	1	74	SER	CB	C	65.662	0.000
797	1	74	SER	N	N	119.564	0.000
798	1	75	ARG	H	H	8.825	0.012
799	1	75	ARG	HA	H	5.134	0.013
800	1	75	ARG	HB2	H	1.962	0.002
801	1	75	ARG	HB3	H	1.657	0.008
802	1	75	ARG	HG2	H	1.723	0.013
803	1	75	ARG	HG3	H	1.604	0.000
804	1	75	ARG	HD2	H	3.079	0.006
805	1	75	ARG	HD3	H	3.079	0.006
806	1	75	ARG	HE	H	7.362	0.000
807	1	75	ARG	C	C	175.176	0.000
808	1	75	ARG	CA	C	55.152	0.000
809	1	75	ARG	CB	C	33.820	0.000
810	1	75	ARG	CG	C	26.977	0.000
811	1	75	ARG	CD	C	44.457	0.000
812	1	75	ARG	N	N	123.492	0.000
813	1	75	ARG	NE	N	85.315	0.000
814	1	76	ASP	H	H	8.319	0.008
815	1	76	ASP	HA	H	4.891	0.002
816	1	76	ASP	HB2	H	3.233	0.012
817	1	76	ASP	HB3	H	2.316	0.013
818	1	76	ASP	C	C	177.347	0.000
819	1	76	ASP	CA	C	53.216	0.000
820	1	76	ASP	CB	C	42.074	0.000
821	1	76	ASP	N	N	123.806	0.000
822	1	77	ASN	H	H	9.102	0.006
823	1	77	ASN	HA	H	4.623	0.000
824	1	77	ASN	HB2	H	2.901	0.004
825	1	77	ASN	HB3	H	2.792	0.010
826	1	77	ASN	HD21	H	6.988	0.003
827	1	77	ASN	HD22	H	7.659	0.008
828	1	77	ASN	C	C	176.137	0.000
829	1	77	ASN	CA	C	55.463	0.000
830	1	77	ASN	CB	C	38.815	0.000
831	1	77	ASN	N	N	123.636	0.000
832	1	77	ASN	ND2	N	112.755	0.000
833	1	78	ASP	H	H	8.483	0.002
834	1	78	ASP	HA	H	4.626	0.016
835	1	78	ASP	HB2	H	2.807	0.000
836	1	78	ASP	HB3	H	2.704	0.000
837	1	78	ASP	C	C	177.413	0.000
838	1	78	ASP	CA	C	56.454	0.000
839	1	78	ASP	CB	C	41.693	0.000
840	1	78	ASP	N	N	118.757	0.000
841	1	79	LYS	H	H	7.755	0.008
842	1	79	LYS	HA	H	4.319	0.000
843	1	79	LYS	HB2	H	1.949	0.015
844	1	79	LYS	HB3	H	1.585	0.005
845	1	79	LYS	HG2	H	1.463	0.007
846	1	79	LYS	HG3	H	1.384	0.000
847	1	79	LYS	HD2	H	1.621	0.000
848	1	79	LYS	HD3	H	1.621	0.000
849	1	79	LYS	HE2	H	2.973	0.000
850	1	79	LYS	HE3	H	2.973	0.000
851	1	79	LYS	C	C	176.283	0.000
852	1	79	LYS	CA	C	56.043	0.000
853	1	79	LYS	CB	C	33.950	0.000
854	1	79	LYS	CG	C	25.606	0.000
855	1	79	LYS	CD	C	29.243	0.000
856	1	79	LYS	CE	C	41.867	0.000
857	1	79	LYS	N	N	116.957	0.000
858	1	80	ASN	H	H	8.059	0.010
859	1	80	ASN	HA	H	4.640	0.000
860	1	80	ASN	HB2	H	3.100	0.002
861	1	80	ASN	HB3	H	2.959	0.002
862	1	80	ASN	HD21	H	6.698	0.008
863	1	80	ASN	HD22	H	7.450	0.005
864	1	80	ASN	N	N	116.433	0.000
865	1	80	ASN	ND2	N	113.140	0.000
866	1	81	THR	H	H	7.691	0.009
867	1	81	THR	HA	H	5.669	0.012
868	1	81	THR	HB	H	4.191	0.017
869	1	81	THR	HG21	H	1.100	0.010
870	1	81	THR	HG22	H	1.100	0.010
871	1	81	THR	HG23	H	1.100	0.010
872	1	81	THR	C	C	175.113	0.000
873	1	81	THR	CA	C	59.422	0.000
874	1	81	THR	CB	C	72.629	0.000
875	1	81	THR	CG2	C	21.474	0.000
876	1	81	THR	N	N	106.653	0.000
877	1	82	VAL	H	H	9.088	0.004
878	1	82	VAL	HA	H	5.268	0.006
879	1	82	VAL	HB	H	2.106	0.005
880	1	82	VAL	HG11	H	0.985	0.008
881	1	82	VAL	HG12	H	0.985	0.008
882	1	82	VAL	HG13	H	0.985	0.008
883	1	82	VAL	HG21	H	0.991	0.000
884	1	82	VAL	HG22	H	0.991	0.000
885	1	82	VAL	HG23	H	0.991	0.000
886	1	82	VAL	C	C	173.457	0.000
887	1	82	VAL	CA	C	59.960	0.000
888	1	82	VAL	CB	C	34.788	0.000
889	1	82	VAL	CG1	C	22.516	0.000
890	1	82	VAL	CG2	C	21.965	0.000
891	1	82	VAL	N	N	118.816	0.000
892	1	83	ASP	H	H	9.235	0.009
893	1	83	ASP	HA	H	5.841	0.008
894	1	83	ASP	HB2	H	2.601	0.000
895	1	83	ASP	HB3	H	2.444	0.000
896	1	83	ASP	C	C	174.820	0.000
897	1	83	ASP	CA	C	53.061	0.000
898	1	83	ASP	CB	C	43.916	0.000
899	1	83	ASP	N	N	129.606	0.000
900	1	84	LEU	H	H	9.054	0.001
901	1	84	LEU	HA	H	4.838	0.010
902	1	84	LEU	HB2	H	0.982	0.000
903	1	84	LEU	HB3	H	0.021	0.008
904	1	84	LEU	HG	H	0.675	0.000
905	1	84	LEU	HD11	H	0.396	0.016
906	1	84	LEU	HD12	H	0.396	0.016
907	1	84	LEU	HD13	H	0.396	0.016
908	1	84	LEU	HD21	H	0.796	0.011
909	1	84	LEU	HD22	H	0.796	0.011
910	1	84	LEU	HD23	H	0.796	0.011
911	1	84	LEU	C	C	174.134	0.000
912	1	84	LEU	CA	C	52.815	0.000
913	1	84	LEU	CB	C	44.468	0.000
914	1	84	LEU	CG	C	26.977	0.000
915	1	84	LEU	CD1	C	26.489	0.000
916	1	84	LEU	CD2	C	23.731	0.000
917	1	84	LEU	N	N	122.995	0.000
918	1	85	GLN	H	H	9.046	0.005
919	1	85	GLN	HA	H	4.210	0.007
920	1	85	GLN	HB2	H	2.068	0.008
921	1	85	GLN	HB3	H	1.967	0.004
922	1	85	GLN	HG2	H	2.427	0.005
923	1	85	GLN	HG3	H	2.427	0.005
924	1	85	GLN	HE21	H	7.074	0.005
925	1	85	GLN	HE22	H	6.964	0.015
926	1	85	GLN	C	C	174.461	0.000
927	1	85	GLN	CA	C	54.945	0.000
928	1	85	GLN	CB	C	29.105	0.000
929	1	85	GLN	CG	C	33.661	0.000
930	1	85	GLN	N	N	128.497	0.000
931	1	85	GLN	NE2	N	113.344	0.000
932	1	86	MET	H	H	8.795	0.005
933	1	86	MET	HA	H	3.951	0.005
934	1	86	MET	HB2	H	1.747	0.010
935	1	86	MET	HB3	H	0.991	0.000
936	1	86	MET	HG2	H	1.512	0.020
937	1	86	MET	HG3	H	0.096	0.016
938	1	86	MET	C	C	173.158	0.000
939	1	86	MET	CA	C	55.092	0.000
940	1	86	MET	CB	C	35.236	0.000
941	1	86	MET	CG	C	30.130	0.000
942	1	86	MET	N	N	127.321	0.000
943	1	87	ASN	H	H	7.559	0.007
944	1	87	ASN	HA	H	5.121	0.012
945	1	87	ASN	HB2	H	3.146	0.011
946	1	87	ASN	HB3	H	2.705	0.008
947	1	87	ASN	HD21	H	7.430	0.015
948	1	87	ASN	HD22	H	6.888	0.011
949	1	87	ASN	C	C	173.371	0.000
950	1	87	ASN	CA	C	51.327	0.000
951	1	87	ASN	CB	C	41.366	0.000
952	1	87	ASN	N	N	119.576	0.000
953	1	87	ASN	ND2	N	113.668	0.000
954	1	88	ASN	H	H	8.610	0.005
955	1	88	ASN	HA	H	4.065	0.010
956	1	88	ASN	HB2	H	3.043	0.010
957	1	88	ASN	HB3	H	2.556	0.014
958	1	88	ASN	HD21	H	6.872	0.002
959	1	88	ASN	HD22	H	7.318	0.009
960	1	88	ASN	C	C	176.000	0.000
961	1	88	ASN	CA	C	53.436	0.000
962	1	88	ASN	CB	C	37.562	0.000
963	1	88	ASN	N	N	114.508	0.000
964	1	88	ASN	ND2	N	110.311	0.000
965	1	89	LEU	H	H	8.150	0.005
966	1	89	LEU	HA	H	3.951	0.005
967	1	89	LEU	HB2	H	1.410	0.005
968	1	89	LEU	HB3	H	1.327	0.003
969	1	89	LEU	HG	H	1.330	0.000
970	1	89	LEU	HD11	H	0.925	0.012
971	1	89	LEU	HD12	H	0.925	0.012
972	1	89	LEU	HD13	H	0.925	0.012
973	1	89	LEU	HD21	H	0.554	0.010
974	1	89	LEU	HD22	H	0.554	0.010
975	1	89	LEU	HD23	H	0.554	0.010
976	1	89	LEU	C	C	177.094	0.000
977	1	89	LEU	CA	C	57.028	0.000
978	1	89	LEU	CB	C	43.021	0.000
979	1	89	LEU	CG	C	28.595	0.000
980	1	89	LEU	CD1	C	24.834	0.000
981	1	89	LEU	CD2	C	27.372	0.000
982	1	89	LEU	N	N	117.460	0.000
983	1	90	LYS	H	H	9.653	0.001
984	1	90	LYS	HA	H	4.879	0.000
985	1	90	LYS	HB2	H	2.169	0.000
986	1	90	LYS	HB3	H	1.494	0.006
987	1	90	LYS	HG2	H	1.582	0.000
988	1	90	LYS	HG3	H	1.582	0.000
989	1	90	LYS	HD2	H	1.684	0.000
990	1	90	LYS	HD3	H	1.684	0.000
991	1	90	LYS	HE2	H	2.895	0.000
992	1	90	LYS	HE3	H	2.895	0.000
993	1	90	LYS	C	C	175.111	0.000
994	1	90	LYS	CA	C	53.520	0.000
995	1	90	LYS	CB	C	34.746	0.000
996	1	90	LYS	CG	C	25.035	0.000
997	1	90	LYS	CD	C	29.890	0.000
998	1	90	LYS	CE	C	42.514	0.000
999	1	90	LYS	N	N	122.447	0.000
1000	1	91	PRO	HA	H	4.329	0.000
1001	1	91	PRO	HB2	H	1.963	0.000
1002	1	91	PRO	HB3	H	2.454	0.000
1003	1	91	PRO	HG2	H	2.297	0.002
1004	1	91	PRO	HG3	H	1.818	0.002
1005	1	91	PRO	HD2	H	3.858	0.000
1006	1	91	PRO	HD3	H	3.652	0.000
1007	1	91	PRO	C	C	179.062	0.000
1008	1	91	PRO	CA	C	66.462	0.000
1009	1	91	PRO	CB	C	32.156	0.000
1010	1	91	PRO	CG	C	28.475	0.000
1011	1	91	PRO	CD	C	50.433	0.000
1012	1	92	GLU	H	H	9.252	0.001
1013	1	92	GLU	HA	H	4.339	0.000
1014	1	92	GLU	HB2	H	2.108	0.003
1015	1	92	GLU	HB3	H	2.108	0.003
1016	1	92	GLU	HG2	H	2.210	0.000
1017	1	92	GLU	HG3	H	2.210	0.000
1018	1	92	GLU	C	C	176.270	0.000
1019	1	92	GLU	CA	C	58.800	0.000
1020	1	92	GLU	CB	C	28.613	0.000
1021	1	92	GLU	CG	C	36.861	0.000
1022	1	92	GLU	N	N	115.004	0.000
1023	1	93	ASP	H	H	8.758	0.005
1024	1	93	ASP	HA	H	4.783	0.013
1025	1	93	ASP	HB2	H	3.099	0.009
1026	1	93	ASP	HB3	H	2.807	0.008
1027	1	93	ASP	C	C	176.722	0.000
1028	1	93	ASP	CA	C	55.306	0.000
1029	1	93	ASP	CB	C	42.529	0.000
1030	1	93	ASP	N	N	118.834	0.000
1031	1	94	THR	H	H	7.911	0.003
1032	1	94	THR	HA	H	4.368	0.008
1033	1	94	THR	HB	H	4.358	0.000
1034	1	94	THR	HG21	H	1.558	0.009
1035	1	94	THR	HG22	H	1.558	0.009
1036	1	94	THR	HG23	H	1.558	0.009
1037	1	94	THR	C	C	174.399	0.000
1038	1	94	THR	CA	C	65.236	0.000
1039	1	94	THR	CB	C	70.449	0.000
1040	1	94	THR	CG2	C	21.855	0.000
1041	1	94	THR	N	N	120.673	0.000
1042	1	95	ALA	H	H	9.200	0.006
1043	1	95	ALA	HA	H	4.486	0.000
1044	1	95	ALA	HB1	H	1.186	0.009
1045	1	95	ALA	HB2	H	1.186	0.009
1046	1	95	ALA	HB3	H	1.186	0.009
1047	1	95	ALA	C	C	175.738	0.000
1048	1	95	ALA	CA	C	53.047	0.000
1049	1	95	ALA	CB	C	21.600	0.000
1050	1	95	ALA	N	N	128.487	0.000
1051	1	96	ASP	H	H	7.578	0.004
1052	1	96	ASP	HA	H	5.249	0.005
1053	1	96	ASP	HB2	H	2.699	0.000
1054	1	96	ASP	HB3	H	2.154	0.009
1055	1	96	ASP	C	C	175.326	0.000
1056	1	96	ASP	CA	C	54.781	0.000
1057	1	96	ASP	CB	C	42.708	0.000
1058	1	96	ASP	N	N	117.950	0.000
1059	1	97	TYR	H	H	9.526	0.004
1060	1	97	TYR	HA	H	5.283	0.008
1061	1	97	TYR	HB2	H	2.974	0.010
1062	1	97	TYR	HB3	H	2.935	0.000
1063	1	97	TYR	HD1	H	7.298	0.000
1064	1	97	TYR	HD2	H	7.298	0.000
1065	1	97	TYR	HE1	H	7.011	0.200
1066	1	97	TYR	HE2	H	7.011	0.200
1067	1	97	TYR	C	C	174.820	0.000
1068	1	97	TYR	CA	C	57.903	0.000
1069	1	97	TYR	CB	C	40.918	0.000
1070	1	97	TYR	CE1	C	122.800	5.798
1071	1	97	TYR	N	N	124.548	0.000
1072	1	98	TYR	H	H	9.577	0.002
1073	1	98	TYR	HA	H	5.208	0.006
1074	1	98	TYR	HB2	H	3.146	0.000
1075	1	98	TYR	HB3	H	2.715	0.004
1076	1	98	TYR	HD1	H	6.865	0.010
1077	1	98	TYR	HD2	H	6.865	0.010
1078	1	98	TYR	HE1	H	6.631	0.018
1079	1	98	TYR	HE2	H	6.631	0.018
1080	1	98	TYR	C	C	174.725	0.000
1081	1	98	TYR	CA	C	56.925	0.000
1082	1	98	TYR	CB	C	43.916	0.000
1083	1	98	TYR	CD1	C	132.789	0.000
1084	1	98	TYR	CE1	C	118.701	0.000
1085	1	98	TYR	N	N	118.562	0.000
1086	1	99	CYS	H	H	10.600	0.001
1087	1	99	CYS	HA	H	4.307	0.015
1088	1	99	CYS	HB2	H	2.648	0.000
1089	1	99	CYS	HB3	H	2.085	0.003
1090	1	99	CYS	C	C	171.543	0.000
1091	1	99	CYS	CA	C	53.287	0.000
1092	1	99	CYS	CB	C	42.529	0.000
1093	1	99	CYS	N	N	126.161	0.000
1094	1	100	ARG	H	H	8.467	0.002
1095	1	100	ARG	HA	H	4.516	0.018
1096	1	100	ARG	HB2	H	0.654	0.004
1097	1	100	ARG	HB3	H	0.463	0.005
1098	1	100	ARG	HG2	H	0.446	0.000
1099	1	100	ARG	HG3	H	-0.319	0.013
1100	1	100	ARG	HD2	H	2.063	0.012
1101	1	100	ARG	HD3	H	1.873	0.001
1102	1	100	ARG	HE	H	6.527	0.000
1103	1	100	ARG	C	C	174.289	0.000
1104	1	100	ARG	CA	C	53.487	0.000
1105	1	100	ARG	CB	C	36.086	0.000
1106	1	100	ARG	CG	C	26.977	0.000
1107	1	100	ARG	CD	C	44.365	0.000
1108	1	100	ARG	N	N	125.380	0.000
1109	1	100	ARG	NE	N	83.685	0.000
1110	1	101	ALA	H	H	8.604	0.000
1111	1	101	ALA	HA	H	5.085	0.006
1112	1	101	ALA	HB1	H	1.287	0.007
1113	1	101	ALA	HB2	H	1.287	0.007
1114	1	101	ALA	HB3	H	1.287	0.007
1115	1	101	ALA	CA	C	50.305	0.000
1116	1	101	ALA	CB	C	24.362	0.000
1117	1	101	ALA	N	N	125.184	0.000
1118	1	102	GLN	H	H	8.817	0.006
1119	1	102	GLN	HA	H	5.379	0.010
1120	1	102	GLN	HB2	H	2.144	0.008
1121	1	102	GLN	HB3	H	1.600	0.000
1122	1	102	GLN	HG2	H	2.196	0.000
1123	1	102	GLN	HG3	H	2.019	0.006
1124	1	102	GLN	HE21	H	6.072	0.002
1125	1	102	GLN	HE22	H	7.371	0.002
1126	1	102	GLN	C	C	174.441	0.034
1127	1	102	GLN	CA	C	54.548	0.000
1128	1	102	GLN	CB	C	33.714	0.000
1129	1	102	GLN	CG	C	35.278	0.000
1130	1	102	GLN	N	N	120.616	0.000
1131	1	102	GLN	NE2	N	110.783	0.000
1132	1	103	GLN	H	H	9.434	0.006
1133	1	103	GLN	HA	H	5.065	0.009
1134	1	103	GLN	HB2	H	1.846	0.006
1135	1	103	GLN	HB3	H	2.424	0.001
1136	1	103	GLN	HG2	H	2.406	0.000
1137	1	103	GLN	HG3	H	2.110	0.005
1138	1	103	GLN	HE21	H	6.812	0.003
1139	1	103	GLN	HE22	H	7.461	0.003
1140	1	103	GLN	C	C	174.847	0.000
1141	1	103	GLN	CA	C	54.099	0.000
1142	1	103	GLN	CB	C	34.021	0.000
1143	1	103	GLN	CG	C	33.775	0.000
1144	1	103	GLN	N	N	126.708	0.000
1145	1	103	GLN	NE2	N	112.259	0.000
1146	1	104	LYS	H	H	9.253	0.001
1147	1	104	LYS	HA	H	4.345	0.010
1148	1	104	LYS	HB2	H	1.816	0.000
1149	1	104	LYS	HB3	H	1.198	0.000
1150	1	104	LYS	HG2	H	1.001	0.000
1151	1	104	LYS	HG3	H	0.692	0.000
1152	1	104	LYS	HD2	H	1.414	0.000
1153	1	104	LYS	HD3	H	1.364	0.000
1154	1	104	LYS	HE2	H	2.768	0.000
1155	1	104	LYS	HE3	H	2.768	0.000
1156	1	104	LYS	C	C	175.738	0.000
1157	1	104	LYS	CA	C	56.723	0.000
1158	1	104	LYS	CB	C	33.804	0.000
1159	1	104	LYS	CG	C	25.165	0.000
1160	1	104	LYS	CD	C	29.799	0.000
1161	1	104	LYS	CE	C	42.191	0.000
1162	1	104	LYS	N	N	129.090	0.000
1163	1	105	ILE	H	H	8.424	0.014
1164	1	105	ILE	HA	H	4.309	0.000
1165	1	105	ILE	HB	H	1.713	0.005
1166	1	105	ILE	HG12	H	0.737	0.007
1167	1	105	ILE	HG13	H	1.080	0.000
1168	1	105	ILE	HG21	H	0.736	0.000
1169	1	105	ILE	HG22	H	0.736	0.000
1170	1	105	ILE	HG23	H	0.736	0.000
1171	1	105	ILE	HD11	H	0.697	0.005
1172	1	105	ILE	HD12	H	0.697	0.005
1173	1	105	ILE	HD13	H	0.697	0.005
1174	1	105	ILE	C	C	175.339	0.000
1175	1	105	ILE	CA	C	60.885	0.000
1176	1	105	ILE	CB	C	39.038	0.000
1177	1	105	ILE	CG1	C	27.300	0.000
1178	1	105	ILE	CG2	C	18.103	0.000
1179	1	105	ILE	CD1	C	13.469	0.000
1180	1	105	ILE	N	N	125.224	0.070
1181	1	106	GLY	H	H	7.879	0.000
1182	1	106	GLY	N	N	111.316	0.000
1183	1	107	ARG	HA	H	3.962	0.000
1184	1	107	ARG	HB2	H	1.723	0.000
1185	1	107	ARG	HB3	H	1.723	0.000
1186	1	107	ARG	HG2	H	1.518	0.000
1187	1	107	ARG	HG3	H	1.623	0.011
1188	1	107	ARG	HD2	H	3.183	0.004
1189	1	107	ARG	HD3	H	3.183	0.004
1190	1	107	ARG	CA	C	59.023	0.000
1191	1	107	ARG	CB	C	30.537	0.000
1192	1	107	ARG	CG	C	26.977	0.000
1193	1	107	ARG	CD	C	43.486	0.000
1194	1	108	ASP	H	H	7.294	0.000
1195	1	108	ASP	HA	H	4.513	0.000
1196	1	108	ASP	HB2	H	2.729	0.000
1197	1	108	ASP	HB3	H	2.729	0.000
1198	1	108	ASP	C	C	174.661	0.000
1199	1	108	ASP	CA	C	54.486	0.000
1200	1	108	ASP	CB	C	41.768	0.000
1201	1	109	THR	H	H	6.891	0.009
1202	1	109	THR	HA	H	4.555	0.000
1203	1	109	THR	HB	H	3.714	0.004
1204	1	109	THR	HG21	H	1.090	0.000
1205	1	109	THR	HG22	H	1.090	0.000
1206	1	109	THR	HG23	H	1.090	0.000
1207	1	109	THR	C	C	172.307	0.000
1208	1	109	THR	CA	C	61.613	0.000
1209	1	109	THR	CB	C	71.165	0.000
1210	1	109	THR	CG2	C	21.797	0.000
1211	1	109	THR	N	N	113.181	0.105
1212	1	110	PHE	H	H	8.799	0.004
1213	1	110	PHE	HA	H	5.406	0.009
1214	1	110	PHE	HB2	H	2.778	0.000
1215	1	110	PHE	HB3	H	2.719	0.000
1216	1	110	PHE	HD1	H	6.857	0.005
1217	1	110	PHE	HD2	H	6.857	0.005
1218	1	110	PHE	C	C	175.219	0.000
1219	1	110	PHE	CA	C	56.374	0.000
1220	1	110	PHE	CB	C	43.334	0.000
1221	1	110	PHE	CD1	C	131.712	0.000
1222	1	110	PHE	N	N	123.492	0.000
1223	1	111	ARG	H	H	9.069	0.006
1224	1	111	ARG	HA	H	4.574	0.000
1225	1	111	ARG	HB2	H	1.643	0.017
1226	1	111	ARG	HB3	H	1.643	0.017
1227	1	111	ARG	HG2	H	1.477	0.005
1228	1	111	ARG	HG3	H	1.306	0.010
1229	1	111	ARG	HD2	H	3.220	0.000
1230	1	111	ARG	HD3	H	3.136	0.000
1231	1	111	ARG	C	C	173.797	0.000
1232	1	111	ARG	CA	C	55.221	0.000
1233	1	111	ARG	CB	C	33.938	0.000
1234	1	111	ARG	CG	C	27.482	0.000
1235	1	111	ARG	CD	C	43.813	0.000
1236	1	111	ARG	N	N	121.707	0.000
1237	1	112	ASP	H	H	8.351	0.007
1238	1	112	ASP	HA	H	5.263	0.008
1239	1	112	ASP	HB2	H	2.449	0.005
1240	1	112	ASP	HB3	H	2.097	0.006
1241	1	112	ASP	C	C	174.900	0.000
1242	1	112	ASP	CA	C	54.023	0.000
1243	1	112	ASP	CB	C	44.780	0.000
1244	1	112	ASP	N	N	123.422	0.000
1245	1	113	TYR	H	H	8.757	0.003
1246	1	113	TYR	HA	H	4.731	0.000
1247	1	113	TYR	HB2	H	2.944	0.009
1248	1	113	TYR	HB3	H	2.409	0.004
1249	1	113	TYR	HD1	H	7.009	0.011
1250	1	113	TYR	HD2	H	7.009	0.011
1251	1	113	TYR	HE1	H	6.714	0.010
1252	1	113	TYR	HE2	H	6.714	0.010
1253	1	113	TYR	C	C	173.172	0.000
1254	1	113	TYR	CA	C	57.028	0.000
1255	1	113	TYR	CB	C	41.435	0.000
1256	1	113	TYR	CD1	C	133.806	0.000
1257	1	113	TYR	CE1	C	117.365	0.000
1258	1	113	TYR	N	N	120.463	0.000
1259	1	114	TRP	H	H	8.626	0.002
1260	1	114	TRP	HA	H	5.406	0.021
1261	1	114	TRP	HB2	H	3.400	0.005
1262	1	114	TRP	HB3	H	2.868	0.009
1263	1	114	TRP	HD1	H	7.027	0.000
1264	1	114	TRP	HE1	H	9.946	0.000
1265	1	114	TRP	HE3	H	7.304	0.004
1266	1	114	TRP	HZ2	H	6.853	0.000
1267	1	114	TRP	HZ3	H	6.166	0.006
1268	1	114	TRP	HH2	H	5.485	0.000
1269	1	114	TRP	C	C	178.689	0.000
1270	1	114	TRP	CA	C	55.889	0.000
1271	1	114	TRP	CB	C	33.948	0.000
1272	1	114	TRP	CD1	C	126.705	0.000
1273	1	114	TRP	CE3	C	120.397	0.000
1274	1	114	TRP	CZ2	C	113.839	0.000
1275	1	114	TRP	CZ3	C	120.397	0.000
1276	1	114	TRP	CH2	C	123.175	0.000
1277	1	114	TRP	N	N	119.727	0.000
1278	1	114	TRP	NE1	N	128.587	0.000
1279	1	115	GLY	H	H	9.139	0.004
1280	1	115	GLY	HA2	H	4.731	0.016
1281	1	115	GLY	HA3	H	4.403	0.013
1282	1	115	GLY	C	C	173.770	0.000
1283	1	115	GLY	CA	C	44.506	0.000
1284	1	115	GLY	N	N	110.324	0.000
1285	1	116	GLN	H	H	8.670	0.007
1286	1	116	GLN	HA	H	4.484	0.000
1287	1	116	GLN	HB2	H	2.391	0.011
1288	1	116	GLN	HB3	H	2.274	0.004
1289	1	116	GLN	HG2	H	2.668	0.019
1290	1	116	GLN	HG3	H	2.668	0.019
1291	1	116	GLN	HE21	H	7.810	0.000
1292	1	116	GLN	HE22	H	7.021	0.006
1293	1	116	GLN	C	C	177.294	0.000
1294	1	116	GLN	CA	C	57.212	0.000
1295	1	116	GLN	CB	C	30.448	0.000
1296	1	116	GLN	CG	C	34.765	0.000
1297	1	116	GLN	N	N	116.908	0.000
1298	1	116	GLN	NE2	N	112.583	0.000
1299	1	117	GLY	H	H	9.491	0.000
1300	1	117	GLY	HA2	H	3.608	0.008
1301	1	117	GLY	HA3	H	3.583	0.000
1302	1	117	GLY	C	C	173.836	0.000
1303	1	117	GLY	CA	C	44.470	0.000
1304	1	117	GLY	N	N	113.222	0.000
1305	1	118	THR	H	H	9.115	0.002
1306	1	118	THR	HA	H	4.643	0.010
1307	1	118	THR	HB	H	3.907	0.010
1308	1	118	THR	HG21	H	1.125	0.010
1309	1	118	THR	HG22	H	1.125	0.010
1310	1	118	THR	HG23	H	1.125	0.010
1311	1	118	THR	C	C	172.726	0.000
1312	1	118	THR	CA	C	61.002	0.000
1313	1	118	THR	CB	C	71.300	0.000
1314	1	118	THR	CG2	C	20.531	0.000
1315	1	118	THR	N	N	118.359	0.000
1316	1	119	GLN	H	H	8.379	0.001
1317	1	119	GLN	HA	H	4.741	0.008
1318	1	119	GLN	HB2	H	2.077	0.009
1319	1	119	GLN	HB3	H	2.077	0.009
1320	1	119	GLN	HG2	H	2.393	0.010
1321	1	119	GLN	HG3	H	2.262	0.010
1322	1	119	GLN	HE21	H	6.655	0.009
1323	1	119	GLN	HE22	H	7.821	0.008
1324	1	119	GLN	C	C	175.858	0.000
1325	1	119	GLN	CA	C	57.899	0.000
1326	1	119	GLN	CB	C	30.720	0.000
1327	1	119	GLN	CG	C	35.069	0.000
1328	1	119	GLN	N	N	129.339	0.000
1329	1	119	GLN	NE2	N	112.491	0.000
1330	1	120	VAL	H	H	8.664	0.002
1331	1	120	VAL	HA	H	4.541	0.012
1332	1	120	VAL	HB	H	2.336	0.016
1333	1	120	VAL	HG11	H	0.493	0.014
1334	1	120	VAL	HG12	H	0.493	0.014
1335	1	120	VAL	HG13	H	0.493	0.014
1336	1	120	VAL	HG21	H	0.579	0.000
1337	1	120	VAL	HG22	H	0.579	0.000
1338	1	120	VAL	HG23	H	0.579	0.000
1339	1	120	VAL	C	C	174.874	0.000
1340	1	120	VAL	CA	C	62.069	0.000
1341	1	120	VAL	CB	C	34.340	0.000
1342	1	120	VAL	CG1	C	22.627	0.000
1343	1	120	VAL	CG2	C	20.089	0.000
1344	1	120	VAL	N	N	126.947	0.000
1345	1	121	THR	H	H	8.480	0.002
1346	1	121	THR	HA	H	4.589	0.005
1347	1	121	THR	HB	H	3.886	0.008
1348	1	121	THR	HG21	H	1.127	0.005
1349	1	121	THR	HG22	H	1.127	0.005
1350	1	121	THR	HG23	H	1.127	0.005
1351	1	121	THR	C	C	171.876	0.000
1352	1	121	THR	CA	C	62.241	0.000
1353	1	121	THR	CB	C	71.031	0.000
1354	1	121	THR	CG2	C	21.855	0.000
1355	1	121	THR	N	N	124.560	0.000
1356	1	122	VAL	H	H	8.424	0.003
1357	1	122	VAL	HA	H	4.891	0.012
1358	1	122	VAL	HB	H	1.914	0.007
1359	1	122	VAL	HG11	H	0.454	0.011
1360	1	122	VAL	HG12	H	0.454	0.011
1361	1	122	VAL	HG13	H	0.454	0.011
1362	1	122	VAL	HG21	H	0.657	0.011
1363	1	122	VAL	HG22	H	0.657	0.011
1364	1	122	VAL	HG23	H	0.657	0.011
1365	1	122	VAL	C	C	176.030	0.000
1366	1	122	VAL	CA	C	59.987	0.000
1367	1	122	VAL	CB	C	32.282	0.000
1368	1	122	VAL	CG1	C	20.641	0.000
1369	1	122	VAL	CG2	C	20.942	0.000
1370	1	122	VAL	N	N	127.803	0.000
1371	1	123	SER	H	H	8.726	0.006
1372	1	123	SER	HA	H	4.574	0.000
1373	1	123	SER	HB2	H	3.897	0.020
1374	1	123	SER	HB3	H	3.755	0.005
1375	1	123	SER	C	C	173.491	0.000
1376	1	123	SER	CA	C	57.777	0.000
1377	1	123	SER	CB	C	65.394	0.000
1378	1	123	SER	N	N	122.998	0.000
1379	1	124	SER	H	H	8.153	0.000
1380	1	124	SER	C	C	179.329	0.000
1381	1	124	SER	N	N	122.027	0.000

Release date

2023-10-23

Citation

Structural basis for selectivity and antagonism in extracellular GPCR-nanobodies
Schlimgen, R.R., Peterson, F.C., Heukers, R., Smit, M.J., McCorvy, J.D., Volkman, B.F.
Nat. Commun. (2024), 15, 4611-4611, PubMed 38816420 , DOI 10.1038/s41467-024-49000-x , Abstract