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BMRB: 31060

8FA3

Structure of N-terminal of Schistosoma japonicum asparaginyl-tRNA synthetase

Authors

Peck, Y., Daly, N.L., Mobli, M.

Assembly

Asparagine--tRNA ligase

Entity

1. Asparagine--tRNA ligase (polymer, Thiol state: not present), 120 monomers, 13551.05 Da Detail

MQIYTSEKRG SDTAGNGTEE APLKTVLQAI VKLDGKIEAD TRIWVDGTGD EMWDVVSKSK LKKATKQYHI QTKKQEKAPH EKIVSYENGD NVNLSEAINV QLTLDTKLPE AKELHHHHHH

Formula weight

13551.05 Da

Source organism

Schistosoma japonicum

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 632, ¹³C: 421, ¹⁵N: 120 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	2	GLN	HA	H	5.329	0.020	1
2	1	2	GLN	HB2	H	1.852	0.020	2
3	1	2	GLN	HB3	H	2.017	0.020	2
4	1	2	GLN	HG2	H	2.458	0.020	2
5	1	2	GLN	HG3	H	2.270	0.020	2
6	1	2	GLN	HE21	H	6.857	0.020	2
7	1	2	GLN	HE22	H	7.524	0.020	2
8	1	2	GLN	C	C	174.327	0.400	1
9	1	2	GLN	CA	C	53.968	0.400	1
10	1	2	GLN	CB	C	30.943	0.400	1
11	1	2	GLN	CG	C	33.413	0.400	1
12	1	2	GLN	NE2	N	111.993	0.400	1
13	1	3	ILE	H	H	8.668	0.020	1
14	1	3	ILE	HA	H	4.495	0.020	1
15	1	3	ILE	HB	H	1.579	0.020	1
16	1	3	ILE	HG12	H	1.367	0.020	2
17	1	3	ILE	HG13	H	1.043	0.020	2
18	1	3	ILE	HG21	H	0.777	0.020	1
19	1	3	ILE	HG22	H	0.777	0.020	1
20	1	3	ILE	HG23	H	0.777	0.020	1
21	1	3	ILE	HD11	H	0.758	0.020	1
22	1	3	ILE	HD12	H	0.758	0.020	1
23	1	3	ILE	HD13	H	0.758	0.020	1
24	1	3	ILE	C	C	173.181	0.400	1
25	1	3	ILE	CA	C	59.367	0.400	1
26	1	3	ILE	CB	C	40.692	0.400	1
27	1	3	ILE	CG1	C	27.828	0.400	1
28	1	3	ILE	CG2	C	18.691	0.400	1
29	1	3	ILE	CD1	C	12.830	0.400	1
30	1	3	ILE	N	N	122.066	0.400	1
31	1	4	TYR	H	H	9.108	0.020	1
32	1	4	TYR	HA	H	4.001	0.020	1
33	1	4	TYR	HB2	H	2.058	0.020	2
34	1	4	TYR	HB3	H	1.757	0.020	2
35	1	4	TYR	HD1	H	7.029	0.020	1
36	1	4	TYR	HD2	H	7.029	0.020	1
37	1	4	TYR	HE1	H	6.721	0.020	1
38	1	4	TYR	HE2	H	6.721	0.020	1
39	1	4	TYR	C	C	174.513	0.400	1
40	1	4	TYR	CA	C	59.012	0.400	1
41	1	4	TYR	CB	C	37.959	0.400	1
42	1	4	TYR	CD1	C	133.195	0.400	3
43	1	4	TYR	CE2	C	118.255	0.400	3
44	1	4	TYR	N	N	126.575	0.400	1
45	1	5	THR	H	H	7.854	0.020	1
46	1	5	THR	HA	H	4.759	0.020	1
47	1	5	THR	HB	H	3.256	0.020	1
48	1	5	THR	HG21	H	0.877	0.020	1
49	1	5	THR	HG22	H	0.877	0.020	1
50	1	5	THR	HG23	H	0.877	0.020	1
51	1	5	THR	C	C	170.033	0.400	1
52	1	5	THR	CA	C	58.562	0.400	1
53	1	5	THR	CB	C	70.608	0.400	1
54	1	5	THR	CG2	C	22.804	0.400	1
55	1	5	THR	N	N	116.370	0.400	1
56	1	6	SER	H	H	9.004	0.020	1
57	1	6	SER	HA	H	5.041	0.020	1
58	1	6	SER	HB2	H	3.267	0.020	2
59	1	6	SER	HB3	H	4.024	0.020	2
60	1	6	SER	C	C	176.331	0.400	1
61	1	6	SER	CA	C	55.801	0.400	1
62	1	6	SER	CB	C	65.715	0.400	1
63	1	6	SER	N	N	113.251	0.400	1
64	1	7	GLU	H	H	9.130	0.020	1
65	1	7	GLU	HA	H	4.175	0.020	1
66	1	7	GLU	HB2	H	2.086	0.020	2
67	1	7	GLU	HB3	H	1.994	0.020	2
68	1	7	GLU	HG2	H	2.415	0.020	2
69	1	7	GLU	HG3	H	2.257	0.020	2
70	1	7	GLU	C	C	180.089	0.400	1
71	1	7	GLU	CA	C	59.757	0.400	1
72	1	7	GLU	CB	C	29.440	0.400	1
73	1	7	GLU	CG	C	37.103	0.400	1
74	1	7	GLU	N	N	134.494	0.400	1
75	1	8	LYS	H	H	9.641	0.020	1
76	1	8	LYS	HA	H	4.022	0.020	1
77	1	8	LYS	HB2	H	1.649	0.020	2
78	1	8	LYS	HB3	H	1.649	0.020	2
79	1	8	LYS	HG2	H	1.334	0.020	2
80	1	8	LYS	HG3	H	1.334	0.020	2
81	1	8	LYS	HD2	H	1.472	0.020	2
82	1	8	LYS	HD3	H	1.472	0.020	2
83	1	8	LYS	HE2	H	2.829	0.020	2
84	1	8	LYS	HE3	H	2.829	0.020	2
85	1	8	LYS	C	C	179.101	0.400	1
86	1	8	LYS	CA	C	59.802	0.400	1
87	1	8	LYS	CB	C	33.928	0.400	1
88	1	8	LYS	CG	C	26.030	0.400	1
89	1	8	LYS	CE	C	42.179	0.400	1
90	1	8	LYS	N	N	120.256	0.400	1
91	1	9	ARG	H	H	8.702	0.020	1
92	1	9	ARG	HA	H	4.679	0.020	1
93	1	9	ARG	HB2	H	1.731	0.020	2
94	1	9	ARG	HB3	H	1.643	0.020	2
95	1	9	ARG	HG2	H	1.444	0.020	2
96	1	9	ARG	HG3	H	1.299	0.020	2
97	1	9	ARG	HD2	H	3.045	0.020	2
98	1	9	ARG	HD3	H	3.121	0.020	2
99	1	9	ARG	C	C	177.471	0.400	1
100	1	9	ARG	CA	C	55.797	0.400	1
101	1	9	ARG	CB	C	32.729	0.400	1
102	1	9	ARG	CG	C	26.893	0.400	1
103	1	9	ARG	CD	C	42.728	0.400	1
104	1	9	ARG	N	N	113.857	0.400	1
105	1	10	GLY	H	H	8.564	0.020	1
106	1	10	GLY	HA2	H	3.983	0.020	2
107	1	10	GLY	HA3	H	3.953	0.020	2
108	1	10	GLY	C	C	172.961	0.400	1
109	1	10	GLY	CA	C	44.781	0.400	1
110	1	10	GLY	N	N	109.069	0.400	1
111	1	11	SER	H	H	7.758	0.020	1
112	1	11	SER	HA	H	4.712	0.020	1
113	1	11	SER	HB2	H	3.476	0.020	2
114	1	11	SER	HB3	H	3.951	0.020	2
115	1	11	SER	C	C	175.867	0.400	1
116	1	11	SER	CA	C	56.644	0.400	1
117	1	11	SER	CB	C	64.028	0.400	1
118	1	11	SER	N	N	109.671	0.400	1
119	1	12	ASP	H	H	9.730	0.020	1
120	1	12	ASP	HA	H	4.900	0.020	1
121	1	12	ASP	HB2	H	2.741	0.020	2
122	1	12	ASP	HB3	H	2.515	0.020	2
123	1	12	ASP	C	C	176.258	0.400	1
124	1	12	ASP	CA	C	56.303	0.400	1
125	1	12	ASP	CB	C	40.232	0.400	1
126	1	12	ASP	N	N	130.479	0.400	1
127	1	13	THR	H	H	7.847	0.020	1
128	1	13	THR	HA	H	4.289	0.020	1
129	1	13	THR	HB	H	4.075	0.020	1
130	1	13	THR	HG21	H	1.148	0.020	1
131	1	13	THR	HG22	H	1.148	0.020	1
132	1	13	THR	HG23	H	1.148	0.020	1
133	1	13	THR	C	C	175.554	0.400	1
134	1	13	THR	CA	C	62.512	0.400	1
135	1	13	THR	CB	C	68.995	0.400	1
136	1	13	THR	N	N	109.739	0.400	1
137	1	14	ALA	H	H	8.342	0.020	1
138	1	14	ALA	HA	H	4.518	0.020	1
139	1	14	ALA	HB1	H	1.311	0.020	1
140	1	14	ALA	HB2	H	1.311	0.020	1
141	1	14	ALA	HB3	H	1.311	0.020	1
142	1	14	ALA	C	C	178.379	0.400	1
143	1	14	ALA	CA	C	51.754	0.400	1
144	1	14	ALA	CB	C	20.073	0.400	1
145	1	14	ALA	N	N	122.524	0.400	1
146	1	15	GLY	H	H	7.265	0.020	1
147	1	15	GLY	HA2	H	3.898	0.020	2
148	1	15	GLY	HA3	H	3.799	0.020	2
149	1	15	GLY	C	C	172.745	0.400	1
150	1	15	GLY	CA	C	45.003	0.400	1
151	1	15	GLY	N	N	106.383	0.400	1
152	1	16	ASN	H	H	8.990	0.020	1
153	1	16	ASN	HA	H	4.948	0.020	1
154	1	16	ASN	HB2	H	3.184	0.020	2
155	1	16	ASN	HB3	H	2.822	0.020	2
156	1	16	ASN	HD21	H	7.633	0.020	2
157	1	16	ASN	HD22	H	7.164	0.020	2
158	1	16	ASN	C	C	177.083	0.400	1
159	1	16	ASN	CA	C	52.001	0.400	1
160	1	16	ASN	CB	C	39.637	0.400	1
161	1	16	ASN	N	N	114.325	0.400	1
162	1	16	ASN	ND2	N	110.661	0.400	1
163	1	17	GLY	H	H	8.406	0.020	1
164	1	17	GLY	HA2	H	4.288	0.020	2
165	1	17	GLY	HA3	H	4.325	0.020	2
166	1	17	GLY	C	C	174.911	0.400	1
167	1	17	GLY	CA	C	45.986	0.400	1
168	1	17	GLY	N	N	106.091	0.400	1
169	1	18	THR	H	H	7.691	0.020	1
170	1	18	THR	HA	H	4.516	0.020	1
171	1	18	THR	HB	H	4.467	0.020	1
172	1	18	THR	C	C	174.623	0.400	1
173	1	18	THR	CA	C	61.304	0.400	1
174	1	18	THR	CB	C	72.019	0.400	1
175	1	18	THR	N	N	112.797	0.400	1
176	1	19	GLU	H	H	8.329	0.020	1
177	1	19	GLU	HA	H	2.661	0.020	1
178	1	19	GLU	HB2	H	1.296	0.020	2
179	1	19	GLU	HB3	H	0.808	0.020	2
180	1	19	GLU	HG2	H	1.234	0.020	2
181	1	19	GLU	HG3	H	1.471	0.020	2
182	1	19	GLU	C	C	177.429	0.400	1
183	1	19	GLU	CA	C	59.728	0.400	1
184	1	19	GLU	CB	C	29.196	0.400	1
185	1	19	GLU	CG	C	36.278	0.400	1
186	1	19	GLU	N	N	120.665	0.400	1
187	1	20	GLU	H	H	8.081	0.020	1
188	1	20	GLU	HA	H	4.035	0.020	1
189	1	20	GLU	HB2	H	1.883	0.020	2
190	1	20	GLU	HB3	H	1.898	0.020	2
191	1	20	GLU	HG2	H	2.150	0.020	2
192	1	20	GLU	HG3	H	2.257	0.020	2
193	1	20	GLU	C	C	176.480	0.400	1
194	1	20	GLU	CA	C	57.700	0.400	1
195	1	20	GLU	CB	C	29.458	0.400	1
196	1	20	GLU	CG	C	36.330	0.400	1
197	1	20	GLU	N	N	113.182	0.400	1
198	1	21	ALA	H	H	7.318	0.020	1
199	1	21	ALA	HA	H	3.523	0.020	1
200	1	21	ALA	HB1	H	1.223	0.020	1
201	1	21	ALA	HB2	H	1.223	0.020	1
202	1	21	ALA	HB3	H	1.223	0.020	1
203	1	21	ALA	CA	C	49.942	0.400	1
204	1	21	ALA	CB	C	18.315	0.400	1
205	1	21	ALA	N	N	122.568	0.400	1
206	1	22	PRO	HA	H	4.472	0.020	1
207	1	22	PRO	HB2	H	1.984	0.020	2
208	1	22	PRO	HB3	H	2.171	0.020	2
209	1	22	PRO	HG2	H	1.947	0.020	2
210	1	22	PRO	HD2	H	3.713	0.020	2
211	1	22	PRO	HD3	H	3.594	0.020	2
212	1	22	PRO	C	C	180.142	0.400	1
213	1	22	PRO	CA	C	63.763	0.400	1
214	1	22	PRO	CB	C	32.054	0.400	1
215	1	22	PRO	CG	C	27.469	0.400	1
216	1	22	PRO	CD	C	50.419	0.400	1
217	1	23	LEU	H	H	7.914	0.020	1
218	1	23	LEU	HA	H	4.731	0.020	1
219	1	23	LEU	HB2	H	1.397	0.020	2
220	1	23	LEU	HB3	H	1.836	0.020	2
221	1	23	LEU	HD11	H	0.643	0.020	2
222	1	23	LEU	HD12	H	0.643	0.020	2
223	1	23	LEU	HD13	H	0.643	0.020	2
224	1	23	LEU	HD21	H	0.741	0.020	2
225	1	23	LEU	HD22	H	0.741	0.020	2
226	1	23	LEU	HD23	H	0.741	0.020	2
227	1	23	LEU	C	C	175.288	0.400	1
228	1	23	LEU	CA	C	54.726	0.400	1
229	1	23	LEU	CB	C	41.776	0.400	1
230	1	23	LEU	CD1	C	23.576	0.400	2
231	1	23	LEU	CD2	C	23.811	0.400	2
232	1	23	LEU	N	N	119.010	0.400	1
233	1	24	LYS	H	H	9.021	0.020	1
234	1	24	LYS	HA	H	4.640	0.020	1
235	1	24	LYS	HB2	H	1.250	0.020	2
236	1	24	LYS	HB3	H	1.772	0.020	2
237	1	24	LYS	HG2	H	1.561	0.020	2
238	1	24	LYS	C	C	176.834	0.400	1
239	1	24	LYS	CA	C	58.220	0.400	1
240	1	24	LYS	CB	C	35.526	0.400	1
241	1	24	LYS	CG	C	26.479	0.400	1
242	1	24	LYS	N	N	123.268	0.400	1
243	1	25	THR	H	H	9.407	0.020	1
244	1	25	THR	HA	H	4.750	0.020	1
245	1	25	THR	HB	H	4.487	0.020	1
246	1	25	THR	HG21	H	1.263	0.020	1
247	1	25	THR	HG22	H	1.263	0.020	1
248	1	25	THR	HG23	H	1.263	0.020	1
249	1	25	THR	C	C	174.575	0.400	1
250	1	25	THR	CA	C	59.646	0.400	1
251	1	25	THR	CB	C	73.236	0.400	1
252	1	25	THR	CG2	C	21.198	0.400	1
253	1	25	THR	N	N	108.478	0.400	1
254	1	26	VAL	H	H	8.211	0.020	1
255	1	26	VAL	HA	H	3.401	0.020	1
256	1	26	VAL	HB	H	1.863	0.020	1
257	1	26	VAL	HG11	H	0.872	0.020	2
258	1	26	VAL	HG12	H	0.872	0.020	2
259	1	26	VAL	HG13	H	0.872	0.020	2
260	1	26	VAL	HG21	H	0.688	0.020	2
261	1	26	VAL	HG22	H	0.688	0.020	2
262	1	26	VAL	HG23	H	0.688	0.020	2
263	1	26	VAL	C	C	178.264	0.400	1
264	1	26	VAL	CA	C	66.163	0.400	1
265	1	26	VAL	CB	C	31.379	0.400	1
266	1	26	VAL	CG1	C	23.926	0.400	2
267	1	26	VAL	CG2	C	21.901	0.400	2
268	1	26	VAL	N	N	121.135	0.400	1
269	1	27	LEU	H	H	8.340	0.020	1
270	1	27	LEU	HA	H	3.885	0.020	1
271	1	27	LEU	HB2	H	1.816	0.020	2
272	1	27	LEU	HB3	H	1.500	0.020	2
273	1	27	LEU	HD11	H	0.941	0.020	2
274	1	27	LEU	HD12	H	0.941	0.020	2
275	1	27	LEU	HD13	H	0.941	0.020	2
276	1	27	LEU	C	C	177.401	0.400	1
277	1	27	LEU	CA	C	58.798	0.400	1
278	1	27	LEU	CB	C	41.566	0.400	1
279	1	27	LEU	CG	C	27.096	0.400	1
280	1	27	LEU	CD1	C	23.404	0.400	2
281	1	27	LEU	N	N	119.330	0.400	1
282	1	28	GLN	H	H	7.729	0.020	1
283	1	28	GLN	HA	H	3.861	0.020	1
284	1	28	GLN	HB2	H	2.069	0.020	2
285	1	28	GLN	HB3	H	1.952	0.020	2
286	1	28	GLN	HG2	H	2.330	0.020	2
287	1	28	GLN	HE21	H	6.901	0.020	2
288	1	28	GLN	HE22	H	7.374	0.020	2
289	1	28	GLN	C	C	178.050	0.400	1
290	1	28	GLN	CA	C	57.771	0.400	1
291	1	28	GLN	CB	C	26.731	0.400	1
292	1	28	GLN	CG	C	33.718	0.400	1
293	1	28	GLN	N	N	117.013	0.400	1
294	1	28	GLN	NE2	N	111.486	0.400	1
295	1	29	ALA	H	H	7.434	0.020	1
296	1	29	ALA	HA	H	3.634	0.020	1
297	1	29	ALA	HB1	H	1.281	0.020	1
298	1	29	ALA	HB2	H	1.281	0.020	1
299	1	29	ALA	HB3	H	1.281	0.020	1
300	1	29	ALA	C	C	177.738	0.400	1
301	1	29	ALA	CA	C	55.405	0.400	1
302	1	29	ALA	CB	C	18.171	0.400	1
303	1	29	ALA	N	N	121.528	0.400	1
304	1	30	ILE	H	H	7.689	0.020	1
305	1	30	ILE	HA	H	3.109	0.020	1
306	1	30	ILE	HB	H	1.879	0.020	1
307	1	30	ILE	HG12	H	1.332	0.020	2
308	1	30	ILE	HG21	H	0.066	0.020	1
309	1	30	ILE	HG22	H	0.066	0.020	1
310	1	30	ILE	HG23	H	0.066	0.020	1
311	1	30	ILE	HD11	H	0.463	0.020	1
312	1	30	ILE	HD12	H	0.463	0.020	1
313	1	30	ILE	HD13	H	0.463	0.020	1
314	1	30	ILE	C	C	178.588	0.400	1
315	1	30	ILE	CA	C	64.579	0.400	1
316	1	30	ILE	CB	C	35.986	0.400	1
317	1	30	ILE	CG1	C	27.847	0.400	1
318	1	30	ILE	CG2	C	18.085	0.400	1
319	1	30	ILE	CD1	C	12.600	0.400	1
320	1	30	ILE	N	N	116.745	0.400	1
321	1	31	VAL	H	H	8.155	0.020	1
322	1	31	VAL	HA	H	3.445	0.020	1
323	1	31	VAL	HB	H	2.248	0.020	1
324	1	31	VAL	HG11	H	0.922	0.020	2
325	1	31	VAL	HG12	H	0.922	0.020	2
326	1	31	VAL	HG13	H	0.922	0.020	2
327	1	31	VAL	HG21	H	1.047	0.020	2
328	1	31	VAL	HG22	H	1.047	0.020	2
329	1	31	VAL	HG23	H	1.047	0.020	2
330	1	31	VAL	C	C	180.898	0.400	1
331	1	31	VAL	CA	C	66.529	0.400	1
332	1	31	VAL	CB	C	31.337	0.400	1
333	1	31	VAL	CG1	C	21.101	0.400	2
334	1	31	VAL	CG2	C	22.333	0.400	2
335	1	31	VAL	N	N	121.467	0.400	1
336	1	32	LYS	H	H	8.509	0.020	1
337	1	32	LYS	HA	H	3.961	0.020	1
338	1	32	LYS	HB2	H	1.932	0.020	2
339	1	32	LYS	HG2	H	1.331	0.020	2
340	1	32	LYS	HD2	H	1.508	0.020	2
341	1	32	LYS	C	C	178.026	0.400	1
342	1	32	LYS	CA	C	58.788	0.400	1
343	1	32	LYS	CB	C	31.870	0.400	1
344	1	32	LYS	CG	C	25.162	0.400	1
345	1	32	LYS	N	N	123.161	0.400	1
346	1	33	LEU	H	H	7.390	0.020	1
347	1	33	LEU	HA	H	4.148	0.020	1
348	1	33	LEU	HB2	H	1.414	0.020	2
349	1	33	LEU	HB3	H	1.821	0.020	2
350	1	33	LEU	HG	H	0.521	0.020	1
351	1	33	LEU	HD11	H	0.762	0.020	2
352	1	33	LEU	HD12	H	0.762	0.020	2
353	1	33	LEU	HD13	H	0.762	0.020	2
354	1	33	LEU	C	C	177.228	0.400	1
355	1	33	LEU	CA	C	54.599	0.400	1
356	1	33	LEU	CB	C	41.447	0.400	1
357	1	33	LEU	CG	C	25.951	0.400	1
358	1	33	LEU	CD1	C	22.389	0.400	2
359	1	33	LEU	CD2	C	22.389	0.400	2
360	1	33	LEU	N	N	117.784	0.400	1
361	1	34	ASP	H	H	8.441	0.020	1
362	1	34	ASP	HA	H	4.290	0.020	1
363	1	34	ASP	HB2	H	3.034	0.020	2
364	1	34	ASP	HB3	H	2.515	0.020	2
365	1	34	ASP	C	C	176.219	0.400	1
366	1	34	ASP	CA	C	55.242	0.400	1
367	1	34	ASP	CB	C	40.160	0.400	1
368	1	34	ASP	N	N	122.068	0.400	1
369	1	35	GLY	H	H	8.019	0.020	1
370	1	35	GLY	HA2	H	3.783	0.020	2
371	1	35	GLY	HA3	H	2.713	0.020	2
372	1	35	GLY	C	C	173.294	0.400	1
373	1	35	GLY	CA	C	45.979	0.400	1
374	1	35	GLY	N	N	100.293	0.400	1
375	1	36	LYS	H	H	7.378	0.020	1
376	1	36	LYS	HA	H	4.276	0.020	1
377	1	36	LYS	HB2	H	1.741	0.020	2
378	1	36	LYS	HG2	H	1.231	0.020	2
379	1	36	LYS	C	C	173.682	0.400	1
380	1	36	LYS	CA	C	55.738	0.400	1
381	1	36	LYS	CB	C	31.675	0.400	1
382	1	36	LYS	CG	C	24.393	0.400	1
383	1	36	LYS	N	N	122.692	0.400	1
384	1	37	ILE	H	H	8.000	0.020	1
385	1	37	ILE	HA	H	3.976	0.020	1
386	1	37	ILE	HB	H	1.762	0.020	1
387	1	37	ILE	HG12	H	1.156	0.020	2
388	1	37	ILE	HG13	H	0.910	0.020	2
389	1	37	ILE	HG21	H	0.672	0.020	1
390	1	37	ILE	HG22	H	0.672	0.020	1
391	1	37	ILE	HG23	H	0.672	0.020	1
392	1	37	ILE	HD11	H	0.513	0.020	1
393	1	37	ILE	HD12	H	0.513	0.020	1
394	1	37	ILE	HD13	H	0.513	0.020	1
395	1	37	ILE	C	C	175.912	0.400	1
396	1	37	ILE	CA	C	59.906	0.400	1
397	1	37	ILE	CB	C	37.130	0.400	1
398	1	37	ILE	CG1	C	26.915	0.400	1
399	1	37	ILE	CG2	C	17.952	0.400	1
400	1	37	ILE	CD1	C	12.545	0.400	1
401	1	37	ILE	N	N	125.297	0.400	1
402	1	38	GLU	H	H	8.562	0.020	1
403	1	38	GLU	HA	H	4.544	0.020	1
404	1	38	GLU	HB2	H	2.343	0.020	2
405	1	38	GLU	HB3	H	2.004	0.020	2
406	1	38	GLU	HG2	H	2.186	0.020	2
407	1	38	GLU	C	C	177.561	0.400	1
408	1	38	GLU	CA	C	54.838	0.400	1
409	1	38	GLU	CB	C	31.937	0.400	1
410	1	38	GLU	CG	C	36.367	0.400	1
411	1	38	GLU	N	N	126.622	0.400	1
412	1	39	ALA	H	H	8.886	0.020	1
413	1	39	ALA	HA	H	3.969	0.020	1
414	1	39	ALA	HB1	H	1.347	0.020	1
415	1	39	ALA	HB2	H	1.347	0.020	1
416	1	39	ALA	HB3	H	1.347	0.020	1
417	1	39	ALA	C	C	178.260	0.400	1
418	1	39	ALA	CA	C	55.093	0.400	1
419	1	39	ALA	CB	C	18.260	0.400	1
420	1	39	ALA	N	N	123.387	0.400	1
421	1	40	ASP	H	H	8.107	0.020	1
422	1	40	ASP	HA	H	4.463	0.020	1
423	1	40	ASP	HB2	H	2.729	0.020	2
424	1	40	ASP	HB3	H	2.496	0.020	2
425	1	40	ASP	C	C	176.428	0.400	1
426	1	40	ASP	CA	C	52.868	0.400	1
427	1	40	ASP	CB	C	39.986	0.400	1
428	1	40	ASP	N	N	112.278	0.400	1
429	1	41	THR	H	H	7.645	0.020	1
430	1	41	THR	HA	H	4.336	0.020	1
431	1	41	THR	HB	H	3.965	0.020	1
432	1	41	THR	HG21	H	0.978	0.020	1
433	1	41	THR	HG22	H	0.978	0.020	1
434	1	41	THR	HG23	H	0.978	0.020	1
435	1	41	THR	C	C	174.107	0.400	1
436	1	41	THR	CA	C	63.715	0.400	1
437	1	41	THR	CB	C	68.562	0.400	1
438	1	41	THR	CG2	C	22.858	0.400	1
439	1	41	THR	N	N	119.909	0.400	1
440	1	42	ARG	H	H	8.272	0.020	1
441	1	42	ARG	HA	H	4.294	0.020	1
442	1	42	ARG	HB2	H	1.398	0.020	2
443	1	42	ARG	HB3	H	0.972	0.020	2
444	1	42	ARG	C	C	172.848	0.400	1
445	1	42	ARG	CA	C	54.443	0.400	1
446	1	42	ARG	CB	C	32.185	0.400	1
447	1	42	ARG	CG	C	26.214	0.400	1
448	1	42	ARG	N	N	129.002	0.400	1
449	1	43	ILE	H	H	7.955	0.020	1
450	1	43	ILE	HA	H	4.499	0.020	1
451	1	43	ILE	HB	H	1.384	0.020	1
452	1	43	ILE	HG12	H	1.205	0.020	2
453	1	43	ILE	HG13	H	0.477	0.020	2
454	1	43	ILE	HG21	H	0.590	0.020	1
455	1	43	ILE	HG22	H	0.590	0.020	1
456	1	43	ILE	HG23	H	0.590	0.020	1
457	1	43	ILE	HD11	H	0.469	0.020	1
458	1	43	ILE	HD12	H	0.469	0.020	1
459	1	43	ILE	HD13	H	0.469	0.020	1
460	1	43	ILE	C	C	173.705	0.400	1
461	1	43	ILE	CA	C	59.868	0.400	1
462	1	43	ILE	CB	C	39.283	0.400	1
463	1	43	ILE	CG1	C	27.857	0.400	1
464	1	43	ILE	CG2	C	17.998	0.400	1
465	1	43	ILE	CD1	C	13.731	0.400	1
466	1	43	ILE	N	N	125.320	0.400	1
467	1	44	TRP	H	H	8.611	0.020	1
468	1	44	TRP	HA	H	5.180	0.020	1
469	1	44	TRP	HB2	H	3.243	0.020	2
470	1	44	TRP	HB3	H	2.215	0.020	2
471	1	44	TRP	HD1	H	5.103	0.020	1
472	1	44	TRP	HE1	H	9.654	0.020	1
473	1	44	TRP	HE3	H	7.325	0.020	1
474	1	44	TRP	HZ2	H	7.216	0.020	1
475	1	44	TRP	HZ3	H	7.041	0.020	1
476	1	44	TRP	C	C	176.591	0.400	1
477	1	44	TRP	CA	C	55.354	0.400	1
478	1	44	TRP	CB	C	32.754	0.400	1
479	1	44	TRP	CD1	C	127.263	0.400	1
480	1	44	TRP	CE3	C	121.360	0.400	1
481	1	44	TRP	CZ2	C	113.669	0.400	1
482	1	44	TRP	CZ3	C	123.214	0.400	1
483	1	44	TRP	N	N	127.959	0.400	1
484	1	44	TRP	NE1	N	128.438	0.400	1
485	1	45	VAL	H	H	9.911	0.020	1
486	1	45	VAL	HA	H	5.340	0.020	1
487	1	45	VAL	HB	H	2.459	0.020	1
488	1	45	VAL	HG11	H	0.704	0.020	2
489	1	45	VAL	HG12	H	0.704	0.020	2
490	1	45	VAL	HG13	H	0.704	0.020	2
491	1	45	VAL	HG21	H	0.742	0.020	2
492	1	45	VAL	HG22	H	0.742	0.020	2
493	1	45	VAL	HG23	H	0.742	0.020	2
494	1	45	VAL	C	C	176.157	0.400	1
495	1	45	VAL	CA	C	59.295	0.400	1
496	1	45	VAL	CB	C	35.857	0.400	1
497	1	45	VAL	CG1	C	21.660	0.400	2
498	1	45	VAL	CG2	C	18.436	0.400	2
499	1	45	VAL	N	N	116.791	0.400	1
500	1	46	ASP	H	H	9.175	0.020	1
501	1	46	ASP	HA	H	4.589	0.020	1
502	1	46	ASP	HB2	H	2.716	0.020	2
503	1	46	ASP	HB3	H	2.519	0.020	2
504	1	46	ASP	C	C	177.871	0.400	1
505	1	46	ASP	CA	C	56.974	0.400	1
506	1	46	ASP	CB	C	41.239	0.400	1
507	1	46	ASP	N	N	119.987	0.400	1
508	1	47	GLY	H	H	7.861	0.020	1
509	1	47	GLY	HA2	H	4.060	0.020	2
510	1	47	GLY	HA3	H	3.444	0.020	2
511	1	47	GLY	C	C	174.491	0.400	1
512	1	47	GLY	CA	C	44.575	0.400	1
513	1	47	GLY	N	N	107.809	0.400	1
514	1	48	THR	H	H	8.438	0.020	1
515	1	48	THR	HA	H	4.447	0.020	1
516	1	48	THR	HB	H	4.217	0.020	1
517	1	48	THR	HG21	H	1.179	0.020	1
518	1	48	THR	HG22	H	1.179	0.020	1
519	1	48	THR	HG23	H	1.179	0.020	1
520	1	48	THR	C	C	175.348	0.400	1
521	1	48	THR	CA	C	61.300	0.400	1
522	1	48	THR	CB	C	70.522	0.400	1
523	1	48	THR	CG2	C	21.594	0.400	1
524	1	48	THR	N	N	113.184	0.400	1
525	1	49	GLY	H	H	8.909	0.020	1
526	1	49	GLY	HA2	H	4.006	0.020	2
527	1	49	GLY	HA3	H	3.738	0.020	2
528	1	49	GLY	C	C	174.905	0.400	1
529	1	49	GLY	CA	C	46.013	0.400	1
530	1	49	GLY	N	N	114.030	0.400	1
531	1	50	ASP	H	H	8.851	0.020	1
532	1	50	ASP	HA	H	4.447	0.020	1
533	1	50	ASP	HB2	H	2.705	0.020	2
534	1	50	ASP	HB3	H	2.491	0.020	2
535	1	50	ASP	C	C	176.414	0.400	1
536	1	50	ASP	CA	C	55.217	0.400	1
537	1	50	ASP	CB	C	41.218	0.400	1
538	1	50	ASP	N	N	125.219	0.400	1
539	1	51	GLU	H	H	7.813	0.020	1
540	1	51	GLU	HA	H	4.319	0.020	1
541	1	51	GLU	HB2	H	2.214	0.020	2
542	1	51	GLU	HB3	H	2.050	0.020	2
543	1	51	GLU	HG2	H	2.440	0.020	2
544	1	51	GLU	C	C	176.957	0.400	1
545	1	51	GLU	CA	C	55.514	0.400	1
546	1	51	GLU	CB	C	30.389	0.400	1
547	1	51	GLU	CG	C	36.158	0.400	1
548	1	51	GLU	N	N	118.980	0.400	1
549	1	52	MET	H	H	8.589	0.020	1
550	1	52	MET	HA	H	3.740	0.020	1
551	1	52	MET	HB2	H	1.770	0.020	2
552	1	52	MET	HB3	H	1.385	0.020	2
553	1	52	MET	HG2	H	1.692	0.020	2
554	1	52	MET	HG3	H	1.407	0.020	2
555	1	52	MET	C	C	176.563	0.400	1
556	1	52	MET	CA	C	58.355	0.400	1
557	1	52	MET	CB	C	33.275	0.400	1
558	1	52	MET	CG	C	31.324	0.400	1
559	1	52	MET	N	N	123.202	0.400	1
560	1	53	TRP	H	H	7.936	0.020	1
561	1	53	TRP	HA	H	5.768	0.020	1
562	1	53	TRP	HB2	H	3.447	0.020	2
563	1	53	TRP	HB3	H	2.636	0.020	2
564	1	53	TRP	HD1	H	6.871	0.020	1
565	1	53	TRP	HE1	H	10.357	0.020	1
566	1	53	TRP	HZ2	H	7.249	0.020	1
567	1	53	TRP	HZ3	H	5.326	0.020	1
568	1	53	TRP	HH2	H	6.938	0.020	1
569	1	53	TRP	C	C	175.137	0.400	1
570	1	53	TRP	CA	C	54.410	0.400	1
571	1	53	TRP	CB	C	34.814	0.400	1
572	1	53	TRP	CD1	C	128.791	0.400	1
573	1	53	TRP	CZ2	C	114.994	0.400	1
574	1	53	TRP	CZ3	C	118.839	0.400	1
575	1	53	TRP	CH2	C	120.012	0.400	1
576	1	53	TRP	N	N	116.978	0.400	1
577	1	53	TRP	NE1	N	130.207	0.400	1
578	1	54	ASP	H	H	9.403	0.020	1
579	1	54	ASP	HA	H	5.354	0.020	1
580	1	54	ASP	HB2	H	2.593	0.020	2
581	1	54	ASP	C	C	175.323	0.400	1
582	1	54	ASP	CA	C	52.297	0.400	1
583	1	54	ASP	CB	C	44.548	0.400	1
584	1	54	ASP	N	N	121.181	0.400	1
585	1	55	VAL	H	H	8.873	0.020	1
586	1	55	VAL	HA	H	3.764	0.020	1
587	1	55	VAL	HB	H	1.613	0.020	1
588	1	55	VAL	HG11	H	0.615	0.020	2
589	1	55	VAL	HG12	H	0.615	0.020	2
590	1	55	VAL	HG13	H	0.615	0.020	2
591	1	55	VAL	HG21	H	0.350	0.020	2
592	1	55	VAL	HG22	H	0.350	0.020	2
593	1	55	VAL	HG23	H	0.350	0.020	2
594	1	55	VAL	C	C	176.882	0.400	1
595	1	55	VAL	CA	C	62.698	0.400	1
596	1	55	VAL	CB	C	32.005	0.400	1
597	1	55	VAL	CG1	C	21.270	0.400	2
598	1	55	VAL	CG2	C	21.791	0.400	2
599	1	55	VAL	N	N	122.574	0.400	1
600	1	56	VAL	H	H	8.299	0.020	1
601	1	56	VAL	HA	H	3.820	0.020	1
602	1	56	VAL	HB	H	1.792	0.020	1
603	1	56	VAL	HG11	H	1.084	0.020	2
604	1	56	VAL	HG12	H	1.084	0.020	2
605	1	56	VAL	HG13	H	1.084	0.020	2
606	1	56	VAL	HG21	H	0.787	0.020	2
607	1	56	VAL	HG22	H	0.787	0.020	2
608	1	56	VAL	HG23	H	0.787	0.020	2
609	1	56	VAL	C	C	175.968	0.400	1
610	1	56	VAL	CA	C	62.150	0.400	1
611	1	56	VAL	CB	C	31.885	0.400	1
612	1	56	VAL	CG1	C	23.336	0.400	2
613	1	56	VAL	CG2	C	23.334	0.400	2
614	1	56	VAL	N	N	127.231	0.400	1
615	1	57	SER	H	H	8.225	0.020	1
616	1	57	SER	HA	H	4.339	0.020	1
617	1	57	SER	HB2	H	4.278	0.020	2
618	1	57	SER	HB3	H	4.004	0.020	2
619	1	57	SER	C	C	175.255	0.400	1
620	1	57	SER	CA	C	57.665	0.400	1
621	1	57	SER	CB	C	64.634	0.400	1
622	1	57	SER	N	N	123.298	0.400	1
623	1	58	LYS	H	H	8.890	0.020	1
624	1	58	LYS	HA	H	3.889	0.020	1
625	1	58	LYS	HB2	H	1.817	0.020	2
626	1	58	LYS	CA	C	59.903	0.400	1
627	1	58	LYS	N	N	122.863	0.400	1
628	1	59	SER	H	H	8.417	0.020	1
629	1	59	SER	HA	H	4.103	0.020	1
630	1	59	SER	HB2	H	3.828	0.020	2
631	1	59	SER	C	C	177.393	0.400	1
632	1	59	SER	CA	C	61.290	0.400	1
633	1	59	SER	CB	C	62.433	0.400	1
634	1	59	SER	N	N	122.209	0.400	1
635	1	60	LYS	H	H	7.687	0.020	1
636	1	60	LYS	HA	H	4.017	0.020	1
637	1	60	LYS	HB2	H	1.875	0.020	2
638	1	60	LYS	HB3	H	1.723	0.020	2
639	1	60	LYS	HG2	H	1.355	0.020	2
640	1	60	LYS	C	C	179.327	0.400	1
641	1	60	LYS	CA	C	59.162	0.400	1
642	1	60	LYS	CB	C	32.099	0.400	1
643	1	60	LYS	CG	C	25.802	0.400	1
644	1	60	LYS	N	N	123.552	0.400	1
645	1	61	LEU	H	H	8.442	0.020	1
646	1	61	LEU	HA	H	3.896	0.020	1
647	1	61	LEU	HB2	H	1.436	0.020	2
648	1	61	LEU	HB3	H	1.819	0.020	2
649	1	61	LEU	HD11	H	0.669	0.020	2
650	1	61	LEU	HD12	H	0.669	0.020	2
651	1	61	LEU	HD13	H	0.669	0.020	2
652	1	61	LEU	C	C	179.358	0.400	1
653	1	61	LEU	CA	C	58.084	0.400	1
654	1	61	LEU	CB	C	41.690	0.400	1
655	1	61	LEU	CD1	C	22.633	0.400	2
656	1	61	LEU	N	N	121.636	0.400	1
657	1	62	LYS	H	H	8.406	0.020	1
658	1	62	LYS	HA	H	3.970	0.020	1
659	1	62	LYS	HB2	H	1.861	0.020	2
660	1	62	LYS	HB3	H	1.882	0.020	2
661	1	62	LYS	HG2	H	1.367	0.020	2
662	1	62	LYS	HD2	H	1.525	0.020	2
663	1	62	LYS	C	C	179.133	0.400	1
664	1	62	LYS	CA	C	59.773	0.400	1
665	1	62	LYS	CB	C	32.202	0.400	1
666	1	62	LYS	CG	C	25.164	0.400	1
667	1	62	LYS	CD	C	29.230	0.400	1
668	1	62	LYS	N	N	121.337	0.400	1
669	1	63	LYS	H	H	7.732	0.020	1
670	1	63	LYS	HA	H	3.993	0.020	1
671	1	63	LYS	HB2	H	1.883	0.020	2
672	1	63	LYS	HB3	H	1.852	0.020	2
673	1	63	LYS	HG2	H	1.372	0.020	2
674	1	63	LYS	HD2	H	1.562	0.020	2
675	1	63	LYS	C	C	178.996	0.400	1
676	1	63	LYS	CA	C	59.846	0.400	1
677	1	63	LYS	CB	C	32.597	0.400	1
678	1	63	LYS	CG	C	25.233	0.400	1
679	1	63	LYS	N	N	119.695	0.400	1
680	1	64	ALA	H	H	8.022	0.020	1
681	1	64	ALA	HA	H	4.269	0.020	1
682	1	64	ALA	HB1	H	1.312	0.020	1
683	1	64	ALA	HB2	H	1.312	0.020	1
684	1	64	ALA	HB3	H	1.312	0.020	1
685	1	64	ALA	C	C	179.205	0.400	1
686	1	64	ALA	CA	C	54.987	0.400	1
687	1	64	ALA	CB	C	18.936	0.400	1
688	1	64	ALA	N	N	121.619	0.400	1
689	1	65	THR	H	H	8.489	0.020	1
690	1	65	THR	HA	H	3.712	0.020	1
691	1	65	THR	HB	H	4.227	0.020	1
692	1	65	THR	HG21	H	1.146	0.020	1
693	1	65	THR	HG22	H	1.146	0.020	1
694	1	65	THR	HG23	H	1.146	0.020	1
695	1	65	THR	C	C	176.261	0.400	1
696	1	65	THR	CA	C	67.295	0.400	1
697	1	65	THR	CB	C	68.369	0.400	1
698	1	65	THR	CG2	C	21.613	0.400	1
699	1	65	THR	N	N	114.038	0.400	1
700	1	66	LYS	H	H	7.876	0.020	1
701	1	66	LYS	HA	H	4.122	0.020	1
702	1	66	LYS	HB2	H	2.048	0.020	2
703	1	66	LYS	HB3	H	1.933	0.020	2
704	1	66	LYS	HG2	H	1.363	0.020	2
705	1	66	LYS	HD2	H	1.534	0.020	2
706	1	66	LYS	C	C	178.987	0.400	1
707	1	66	LYS	CA	C	59.687	0.400	1
708	1	66	LYS	CB	C	32.012	0.400	1
709	1	66	LYS	CG	C	24.950	0.400	1
710	1	66	LYS	CD	C	29.230	0.400	1
711	1	66	LYS	N	N	122.445	0.400	1
712	1	67	GLN	H	H	7.843	0.020	1
713	1	67	GLN	HA	H	3.951	0.020	1
714	1	67	GLN	HB2	H	2.283	0.020	2
715	1	67	GLN	HB3	H	2.050	0.020	2
716	1	67	GLN	HG2	H	2.402	0.020	2
717	1	67	GLN	HE21	H	7.539	0.020	2
718	1	67	GLN	HE22	H	6.862	0.020	2
719	1	67	GLN	C	C	178.164	0.400	1
720	1	67	GLN	CA	C	58.740	0.400	1
721	1	67	GLN	CB	C	28.183	0.400	1
722	1	67	GLN	N	N	118.054	0.400	1
723	1	67	GLN	NE2	N	111.144	0.400	1
724	1	68	TYR	H	H	8.471	0.020	1
725	1	68	TYR	HA	H	3.860	0.020	1
726	1	68	TYR	HB2	H	3.021	0.020	2
727	1	68	TYR	HB3	H	2.817	0.020	2
728	1	68	TYR	HD1	H	6.487	0.020	1
729	1	68	TYR	HD2	H	6.487	0.020	1
730	1	68	TYR	HE1	H	6.523	0.020	1
731	1	68	TYR	HE2	H	6.523	0.020	1
732	1	68	TYR	C	C	177.691	0.400	1
733	1	68	TYR	CA	C	61.798	0.400	1
734	1	68	TYR	CB	C	38.203	0.400	1
735	1	68	TYR	CD2	C	132.406	0.400	3
736	1	68	TYR	CE2	C	118.115	0.400	3
737	1	68	TYR	N	N	121.022	0.400	1
738	1	69	HIS	H	H	8.135	0.020	1
739	1	69	HIS	HA	H	4.019	0.020	1
740	1	69	HIS	HB2	H	3.125	0.020	2
741	1	69	HIS	HD2	H	7.001	0.020	1
742	1	69	HIS	C	C	177.752	0.400	1
743	1	69	HIS	CA	C	59.765	0.400	1
744	1	69	HIS	CB	C	30.378	0.400	1
745	1	69	HIS	CD2	C	120.426	0.400	1
746	1	69	HIS	N	N	119.314	0.400	1
747	1	70	ILE	H	H	7.984	0.020	1
748	1	70	ILE	HA	H	3.737	0.020	1
749	1	70	ILE	HB	H	1.906	0.020	1
750	1	70	ILE	HG12	H	1.142	0.020	2
751	1	70	ILE	HG13	H	1.646	0.020	2
752	1	70	ILE	HG21	H	0.840	0.020	1
753	1	70	ILE	HG22	H	0.840	0.020	1
754	1	70	ILE	HG23	H	0.840	0.020	1
755	1	70	ILE	C	C	178.316	0.400	1
756	1	70	ILE	CA	C	64.460	0.400	1
757	1	70	ILE	CB	C	38.244	0.400	1
758	1	70	ILE	CG1	C	28.966	0.400	1
759	1	70	ILE	CG2	C	17.200	0.400	1
760	1	70	ILE	N	N	119.427	0.400	1
761	1	71	GLN	H	H	8.085	0.020	1
762	1	71	GLN	HA	H	4.098	0.020	1
763	1	71	GLN	HB2	H	2.042	0.020	2
764	1	71	GLN	HG2	H	2.370	0.020	2
765	1	71	GLN	HE21	H	7.451	0.020	2
766	1	71	GLN	HE22	H	6.690	0.020	2
767	1	71	GLN	C	C	177.556	0.400	1
768	1	71	GLN	CA	C	57.926	0.400	1
769	1	71	GLN	CB	C	28.841	0.400	1
770	1	71	GLN	CG	C	33.955	0.400	1
771	1	71	GLN	N	N	118.416	0.400	1
772	1	71	GLN	NE2	N	110.012	0.400	1
773	1	72	THR	H	H	7.696	0.020	1
774	1	72	THR	HA	H	4.038	0.020	1
775	1	72	THR	HB	H	3.930	0.020	1
776	1	72	THR	HG21	H	0.846	0.020	1
777	1	72	THR	HG22	H	0.846	0.020	1
778	1	72	THR	HG23	H	0.846	0.020	1
779	1	72	THR	C	C	175.124	0.400	1
780	1	72	THR	CA	C	63.250	0.400	1
781	1	72	THR	CB	C	69.492	0.400	1
782	1	72	THR	CG2	C	21.418	0.400	1
783	1	72	THR	N	N	111.579	0.400	1
784	1	73	LYS	H	H	7.711	0.020	1
785	1	73	LYS	HA	H	4.109	0.020	1
786	1	73	LYS	HB2	H	1.738	0.020	2
787	1	73	LYS	HG2	H	1.328	0.020	2
788	1	73	LYS	HD2	H	1.566	0.020	2
789	1	73	LYS	C	C	176.808	0.400	1
790	1	73	LYS	CA	C	56.942	0.400	1
791	1	73	LYS	CB	C	31.956	0.400	1
792	1	73	LYS	CG	C	24.637	0.400	1
793	1	73	LYS	CD	C	28.940	0.400	1
794	1	73	LYS	N	N	122.210	0.400	1
795	1	74	LYS	H	H	8.060	0.020	1
796	1	74	LYS	HA	H	4.166	0.020	1
797	1	74	LYS	HB2	H	1.726	0.020	2
798	1	74	LYS	HB3	H	1.681	0.020	2
799	1	74	LYS	HG2	H	1.347	0.020	2
800	1	74	LYS	HD2	H	1.580	0.020	2
801	1	74	LYS	HE2	H	2.908	0.020	2
802	1	74	LYS	C	C	176.751	0.400	1
803	1	74	LYS	CA	C	56.813	0.400	1
804	1	74	LYS	CB	C	32.857	0.400	1
805	1	74	LYS	CG	C	24.754	0.400	1
806	1	74	LYS	CD	C	29.097	0.400	1
807	1	74	LYS	N	N	121.388	0.400	1
808	1	75	GLN	H	H	8.254	0.020	1
809	1	75	GLN	HA	H	4.228	0.020	1
810	1	75	GLN	HB2	H	2.040	0.020	2
811	1	75	GLN	HB3	H	1.895	0.020	2
812	1	75	GLN	HG2	H	2.295	0.020	2
813	1	75	GLN	HE21	H	6.862	0.020	2
814	1	75	GLN	HE22	H	7.538	0.020	2
815	1	75	GLN	C	C	175.933	0.400	1
816	1	75	GLN	CA	C	55.867	0.400	1
817	1	75	GLN	CB	C	29.588	0.400	1
818	1	75	GLN	CG	C	33.870	0.400	1
819	1	75	GLN	N	N	120.826	0.400	1
820	1	75	GLN	NE2	N	111.623	0.400	1
821	1	76	GLU	H	H	8.335	0.020	1
822	1	76	GLU	CA	C	56.756	0.400	1
823	1	76	GLU	CB	C	30.496	0.400	1
824	1	76	GLU	N	N	122.516	0.400	1
825	1	77	LYS	HA	H	4.215	0.020	1
826	1	77	LYS	HB2	H	1.737	0.020	2
827	1	77	LYS	HB3	H	1.631	0.020	2
828	1	77	LYS	HG2	H	1.338	0.020	2
829	1	77	LYS	C	C	175.869	0.400	1
830	1	77	LYS	CA	C	55.922	0.400	1
831	1	77	LYS	CB	C	33.197	0.400	1
832	1	77	LYS	CG	C	24.663	0.400	1
833	1	77	LYS	CD	C	28.977	0.400	1
834	1	78	ALA	H	H	8.402	0.020	1
835	1	78	ALA	CA	C	50.501	0.400	1
836	1	78	ALA	CB	C	18.220	0.400	1
837	1	78	ALA	N	N	126.639	0.400	1
838	1	81	GLU	HA	H	4.168	0.020	1
839	1	81	GLU	HB2	H	1.906	0.020	2
840	1	81	GLU	HB3	H	1.816	0.020	2
841	1	81	GLU	HG2	H	2.054	0.020	2
842	1	81	GLU	C	C	176.046	0.400	1
843	1	81	GLU	CA	C	57.763	0.400	1
844	1	81	GLU	CG	C	36.251	0.400	1
845	1	82	LYS	H	H	8.267	0.020	1
846	1	82	LYS	HA	H	4.218	0.020	1
847	1	82	LYS	HB2	H	1.716	0.020	2
848	1	82	LYS	HB3	H	1.653	0.020	2
849	1	82	LYS	HG2	H	1.322	0.020	2
850	1	82	LYS	C	C	176.134	0.400	1
851	1	82	LYS	CA	C	56.256	0.400	1
852	1	82	LYS	CB	C	33.015	0.400	1
853	1	82	LYS	CG	C	24.739	0.400	1
854	1	82	LYS	N	N	122.491	0.400	1
855	1	83	ILE	H	H	8.186	0.020	1
856	1	83	ILE	HA	H	4.071	0.020	1
857	1	83	ILE	HB	H	1.752	0.020	1
858	1	83	ILE	HG12	H	1.392	0.020	2
859	1	83	ILE	HG13	H	1.097	0.020	2
860	1	83	ILE	HG21	H	0.765	0.020	1
861	1	83	ILE	HG22	H	0.765	0.020	1
862	1	83	ILE	HG23	H	0.765	0.020	1
863	1	83	ILE	C	C	176.130	0.400	1
864	1	83	ILE	CA	C	61.089	0.400	1
865	1	83	ILE	CB	C	38.497	0.400	1
866	1	83	ILE	CG1	C	27.310	0.400	1
867	1	83	ILE	CG2	C	17.541	0.400	1
868	1	83	ILE	N	N	123.174	0.400	1
869	1	84	VAL	H	H	8.234	0.020	1
870	1	84	VAL	HA	H	4.048	0.020	1
871	1	84	VAL	HB	H	1.890	0.020	1
872	1	84	VAL	HG11	H	0.791	0.020	2
873	1	84	VAL	HG12	H	0.791	0.020	2
874	1	84	VAL	HG13	H	0.791	0.020	2
875	1	84	VAL	C	C	175.487	0.400	1
876	1	84	VAL	CA	C	62.152	0.400	1
877	1	84	VAL	CB	C	32.911	0.400	1
878	1	84	VAL	CG1	C	20.722	0.400	2
879	1	84	VAL	N	N	125.035	0.400	1
880	1	85	SER	H	H	8.227	0.020	1
881	1	85	SER	HA	H	4.385	0.020	1
882	1	85	SER	HB2	H	3.699	0.020	2
883	1	85	SER	C	C	173.986	0.400	1
884	1	85	SER	CA	C	57.682	0.400	1
885	1	85	SER	CB	C	64.097	0.400	1
886	1	85	SER	N	N	119.370	0.400	1
887	1	86	TYR	H	H	8.310	0.020	1
888	1	86	TYR	HA	H	4.257	0.020	1
889	1	86	TYR	HB2	H	2.203	0.020	2
890	1	86	TYR	HB3	H	1.785	0.020	2
891	1	86	TYR	C	C	176.971	0.400	1
892	1	86	TYR	CA	C	57.962	0.400	1
893	1	86	TYR	CB	C	38.907	0.400	1
894	1	86	TYR	N	N	122.809	0.400	1
895	1	87	GLU	H	H	8.157	0.020	1
896	1	87	GLU	HA	H	4.192	0.020	1
897	1	87	GLU	HB2	H	1.941	0.020	2
898	1	87	GLU	HB3	H	1.781	0.020	2
899	1	87	GLU	HG2	H	2.134	0.020	2
900	1	87	GLU	C	C	175.993	0.400	1
901	1	87	GLU	CA	C	56.484	0.400	1
902	1	87	GLU	CB	C	30.522	0.400	1
903	1	87	GLU	CG	C	36.274	0.400	1
904	1	87	GLU	N	N	117.717	0.400	1
905	1	88	ASN	H	H	8.277	0.020	1
906	1	88	ASN	HA	H	4.516	0.020	1
907	1	88	ASN	HB2	H	2.699	0.020	2
908	1	88	ASN	HB3	H	2.593	0.020	2
909	1	88	ASN	HD21	H	8.298	0.020	2
910	1	88	ASN	C	C	176.769	0.400	1
911	1	88	ASN	CA	C	54.538	0.400	1
912	1	88	ASN	CB	C	41.441	0.400	1
913	1	88	ASN	N	N	121.276	0.400	1
914	1	88	ASN	ND2	N	114.155	0.400	1
915	1	89	GLY	H	H	8.279	0.020	1
916	1	89	GLY	HA2	H	3.841	0.020	2
917	1	89	GLY	C	C	174.339	0.400	1
918	1	89	GLY	CA	C	45.576	0.400	1
919	1	89	GLY	N	N	109.242	0.400	1
920	1	90	ASP	H	H	8.403	0.020	1
921	1	90	ASP	HA	H	4.533	0.020	1
922	1	90	ASP	HB2	H	2.605	0.020	2
923	1	90	ASP	HB3	H	2.524	0.020	2
924	1	90	ASP	C	C	176.156	0.400	1
925	1	90	ASP	CA	C	54.496	0.400	1
926	1	90	ASP	CB	C	41.164	0.400	1
927	1	90	ASP	N	N	120.131	0.400	1
928	1	91	ASN	H	H	8.354	0.020	1
929	1	91	ASN	HA	H	4.650	0.020	1
930	1	91	ASN	HB2	H	2.773	0.020	2
931	1	91	ASN	HB3	H	2.670	0.020	2
932	1	91	ASN	HD21	H	7.607	0.020	2
933	1	91	ASN	HD22	H	6.907	0.020	2
934	1	91	ASN	C	C	175.334	0.400	1
935	1	91	ASN	CA	C	53.482	0.400	1
936	1	91	ASN	CB	C	38.895	0.400	1
937	1	91	ASN	N	N	118.709	0.400	1
938	1	91	ASN	ND2	N	112.661	0.400	1
939	1	92	VAL	H	H	7.994	0.020	1
940	1	92	VAL	HA	H	3.989	0.020	1
941	1	92	VAL	HB	H	2.010	0.020	1
942	1	92	VAL	HG11	H	0.831	0.020	2
943	1	92	VAL	HG12	H	0.831	0.020	2
944	1	92	VAL	HG13	H	0.831	0.020	2
945	1	92	VAL	C	C	175.760	0.400	1
946	1	92	VAL	CA	C	62.728	0.400	1
947	1	92	VAL	CB	C	32.546	0.400	1
948	1	92	VAL	CG1	C	21.214	0.400	2
949	1	92	VAL	CG2	C	21.214	0.400	2
950	1	92	VAL	N	N	119.902	0.400	1
951	1	93	ASN	H	H	8.491	0.020	1
952	1	93	ASN	HA	H	4.665	0.020	1
953	1	93	ASN	HB2	H	2.797	0.020	2
954	1	93	ASN	HB3	H	2.655	0.020	2
955	1	93	ASN	HD21	H	7.606	0.020	2
956	1	93	ASN	HD22	H	6.907	0.020	2
957	1	93	ASN	C	C	175.329	0.400	1
958	1	93	ASN	CA	C	53.235	0.400	1
959	1	93	ASN	CB	C	38.728	0.400	1
960	1	93	ASN	N	N	121.876	0.400	1
961	1	93	ASN	ND2	N	112.411	0.400	1
962	1	94	LEU	H	H	8.268	0.020	1
963	1	94	LEU	HA	H	4.259	0.020	1
964	1	94	LEU	HB2	H	1.574	0.020	2
965	1	94	LEU	HB3	H	1.536	0.020	2
966	1	94	LEU	HD11	H	0.830	0.020	2
967	1	94	LEU	HD12	H	0.830	0.020	2
968	1	94	LEU	HD13	H	0.830	0.020	2
969	1	94	LEU	C	C	177.620	0.400	1
970	1	94	LEU	CA	C	55.542	0.400	1
971	1	94	LEU	CB	C	42.205	0.400	1
972	1	94	LEU	CG	C	26.977	0.400	1
973	1	94	LEU	CD1	C	24.980	0.400	2
974	1	94	LEU	CD2	C	23.289	0.400	2
975	1	94	LEU	N	N	123.434	0.400	1
976	1	95	SER	H	H	8.243	0.020	1
977	1	95	SER	HA	H	4.321	0.020	1
978	1	95	SER	HB2	H	3.827	0.020	2
979	1	95	SER	C	C	174.707	0.400	1
980	1	95	SER	CA	C	59.006	0.400	1
981	1	95	SER	CB	C	63.741	0.400	1
982	1	95	SER	N	N	115.926	0.400	1
983	1	96	GLU	H	H	8.246	0.020	1
984	1	96	GLU	HA	H	4.208	0.020	1
985	1	96	GLU	HB2	H	1.992	0.020	2
986	1	96	GLU	HB3	H	1.857	0.020	2
987	1	96	GLU	HG2	H	2.167	0.020	2
988	1	96	GLU	HG3	H	2.272	0.020	2
989	1	96	GLU	C	C	176.215	0.400	1
990	1	96	GLU	CA	C	56.735	0.400	1
991	1	96	GLU	CB	C	30.279	0.400	1
992	1	96	GLU	CG	C	36.161	0.400	1
993	1	96	GLU	N	N	122.313	0.400	1
994	1	97	ALA	H	H	8.174	0.020	1
995	1	97	ALA	HA	H	4.231	0.020	1
996	1	97	ALA	HB1	H	1.304	0.020	1
997	1	97	ALA	HB2	H	1.304	0.020	1
998	1	97	ALA	HB3	H	1.304	0.020	1
999	1	97	ALA	CA	C	52.728	0.400	1
1000	1	97	ALA	CB	C	19.035	0.400	1
1001	1	97	ALA	N	N	124.597	0.400	1
1002	1	98	ILE	H	H	7.999	0.020	1
1003	1	98	ILE	HA	H	4.056	0.020	1
1004	1	98	ILE	HB	H	1.765	0.020	1
1005	1	98	ILE	HG12	H	1.394	0.020	2
1006	1	98	ILE	HG13	H	1.101	0.020	2
1007	1	98	ILE	HG21	H	0.808	0.020	1
1008	1	98	ILE	HG22	H	0.808	0.020	1
1009	1	98	ILE	HG23	H	0.808	0.020	1
1010	1	98	ILE	HD11	H	0.676	0.020	1
1011	1	98	ILE	HD12	H	0.676	0.020	1
1012	1	98	ILE	HD13	H	0.676	0.020	1
1013	1	98	ILE	C	C	176.004	0.400	1
1014	1	98	ILE	CA	C	61.270	0.400	1
1015	1	98	ILE	CB	C	38.774	0.400	1
1016	1	98	ILE	CG1	C	27.325	0.400	1
1017	1	98	ILE	CG2	C	17.495	0.400	1
1018	1	98	ILE	N	N	119.317	0.400	1
1019	1	99	ASN	H	H	8.421	0.020	1
1020	1	99	ASN	HA	H	4.666	0.020	1
1021	1	99	ASN	HB2	H	2.773	0.020	2
1022	1	99	ASN	HB3	H	2.667	0.020	2
1023	1	99	ASN	HD21	H	6.905	0.020	2
1024	1	99	ASN	HD22	H	7.609	0.020	2
1025	1	99	ASN	C	C	175.351	0.400	1
1026	1	99	ASN	CA	C	53.298	0.400	1
1027	1	99	ASN	CB	C	38.733	0.400	1
1028	1	99	ASN	N	N	122.336	0.400	1
1029	1	99	ASN	ND2	N	112.181	0.400	1
1030	1	100	VAL	H	H	8.083	0.020	1
1031	1	100	VAL	HA	H	3.989	0.020	1
1032	1	100	VAL	HB	H	2.026	0.020	1
1033	1	100	VAL	HG11	H	0.849	0.020	2
1034	1	100	VAL	HG12	H	0.849	0.020	2
1035	1	100	VAL	HG13	H	0.849	0.020	2
1036	1	100	VAL	C	C	176.147	0.400	1
1037	1	100	VAL	CA	C	62.730	0.400	1
1038	1	100	VAL	CB	C	32.521	0.400	1
1039	1	100	VAL	CG1	C	21.312	0.400	2
1040	1	100	VAL	N	N	120.739	0.400	1
1041	1	101	GLN	H	H	8.377	0.020	1
1042	1	101	GLN	HA	H	4.241	0.020	1
1043	1	101	GLN	HB2	H	2.016	0.020	2
1044	1	101	GLN	HB3	H	1.911	0.020	2
1045	1	101	GLN	HG2	H	2.262	0.020	2
1046	1	101	GLN	HE21	H	6.856	0.020	2
1047	1	101	GLN	HE22	H	7.539	0.020	2
1048	1	101	GLN	CA	C	56.031	0.400	1
1049	1	101	GLN	CB	C	29.313	0.400	1
1050	1	101	GLN	N	N	123.357	0.400	1
1051	1	101	GLN	NE2	N	112.347	0.400	1
1052	1	102	LEU	H	H	8.232	0.020	1
1053	1	102	LEU	HA	H	4.297	0.020	1
1054	1	102	LEU	HB2	H	1.598	0.020	2
1055	1	102	LEU	HB3	H	1.522	0.020	2
1056	1	102	LEU	HG	H	1.545	0.020	1
1057	1	102	LEU	HD11	H	0.795	0.020	2
1058	1	102	LEU	HD12	H	0.795	0.020	2
1059	1	102	LEU	HD13	H	0.795	0.020	2
1060	1	102	LEU	C	C	177.513	0.400	1
1061	1	102	LEU	CA	C	55.472	0.400	1
1062	1	102	LEU	CB	C	42.532	0.400	1
1063	1	102	LEU	CG	C	26.980	0.400	1
1064	1	102	LEU	CD1	C	24.931	0.400	2
1065	1	102	LEU	N	N	123.315	0.400	1
1066	1	103	THR	H	H	8.102	0.020	1
1067	1	103	THR	HA	H	4.274	0.020	1
1068	1	103	THR	HB	H	4.154	0.020	1
1069	1	103	THR	HG21	H	1.123	0.020	1
1070	1	103	THR	HG22	H	1.123	0.020	1
1071	1	103	THR	HG23	H	1.123	0.020	1
1072	1	103	THR	C	C	174.431	0.400	1
1073	1	103	THR	CA	C	61.827	0.400	1
1074	1	103	THR	CB	C	69.761	0.400	1
1075	1	103	THR	N	N	115.008	0.400	1
1076	1	104	LEU	H	H	8.227	0.020	1
1077	1	104	LEU	HA	H	4.285	0.020	1
1078	1	104	LEU	HB2	H	1.560	0.020	2
1079	1	104	LEU	HD11	H	0.787	0.020	2
1080	1	104	LEU	HD12	H	0.787	0.020	2
1081	1	104	LEU	HD13	H	0.787	0.020	2
1082	1	104	LEU	C	C	177.022	0.400	1
1083	1	104	LEU	CA	C	55.268	0.400	1
1084	1	104	LEU	CB	C	42.485	0.400	1
1085	1	104	LEU	CD1	C	24.717	0.400	2
1086	1	104	LEU	N	N	124.533	0.400	1
1087	1	105	ASP	H	H	8.344	0.020	1
1088	1	105	ASP	HA	H	4.555	0.020	1
1089	1	105	ASP	HB2	H	2.660	0.020	2
1090	1	105	ASP	HB3	H	2.520	0.020	2
1091	1	105	ASP	C	C	176.429	0.400	1
1092	1	105	ASP	CA	C	54.421	0.400	1
1093	1	105	ASP	CB	C	41.211	0.400	1
1094	1	105	ASP	N	N	121.233	0.400	1
1095	1	106	THR	H	H	8.010	0.020	1
1096	1	106	THR	HA	H	4.183	0.020	1
1097	1	106	THR	HB	H	4.008	0.020	1
1098	1	106	THR	HG21	H	1.129	0.020	1
1099	1	106	THR	HG22	H	1.129	0.020	1
1100	1	106	THR	HG23	H	1.129	0.020	1
1101	1	106	THR	C	C	174.385	0.400	1
1102	1	106	THR	CA	C	61.993	0.400	1
1103	1	106	THR	CB	C	69.729	0.400	1
1104	1	106	THR	N	N	114.567	0.400	1
1105	1	107	LYS	H	H	8.255	0.020	1
1106	1	107	LYS	HA	H	4.254	0.020	1
1107	1	107	LYS	HB2	H	1.720	0.020	2
1108	1	107	LYS	HD2	H	1.339	0.020	2
1109	1	107	LYS	HE2	H	2.935	0.020	2
1110	1	107	LYS	C	C	176.240	0.400	1
1111	1	107	LYS	CA	C	56.086	0.400	1
1112	1	107	LYS	CB	C	32.791	0.400	1
1113	1	107	LYS	CD	C	28.917	0.400	1
1114	1	107	LYS	CE	C	42.088	0.400	1
1115	1	107	LYS	N	N	123.754	0.400	1
1116	1	108	LEU	H	H	8.273	0.020	1
1117	1	108	LEU	HA	H	4.497	0.020	1
1118	1	108	LEU	CA	C	53.228	0.400	1
1119	1	108	LEU	CB	C	41.508	0.400	1
1120	1	108	LEU	N	N	125.260	0.400	1
1121	1	109	PRO	HA	H	4.319	0.020	1
1122	1	109	PRO	HB2	H	1.813	0.020	2
1123	1	109	PRO	HD2	H	3.565	0.020	2
1124	1	109	PRO	HD3	H	3.765	0.020	2
1125	1	109	PRO	CA	C	63.238	0.400	1
1126	1	109	PRO	CB	C	31.980	0.400	1
1127	1	109	PRO	CD	C	50.558	0.400	1
1128	1	110	GLU	H	H	8.492	0.020	1
1129	1	110	GLU	HA	H	4.148	0.020	1
1130	1	110	GLU	HB2	H	1.964	0.020	2
1131	1	110	GLU	HB3	H	1.847	0.020	2
1132	1	110	GLU	HG2	H	2.202	0.020	2
1133	1	110	GLU	C	C	176.375	0.400	1
1134	1	110	GLU	CA	C	56.613	0.400	1
1135	1	110	GLU	CB	C	30.332	0.400	1
1136	1	110	GLU	CG	C	36.349	0.400	1
1137	1	110	GLU	N	N	120.927	0.400	1
1138	1	111	ALA	H	H	8.322	0.020	1
1139	1	111	ALA	HA	H	4.219	0.020	1
1140	1	111	ALA	HB1	H	1.317	0.020	1
1141	1	111	ALA	HB2	H	1.317	0.020	1
1142	1	111	ALA	HB3	H	1.317	0.020	1
1143	1	111	ALA	C	C	177.780	0.400	1
1144	1	111	ALA	CA	C	52.684	0.400	1
1145	1	111	ALA	CB	C	19.016	0.400	1
1146	1	111	ALA	N	N	125.538	0.400	1
1147	1	112	LYS	H	H	8.257	0.020	1
1148	1	112	LYS	HA	H	4.182	0.020	1
1149	1	112	LYS	HB2	H	1.707	0.020	2
1150	1	112	LYS	HG2	H	1.183	0.020	2
1151	1	112	LYS	HD2	H	1.335	0.020	2
1152	1	112	LYS	HE2	H	2.899	0.020	2
1153	1	112	LYS	CA	C	56.586	0.400	1
1154	1	112	LYS	CB	C	33.044	0.400	1
1155	1	112	LYS	N	N	120.526	0.400	1
1156	1	113	GLU	H	H	8.372	0.020	1
1157	1	113	GLU	HA	H	4.159	0.020	1
1158	1	113	GLU	HB2	H	1.911	0.020	2
1159	1	113	GLU	HB3	H	1.812	0.020	2
1160	1	113	GLU	HG2	H	2.323	0.020	2
1161	1	113	GLU	HG3	H	2.133	0.020	2
1162	1	113	GLU	C	C	176.306	0.400	1
1163	1	113	GLU	CA	C	56.526	0.400	1
1164	1	113	GLU	CB	C	30.103	0.400	1
1165	1	113	GLU	CG	C	36.318	0.400	1
1166	1	113	GLU	N	N	121.193	0.400	1
1167	1	114	LEU	H	H	8.148	0.020	1
1168	1	114	LEU	C	C	172.682	0.400	1
1169	1	114	LEU	CA	C	55.247	0.400	1
1170	1	114	LEU	CB	C	42.408	0.400	1
1171	1	114	LEU	N	N	122.781	0.400	1
1172	1	115	HIS	H	H	8.702	0.020	1
1173	1	115	HIS	N	N	122.365	0.400	1

Release date

2023-02-01

Citation

Solution structure of the N-terminal extension domain of a Schistosoma japonicum asparaginyl-tRNA synthetase
Ruscher, R., Ryan, S., Buitrago, G., McHugh, C., Love, N.C., Pinlac, T., Haertlein, M., Kron, M.A., Loukas, A., Daly, N.L., Peck, Y., Pickering, D., Mobli, M., Liddell, M.J., Wilson, D.T.
J. Biomol. Struct. Dyn. (2023), 1-11, PubMed 37572327 , DOI 10.1080/07391102.2023.2241918 , Abstract

Related entities 1. Asparagine--tRNA ligase, : 1 : 16 entities Detail

Experiments performed 9 experiments Detail

1 3D 1H-13C NOESY aliphatic