BMRBj - BMREntryMaster

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BMRB: 34736

8A4F

Human Interleukin-4 mutant - C3T-IL4

Authors

Vaz, D.C., Rodrigues, J.R., Mueller, T.D., Sebald, W., Redfield, C., Brito, R.M.M.

Assembly

Interleukin-4

Entity

1. Interleukin-4 (polymer), 129 monomers, 14960.99 Da Detail

HKTDITLQEI IKTLNSLTEQ KTLCTELTVT DIFAASKNTT EKETFCRAAT VLRQFYSHHE KDTRCLGATA QQFHRHKQLI RFLKRLDRNL WGLAGLNSCP VKEANQSTLE NFLERLKTIM REKYSKCSS

Formula weight

14960.99 Da

Entity Connection

disulfide 2 Detail

ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS24:SG	1:CYS65:SG
2	disulfide	sing	1:CYS46:SG	1:CYS99:SG

Source organism

Homo sapiens

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 741, ¹⁵N: 124 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	2	LYS	H	H	8.680	0.02	1
2	1	2	LYS	HA	H	4.270	0.02	1
3	1	2	LYS	HB2	H	1.820	0.02	2
4	1	2	LYS	HB3	H	1.820	0.02	2
5	1	2	LYS	HG2	H	1.410	0.02	2
6	1	2	LYS	HG3	H	1.410	0.02	2
7	1	2	LYS	N	N	124.200	0.30	1
8	1	3	THR	H	H	8.320	0.02	1
9	1	3	THR	HA	H	4.320	0.02	1
10	1	3	THR	HB	H	4.210	0.02	1
11	1	3	THR	HG21	H	1.210	0.02	1
12	1	3	THR	HG22	H	1.210	0.02	1
13	1	3	THR	HG23	H	1.210	0.02	1
14	1	3	THR	N	N	115.800	0.30	1
15	1	4	ASP	H	H	8.280	0.02	1
16	1	4	ASP	HA	H	4.210	0.02	1
17	1	4	ASP	HB2	H	2.750	0.02	2
18	1	4	ASP	HB3	H	2.820	0.02	2
19	1	4	ASP	N	N	124.900	0.30	1
20	1	5	ILE	H	H	8.060	0.02	1
21	1	5	ILE	HA	H	3.990	0.02	1
22	1	5	ILE	HB	H	1.980	0.02	2
23	1	5	ILE	HG12	H	1.530	0.02	2
24	1	5	ILE	HG13	H	1.350	0.02	2
25	1	5	ILE	HG21	H	0.920	0.02	1
26	1	5	ILE	HG22	H	0.920	0.02	1
27	1	5	ILE	HG23	H	0.920	0.02	1
28	1	5	ILE	HD11	H	0.920	0.02	1
29	1	5	ILE	HD12	H	0.920	0.02	1
30	1	5	ILE	HD13	H	0.920	0.02	1
31	1	5	ILE	N	N	123.300	0.30	1
32	1	6	THR	H	H	7.970	0.02	1
33	1	6	THR	HA	H	3.990	0.02	1
34	1	6	THR	HB	H	4.250	0.02	1
35	1	6	THR	HG21	H	1.210	0.02	1
36	1	6	THR	HG22	H	1.210	0.02	1
37	1	6	THR	HG23	H	1.210	0.02	1
38	1	6	THR	N	N	119.200	0.30	1
39	1	7	LEU	H	H	8.290	0.02	1
40	1	7	LEU	HA	H	3.880	0.02	1
41	1	7	LEU	HB2	H	1.830	0.02	4
42	1	7	LEU	HB3	H	1.470	0.02	4
43	1	7	LEU	HG	H	1.720	0.02	4
44	1	7	LEU	HD11	H	0.920	0.02	2
45	1	7	LEU	HD12	H	0.920	0.02	2
46	1	7	LEU	HD13	H	0.920	0.02	2
47	1	7	LEU	HD21	H	0.810	0.02	2
48	1	7	LEU	HD22	H	0.810	0.02	2
49	1	7	LEU	HD23	H	0.810	0.02	2
50	1	7	LEU	N	N	122.900	0.30	1
51	1	8	GLN	H	H	8.130	0.02	1
52	1	8	GLN	HA	H	3.700	0.02	1
53	1	8	GLN	HB2	H	2.200	0.02	2
54	1	8	GLN	HB3	H	2.090	0.02	2
55	1	8	GLN	HG2	H	2.420	0.02	2
56	1	8	GLN	HG3	H	2.230	0.02	2
57	1	8	GLN	N	N	117.600	0.30	1
58	1	9	GLU	H	H	8.070	0.02	1
59	1	9	GLU	HA	H	3.990	0.02	1
60	1	9	GLU	HB2	H	2.200	0.02	2
61	1	9	GLU	HB3	H	2.090	0.02	2
62	1	9	GLU	HG2	H	2.270	0.02	2
63	1	9	GLU	HG3	H	2.270	0.02	2
64	1	9	GLU	N	N	121.200	0.30	1
65	1	10	ILE	H	H	8.220	0.02	1
66	1	10	ILE	HA	H	3.550	0.02	1
67	1	10	ILE	HB	H	2.020	0.02	2
68	1	10	ILE	HG12	H	1.910	0.02	2
69	1	10	ILE	HG13	H	1.910	0.02	2
70	1	10	ILE	HG21	H	0.770	0.02	1
71	1	10	ILE	HG22	H	0.770	0.02	1
72	1	10	ILE	HG23	H	0.770	0.02	1
73	1	10	ILE	HD11	H	0.620	0.02	1
74	1	10	ILE	HD12	H	0.620	0.02	1
75	1	10	ILE	HD13	H	0.620	0.02	1
76	1	10	ILE	N	N	124.600	0.30	1
77	1	11	ILE	H	H	8.160	0.02	1
78	1	11	ILE	HA	H	3.410	0.02	1
79	1	11	ILE	HB	H	1.720	0.02	2
80	1	11	ILE	HG12	H	1.540	0.02	2
81	1	11	ILE	HG13	H	0.880	0.02	2
82	1	11	ILE	HG21	H	0.810	0.02	1
83	1	11	ILE	HG22	H	0.810	0.02	1
84	1	11	ILE	HG23	H	0.810	0.02	1
85	1	11	ILE	HD11	H	0.620	0.02	1
86	1	11	ILE	HD12	H	0.620	0.02	1
87	1	11	ILE	HD13	H	0.620	0.02	1
88	1	11	ILE	N	N	122.000	0.30	1
89	1	12	LYS	H	H	8.000	0.02	1
90	1	12	LYS	HA	H	3.850	0.02	1
91	1	12	LYS	HB2	H	1.940	0.02	2
92	1	12	LYS	HB3	H	1.940	0.02	2
93	1	12	LYS	HG2	H	1.610	0.02	4
94	1	12	LYS	HG3	H	1.400	0.02	4
95	1	12	LYS	N	N	120.200	0.30	1
96	1	13	THR	H	H	8.120	0.02	1
97	1	13	THR	HA	H	3.630	0.02	1
98	1	13	THR	HB	H	4.250	0.02	1
99	1	13	THR	N	N	117.700	0.30	1
100	1	14	LEU	H	H	8.570	0.02	1
101	1	14	LEU	HA	H	3.960	0.02	1
102	1	14	LEU	HB2	H	2.050	0.02	2
103	1	14	LEU	HB3	H	1.170	0.02	2
104	1	14	LEU	HG	H	1.800	0.02	1
105	1	14	LEU	HD11	H	0.920	0.02	2
106	1	14	LEU	HD12	H	0.920	0.02	2
107	1	14	LEU	HD13	H	0.920	0.02	2
108	1	14	LEU	HD21	H	0.700	0.02	2
109	1	14	LEU	HD22	H	0.700	0.02	2
110	1	14	LEU	HD23	H	0.700	0.02	2
111	1	14	LEU	N	N	123.500	0.30	1
112	1	15	ASN	H	H	8.600	0.02	1
113	1	15	ASN	HA	H	4.290	0.02	1
114	1	15	ASN	HB2	H	2.930	0.02	2
115	1	15	ASN	HB3	H	2.820	0.02	2
116	1	15	ASN	N	N	121.700	0.30	1
117	1	16	SER	H	H	7.830	0.02	1
118	1	16	SER	HA	H	4.210	0.02	1
119	1	16	SER	HB2	H	3.630	0.02	2
120	1	16	SER	HB3	H	3.630	0.02	2
121	1	16	SER	N	N	116.500	0.30	1
122	1	17	LEU	H	H	8.110	0.02	1
123	1	17	LEU	HA	H	4.070	0.02	1
124	1	17	LEU	HB2	H	1.980	0.02	2
125	1	17	LEU	HB3	H	1.470	0.02	2
126	1	17	LEU	HG	H	1.690	0.02	1
127	1	17	LEU	HD11	H	1.100	0.02	2
128	1	17	LEU	HD12	H	1.100	0.02	2
129	1	17	LEU	HD13	H	1.100	0.02	2
130	1	17	LEU	HD21	H	0.880	0.02	2
131	1	17	LEU	HD22	H	0.880	0.02	2
132	1	17	LEU	HD23	H	0.880	0.02	2
133	1	17	LEU	N	N	121.700	0.30	1
134	1	18	THR	H	H	7.700	0.02	1
135	1	18	THR	HA	H	4.430	0.02	1
136	1	18	THR	HB	H	4.510	0.02	1
137	1	18	THR	HG21	H	1.210	0.02	1
138	1	18	THR	HG22	H	1.210	0.02	1
139	1	18	THR	HG23	H	1.210	0.02	1
140	1	18	THR	N	N	104.800	0.30	1
141	1	19	GLU	H	H	7.390	0.02	1
142	1	19	GLU	HA	H	4.250	0.02	1
143	1	19	GLU	HB2	H	2.120	0.02	2
144	1	19	GLU	HB3	H	2.120	0.02	2
145	1	19	GLU	HG2	H	2.450	0.02	2
146	1	19	GLU	HG3	H	2.340	0.02	2
147	1	19	GLU	N	N	121.600	0.30	1
148	1	20	GLN	H	H	7.420	0.02	1
149	1	20	GLN	HA	H	4.510	0.02	1
150	1	20	GLN	HB2	H	2.120	0.02	2
151	1	20	GLN	HB3	H	1.970	0.02	2
152	1	20	GLN	HG2	H	2.340	0.02	2
153	1	20	GLN	HG3	H	2.340	0.02	2
154	1	20	GLN	N	N	117.400	0.30	1
155	1	21	LYS	H	H	8.300	0.02	1
156	1	21	LYS	HA	H	4.430	0.02	1
157	1	21	LYS	HB2	H	1.830	0.02	2
158	1	21	LYS	HB3	H	1.750	0.02	2
159	1	21	LYS	HG2	H	1.430	0.02	2
160	1	21	LYS	HG3	H	1.430	0.02	2
161	1	21	LYS	N	N	125.500	0.30	1
162	1	22	THR	H	H	8.280	0.02	1
163	1	22	THR	HA	H	4.430	0.02	1
164	1	22	THR	HB	H	4.540	0.02	1
165	1	22	THR	HG21	H	1.310	0.02	1
166	1	22	THR	HG22	H	1.310	0.02	1
167	1	22	THR	HG23	H	1.310	0.02	1
168	1	22	THR	N	N	115.400	0.30	1
169	1	23	LEU	H	H	8.530	0.02	1
170	1	23	LEU	HA	H	4.290	0.02	1
171	1	23	LEU	HB2	H	1.870	0.02	2
172	1	23	LEU	HB3	H	1.360	0.02	2
173	1	23	LEU	HG	H	1.720	0.02	1
174	1	23	LEU	HD11	H	0.950	0.02	2
175	1	23	LEU	HD12	H	0.950	0.02	2
176	1	23	LEU	HD13	H	0.950	0.02	2
177	1	23	LEU	HD21	H	0.950	0.02	2
178	1	23	LEU	HD22	H	0.950	0.02	2
179	1	23	LEU	HD23	H	0.950	0.02	2
180	1	23	LEU	N	N	123.600	0.30	1
181	1	24	CYS	H	H	8.470	0.02	1
182	1	24	CYS	HB2	H	3.660	0.02	2
183	1	24	CYS	HB3	H	3.150	0.02	2
184	1	24	CYS	N	N	114.000	0.30	1
185	1	25	THR	H	H	7.750	0.02	1
186	1	25	THR	HA	H	4.210	0.02	1
187	1	25	THR	HB	H	4.510	0.02	1
188	1	25	THR	HG21	H	1.320	0.02	1
189	1	25	THR	HG22	H	1.320	0.02	1
190	1	25	THR	HG23	H	1.320	0.02	1
191	1	25	THR	N	N	105.900	0.30	1
192	1	27	LEU	H	H	7.070	0.02	1
193	1	27	LEU	HA	H	4.430	0.02	1
194	1	27	LEU	HB2	H	2.050	0.02	2
195	1	27	LEU	HB3	H	1.580	0.02	2
196	1	27	LEU	HG	H	1.830	0.02	1
197	1	27	LEU	HD11	H	0.850	0.02	2
198	1	27	LEU	HD12	H	0.850	0.02	2
199	1	27	LEU	HD13	H	0.850	0.02	2
200	1	27	LEU	HD21	H	0.620	0.02	2
201	1	27	LEU	HD22	H	0.620	0.02	2
202	1	27	LEU	HD23	H	0.620	0.02	2
203	1	27	LEU	N	N	120.100	0.30	1
204	1	28	THR	H	H	8.050	0.02	1
205	1	28	THR	HA	H	5.020	0.02	1
206	1	28	THR	HB	H	4.210	0.02	1
207	1	28	THR	HG21	H	1.140	0.02	1
208	1	28	THR	HG22	H	1.140	0.02	1
209	1	28	THR	HG23	H	1.140	0.02	1
210	1	28	THR	N	N	103.700	0.30	1
211	1	29	VAL	H	H	9.030	0.02	1
212	1	29	VAL	HA	H	4.650	0.02	1
213	1	29	VAL	HB	H	1.140	0.02	1
214	1	29	VAL	HG11	H	0.700	0.02	2
215	1	29	VAL	HG12	H	0.700	0.02	2
216	1	29	VAL	HG13	H	0.700	0.02	2
217	1	29	VAL	HG21	H	0.290	0.02	2
218	1	29	VAL	HG22	H	0.290	0.02	2
219	1	29	VAL	HG23	H	0.290	0.02	2
220	1	29	VAL	N	N	113.600	0.30	1
221	1	30	THR	H	H	7.840	0.02	1
222	1	30	THR	HA	H	4.100	0.02	1
223	1	30	THR	HB	H	3.850	0.02	1
224	1	30	THR	HG21	H	1.100	0.02	1
225	1	30	THR	HG22	H	1.100	0.02	1
226	1	30	THR	HG23	H	1.100	0.02	1
227	1	30	THR	N	N	119.500	0.30	1
228	1	31	ASP	H	H	8.610	0.02	1
229	1	31	ASP	HA	H	4.690	0.02	1
230	1	31	ASP	HB2	H	2.780	0.02	2
231	1	31	ASP	HB3	H	2.340	0.02	2
232	1	31	ASP	N	N	126.100	0.30	1
233	1	32	ILE	H	H	6.610	0.02	1
234	1	32	ILE	HA	H	4.070	0.02	1
235	1	32	ILE	HB	H	1.940	0.02	1
236	1	32	ILE	HG12	H	0.700	0.02	2
237	1	32	ILE	HG13	H	0.440	0.02	2
238	1	32	ILE	HG21	H	0.880	0.02	1
239	1	32	ILE	HG22	H	0.880	0.02	1
240	1	32	ILE	HG23	H	0.880	0.02	1
241	1	32	ILE	HD11	H	0.330	0.02	1
242	1	32	ILE	HD12	H	0.330	0.02	1
243	1	32	ILE	HD13	H	0.330	0.02	1
244	1	32	ILE	N	N	120.400	0.30	1
245	1	33	PHE	H	H	8.120	0.02	1
246	1	33	PHE	HA	H	4.470	0.02	1
247	1	33	PHE	HB2	H	3.260	0.02	2
248	1	33	PHE	HB3	H	3.080	0.02	2
249	1	33	PHE	N	N	121.700	0.30	1
250	1	34	ALA	H	H	7.440	0.02	1
251	1	34	ALA	HA	H	4.250	0.02	1
252	1	34	ALA	HB1	H	1.430	0.02	1
253	1	34	ALA	HB2	H	1.430	0.02	1
254	1	34	ALA	HB3	H	1.430	0.02	1
255	1	34	ALA	N	N	125.900	0.30	1
256	1	35	ALA	H	H	7.750	0.02	1
257	1	35	ALA	HA	H	4.430	0.02	1
258	1	35	ALA	HB1	H	1.390	0.02	1
259	1	35	ALA	HB2	H	1.390	0.02	1
260	1	35	ALA	HB3	H	1.390	0.02	1
261	1	35	ALA	N	N	122.300	0.30	1
262	1	36	SER	H	H	7.870	0.02	1
263	1	36	SER	HA	H	4.430	0.02	1
264	1	36	SER	HB2	H	3.960	0.02	2
265	1	36	SER	HB3	H	3.880	0.02	2
266	1	36	SER	N	N	114.100	0.50	1
267	1	37	LYS	H	H	8.220	0.02	1
268	1	37	LYS	HA	H	4.240	0.02	1
269	1	37	LYS	HB2	H	1.790	0.02	2
270	1	37	LYS	HB3	H	1.790	0.02	2
271	1	37	LYS	HG2	H	1.430	0.02	2
272	1	37	LYS	HG3	H	1.430	0.02	2
273	1	37	LYS	N	N	124.900	0.30	1
274	1	38	ASN	H	H	8.470	0.02	1
275	1	38	ASN	HA	H	4.760	0.02	1
276	1	38	ASN	HB2	H	2.930	0.02	2
277	1	38	ASN	HB3	H	2.750	0.02	2
278	1	38	ASN	N	N	118.900	0.30	1
279	1	39	THR	H	H	7.780	0.02	1
280	1	39	THR	HA	H	4.540	0.02	1
281	1	39	THR	HB	H	4.100	0.02	1
282	1	39	THR	HG21	H	1.170	0.02	1
283	1	39	THR	HG22	H	1.170	0.02	1
284	1	39	THR	HG23	H	1.170	0.02	1
285	1	39	THR	N	N	114.700	0.30	1
286	1	40	THR	H	H	8.480	0.02	1
287	1	40	THR	HA	H	4.470	0.02	1
288	1	40	THR	HB	H	4.620	0.02	1
289	1	40	THR	HG21	H	1.310	0.02	1
290	1	40	THR	HG22	H	1.310	0.02	1
291	1	40	THR	HG23	H	1.310	0.02	1
292	1	40	THR	N	N	115.200	0.30	1
293	1	41	GLU	H	H	8.790	0.02	1
294	1	41	GLU	HA	H	3.660	0.02	1
295	1	41	GLU	HB2	H	1.800	0.02	2
296	1	41	GLU	HB3	H	1.870	0.02	2
297	1	41	GLU	N	N	125.300	0.30	1
298	1	42	LYS	H	H	8.080	0.02	1
299	1	42	LYS	HA	H	3.810	0.02	1
300	1	42	LYS	HB2	H	1.970	0.02	4
301	1	42	LYS	HB3	H	1.830	0.02	4
302	1	42	LYS	HG2	H	1.720	0.02	4
303	1	42	LYS	HG3	H	1.580	0.02	4
304	1	42	LYS	N	N	116.700	0.30	1
305	1	43	GLU	H	H	7.530	0.02	1
306	1	43	GLU	HA	H	3.850	0.02	1
307	1	43	GLU	HB2	H	1.910	0.02	4
308	1	43	GLU	HB3	H	1.830	0.02	4
309	1	43	GLU	HG2	H	2.200	0.02	4
310	1	43	GLU	HG3	H	2.200	0.02	4
311	1	43	GLU	N	N	118.700	0.30	1
312	1	44	THR	H	H	8.160	0.02	1
313	1	44	THR	HA	H	3.730	0.02	1
314	1	44	THR	HB	H	4.140	0.02	1
315	1	44	THR	HG21	H	1.140	0.02	1
316	1	44	THR	HG22	H	1.140	0.02	1
317	1	44	THR	HG23	H	1.140	0.02	1
318	1	44	THR	N	N	119.200	0.30	1
319	1	45	PHE	H	H	8.340	0.02	1
320	1	45	PHE	HA	H	4.510	0.02	1
321	1	45	PHE	HB2	H	3.300	0.02	2
322	1	45	PHE	HB3	H	3.190	0.02	2
323	1	45	PHE	N	N	121.300	0.30	1
324	1	46	CYS	H	H	8.190	0.02	1
325	1	46	CYS	HA	H	3.960	0.02	1
326	1	46	CYS	HB2	H	3.260	0.02	2
327	1	46	CYS	HB3	H	3.000	0.02	2
328	1	46	CYS	N	N	121.000	0.30	1
329	1	47	ARG	H	H	9.090	0.02	1
330	1	47	ARG	HA	H	3.880	0.02	1
331	1	47	ARG	HB2	H	2.090	0.02	4
332	1	47	ARG	HB3	H	2.090	0.02	4
333	1	47	ARG	HG2	H	1.940	0.02	4
334	1	47	ARG	HG3	H	1.650	0.02	4
335	1	47	ARG	N	N	126.400	0.30	1
336	1	48	ALA	H	H	8.820	0.02	1
337	1	48	ALA	HA	H	4.210	0.02	1
338	1	48	ALA	HB1	H	1.650	0.02	1
339	1	48	ALA	HB2	H	1.650	0.02	1
340	1	48	ALA	HB3	H	1.650	0.02	1
341	1	48	ALA	N	N	123.300	0.30	1
342	1	49	ALA	H	H	8.240	0.02	1
343	1	49	ALA	HA	H	3.990	0.02	1
344	1	49	ALA	HB1	H	1.650	0.02	1
345	1	49	ALA	HB2	H	1.650	0.02	1
346	1	49	ALA	HB3	H	1.650	0.02	1
347	1	49	ALA	N	N	121.900	0.30	1
348	1	50	THR	H	H	8.230	0.02	1
349	1	50	THR	HA	H	3.840	0.02	1
350	1	50	THR	HB	H	4.580	0.02	1
351	1	50	THR	HG21	H	1.320	0.02	1
352	1	50	THR	HG22	H	1.320	0.02	1
353	1	50	THR	HG23	H	1.320	0.02	1
354	1	50	THR	N	N	114.500	0.30	1
355	1	51	VAL	H	H	8.230	0.02	1
356	1	51	VAL	HA	H	3.850	0.02	1
357	1	51	VAL	HB	H	2.230	0.02	1
358	1	51	VAL	HG11	H	1.100	0.02	2
359	1	51	VAL	HG12	H	1.100	0.02	2
360	1	51	VAL	HG13	H	1.100	0.02	2
361	1	51	VAL	HG21	H	0.810	0.02	2
362	1	51	VAL	HG22	H	0.810	0.02	2
363	1	51	VAL	HG23	H	0.810	0.02	2
364	1	51	VAL	N	N	121.800	0.30	1
365	1	52	LEU	H	H	8.180	0.02	1
366	1	52	LEU	HA	H	3.940	0.02	1
367	1	52	LEU	HB2	H	2.180	0.02	4
368	1	52	LEU	HB3	H	1.410	0.02	4
369	1	52	LEU	HD11	H	0.900	0.02	2
370	1	52	LEU	HD12	H	0.900	0.02	2
371	1	52	LEU	HD13	H	0.900	0.02	2
372	1	52	LEU	HD21	H	0.790	0.02	2
373	1	52	LEU	HD22	H	0.790	0.02	2
374	1	52	LEU	HD23	H	0.790	0.02	2
375	1	52	LEU	N	N	121.700	0.30	1
376	1	54	GLN	H	H	8.220	0.02	1
377	1	54	GLN	HA	H	3.800	0.02	1
378	1	54	GLN	HB2	H	2.290	0.02	2
379	1	54	GLN	HB3	H	2.070	0.02	2
380	1	54	GLN	HG2	H	2.480	0.02	2
381	1	54	GLN	HG3	H	2.290	0.02	2
382	1	54	GLN	N	N	122.300	0.30	1
383	1	55	PHE	H	H	8.060	0.02	1
384	1	55	PHE	HA	H	4.360	0.02	1
385	1	55	PHE	HB2	H	3.480	0.02	2
386	1	55	PHE	HB3	H	3.180	0.02	2
387	1	55	PHE	N	N	120.300	0.30	1
388	1	56	TYR	H	H	9.240	0.02	1
389	1	56	TYR	HA	H	4.290	0.02	1
390	1	56	TYR	HB2	H	3.480	0.02	2
391	1	56	TYR	HB3	H	2.930	0.02	2
392	1	56	TYR	N	N	118.100	0.30	1
393	1	57	SER	H	H	8.000	0.02	1
394	1	57	SER	HA	H	4.430	0.02	1
395	1	57	SER	HB2	H	3.850	0.02	2
396	1	57	SER	HB3	H	3.810	0.02	2
397	1	57	SER	N	N	120.000	0.30	1
398	1	58	HIS	H	H	7.530	0.02	1
399	1	58	HIS	HA	H	4.580	0.02	1
400	1	58	HIS	HB2	H	2.780	0.02	2
401	1	58	HIS	HB3	H	2.750	0.02	2
402	1	58	HIS	N	N	116.700	0.30	1
403	1	59	HIS	H	H	7.900	0.02	1
404	1	59	HIS	HA	H	5.060	0.02	1
405	1	59	HIS	HB2	H	3.440	0.02	2
406	1	59	HIS	HB3	H	2.230	0.02	2
407	1	59	HIS	N	N	111.700	0.30	1
408	1	60	GLU	H	H	8.130	0.02	1
409	1	60	GLU	HA	H	3.960	0.02	1
410	1	60	GLU	HB2	H	2.600	0.02	4
411	1	60	GLU	HB3	H	2.310	0.02	4
412	1	60	GLU	HG2	H	2.120	0.02	2
413	1	60	GLU	HG3	H	2.120	0.02	2
414	1	60	GLU	N	N	127.000	0.30	1
415	1	61	LYS	H	H	8.670	0.02	1
416	1	61	LYS	HA	H	4.510	0.02	1
417	1	61	LYS	HB2	H	2.120	0.02	4
418	1	61	LYS	HB3	H	2.120	0.02	4
419	1	61	LYS	HG2	H	1.610	0.02	4
420	1	61	LYS	HG3	H	1.360	0.02	4
421	1	61	LYS	N	N	117.200	0.30	1
422	1	62	ASP	H	H	6.610	0.02	1
423	1	62	ASP	HA	H	4.620	0.02	1
424	1	62	ASP	HB2	H	3.000	0.02	2
425	1	62	ASP	HB3	H	2.710	0.02	2
426	1	62	ASP	N	N	120.400	0.30	1
427	1	63	THR	H	H	8.890	0.02	1
428	1	63	THR	HA	H	3.880	0.02	1
429	1	63	THR	HB	H	4.290	0.02	1
430	1	63	THR	HG21	H	1.360	0.02	1
431	1	63	THR	HG22	H	1.360	0.02	1
432	1	63	THR	HG23	H	1.360	0.02	1
433	1	63	THR	N	N	124.900	0.30	1
434	1	64	ARG	H	H	8.520	0.02	1
435	1	64	ARG	HA	H	4.100	0.02	1
436	1	64	ARG	HB2	H	1.870	0.02	4
437	1	64	ARG	HB3	H	1.720	0.02	4
438	1	64	ARG	N	N	123.300	0.30	1
439	1	65	CYS	H	H	7.460	0.02	1
440	1	65	CYS	HA	H	4.430	0.02	1
441	1	65	CYS	HB2	H	3.260	0.02	2
442	1	65	CYS	HB3	H	2.710	0.02	2
443	1	65	CYS	N	N	113.500	0.30	1
444	1	66	LEU	H	H	7.420	0.02	1
445	1	66	LEU	HA	H	3.740	0.02	1
446	1	66	LEU	HB2	H	1.650	0.02	2
447	1	66	LEU	HB3	H	1.470	0.02	2
448	1	66	LEU	HD11	H	0.790	0.02	2
449	1	66	LEU	HD12	H	0.790	0.02	2
450	1	66	LEU	HD13	H	0.790	0.02	2
451	1	66	LEU	HD21	H	0.790	0.02	2
452	1	66	LEU	HD22	H	0.790	0.02	2
453	1	66	LEU	HD23	H	0.790	0.02	2
454	1	66	LEU	N	N	120.800	0.30	1
455	1	67	GLY	H	H	7.110	0.02	1
456	1	67	GLY	HA2	H	3.960	0.02	2
457	1	67	GLY	HA3	H	3.700	0.02	2
458	1	68	ALA	H	H	8.440	0.02	1
459	1	68	ALA	HA	H	4.760	0.02	1
460	1	68	ALA	HB1	H	1.470	0.02	1
461	1	68	ALA	HB2	H	1.470	0.02	1
462	1	68	ALA	HB3	H	1.470	0.02	1
463	1	68	ALA	N	N	122.400	0.30	1
464	1	69	THR	H	H	7.610	0.02	1
465	1	69	THR	HA	H	4.760	0.02	1
466	1	69	THR	HB	H	4.690	0.02	1
467	1	69	THR	HG21	H	1.280	0.02	1
468	1	69	THR	HG22	H	1.280	0.02	1
469	1	69	THR	HG23	H	1.280	0.02	1
470	1	69	THR	N	N	105.900	0.30	1
471	1	70	ALA	H	H	9.010	0.02	1
472	1	70	ALA	HA	H	4.140	0.02	1
473	1	70	ALA	HB1	H	1.500	0.02	1
474	1	70	ALA	HB2	H	1.500	0.02	1
475	1	70	ALA	HB3	H	1.500	0.02	1
476	1	70	ALA	N	N	127.600	0.30	1
477	1	71	GLN	H	H	8.580	0.02	1
478	1	71	GLN	HA	H	4.250	0.02	1
479	1	71	GLN	HB2	H	2.200	0.02	2
480	1	71	GLN	HB3	H	2.090	0.02	2
481	1	71	GLN	HG2	H	2.490	0.02	2
482	1	71	GLN	HG3	H	2.490	0.02	2
483	1	71	GLN	N	N	118.100	0.30	1
484	1	72	GLN	H	H	7.860	0.02	1
485	1	72	GLN	HA	H	4.140	0.02	1
486	1	72	GLN	HB2	H	2.560	0.02	4
487	1	72	GLN	HB3	H	2.340	0.02	4
488	1	72	GLN	N	N	121.300	0.30	1
489	1	73	PHE	H	H	8.500	0.02	1
490	1	73	PHE	HA	H	4.580	0.02	1
491	1	73	PHE	HB2	H	3.480	0.02	2
492	1	73	PHE	HB3	H	3.300	0.02	2
493	1	73	PHE	N	N	125.200	0.30	1
494	1	74	HIS	H	H	8.500	0.02	1
495	1	74	HIS	HA	H	4.290	0.02	1
496	1	74	HIS	HB2	H	3.370	0.02	2
497	1	74	HIS	HB3	H	3.370	0.02	2
498	1	74	HIS	N	N	118.100	0.30	1
499	1	75	ARG	H	H	8.260	0.02	1
500	1	75	ARG	HA	H	4.070	0.02	1
501	1	75	ARG	HB2	H	2.120	0.02	2
502	1	75	ARG	HB3	H	2.020	0.02	2
503	1	75	ARG	HG2	H	1.800	0.02	2
504	1	75	ARG	HG3	H	1.800	0.02	2
505	1	75	ARG	HD2	H	3.370	0.02	2
506	1	75	ARG	HD3	H	3.300	0.02	2
507	1	75	ARG	N	N	120.600	0.30	1
508	1	76	HIS	H	H	8.360	0.02	1
509	1	76	HIS	HA	H	4.610	0.02	1
510	1	76	HIS	HB2	H	3.330	0.02	2
511	1	76	HIS	HB3	H	3.220	0.02	2
512	1	76	HIS	N	N	122.300	0.30	1
513	1	77	LYS	H	H	8.170	0.02	1
514	1	77	LYS	HA	H	3.660	0.02	1
515	1	77	LYS	HB2	H	1.870	0.02	4
516	1	77	LYS	HB3	H	1.720	0.02	4
517	1	77	LYS	HG2	H	1.430	0.02	4
518	1	77	LYS	HG3	H	1.430	0.02	4
519	1	77	LYS	N	N	118.300	0.30	1
520	1	78	GLN	H	H	7.900	0.02	1
521	1	78	GLN	HA	H	3.770	0.02	1
522	1	78	GLN	HG2	H	1.940	0.02	4
523	1	78	GLN	HG3	H	1.870	0.02	4
524	1	78	GLN	N	N	119.700	0.30	1
525	1	79	LEU	H	H	7.920	0.02	1
526	1	79	LEU	HA	H	4.070	0.02	1
527	1	79	LEU	HB2	H	1.760	0.02	2
528	1	79	LEU	HB3	H	1.760	0.02	2
529	1	79	LEU	HG	H	2.270	0.02	1
530	1	79	LEU	HD11	H	1.030	0.02	2
531	1	79	LEU	HD12	H	1.030	0.02	2
532	1	79	LEU	HD13	H	1.030	0.02	2
533	1	79	LEU	HD21	H	0.950	0.02	2
534	1	79	LEU	HD22	H	0.950	0.02	2
535	1	79	LEU	HD23	H	0.950	0.02	2
536	1	79	LEU	N	N	123.600	0.30	1
537	1	80	ILE	H	H	8.100	0.02	1
538	1	80	ILE	HA	H	3.840	0.02	1
539	1	80	ILE	HB	H	2.090	0.02	1
540	1	80	ILE	HG12	H	1.430	0.02	2
541	1	80	ILE	HG13	H	1.060	0.02	2
542	1	80	ILE	HG21	H	0.920	0.02	1
543	1	80	ILE	HG22	H	0.920	0.02	1
544	1	80	ILE	HG23	H	0.920	0.02	1
545	1	80	ILE	HD11	H	0.770	0.02	1
546	1	80	ILE	HD12	H	0.770	0.02	1
547	1	80	ILE	HD13	H	0.770	0.02	1
548	1	80	ILE	N	N	117.300	0.30	1
549	1	81	ARG	H	H	7.860	0.02	1
550	1	81	ARG	HA	H	3.810	0.02	1
551	1	81	ARG	HB2	H	2.090	0.02	2
552	1	81	ARG	HB3	H	1.800	0.02	2
553	1	81	ARG	HG2	H	1.390	0.02	2
554	1	81	ARG	HG3	H	1.390	0.02	2
555	1	81	ARG	HD2	H	3.080	0.02	2
556	1	81	ARG	HD3	H	2.970	0.02	2
557	1	81	ARG	N	N	120.600	0.30	1
558	1	82	PHE	H	H	8.570	0.02	1
559	1	82	PHE	HA	H	4.470	0.02	1
560	1	82	PHE	HB2	H	3.440	0.02	2
561	1	82	PHE	HB3	H	2.970	0.02	2
562	1	82	PHE	N	N	120.200	0.30	1
563	1	83	LEU	H	H	8.840	0.02	1
564	1	83	LEU	HA	H	4.140	0.02	1
565	1	83	LEU	HB2	H	2.380	0.02	2
566	1	83	LEU	HB3	H	2.270	0.02	2
567	1	83	LEU	HG	H	1.610	0.02	1
568	1	83	LEU	HD11	H	1.060	0.02	2
569	1	83	LEU	HD12	H	1.060	0.02	2
570	1	83	LEU	HD13	H	1.060	0.02	2
571	1	83	LEU	HD21	H	0.990	0.02	2
572	1	83	LEU	HD22	H	0.990	0.02	2
573	1	83	LEU	HD23	H	0.990	0.02	2
574	1	83	LEU	N	N	121.800	0.30	1
575	1	84	LYS	H	H	8.160	0.02	1
576	1	84	LYS	HA	H	3.810	0.02	1
577	1	84	LYS	N	N	120.200	0.30	1
578	1	85	ARG	H	H	7.680	0.02	1
579	1	85	ARG	HA	H	4.030	0.02	1
580	1	85	ARG	HB2	H	2.020	0.02	2
581	1	85	ARG	HB3	H	2.020	0.02	2
582	1	85	ARG	HG2	H	1.760	0.02	2
583	1	85	ARG	HG3	H	1.650	0.02	2
584	1	85	ARG	HD2	H	3.190	0.02	2
585	1	85	ARG	HD3	H	3.190	0.02	2
586	1	85	ARG	N	N	122.100	0.30	1
587	1	86	LEU	H	H	8.560	0.02	1
588	1	86	LEU	HA	H	4.100	0.02	1
589	1	86	LEU	HB2	H	1.800	0.02	4
590	1	86	LEU	HB3	H	1.800	0.02	4
591	1	86	LEU	HG	H	1.720	0.02	1
592	1	86	LEU	HD11	H	0.920	0.02	4
593	1	86	LEU	HD12	H	0.920	0.02	4
594	1	86	LEU	HD13	H	0.920	0.02	4
595	1	86	LEU	HD21	H	0.880	0.02	4
596	1	86	LEU	HD22	H	0.880	0.02	4
597	1	86	LEU	HD23	H	0.880	0.02	4
598	1	86	LEU	N	N	121.900	0.30	1
599	1	87	ASP	H	H	8.390	0.02	1
600	1	87	ASP	HA	H	4.290	0.02	1
601	1	87	ASP	HB2	H	3.330	0.02	2
602	1	87	ASP	HB3	H	3.190	0.02	2
603	1	87	ASP	N	N	118.300	0.30	1
604	1	88	ARG	H	H	7.650	0.02	1
605	1	88	ARG	HA	H	4.070	0.02	1
606	1	88	ARG	HB2	H	2.010	0.02	2
607	1	88	ARG	HB3	H	2.010	0.02	2
608	1	88	ARG	HG2	H	1.790	0.02	2
609	1	88	ARG	HG3	H	1.720	0.02	2
610	1	88	ARG	N	N	115.300	0.30	1
611	1	89	ASN	H	H	8.230	0.02	1
612	1	89	ASN	HA	H	4.580	0.02	1
613	1	89	ASN	HB2	H	2.780	0.02	2
614	1	89	ASN	HB3	H	2.450	0.02	2
615	1	89	ASN	N	N	117.800	0.30	1
616	1	90	LEU	H	H	8.790	0.02	1
617	1	90	LEU	HA	H	3.840	0.02	1
618	1	90	LEU	HB2	H	2.160	0.02	2
619	1	90	LEU	HB3	H	1.650	0.02	2
620	1	90	LEU	HG	H	1.750	0.02	1
621	1	90	LEU	HD11	H	0.840	0.02	2
622	1	90	LEU	HD12	H	0.840	0.02	2
623	1	90	LEU	HD13	H	0.840	0.02	2
624	1	90	LEU	HD21	H	0.660	0.02	2
625	1	90	LEU	HD22	H	0.660	0.02	2
626	1	90	LEU	HD23	H	0.660	0.02	2
627	1	90	LEU	N	N	123.300	0.30	1
628	1	91	TRP	H	H	9.150	0.02	1
629	1	91	TRP	HA	H	4.250	0.02	1
630	1	91	TRP	HB2	H	3.370	0.02	2
631	1	91	TRP	HB3	H	3.370	0.02	2
632	1	91	TRP	N	N	120.100	0.30	1
633	1	92	GLY	H	H	8.050	0.02	1
634	1	92	GLY	HA2	H	4.030	0.02	2
635	1	92	GLY	HA3	H	3.850	0.02	2
636	1	92	GLY	N	N	103.700	0.30	1
637	1	93	LEU	H	H	7.680	0.02	1
638	1	93	LEU	HA	H	4.180	0.02	1
639	1	93	LEU	HB2	H	2.010	0.02	2
640	1	93	LEU	HB3	H	1.540	0.02	2
641	1	93	LEU	HG	H	1.650	0.02	1
642	1	93	LEU	HD11	H	0.590	0.02	2
643	1	93	LEU	HD12	H	0.590	0.02	2
644	1	93	LEU	HD13	H	0.590	0.02	2
645	1	93	LEU	HD21	H	0.590	0.02	2
646	1	93	LEU	HD22	H	0.590	0.02	2
647	1	93	LEU	HD23	H	0.590	0.02	2
648	1	93	LEU	N	N	122.700	0.30	1
649	1	94	ALA	H	H	7.960	0.02	1
650	1	94	ALA	HA	H	4.210	0.02	1
651	1	94	ALA	HB1	H	1.580	0.02	1
652	1	94	ALA	HB2	H	1.580	0.02	1
653	1	94	ALA	HB3	H	1.580	0.02	1
654	1	94	ALA	N	N	121.300	0.30	1
655	1	95	GLY	H	H	7.580	0.02	1
656	1	95	GLY	HA2	H	3.810	0.02	2
657	1	95	GLY	HA3	H	3.700	0.02	2
658	1	95	GLY	N	N	110.500	0.30	1
659	1	96	LEU	H	H	7.590	0.02	1
660	1	96	LEU	HA	H	4.400	0.02	1
661	1	96	LEU	HB2	H	1.430	0.02	2
662	1	96	LEU	HB3	H	1.430	0.02	2
663	1	96	LEU	HG	H	1.610	0.02	1
664	1	96	LEU	HD11	H	0.840	0.02	2
665	1	96	LEU	HD12	H	0.840	0.02	2
666	1	96	LEU	HD13	H	0.840	0.02	2
667	1	96	LEU	HD21	H	0.840	0.02	2
668	1	96	LEU	HD22	H	0.840	0.02	2
669	1	96	LEU	HD23	H	0.840	0.02	2
670	1	96	LEU	N	N	119.800	0.30	1
671	1	97	ASN	H	H	8.500	0.02	1
672	1	97	ASN	HA	H	4.870	0.02	1
673	1	97	ASN	HB2	H	2.750	0.02	2
674	1	97	ASN	HB3	H	2.750	0.02	2
675	1	97	ASN	N	N	118.100	0.30	1
676	1	98	SER	H	H	7.530	0.02	1
677	1	98	SER	HA	H	4.650	0.02	1
678	1	98	SER	HB2	H	3.850	0.02	2
679	1	98	SER	HB3	H	3.850	0.02	2
680	1	98	SER	N	N	111.400	0.30	1
681	1	99	CYS	H	H	9.030	0.02	1
682	1	99	CYS	HA	H	4.950	0.02	1
683	1	99	CYS	HB2	H	3.550	0.02	2
684	1	99	CYS	HB3	H	3.660	0.02	2
685	1	99	CYS	N	N	119.900	0.30	1
686	1	100	PRO	HB2	H	2.230	0.02	2
687	1	100	PRO	HB3	H	1.800	0.02	2
688	1	100	PRO	HG2	H	2.010	0.02	2
689	1	100	PRO	HG3	H	1.980	0.02	2
690	1	101	VAL	H	H	8.480	0.02	1
691	1	101	VAL	HA	H	4.320	0.02	1
692	1	101	VAL	HB	H	1.940	0.02	1
693	1	101	VAL	HG11	H	0.990	0.02	2
694	1	101	VAL	HG12	H	0.990	0.02	2
695	1	101	VAL	HG13	H	0.990	0.02	2
696	1	101	VAL	HG21	H	0.810	0.02	2
697	1	101	VAL	HG22	H	0.810	0.02	2
698	1	101	VAL	HG23	H	0.810	0.02	2
699	1	101	VAL	N	N	124.900	0.30	1
700	1	102	LYS	H	H	8.580	0.02	1
701	1	102	LYS	HA	H	4.400	0.02	1
702	1	102	LYS	HB2	H	1.800	0.02	2
703	1	102	LYS	HB3	H	1.650	0.02	2
704	1	102	LYS	HG2	H	1.360	0.02	2
705	1	102	LYS	HG3	H	1.360	0.02	2
706	1	102	LYS	N	N	131.900	0.30	1
707	1	103	GLU	H	H	8.330	0.02	1
708	1	103	GLU	HA	H	4.210	0.02	1
709	1	103	GLU	HB2	H	1.910	0.02	2
710	1	103	GLU	HB3	H	1.910	0.02	2
711	1	103	GLU	HG2	H	2.230	0.02	2
712	1	103	GLU	HG3	H	2.230	0.02	2
713	1	103	GLU	N	N	125.800	0.30	1
714	1	104	ALA	H	H	8.180	0.02	1
715	1	104	ALA	HA	H	4.470	0.02	1
716	1	104	ALA	HB1	H	1.390	0.02	1
717	1	104	ALA	HB2	H	1.390	0.02	1
718	1	104	ALA	HB3	H	1.390	0.02	1
719	1	104	ALA	N	N	128.300	0.30	1
720	1	105	ASN	H	H	8.360	0.02	1
721	1	105	ASN	HA	H	4.690	0.02	1
722	1	105	ASN	HB2	H	2.960	0.02	2
723	1	105	ASN	HB3	H	2.780	0.02	2
724	1	105	ASN	N	N	119.000	0.30	1
725	1	106	GLN	H	H	8.790	0.02	1
726	1	106	GLN	HB3	H	2.050	0.02	2
727	1	106	GLN	HG2	H	2.340	0.02	2
728	1	106	GLN	HG3	H	2.340	0.02	2
729	1	106	GLN	N	N	120.600	0.30	1
730	1	107	SER	H	H	9.180	0.02	1
731	1	107	SER	HA	H	5.090	0.02	1
732	1	107	SER	HB2	H	3.700	0.02	2
733	1	107	SER	HB3	H	3.700	0.02	2
734	1	107	SER	N	N	116.500	0.30	1
735	1	108	THR	H	H	8.990	0.02	1
736	1	108	THR	HA	H	4.760	0.02	1
737	1	108	THR	HB	H	3.990	0.02	1
738	1	108	THR	HG21	H	1.420	0.02	1
739	1	108	THR	HG22	H	1.420	0.02	1
740	1	108	THR	HG23	H	1.420	0.02	1
741	1	108	THR	N	N	113.400	0.30	1
742	1	109	LEU	H	H	8.910	0.02	1
743	1	109	LEU	HA	H	4.430	0.02	1
744	1	109	LEU	HB2	H	1.790	0.02	2
745	1	109	LEU	HB3	H	0.950	0.02	2
746	1	109	LEU	HG	H	1.100	0.02	1
747	1	109	LEU	N	N	126.100	0.30	1
748	1	110	GLU	H	H	8.590	0.02	1
749	1	110	GLU	HA	H	3.960	0.02	1
750	1	110	GLU	HB2	H	2.080	0.02	2
751	1	110	GLU	HB3	H	1.940	0.02	2
752	1	110	GLU	HG2	H	2.340	0.02	2
753	1	110	GLU	HG3	H	2.340	0.02	2
754	1	110	GLU	N	N	118.100	0.30	1
755	1	111	ASN	H	H	7.940	0.02	1
756	1	111	ASN	HA	H	4.380	0.02	1
757	1	111	ASN	HB2	H	2.840	0.02	2
758	1	111	ASN	HB3	H	2.770	0.02	2
759	1	111	ASN	N	N	118.600	0.30	1
760	1	112	PHE	H	H	8.380	0.02	1
761	1	112	PHE	HA	H	4.430	0.02	1
762	1	112	PHE	HB2	H	3.480	0.02	2
763	1	112	PHE	HB3	H	2.970	0.02	2
764	1	112	PHE	HD1	H	7.220	0.02	1
765	1	112	PHE	HD2	H	7.220	0.02	1
766	1	112	PHE	N	N	123.800	0.30	1
767	1	113	LEU	H	H	8.930	0.02	1
768	1	113	LEU	HA	H	3.920	0.02	1
769	1	113	LEU	HB2	H	2.090	0.02	4
770	1	113	LEU	HB3	H	1.170	0.02	4
771	1	113	LEU	HD11	H	0.950	0.02	2
772	1	113	LEU	HD12	H	0.950	0.02	2
773	1	113	LEU	HD13	H	0.950	0.02	2
774	1	113	LEU	HD21	H	0.810	0.02	2
775	1	113	LEU	HD22	H	0.810	0.02	2
776	1	113	LEU	HD23	H	0.810	0.02	2
777	1	113	LEU	N	N	119.200	0.30	1
778	1	114	GLU	H	H	8.030	0.02	1
779	1	114	GLU	HA	H	4.070	0.02	1
780	1	114	GLU	N	N	119.900	0.30	1
781	1	115	ARG	H	H	7.960	0.02	1
782	1	115	ARG	HA	H	3.880	0.02	1
783	1	115	ARG	N	N	122.700	0.30	1
784	1	116	LEU	H	H	8.150	0.02	1
785	1	116	LEU	HA	H	3.810	0.02	1
786	1	116	LEU	N	N	121.100	0.30	1
787	1	117	LYS	H	H	8.460	0.02	1
788	1	117	LYS	HA	H	3.630	0.02	1
789	1	117	LYS	HB2	H	2.120	0.02	2
790	1	117	LYS	HB3	H	1.790	0.02	2
791	1	117	LYS	N	N	121.100	0.30	1
792	1	118	THR	H	H	7.890	0.02	1
793	1	118	THR	HA	H	3.810	0.02	1
794	1	118	THR	HB	H	4.290	0.02	1
795	1	118	THR	HG21	H	1.210	0.02	1
796	1	118	THR	HG22	H	1.210	0.02	1
797	1	118	THR	HG23	H	1.210	0.02	1
798	1	118	THR	N	N	116.800	0.30	1
799	1	119	ILE	H	H	7.780	0.02	1
800	1	119	ILE	HA	H	3.810	0.02	1
801	1	119	ILE	HB	H	1.910	0.02	1
802	1	119	ILE	HG12	H	1.580	0.02	2
803	1	119	ILE	HG13	H	1.170	0.02	2
804	1	119	ILE	HG21	H	1.030	0.02	1
805	1	119	ILE	HG22	H	1.030	0.02	1
806	1	119	ILE	HG23	H	1.030	0.02	1
807	1	119	ILE	HD11	H	0.920	0.02	1
808	1	119	ILE	HD12	H	0.920	0.02	1
809	1	119	ILE	HD13	H	0.920	0.02	1
810	1	119	ILE	N	N	123.100	0.30	1
811	1	120	MET	H	H	8.470	0.02	1
812	1	120	MET	HA	H	4.430	0.02	1
813	1	120	MET	HB2	H	2.010	0.02	2
814	1	120	MET	HB3	H	1.800	0.02	2
815	1	120	MET	HG2	H	2.710	0.02	1
816	1	120	MET	HG3	H	2.380	0.02	1
817	1	120	MET	HE1	H	1.910	0.02	1
818	1	120	MET	HE2	H	1.910	0.02	1
819	1	120	MET	HE3	H	1.910	0.02	1
820	1	120	MET	N	N	119.300	0.30	1
821	1	121	ARG	H	H	8.510	0.02	1
822	1	121	ARG	HA	H	4.030	0.02	1
823	1	121	ARG	N	N	120.500	0.30	1
824	1	122	GLU	H	H	8.020	0.02	1
825	1	122	GLU	HA	H	4.100	0.02	1
826	1	122	GLU	HB2	H	2.490	0.02	4
827	1	122	GLU	HB3	H	2.090	0.02	4
828	1	122	GLU	HG2	H	2.270	0.02	4
829	1	122	GLU	HG3	H	2.270	0.02	4
830	1	122	GLU	N	N	120.800	0.30	1
831	1	123	LYS	H	H	8.000	0.02	1
832	1	123	LYS	HA	H	4.430	0.02	1
833	1	123	LYS	N	N	120.100	0.30	1
834	1	124	TYR	H	H	8.360	0.02	1
835	1	124	TYR	HA	H	4.470	0.02	1
836	1	124	TYR	HB2	H	3.150	0.02	2
837	1	124	TYR	HB3	H	2.960	0.02	2
838	1	124	TYR	N	N	119.200	0.30	1
839	1	125	SER	H	H	8.080	0.02	1
840	1	125	SER	HA	H	4.210	0.02	1
841	1	125	SER	HB2	H	4.030	0.02	2
842	1	125	SER	HB3	H	4.030	0.02	2
843	1	125	SER	N	N	114.900	0.30	1
844	1	126	LYS	H	H	7.730	0.02	1
845	1	126	LYS	HA	H	4.320	0.02	1
846	1	126	LYS	HB2	H	1.870	0.02	4
847	1	126	LYS	HB3	H	1.970	0.02	4
848	1	126	LYS	HG2	H	1.570	0.02	4
849	1	126	LYS	HG3	H	1.470	0.02	4
850	1	126	LYS	N	N	121.700	0.30	1
851	1	127	CYS	H	H	8.040	0.02	1
852	1	127	CYS	HA	H	4.690	0.02	1
853	1	127	CYS	HB2	H	3.260	0.02	2
854	1	127	CYS	HB3	H	3.260	0.02	2
855	1	127	CYS	N	N	119.000	0.30	1
856	1	128	SER	H	H	8.100	0.02	1
857	1	128	SER	HA	H	4.510	0.02	1
858	1	128	SER	HB2	H	3.850	0.02	2
859	1	128	SER	HB3	H	3.660	0.02	2
860	1	128	SER	N	N	116.900	0.30	1
861	1	129	SER	H	H	7.880	0.02	1
862	1	129	SER	HA	H	4.290	0.02	1
863	1	129	SER	HB2	H	3.880	0.02	2
864	1	129	SER	HB3	H	3.880	0.02	2
865	1	129	SER	N	N	124.900	0.30	1

Release date

2022-07-04

Citation

RDC-refined NMR solution structure of IL-4 (pH 2.4)
Vaz, D.C., Rodrigues, J.R., Mueller, T.D., Sebald, W., Redfield, C., Brito, R.M.M.

Related entities 1. Interleukin-4, : 1 : 24 : 32 entities Detail

Interaction partners 1. Interleukin-4, : 4 interactors Detail

More details for 4 interactors identified by 2 citations

Experiments performed 6 experiments Detail

1 2D 1H-15N HSQC

Instrument

na Home-built - 750 MHz

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Pressure 1 (±0.01) atm, Temperature 298 (±0.1) K, pH 5.0 (±0.01), Details 1.5 mM [U-100% 15N] Interleukin-4 mutant, C3T-IL4, 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	Interleukin-4 mutant, C3T-IL4	[U-100% 15N]		1.5 (±0.1) mM

2 3D 1H-15N NOESY

Instrument

na Home-built - 750 MHz

Sample

#	Name	Isotope labeling	Type	Concentration
1	Interleukin-4 mutant, C3T-IL4	[U-100% 15N]		1.5 (±0.1) mM

3 3D 1H-15N TOCSY

Instrument

na Home-built - 750 MHz

Sample

#	Name	Isotope labeling	Type	Concentration
1	Interleukin-4 mutant, C3T-IL4	[U-100% 15N]		1.5 (±0.1) mM

4 2D HMQC-J

Instrument

na Home-built - 600 MHz

Sample

#	Name	Isotope labeling	Type	Concentration
1	Interleukin-4 mutant, C3T-IL4	[U-100% 15N]		1.5 (±0.1) mM

5 2D 1H-15N HSQC IPAP

Instrument

na Home-built - 600 MHz

Sample

State anisotropic, Solvent system 90% H2O/10% D2O, Pressure 1 (±0.01) atm, Temperature 298 (±0.1) K, pH 5.0 (±0.01), Details 1.5 mM [U-100% 15N] Interleukin-4 mutant, C3T-IL4, 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	Interleukin-4 mutant, C3T-IL4	[U-100% 15N]		1.5 (±0.1) mM

6 2D 1H-15N HSQC IPAP

Instrument

na Home-built - 600 MHz

Sample

#	Name	Isotope labeling	Type	Concentration
1	Interleukin-4 mutant, C3T-IL4	[U-100% 15N]		1.5 (±0.1) mM

Chemical shift validation 3 contents Detail

Properties

Input source #1: Assigned chemical shifts - Assigned chemical shifts	bmr34736_3.str
Diamagnetism of the molecular assembly	True (excluding Oxygen atoms)
Whether the assembly has a disulfide bond	True (see coordinates for details)
Whether the assembly has a other bond	None
Whether the assembly contains a cyclic polymer	None
Overall data processing status	Warning

Disulfide bonds

Ptnr_site_1	Ptnr_site_2	Redox_state_prediction_1	Redox_state_prediction_2	Distance (Å)
1:24:CYS:SG	1:65:CYS:SG	unknown	unknown	n/a
1:46:CYS:SG	1:99:CYS:SG	unknown	unknown	n/a

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

None

Non-standard residues

None

Content subtype: bmr34736_3.str

#	Content subtype	Saveframe	Status	# of rows	Experiment type	Sequence coverage (%)
1	Assigned chemical shifts	assigned_chemical_shifts_1	Warning	865		97.7 (chain: 1, length: 129)
1	Chemical shift references	chem_shift_reference_1	OK	2		No information

Assigned chemical shifts

Saveframe: assigned_chemical_shifts_1
- Status: Warning
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 129, Sequence coverage: 97.7%
- Total number of assignments
  - ¹H chemical shifts: 741
  - ¹⁵N chemical shifts: 124
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	811	601	74.1
¹⁵N chemical shifts	151	124	82.1

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	260	251	96.5
¹⁵N chemical shifts	128	124	96.9

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	551	350	63.5
¹⁵N chemical shifts	23	0	0.0

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	75	70	93.3

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	54	2	3.7
¹⁵N chemical shifts	1	0	0.0

Keywords 4-helix bundle, Backbone dynamics, C3T, IL-4, Interleukin-4, Molecular dynamics, cytokine, disulphide mutant

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Found 1 Document (0.491 seconds)

BMRB: 34736

Related entities 1. Interleukin-4, : 1 : 24 : 32 entities Detail

Interaction partners 1. Interleukin-4, : 4 interactors Detail

Experiments performed 6 experiments Detail

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Instrument

Sample

Chemical shift validation 3 contents Detail