BMRB: 31139

HADDOCK models of active human alphaM I-domain bound to the the C-terminal domain of the cytokine pleiotrophin

Authors

Wang, X., Nguyen, H.

Assembly

Integrin alpha-M, Pleiotrophin

Entity

1. Integrin alpha-M, Pleiotrophin, entity 1 (polymer), 184 monomers, 21115.86 Da Detail

DSDIAFLIDG SGSIIPHDFR RMKEFVSTVM EQLKKSKTLF SLMQYSEEFR IHFTFKEFQN NPNPRSLVKP ITQLLGRTHT ATGIRKVVRE LFNITNGARK NAFKILVVIT DGEKFGDPLG YEDVIPEADR EGVIRYVIGV GDAFRSEKSR QELNTIASKP PRDHVFQVNN FEALKTIQNQ LREK

2. Integrin alpha-M, Pleiotrophin, entity 2 (polymer, Thiol state: all disulfide bound), 57 monomers, 6460.400 Da Detail

NWKKQFGAEC KYQFQAWGEC DLNTALKTRT GSLKRALHNA ECQKTVTISK PCGKLTK

3. Integrin alpha-M, Pleiotrophin, entity MG (non-polymer), 24.305 Da

Total weight

27600.564 Da

Max. entity weight

21115.86 Da

Entity Connection

na 4, disulfide 2 Detail

---

ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	2:CYS10:SG	2:CYS42:SG
2	disulfide	sing	2:CYS20:SG	2:CYS52:SG
3	na	sing	1:SER11:OG	3:MG1:MG
4	na	sing	1:SER13:OG	3:MG1:MG
5	na	sing	1:THR78:OG1	3:MG1:MG
6	na	sing	2:GLU41:OE2	3:MG1:MG

Source organism

Homo sapiens

Exptl. method

solution NMR

Data set

assigned_chemical_shifts, spectral_peak_list

Chemcal Shifts

¹H: 367, ¹³C: 432, ¹⁵N: 129 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	8	ILE	C	C	172.5000	0.0000	1
2	1	9	ASP	H	H	7.9410	0.0000	1
3	1	9	ASP	C	C	172.7000	0.0000	1
4	1	9	ASP	CA	C	53.7000	0.0000	1
5	1	9	ASP	CB	C	41.8000	0.0000	1
6	1	9	ASP	N	N	127.4400	0.0000	1
7	1	10	GLY	H	H	8.8060	0.0000	1
8	1	10	GLY	C	C	176.3000	0.0000	1
9	1	10	GLY	CA	C	43.4000	0.0000	1
10	1	10	GLY	N	N	112.1800	0.0000	1
11	1	11	SER	H	H	8.7930	0.0000	1
12	1	11	SER	C	C	174.5000	0.0000	1
13	1	11	SER	CA	C	58.0000	0.0000	1
14	1	11	SER	CB	C	65.5000	0.0000	1
15	1	11	SER	N	N	117.2700	0.0000	1
16	1	12	GLY	H	H	9.9100	0.0000	1
17	1	12	GLY	C	C	175.1000	0.0000	1
18	1	12	GLY	CA	C	46.3000	0.0000	1
19	1	12	GLY	N	N	104.4100	0.0000	1
20	1	13	SER	H	H	9.5190	0.0000	1
21	1	13	SER	C	C	174.5000	0.0000	1
22	1	13	SER	CA	C	59.3000	0.0000	1
23	1	13	SER	CB	C	61.4000	0.0000	1
24	1	13	SER	N	N	115.0000	0.0000	1
25	1	14	ILE	H	H	7.6240	0.0000	1
26	1	14	ILE	C	C	176.4000	0.0000	1
27	1	14	ILE	CA	C	57.6000	0.0000	1
28	1	14	ILE	CB	C	33.2000	0.0000	1
29	1	14	ILE	N	N	126.9500	0.0000	1
30	1	15	ILE	H	H	9.1650	0.0000	1
31	1	15	ILE	CA	C	60.4000	0.0000	1
32	1	15	ILE	CB	C	35.6000	0.0000	1
33	1	15	ILE	N	N	126.9100	0.0000	1
34	1	17	HIS	C	C	178.3000	0.0000	1
35	1	18	ASP	H	H	7.4500	0.0000	1
36	1	18	ASP	C	C	177.8000	0.0000	1
37	1	18	ASP	CA	C	56.5000	0.0000	1
38	1	18	ASP	CB	C	39.4000	0.0000	1
39	1	18	ASP	N	N	118.9000	0.0000	1
40	1	19	PHE	H	H	8.3080	0.0000	1
41	1	19	PHE	C	C	177.5000	0.0000	1
42	1	19	PHE	CA	C	62.0000	0.0000	1
43	1	19	PHE	CB	C	38.3000	0.0000	1
44	1	19	PHE	N	N	124.2700	0.0000	1
45	1	20	ARG	H	H	8.0410	0.0000	1
46	1	20	ARG	C	C	179.8000	0.0000	1
47	1	20	ARG	CA	C	59.9000	0.0000	1
48	1	20	ARG	CB	C	28.8000	0.0000	1
49	1	20	ARG	N	N	116.3900	0.0000	1
50	1	21	ARG	H	H	7.5960	0.0000	1
51	1	21	ARG	C	C	178.4000	0.0000	1
52	1	21	ARG	CA	C	59.3000	0.0000	1
53	1	21	ARG	CB	C	28.8000	0.0000	1
54	1	21	ARG	N	N	119.4800	0.0000	1
55	1	22	MET	H	H	8.3470	0.0000	1
56	1	22	MET	C	C	178.0000	0.0000	1
57	1	22	MET	CA	C	59.4000	0.0000	1
58	1	22	MET	CB	C	31.6000	0.0000	1
59	1	22	MET	N	N	118.5700	0.0000	1
60	1	23	LYS	H	H	7.2660	0.0000	1
61	1	23	LYS	C	C	178.4000	0.0000	1
62	1	23	LYS	CA	C	60.3000	0.0000	1
63	1	23	LYS	CB	C	30.5000	0.0000	1
64	1	23	LYS	N	N	116.8100	0.0000	1
65	1	24	GLU	H	H	7.4160	0.0000	1
66	1	24	GLU	C	C	179.5000	0.0000	1
67	1	24	GLU	CA	C	58.2000	0.0000	1
68	1	24	GLU	CB	C	28.3000	0.0000	1
69	1	24	GLU	N	N	119.3100	0.0000	1
70	1	25	PHE	H	H	8.8740	0.0000	1
71	1	25	PHE	CA	C	58.9000	0.0000	1
72	1	25	PHE	CB	C	37.2000	0.0000	1
73	1	25	PHE	N	N	121.9100	0.0000	1
74	1	56	LYS	C	C	178.5000	0.0000	1
75	1	57	GLU	H	H	8.0050	0.0000	1
76	1	57	GLU	C	C	180.1000	0.0000	1
77	1	57	GLU	CA	C	59.0000	0.0000	1
78	1	57	GLU	CB	C	29.2000	0.0000	1
79	1	57	GLU	N	N	119.9600	0.0000	1
80	1	58	PHE	H	H	8.7330	0.0000	1
81	1	58	PHE	C	C	176.2000	0.0000	1
82	1	58	PHE	CA	C	61.6000	0.0000	1
83	1	58	PHE	CB	C	39.3000	0.0000	1
84	1	58	PHE	N	N	120.3900	0.0000	1
85	1	59	GLN	H	H	8.4120	0.0000	1
86	1	59	GLN	CA	C	58.6000	0.0000	1
87	1	59	GLN	CB	C	28.2000	0.0000	1
88	1	59	GLN	N	N	117.1600	0.0000	1
89	1	71	ILE	C	C	176.0000	0.0000	1
90	1	72	THR	H	H	8.2210	0.0000	1
91	1	72	THR	C	C	173.8000	0.0000	1
92	1	72	THR	CA	C	59.7000	0.0000	1
93	1	72	THR	CB	C	70.7000	0.0000	1
94	1	72	THR	N	N	120.0800	0.0000	1
95	1	73	GLN	H	H	8.4580	0.0000	1
96	1	73	GLN	C	C	178.2000	0.0000	1
97	1	73	GLN	CA	C	56.1000	0.0000	1
98	1	73	GLN	CB	C	27.3000	0.0000	1
99	1	73	GLN	N	N	126.3800	0.0000	1
100	1	74	LEU	H	H	9.0400	0.0000	1
101	1	74	LEU	C	C	179.7000	0.0000	1
102	1	74	LEU	CA	C	58.1000	0.0000	1
103	1	74	LEU	CB	C	43.3000	0.0000	1
104	1	74	LEU	N	N	129.6600	0.0000	1
105	1	75	LEU	H	H	7.8650	0.0000	1
106	1	75	LEU	C	C	174.7000	0.0000	1
107	1	75	LEU	CA	C	57.2000	0.0000	1
108	1	75	LEU	CB	C	39.0000	0.0000	1
109	1	75	LEU	N	N	109.2800	0.0000	1
110	1	76	GLY	H	H	7.8360	0.0000	1
111	1	76	GLY	CA	C	43.4000	0.0000	1
112	1	76	GLY	N	N	104.6500	0.0000	1
113	1	77	ARG	H	H	8.5144	0.0000	1
114	1	77	ARG	N	N	117.5313	0.0000	1
115	1	94	ILE	C	C	179.5000	0.0000	1
116	1	95	THR	H	H	8.7060	0.0000	1
117	1	95	THR	C	C	175.7000	0.0000	1
118	1	95	THR	CA	C	65.1000	0.0000	1
119	1	95	THR	CB	C	67.9000	0.0000	1
120	1	95	THR	N	N	117.1000	0.0000	1
121	1	96	ASN	H	H	7.9500	0.0000	1
122	1	96	ASN	C	C	175.6000	0.0000	1
123	1	96	ASN	CA	C	52.6000	0.0000	1
124	1	96	ASN	CB	C	39.1000	0.0000	1
125	1	96	ASN	N	N	117.6000	0.0000	1
126	1	97	GLY	H	H	8.1730	0.0000	1
127	1	97	GLY	C	C	173.1000	0.0000	1
128	1	97	GLY	CA	C	45.4000	0.0000	1
129	1	97	GLY	N	N	106.3900	0.0000	1
130	1	98	ALA	H	H	7.1450	0.0000	1
131	1	98	ALA	C	C	177.1000	0.0000	1
132	1	98	ALA	CA	C	51.6000	0.0000	1
133	1	98	ALA	CB	C	18.3000	0.0000	1
134	1	98	ALA	N	N	121.7300	0.0000	1
135	1	99	ARG	H	H	10.3560	0.0000	1
136	1	99	ARG	C	C	177.9000	0.0000	1
137	1	99	ARG	CA	C	56.2000	0.0000	1
138	1	99	ARG	CB	C	29.5000	0.0000	1
139	1	99	ARG	N	N	124.7700	0.0000	1
140	1	100	LYS	H	H	8.6490	0.0000	1
141	1	100	LYS	CA	C	58.0000	0.0000	1
142	1	100	LYS	CB	C	31.6000	0.0000	1
143	1	100	LYS	N	N	124.2600	0.0000	1
144	1	110	THR	C	C	171.6000	0.0000	1
145	1	111	ASP	H	H	7.1720	0.0000	1
146	1	111	ASP	C	C	177.5000	0.0000	1
147	1	111	ASP	CA	C	53.7000	0.0000	1
148	1	111	ASP	CB	C	40.1000	0.0000	1
149	1	111	ASP	N	N	124.2700	0.0000	1
150	1	112	GLY	H	H	7.8850	0.0000	1
151	1	112	GLY	C	C	171.6000	0.0000	1
152	1	112	GLY	CA	C	46.1000	0.0000	1
153	1	112	GLY	N	N	103.6500	0.0000	1
154	1	113	GLU	H	H	6.9230	0.0000	1
155	1	113	GLU	C	C	174.4000	0.0000	1
156	1	113	GLU	CA	C	53.7000	0.0000	1
157	1	113	GLU	CB	C	29.3000	0.0000	1
158	1	113	GLU	N	N	116.5200	0.0000	1
159	1	114	LYS	H	H	10.2290	0.0000	1
160	1	114	LYS	C	C	177.4000	0.0000	1
161	1	114	LYS	CA	C	59.0000	0.0000	1
162	1	114	LYS	CB	C	30.1000	0.0000	1
163	1	114	LYS	N	N	130.0600	0.0000	1
164	1	115	PHE	H	H	9.7430	0.0000	1
165	1	115	PHE	C	C	174.1000	0.0000	1
166	1	115	PHE	CA	C	59.1000	0.0000	1
167	1	115	PHE	CB	C	40.6000	0.0000	1
168	1	115	PHE	N	N	127.5800	0.0000	1
169	1	116	GLY	H	H	8.4890	0.0000	1
170	1	116	GLY	CA	C	44.0000	0.0000	1
171	1	116	GLY	N	N	115.7100	0.0000	1
172	1	118	PRO	C	C	177.1000	0.0000	1
173	1	119	LEU	H	H	8.5550	0.0000	1
174	1	119	LEU	C	C	176.6000	0.0000	1
175	1	119	LEU	CA	C	52.8000	0.0000	1
176	1	119	LEU	CB	C	42.2000	0.0000	1
177	1	119	LEU	N	N	118.1200	0.0000	1
178	1	120	GLY	H	H	9.0570	0.0000	1
179	1	120	GLY	C	C	175.9000	0.0000	1
180	1	120	GLY	CA	C	42.6000	0.0000	1
181	1	120	GLY	N	N	107.7100	0.0000	1
182	1	121	TYR	H	H	8.8320	0.0000	1
183	1	121	TYR	C	C	178.5000	0.0000	1
184	1	121	TYR	CA	C	62.1000	0.0000	1
185	1	121	TYR	CB	C	36.0000	0.0000	1
186	1	121	TYR	N	N	120.8100	0.0000	1
187	1	122	GLU	H	H	10.2090	0.0000	1
188	1	122	GLU	CA	C	58.3000	0.0000	1
189	1	122	GLU	CB	C	26.9000	0.0000	1
190	1	122	GLU	N	N	119.3800	0.0000	1
191	1	126	PRO	C	C	179.8000	0.0000	1
192	1	127	GLU	H	H	7.3420	0.0000	1
193	1	127	GLU	C	C	177.3000	0.0000	1
194	1	127	GLU	CA	C	58.9000	0.0000	1
195	1	127	GLU	CB	C	29.0000	0.0000	1
196	1	127	GLU	N	N	117.5200	0.0000	1
197	1	128	ALA	H	H	7.6530	0.0000	1
198	1	128	ALA	C	C	179.0000	0.0000	1
199	1	128	ALA	CA	C	55.2000	0.0000	1
200	1	128	ALA	CB	C	16.7000	0.0000	1
201	1	128	ALA	N	N	121.0400	0.0000	1
202	1	129	ASP	H	H	8.5300	0.0000	1
203	1	129	ASP	C	C	180.5000	0.0000	1
204	1	129	ASP	CA	C	56.9000	0.0000	1
205	1	129	ASP	CB	C	39.2000	0.0000	1
206	1	129	ASP	N	N	116.8000	0.0000	1
207	1	130	ARG	H	H	8.3800	0.0000	1
208	1	130	ARG	C	C	178.7000	0.0000	1
209	1	130	ARG	CA	C	58.9000	0.0000	1
210	1	130	ARG	N	N	123.0000	0.0000	1
211	1	131	GLU	H	H	7.7140	0.0000	1
212	1	131	GLU	C	C	176.8000	0.0000	1
213	1	131	GLU	CA	C	55.3000	0.0000	1
214	1	131	GLU	CB	C	29.0000	0.0000	1
215	1	131	GLU	N	N	115.4600	0.0000	1
216	1	132	GLY	H	H	7.7430	0.0000	1
217	1	132	GLY	C	C	174.1000	0.0000	1
218	1	132	GLY	CA	C	46.0000	0.0000	1
219	1	132	GLY	N	N	107.5400	0.0000	1
220	1	133	VAL	H	H	7.7980	0.0000	1
221	1	133	VAL	CA	C	61.8000	0.0000	1
222	1	133	VAL	CB	C	30.8000	0.0000	1
223	1	133	VAL	N	N	119.4500	0.0000	1
224	1	140	VAL	C	C	175.5000	0.0000	1
225	1	141	GLY	H	H	8.5740	0.0000	1
226	1	141	GLY	C	C	176.4000	0.0000	1
227	1	141	GLY	CA	C	46.5000	0.0000	1
228	1	141	GLY	N	N	108.6000	0.0000	1
229	1	142	ASP	H	H	9.3090	0.0000	1
230	1	142	ASP	C	C	177.1000	0.0000	1
231	1	142	ASP	CA	C	54.6000	0.0000	1
232	1	142	ASP	CB	C	39.7000	0.0000	1
233	1	142	ASP	N	N	127.5700	0.0000	1
234	1	143	ALA	H	H	7.5890	0.0000	1
235	1	143	ALA	C	C	178.4000	0.0000	1
236	1	143	ALA	CA	C	55.2000	0.0000	1
237	1	143	ALA	CB	C	19.6000	0.0000	1
238	1	143	ALA	N	N	121.2600	0.0000	1
239	1	144	PHE	H	H	8.6810	0.0000	1
240	1	144	PHE	C	C	177.1000	0.0000	1
241	1	144	PHE	CA	C	58.9000	0.0000	1
242	1	144	PHE	CB	C	37.2000	0.0000	1
243	1	144	PHE	N	N	109.2100	0.0000	1
244	1	145	ARG	H	H	8.1010	0.0000	1
245	1	145	ARG	C	C	175.6000	0.0000	1
246	1	145	ARG	CA	C	56.8000	0.0000	1
247	1	145	ARG	CB	C	30.1000	0.0000	1
248	1	145	ARG	N	N	119.3100	0.0000	1
249	1	146	SER	H	H	7.1950	0.0000	1
250	1	146	SER	C	C	173.7000	0.0000	1
251	1	146	SER	CA	C	55.9000	0.0000	1
252	1	146	SER	CB	C	65.0000	0.0000	1
253	1	146	SER	N	N	111.5500	0.0000	1
254	1	147	GLU	H	H	8.9920	0.0000	1
255	1	147	GLU	CA	C	59.1000	0.0000	1
256	1	147	GLU	CB	C	28.7000	0.0000	1
257	1	147	GLU	N	N	125.5600	0.0000	1
258	1	148	LYS	C	C	179.4000	0.0000	1
259	1	149	SER	H	H	7.6360	0.0000	1
260	1	149	SER	C	C	177.2000	0.0000	1
261	1	149	SER	CA	C	60.2000	0.0000	1
262	1	149	SER	CB	C	62.0000	0.0000	1
263	1	149	SER	N	N	115.1700	0.0000	1
264	1	150	ARG	H	H	8.1140	0.0000	1
265	1	150	ARG	CA	C	60.4000	0.0000	1
266	1	150	ARG	CB	C	29.3000	0.0000	1
267	1	150	ARG	N	N	123.4100	0.0000	1
268	1	151	GLN	C	C	179.3000	0.0000	1
269	1	152	GLU	H	H	7.9020	0.0000	1
270	1	152	GLU	C	C	178.7000	0.0000	1
271	1	152	GLU	CA	C	61.3000	0.0000	1
272	1	152	GLU	CB	C	27.6000	0.0000	1
273	1	152	GLU	N	N	123.1000	0.0000	1
274	1	153	LEU	H	H	7.8000	0.0000	1
275	1	153	LEU	C	C	178.7000	0.0000	1
276	1	153	LEU	CA	C	58.0000	0.0000	1
277	1	153	LEU	CB	C	38.4000	0.0000	1
278	1	153	LEU	N	N	115.1900	0.0000	1
279	1	154	ASN	H	H	7.4300	0.0000	1
280	1	154	ASN	C	C	176.4000	0.0000	1
281	1	154	ASN	CA	C	55.0000	0.0000	1
282	1	154	ASN	CB	C	37.0000	0.0000	1
283	1	154	ASN	N	N	114.1000	0.0000	1
284	1	155	THR	H	H	7.9410	0.0000	1
285	1	155	THR	C	C	175.3000	0.0000	1
286	1	155	THR	CA	C	65.5000	0.0000	1
287	1	155	THR	CB	C	68.1000	0.0000	1
288	1	155	THR	N	N	116.9600	0.0000	1
289	1	156	ILE	H	H	7.2910	0.0000	1
290	1	156	ILE	C	C	175.2000	0.0000	1
291	1	156	ILE	CA	C	63.5000	0.0000	1
292	1	156	ILE	CB	C	38.3000	0.0000	1
293	1	156	ILE	N	N	120.4600	0.0000	1
294	1	157	ALA	H	H	7.1630	0.0000	1
295	1	157	ALA	C	C	178.1000	0.0000	1
296	1	157	ALA	CA	C	52.1000	0.0000	1
297	1	157	ALA	CB	C	20.1000	0.0000	1
298	1	157	ALA	N	N	119.7700	0.0000	1
299	1	158	SER	H	H	8.2530	0.0000	1
300	1	158	SER	N	N	119.0600	0.0000	1
301	1	164	HIS	C	C	171.6000	0.0000	1
302	1	165	VAL	H	H	6.9720	0.0000	1
303	1	165	VAL	C	C	175.3000	0.0000	1
304	1	165	VAL	CA	C	61.3000	0.0000	1
305	1	165	VAL	CB	C	32.5000	0.0000	1
306	1	165	VAL	N	N	119.7700	0.0000	1
307	1	166	PHE	H	H	9.3820	0.0000	1
308	1	166	PHE	C	C	173.7000	0.0000	1
309	1	166	PHE	CA	C	56.6000	0.0000	1
310	1	166	PHE	CB	C	42.8000	0.0000	1
311	1	166	PHE	N	N	124.3100	0.0000	1
312	1	167	GLN	H	H	8.4700	0.0000	1
313	1	167	GLN	CA	C	54.3000	0.0000	1
314	1	167	GLN	CB	C	30.8000	0.0000	1
315	1	167	GLN	N	N	121.0000	0.0000	1
316	1	179	ASN	C	C	177.5000	0.0000	1
317	1	180	GLN	H	H	8.2890	0.0000	1
318	1	180	GLN	C	C	179.1000	0.0000	1
319	1	180	GLN	CA	C	58.7000	0.0000	1
320	1	180	GLN	CB	C	27.8000	0.0000	1
321	1	180	GLN	N	N	119.2000	0.0000	1
322	1	181	LEU	H	H	8.3300	0.0000	1
323	1	181	LEU	C	C	178.5000	0.0000	1
324	1	181	LEU	CA	C	57.9000	0.0000	1
325	1	181	LEU	CB	C	40.8000	0.0000	1
326	1	181	LEU	N	N	119.1000	0.0000	1
327	1	182	ARG	H	H	8.2730	0.0000	1
328	1	182	ARG	C	C	178.2000	0.0000	1
329	1	182	ARG	CA	C	59.5000	0.0000	1
330	1	182	ARG	CB	C	29.6000	0.0000	1
331	1	182	ARG	N	N	118.2300	0.0000	1
332	1	183	GLU	H	H	7.8590	0.0000	1
333	1	183	GLU	CA	C	58.8000	0.0000	1
334	1	183	GLU	CB	C	28.9000	0.0000	1
335	1	183	GLU	N	N	116.7700	0.0000	1
336	2	1	ASN	H	H	8.5510	0.0000	1
337	2	1	ASN	HA	H	4.6200	0.0000	1
338	2	1	ASN	HB2	H	2.7800	0.0000	2
339	2	1	ASN	HD21	H	6.8800	0.0000	2
340	2	1	ASN	HD22	H	7.6400	0.0000	2
341	2	1	ASN	C	C	175.1290	0.0000	1
342	2	1	ASN	CA	C	53.8320	0.0000	1
343	2	1	ASN	CB	C	38.6340	0.0000	1
344	2	1	ASN	N	N	120.9180	0.0000	1
345	2	1	ASN	ND2	N	113.4000	0.0000	1
346	2	2	TRP	H	H	8.0100	0.0000	1
347	2	2	TRP	HA	H	4.6040	0.0000	1
348	2	2	TRP	HB2	H	3.2900	0.0000	2
349	2	2	TRP	HB3	H	3.2000	0.0000	2
350	2	2	TRP	HD1	H	7.2800	0.0000	1
351	2	2	TRP	HE1	H	10.2000	0.0000	1
352	2	2	TRP	HE3	H	7.5000	0.0000	1
353	2	2	TRP	HZ2	H	7.4500	0.0000	1
354	2	2	TRP	HZ3	H	7.0200	0.0000	1
355	2	2	TRP	HH2	H	7.1400	0.0000	1
356	2	2	TRP	C	C	176.3740	0.0000	1
357	2	2	TRP	CA	C	57.6050	0.0000	1
358	2	2	TRP	CB	C	29.4870	0.0000	1
359	2	2	TRP	CD1	C	127.3000	0.0000	1
360	2	2	TRP	CE3	C	120.9000	0.0000	1
361	2	2	TRP	CZ2	C	114.7000	0.0000	1
362	2	2	TRP	CZ3	C	122.0000	0.0000	1
363	2	2	TRP	CH2	C	124.6000	0.0000	1
364	2	2	TRP	N	N	121.7910	0.0000	1
365	2	2	TRP	NE1	N	129.8000	0.0000	1
366	2	3	LYS	H	H	7.7510	0.0000	1
367	2	3	LYS	HA	H	4.0700	0.0000	1
368	2	3	LYS	HB2	H	1.6500	0.0000	2
369	2	3	LYS	HG2	H	0.9800	0.0000	2
370	2	3	LYS	HD2	H	1.5010	0.0000	2
371	2	3	LYS	HE2	H	2.8020	0.0000	2
372	2	3	LYS	C	C	176.6850	0.0000	1
373	2	3	LYS	CA	C	56.9260	0.0000	1
374	2	3	LYS	CB	C	32.8770	0.0000	1
375	2	3	LYS	CG	C	24.5600	0.0000	1
376	2	3	LYS	CD	C	29.0000	0.0000	1
377	2	3	LYS	CE	C	42.1800	0.0000	1
378	2	3	LYS	N	N	122.2890	0.0000	1
379	2	4	LYS	H	H	7.9630	0.0000	1
380	2	4	LYS	HA	H	4.1600	0.0000	1
381	2	4	LYS	HB2	H	1.7100	0.0000	2
382	2	4	LYS	HG2	H	1.3500	0.0000	2
383	2	4	LYS	HD2	H	1.5200	0.0000	2
384	2	4	LYS	HE2	H	2.9500	0.0000	2
385	2	4	LYS	C	C	176.7310	0.0000	1
386	2	4	LYS	CA	C	56.8040	0.0000	1
387	2	4	LYS	CB	C	32.9100	0.0000	1
388	2	4	LYS	CG	C	24.7700	0.0000	1
389	2	4	LYS	CD	C	29.2100	0.0000	1
390	2	4	LYS	CE	C	42.2800	0.0000	1
391	2	4	LYS	N	N	121.6910	0.0000	1
392	2	5	GLN	H	H	8.1770	0.0000	1
393	2	5	GLN	HA	H	4.2400	0.0000	1
394	2	5	GLN	HB2	H	1.9200	0.0000	2
395	2	5	GLN	HG2	H	2.1800	0.0000	2
396	2	5	GLN	C	C	175.6960	0.0000	1
397	2	5	GLN	CA	C	56.4160	0.0000	1
398	2	5	GLN	CB	C	29.7220	0.0000	1
399	2	5	GLN	CG	C	33.6400	0.0000	1
400	2	5	GLN	N	N	120.6110	0.0000	1
401	2	6	PHE	H	H	7.9900	0.0000	1
402	2	6	PHE	HA	H	4.7500	0.0000	1
403	2	6	PHE	HB2	H	3.0800	0.0000	2
404	2	6	PHE	HB3	H	3.3000	0.0000	2
405	2	6	PHE	HD1	H	7.2700	0.0000	3
406	2	6	PHE	HE1	H	7.3200	0.0000	3
407	2	6	PHE	C	C	175.9580	0.0000	1
408	2	6	PHE	CA	C	57.3390	0.0000	1
409	2	6	PHE	CB	C	39.8130	0.0000	1
410	2	6	PHE	CD1	C	132.1000	0.0000	3
411	2	6	PHE	CE1	C	131.3000	0.0000	3
412	2	6	PHE	N	N	119.9640	0.0000	1
413	2	7	GLY	H	H	8.4270	0.0000	1
414	2	7	GLY	HA2	H	4.0340	0.0000	2
415	2	7	GLY	C	C	174.2970	0.0000	1
416	2	7	GLY	CA	C	45.3060	0.0000	1
417	2	7	GLY	N	N	110.6740	0.0000	1
418	2	8	ALA	H	H	8.3160	0.0000	1
419	2	8	ALA	HA	H	4.2600	0.0000	1
420	2	8	ALA	HB1	H	1.4100	0.0000	1
421	2	8	ALA	HB2	H	1.4100	0.0000	1
422	2	8	ALA	HB3	H	1.4100	0.0000	1
423	2	8	ALA	C	C	178.0280	0.0000	1
424	2	8	ALA	CA	C	53.4000	0.0000	1
425	2	8	ALA	CB	C	19.3720	0.0000	1
426	2	8	ALA	N	N	124.2130	0.0000	1
427	2	9	GLU	H	H	8.6970	0.0000	1
428	2	9	GLU	HA	H	4.2400	0.0000	1
429	2	9	GLU	HB2	H	1.8900	0.0000	2
430	2	9	GLU	HG2	H	2.2500	0.0000	2
431	2	9	GLU	C	C	175.1270	0.0000	1
432	2	9	GLU	CA	C	57.2050	0.0000	1
433	2	9	GLU	CB	C	29.9240	0.0000	1
434	2	9	GLU	CG	C	36.3500	0.0000	1
435	2	9	GLU	N	N	117.4890	0.0000	1
436	2	10	CYS	H	H	7.7580	0.0000	1
437	2	10	CYS	HA	H	4.3100	0.0000	1
438	2	10	CYS	HB2	H	3.0300	0.0000	2
439	2	10	CYS	C	C	172.4360	0.0000	1
440	2	10	CYS	CA	C	53.3000	0.0000	1
441	2	10	CYS	CB	C	41.1220	0.0000	1
442	2	10	CYS	N	N	119.3050	0.0000	1
443	2	11	LYS	H	H	8.1740	0.0000	1
444	2	11	LYS	HA	H	4.6800	0.0000	1
445	2	11	LYS	HB2	H	1.6600	0.0000	2
446	2	11	LYS	HG2	H	1.2700	0.0000	2
447	2	11	LYS	HG3	H	1.3100	0.0000	2
448	2	11	LYS	HE2	H	2.8800	0.0000	2
449	2	11	LYS	C	C	174.8040	0.0000	1
450	2	11	LYS	CA	C	54.0090	0.0000	1
451	2	11	LYS	CB	C	33.6510	0.0000	1
452	2	11	LYS	CG	C	24.1100	0.0000	1
453	2	11	LYS	CD	C	28.4400	0.0000	1
454	2	11	LYS	CE	C	44.3100	0.0000	1
455	2	11	LYS	N	N	123.2480	0.0000	1
456	2	12	TYR	H	H	8.7690	0.0000	1
457	2	12	TYR	HA	H	4.4100	0.0000	1
458	2	12	TYR	HB2	H	2.7400	0.0000	2
459	2	12	TYR	HB3	H	2.8500	0.0000	2
460	2	12	TYR	HD1	H	6.4000	0.0000	3
461	2	12	TYR	HE1	H	6.3600	0.0000	3
462	2	12	TYR	C	C	174.6020	0.0000	1
463	2	12	TYR	CA	C	58.2040	0.0000	1
464	2	12	TYR	CB	C	42.1000	0.0000	1
465	2	12	TYR	CD1	C	132.1000	0.0000	3
466	2	12	TYR	CE1	C	117.8000	0.0000	3
467	2	12	TYR	N	N	122.6350	0.0000	1
468	2	13	GLN	H	H	8.5730	0.0000	1
469	2	13	GLN	HA	H	4.5900	0.0000	1
470	2	13	GLN	HB2	H	1.8100	0.0000	2
471	2	13	GLN	HB3	H	1.9900	0.0000	2
472	2	13	GLN	HG2	H	2.2030	0.0000	2
473	2	13	GLN	C	C	175.6340	0.0000	1
474	2	13	GLN	CA	C	54.1080	0.0000	1
475	2	13	GLN	CB	C	29.9000	0.0000	1
476	2	13	GLN	CG	C	33.4500	0.0000	1
477	2	13	GLN	N	N	120.9840	0.0000	1
478	2	14	PHE	H	H	9.2550	0.0000	1
479	2	14	PHE	HA	H	4.9700	0.0000	1
480	2	14	PHE	HB2	H	2.6900	0.0000	2
481	2	14	PHE	HB3	H	2.8500	0.0000	2
482	2	14	PHE	HD1	H	6.8800	0.0000	3
483	2	14	PHE	C	C	177.1490	0.0000	1
484	2	14	PHE	CA	C	58.9760	0.0000	1
485	2	14	PHE	CB	C	40.8370	0.0000	1
486	2	14	PHE	CD1	C	129.6000	0.0000	3
487	2	14	PHE	N	N	127.3890	0.0000	1
488	2	15	GLN	H	H	8.2730	0.0000	1
489	2	15	GLN	HA	H	4.4400	0.0000	1
490	2	15	GLN	HB2	H	1.9200	0.0000	2
491	2	15	GLN	HB3	H	2.0400	0.0000	2
492	2	15	GLN	HG2	H	2.4400	0.0000	2
493	2	15	GLN	HG3	H	2.2100	0.0000	2
494	2	15	GLN	C	C	176.7210	0.0000	1
495	2	15	GLN	CA	C	54.7070	0.0000	1
496	2	15	GLN	CB	C	29.9830	0.0000	1
497	2	15	GLN	CG	C	34.7000	0.0000	1
498	2	15	GLN	N	N	121.5140	0.0000	1
499	2	16	ALA	H	H	8.2930	0.0000	1
500	2	16	ALA	HA	H	4.2200	0.0000	1
501	2	16	ALA	HB1	H	1.4600	0.0000	1
502	2	16	ALA	HB2	H	1.4600	0.0000	1
503	2	16	ALA	HB3	H	1.4600	0.0000	1
504	2	16	ALA	C	C	178.7760	0.0000	1
505	2	16	ALA	CA	C	52.7510	0.0000	1
506	2	16	ALA	CB	C	19.5590	0.0000	1
507	2	16	ALA	N	N	122.4140	0.0000	1
508	2	17	TRP	H	H	8.1360	0.0000	1
509	2	17	TRP	HA	H	4.2600	0.0000	1
510	2	17	TRP	HB2	H	3.1300	0.0000	2
511	2	17	TRP	HB3	H	3.2800	0.0000	2
512	2	17	TRP	HE1	H	10.2000	0.0000	1
513	2	17	TRP	HZ2	H	7.3400	0.0000	1
514	2	17	TRP	HZ3	H	7.0300	0.0000	1
515	2	17	TRP	HH2	H	6.7500	0.0000	1
516	2	17	TRP	C	C	178.2900	0.0000	1
517	2	17	TRP	CA	C	58.9820	0.0000	1
518	2	17	TRP	CB	C	30.6330	0.0000	1
519	2	17	TRP	CZ2	C	114.7000	0.0000	1
520	2	17	TRP	CZ3	C	123.4000	0.0000	1
521	2	17	TRP	CH2	C	124.4000	0.0000	1
522	2	17	TRP	N	N	120.4120	0.0000	1
523	2	17	TRP	NE1	N	129.8000	0.0000	1
524	2	18	GLY	H	H	8.7630	0.0000	1
525	2	18	GLY	HA2	H	4.1600	0.0000	2
526	2	18	GLY	HA3	H	4.4200	0.0000	2
527	2	18	GLY	C	C	177.7000	0.0000	1
528	2	18	GLY	CA	C	44.2870	0.0000	1
529	2	18	GLY	N	N	109.8810	0.0000	1
530	2	19	GLU	H	H	8.4000	0.0000	1
531	2	19	GLU	HA	H	4.2300	0.0000	1
532	2	19	GLU	HB2	H	1.9600	0.0000	2
533	2	19	GLU	HB3	H	2.0600	0.0000	2
534	2	19	GLU	HG2	H	2.3700	0.0000	2
535	2	19	GLU	C	C	177.7700	0.0000	1
536	2	19	GLU	CA	C	55.7000	0.0000	1
537	2	19	GLU	CB	C	30.6000	0.0000	1
538	2	19	GLU	CG	C	36.1100	0.0000	1
539	2	19	GLU	N	N	116.9000	0.0000	1
540	2	20	CYS	H	H	8.9800	0.0000	1
541	2	20	CYS	HA	H	4.1500	0.0000	1
542	2	20	CYS	HB2	H	2.7900	0.0000	2
543	2	20	CYS	HB3	H	2.9400	0.0000	2
544	2	20	CYS	C	C	174.1170	0.0000	1
545	2	20	CYS	CA	C	56.7060	0.0000	1
546	2	20	CYS	CB	C	41.0560	0.0000	1
547	2	20	CYS	N	N	121.8460	0.0000	1
548	2	21	ASP	H	H	8.2790	0.0000	1
549	2	21	ASP	HA	H	4.6800	0.0000	1
550	2	21	ASP	HB2	H	2.6400	0.0000	2
551	2	21	ASP	C	C	176.8900	0.0000	1
552	2	21	ASP	CA	C	53.4920	0.0000	1
553	2	21	ASP	CB	C	41.8190	0.0000	1
554	2	21	ASP	N	N	131.7280	0.0000	1
555	2	22	LEU	H	H	8.7630	0.0000	1
556	2	22	LEU	HA	H	3.9900	0.0000	1
557	2	22	LEU	HB2	H	1.6500	0.0000	2
558	2	22	LEU	HB3	H	1.6800	0.0000	2
559	2	22	LEU	HG	H	1.5200	0.0000	1
560	2	22	LEU	HD11	H	0.8900	0.0000	2
561	2	22	LEU	HD12	H	0.8900	0.0000	2
562	2	22	LEU	HD13	H	0.8900	0.0000	2
563	2	22	LEU	HD21	H	0.8900	0.0000	2
564	2	22	LEU	HD22	H	0.8900	0.0000	2
565	2	22	LEU	HD23	H	0.8900	0.0000	2
566	2	22	LEU	C	C	178.6270	0.0000	1
567	2	22	LEU	CA	C	57.1790	0.0000	1
568	2	22	LEU	CB	C	41.6420	0.0000	1
569	2	22	LEU	CG	C	26.8900	0.0000	1
570	2	22	LEU	CD1	C	22.9200	0.0000	2
571	2	22	LEU	CD2	C	24.8100	0.0000	2
572	2	22	LEU	N	N	127.1910	0.0000	1
573	2	23	ASN	H	H	8.7460	0.0000	1
574	2	23	ASN	HA	H	4.5900	0.0000	1
575	2	23	ASN	HB2	H	2.8030	0.0000	2
576	2	23	ASN	HB3	H	3.0400	0.0000	2
577	2	23	ASN	C	C	176.9050	0.0000	1
578	2	23	ASN	CA	C	55.8000	0.0000	1
579	2	23	ASN	CB	C	39.1510	0.0000	1
580	2	23	ASN	N	N	116.2380	0.0000	1
581	2	24	THR	H	H	7.6660	0.0000	1
582	2	24	THR	HA	H	4.2400	0.0000	1
583	2	24	THR	HB	H	4.1900	0.0000	1
584	2	24	THR	HG21	H	1.1400	0.0000	1
585	2	24	THR	HG22	H	1.1400	0.0000	1
586	2	24	THR	HG23	H	1.1400	0.0000	1
587	2	24	THR	C	C	174.7270	0.0000	1
588	2	24	THR	CA	C	61.5400	0.0000	1
589	2	24	THR	CB	C	70.9000	0.0000	1
590	2	24	THR	CG2	C	21.7200	0.0000	1
591	2	24	THR	N	N	108.4590	0.0000	1
592	2	25	ALA	H	H	8.6870	0.0000	1
593	2	25	ALA	HA	H	3.8200	0.0000	1
594	2	25	ALA	HB1	H	1.4900	0.0000	1
595	2	25	ALA	HB2	H	1.4900	0.0000	1
596	2	25	ALA	HB3	H	1.4900	0.0000	1
597	2	25	ALA	C	C	176.5060	0.0000	1
598	2	25	ALA	CA	C	53.6030	0.0000	1
599	2	25	ALA	CB	C	17.0130	0.0000	1
600	2	25	ALA	N	N	122.8700	0.0000	1
601	2	26	LEU	H	H	7.3530	0.0000	1
602	2	26	LEU	HA	H	5.0310	0.0000	1
603	2	26	LEU	HB2	H	1.5900	0.0000	2
604	2	26	LEU	HG	H	1.1400	0.0000	1
605	2	26	LEU	HD11	H	0.6500	0.0000	2
606	2	26	LEU	HD12	H	0.6500	0.0000	2
607	2	26	LEU	HD13	H	0.6500	0.0000	2
608	2	26	LEU	HD21	H	0.7300	0.0000	2
609	2	26	LEU	HD22	H	0.7300	0.0000	2
610	2	26	LEU	HD23	H	0.7300	0.0000	2
611	2	26	LEU	C	C	177.6160	0.0000	1
612	2	26	LEU	CA	C	54.0980	0.0000	1
613	2	26	LEU	CB	C	46.6220	0.0000	1
614	2	26	LEU	CG	C	25.3600	0.0000	1
615	2	26	LEU	CD1	C	22.9200	0.0000	2
616	2	26	LEU	CD2	C	23.4000	0.0000	2
617	2	26	LEU	N	N	117.3740	0.0000	1
618	2	27	LYS	H	H	9.0430	0.0000	1
619	2	27	LYS	HA	H	4.9400	0.0000	1
620	2	27	LYS	HB2	H	1.6600	0.0000	2
621	2	27	LYS	HG2	H	1.1200	0.0000	2
622	2	27	LYS	HD2	H	1.2900	0.0000	2
623	2	27	LYS	C	C	175.4490	0.0000	1
624	2	27	LYS	CA	C	54.2870	0.0000	1
625	2	27	LYS	CB	C	36.0600	0.0000	1
626	2	27	LYS	CG	C	23.7800	0.0000	1
627	2	27	LYS	CD	C	29.9300	0.0000	1
628	2	27	LYS	CE	C	41.7600	0.0000	1
629	2	27	LYS	N	N	122.0530	0.0000	1
630	2	28	THR	H	H	9.0110	0.0000	1
631	2	28	THR	HA	H	5.8200	0.0000	1
632	2	28	THR	HB	H	3.9500	0.0000	1
633	2	28	THR	HG21	H	1.1400	0.0000	1
634	2	28	THR	HG22	H	1.1400	0.0000	1
635	2	28	THR	HG23	H	1.1400	0.0000	1
636	2	28	THR	C	C	174.1230	0.0000	1
637	2	28	THR	CA	C	61.2260	0.0000	1
638	2	28	THR	CB	C	72.8570	0.0000	1
639	2	28	THR	CG2	C	21.8600	0.0000	1
640	2	28	THR	N	N	114.8960	0.0000	1
641	2	29	ARG	H	H	9.0560	0.0000	1
642	2	29	ARG	C	C	173.7920	0.0000	1
643	2	29	ARG	CA	C	56.7200	0.0000	1
644	2	29	ARG	CB	C	33.1850	0.0000	1
645	2	29	ARG	N	N	123.8040	0.0000	1
646	2	30	THR	H	H	8.3870	0.0000	1
647	2	30	THR	HA	H	5.2700	0.0000	1
648	2	30	THR	HB	H	3.9200	0.0000	1
649	2	30	THR	HG21	H	1.1400	0.0000	1
650	2	30	THR	HG22	H	1.1400	0.0000	1
651	2	30	THR	HG23	H	1.1400	0.0000	1
652	2	30	THR	C	C	173.9390	0.0000	1
653	2	30	THR	CA	C	61.0030	0.0000	1
654	2	30	THR	CB	C	71.0910	0.0000	1
655	2	30	THR	CG2	C	21.5300	0.0000	1
656	2	30	THR	N	N	117.7960	0.0000	1
657	2	31	GLY	H	H	9.0740	0.0000	1
658	2	31	GLY	HA2	H	4.7030	0.0000	2
659	2	31	GLY	C	C	171.6450	0.0000	1
660	2	31	GLY	CA	C	44.6570	0.0000	1
661	2	31	GLY	N	N	112.5010	0.0000	1
662	2	32	SER	H	H	8.2170	0.0000	1
663	2	32	SER	HA	H	5.2600	0.0000	1
664	2	32	SER	HB2	H	3.7700	0.0000	2
665	2	32	SER	C	C	174.7670	0.0000	1
666	2	32	SER	CA	C	56.5120	0.0000	1
667	2	32	SER	CB	C	65.4340	0.0000	1
668	2	32	SER	N	N	115.8020	0.0000	1
669	2	33	LEU	H	H	8.5550	0.0000	1
670	2	33	LEU	HA	H	3.4200	0.0000	1
671	2	33	LEU	HB2	H	1.6400	0.0000	2
672	2	33	LEU	HG	H	0.6200	0.0000	1
673	2	33	LEU	HD11	H	0.3170	0.0000	2
674	2	33	LEU	HD12	H	0.3170	0.0000	2
675	2	33	LEU	HD13	H	0.3170	0.0000	2
676	2	33	LEU	C	C	176.3990	0.0000	1
677	2	33	LEU	CA	C	56.5580	0.0000	1
678	2	33	LEU	CB	C	43.0060	0.0000	1
679	2	33	LEU	CG	C	26.5800	0.0000	1
680	2	33	LEU	CD1	C	21.9600	0.0000	2
681	2	33	LEU	N	N	128.5950	0.0000	1
682	2	34	LYS	H	H	9.0650	0.0000	1
683	2	34	LYS	HA	H	4.3300	0.0000	1
684	2	34	LYS	HB2	H	1.5500	0.0000	2
685	2	34	LYS	HG2	H	1.2800	0.0000	2
686	2	34	LYS	HD2	H	1.4030	0.0000	2
687	2	34	LYS	HE2	H	2.8500	0.0000	2
688	2	34	LYS	C	C	176.3180	0.0000	1
689	2	34	LYS	CA	C	56.1030	0.0000	1
690	2	34	LYS	CB	C	33.5650	0.0000	1
691	2	34	LYS	CG	C	24.4900	0.0000	1
692	2	34	LYS	CD	C	28.5400	0.0000	1
693	2	34	LYS	CE	C	41.6700	0.0000	1
694	2	34	LYS	N	N	128.6460	0.0000	1
695	2	35	ARG	H	H	7.6410	0.0000	1
696	2	35	ARG	HA	H	4.2200	0.0000	1
697	2	35	ARG	HB2	H	1.6300	0.0000	2
698	2	35	ARG	HG2	H	1.4700	0.0000	2
699	2	35	ARG	HD2	H	3.1200	0.0000	2
700	2	35	ARG	C	C	173.2590	0.0000	1
701	2	35	ARG	CA	C	56.2590	0.0000	1
702	2	35	ARG	CB	C	32.6230	0.0000	1
703	2	35	ARG	CG	C	26.5900	0.0000	1
704	2	35	ARG	CD	C	43.4200	0.0000	1
705	2	35	ARG	N	N	118.8340	0.0000	1
706	2	36	ALA	H	H	8.4510	0.0000	1
707	2	36	ALA	HA	H	4.8700	0.0000	1
708	2	36	ALA	HB1	H	1.2900	0.0000	1
709	2	36	ALA	HB2	H	1.2900	0.0000	1
710	2	36	ALA	HB3	H	1.2900	0.0000	1
711	2	36	ALA	C	C	177.0370	0.0000	1
712	2	36	ALA	CA	C	50.9490	0.0000	1
713	2	36	ALA	CB	C	21.6640	0.0000	1
714	2	36	ALA	N	N	127.5740	0.0000	1
715	2	37	LEU	H	H	8.6540	0.0000	1
716	2	37	LEU	HA	H	4.2500	0.0000	1
717	2	37	LEU	HB2	H	1.5040	0.0000	2
718	2	37	LEU	HG	H	1.1600	0.0000	1
719	2	37	LEU	HD11	H	0.7850	0.0000	2
720	2	37	LEU	HD12	H	0.7850	0.0000	2
721	2	37	LEU	HD13	H	0.7850	0.0000	2
722	2	37	LEU	HD21	H	0.7850	0.0000	2
723	2	37	LEU	HD22	H	0.7850	0.0000	2
724	2	37	LEU	HD23	H	0.7850	0.0000	2
725	2	37	LEU	C	C	177.2560	0.0000	1
726	2	37	LEU	CA	C	55.1370	0.0000	1
727	2	37	LEU	CB	C	42.6970	0.0000	1
728	2	37	LEU	CG	C	27.1700	0.0000	1
729	2	37	LEU	CD1	C	23.1900	0.0000	2
730	2	37	LEU	CD2	C	24.7900	0.0000	2
731	2	37	LEU	N	N	123.2960	0.0000	1
732	2	38	HIS	H	H	8.6420	0.0000	1
733	2	38	HIS	HA	H	4.4300	0.0000	1
734	2	38	HIS	HB2	H	3.2100	0.0000	2
735	2	38	HIS	HD2	H	7.1700	0.0000	1
736	2	38	HIS	HE1	H	8.3600	0.0000	1
737	2	38	HIS	C	C	174.8010	0.0000	1
738	2	38	HIS	CA	C	56.4000	0.0000	1
739	2	38	HIS	CB	C	28.2180	0.0000	1
740	2	38	HIS	CD2	C	119.8000	0.0000	1
741	2	38	HIS	CE1	C	136.5000	0.0000	1
742	2	38	HIS	N	N	116.4130	0.0000	1
743	2	39	ASN	H	H	8.4610	0.0000	1
744	2	39	ASN	HA	H	4.4500	0.0000	1
745	2	39	ASN	HB2	H	2.8700	0.0000	2
746	2	39	ASN	HD21	H	7.7800	0.0000	2
747	2	39	ASN	C	C	175.0260	0.0000	1
748	2	39	ASN	CA	C	53.6920	0.0000	1
749	2	39	ASN	CB	C	38.0560	0.0000	1
750	2	39	ASN	N	N	115.8240	0.0000	1
751	2	40	ALA	H	H	7.7910	0.0000	1
752	2	40	ALA	HA	H	4.1300	0.0000	1
753	2	40	ALA	HB1	H	1.3700	0.0000	1
754	2	40	ALA	HB2	H	1.3700	0.0000	1
755	2	40	ALA	HB3	H	1.3700	0.0000	1
756	2	40	ALA	C	C	177.3370	0.0000	1
757	2	40	ALA	CA	C	53.4300	0.0000	1
758	2	40	ALA	CB	C	20.2040	0.0000	1
759	2	40	ALA	N	N	122.5580	0.0000	1
760	2	41	GLU	H	H	8.4780	0.0000	1
761	2	41	GLU	HA	H	4.3200	0.0000	1
762	2	41	GLU	HB2	H	1.9500	0.0000	2
763	2	41	GLU	HG2	H	2.2500	0.0000	2
764	2	41	GLU	C	C	176.1540	0.0000	1
765	2	41	GLU	CA	C	56.6300	0.0000	1
766	2	41	GLU	CB	C	29.4960	0.0000	1
767	2	41	GLU	CG	C	36.0800	0.0000	1
768	2	41	GLU	N	N	120.5040	0.0000	1
769	2	42	CYS	H	H	7.9780	0.0000	1
770	2	42	CYS	HA	H	4.8200	0.0000	1
771	2	42	CYS	HB2	H	2.6040	0.0000	2
772	2	42	CYS	HB3	H	2.9030	0.0000	2
773	2	42	CYS	C	C	174.7110	0.0000	1
774	2	42	CYS	CA	C	53.9850	0.0000	1
775	2	42	CYS	CB	C	44.1770	0.0000	1
776	2	42	CYS	N	N	122.3990	0.0000	1
777	2	43	GLN	H	H	8.8640	0.0000	1
778	2	43	GLN	HA	H	4.3000	0.0000	1
779	2	43	GLN	HB2	H	1.9200	0.0000	2
780	2	43	GLN	HB3	H	2.1800	0.0000	2
781	2	43	GLN	HG2	H	2.5200	0.0000	2
782	2	43	GLN	C	C	178.3170	0.0000	1
783	2	43	GLN	CA	C	56.1570	0.0000	1
784	2	43	GLN	CB	C	29.3030	0.0000	1
785	2	43	GLN	CG	C	34.1300	0.0000	1
786	2	43	GLN	N	N	123.5390	0.0000	1
787	2	44	LYS	H	H	9.0630	0.0000	1
788	2	44	LYS	HA	H	4.0200	0.0000	1
789	2	44	LYS	HB2	H	1.9500	0.0000	2
790	2	44	LYS	HG2	H	1.6100	0.0000	2
791	2	44	LYS	HD2	H	1.7700	0.0000	2
792	2	44	LYS	HE2	H	3.0300	0.0000	2
793	2	44	LYS	C	C	176.6690	0.0000	1
794	2	44	LYS	CA	C	59.8760	0.0000	1
795	2	44	LYS	CB	C	32.7600	0.0000	1
796	2	44	LYS	CG	C	25.4600	0.0000	1
797	2	44	LYS	CD	C	28.9300	0.0000	1
798	2	44	LYS	CE	C	42.0300	0.0000	1
799	2	44	LYS	N	N	125.1530	0.0000	1
800	2	45	THR	H	H	7.7060	0.0000	1
801	2	45	THR	HA	H	5.2600	0.0000	1
802	2	45	THR	HB	H	3.9800	0.0000	1
803	2	45	THR	HG21	H	1.1400	0.0000	1
804	2	45	THR	HG22	H	1.1400	0.0000	1
805	2	45	THR	HG23	H	1.1400	0.0000	1
806	2	45	THR	C	C	173.0970	0.0000	1
807	2	45	THR	CA	C	59.9220	0.0000	1
808	2	45	THR	CB	C	71.7880	0.0000	1
809	2	45	THR	CG2	C	21.7600	0.0000	1
810	2	45	THR	N	N	111.2080	0.0000	1
811	2	46	VAL	H	H	8.1920	0.0000	1
812	2	46	VAL	HA	H	4.5100	0.0000	1
813	2	46	VAL	HB	H	1.5400	0.0000	1
814	2	46	VAL	HG11	H	0.2300	0.0000	2
815	2	46	VAL	HG12	H	0.2300	0.0000	2
816	2	46	VAL	HG13	H	0.2300	0.0000	2
817	2	46	VAL	HG21	H	-0.1100	0.0000	2
818	2	46	VAL	HG22	H	-0.1100	0.0000	2
819	2	46	VAL	HG23	H	-0.1100	0.0000	2
820	2	46	VAL	C	C	174.1320	0.0000	1
821	2	46	VAL	CA	C	59.5380	0.0000	1
822	2	46	VAL	CB	C	35.5230	0.0000	1
823	2	46	VAL	CG1	C	21.4000	0.0000	2
824	2	46	VAL	CG2	C	17.5400	0.0000	2
825	2	46	VAL	N	N	117.3950	0.0000	1
826	2	47	THR	H	H	8.3320	0.0000	1
827	2	47	THR	HA	H	5.0980	0.0000	1
828	2	47	THR	HB	H	3.8600	0.0000	1
829	2	47	THR	HG21	H	1.0800	0.0000	1
830	2	47	THR	HG22	H	1.0800	0.0000	1
831	2	47	THR	HG23	H	1.0800	0.0000	1
832	2	47	THR	C	C	173.6460	0.0000	1
833	2	47	THR	CA	C	61.4580	0.0000	1
834	2	47	THR	CB	C	71.1770	0.0000	1
835	2	47	THR	CG2	C	21.6200	0.0000	1
836	2	47	THR	N	N	117.8620	0.0000	1
837	2	48	ILE	H	H	8.8680	0.0000	1
838	2	48	ILE	HA	H	4.6700	0.0000	1
839	2	48	ILE	HB	H	1.7200	0.0000	1
840	2	48	ILE	HG12	H	1.2400	0.0000	2
841	2	48	ILE	HG21	H	0.9600	0.0000	1
842	2	48	ILE	HG22	H	0.9600	0.0000	1
843	2	48	ILE	HG23	H	0.9600	0.0000	1
844	2	48	ILE	HD11	H	0.5300	0.0000	1
845	2	48	ILE	HD12	H	0.5300	0.0000	1
846	2	48	ILE	HD13	H	0.5300	0.0000	1
847	2	48	ILE	C	C	174.2960	0.0000	1
848	2	48	ILE	CA	C	59.6950	0.0000	1
849	2	48	ILE	CB	C	41.1160	0.0000	1
850	2	48	ILE	CG1	C	27.2200	0.0000	1
851	2	48	ILE	CG2	C	17.9700	0.0000	1
852	2	48	ILE	CD1	C	13.2500	0.0000	1
853	2	48	ILE	N	N	124.4310	0.0000	1
854	2	49	SER	H	H	8.5590	0.0000	1
855	2	49	SER	HA	H	3.7600	0.0000	1
856	2	49	SER	HB2	H	3.7600	0.0000	2
857	2	49	SER	C	C	173.4410	0.0000	1
858	2	49	SER	CA	C	56.8770	0.0000	1
859	2	49	SER	CB	C	67.1150	0.0000	1
860	2	49	SER	N	N	118.4300	0.0000	1
861	2	50	LYS	H	H	9.0600	0.0000	1
862	2	50	LYS	CA	C	53.6250	0.0000	1
863	2	50	LYS	CB	C	35.5150	0.0000	1
864	2	50	LYS	N	N	121.9760	0.0000	1
865	2	51	PRO	HA	H	4.9400	0.0000	1
866	2	51	PRO	HB2	H	2.4500	0.0000	2
867	2	51	PRO	HG2	H	1.8100	0.0000	2
868	2	51	PRO	HG3	H	1.9900	0.0000	2
869	2	51	PRO	HD2	H	3.8200	0.0000	2
870	2	51	PRO	HD3	H	4.1600	0.0000	2
871	2	51	PRO	C	C	176.7410	0.0000	1
872	2	51	PRO	CA	C	62.8700	0.0000	1
873	2	51	PRO	CB	C	32.5900	0.0000	1
874	2	51	PRO	CG	C	27.5300	0.0000	1
875	2	51	PRO	CD	C	51.4900	0.0000	1
876	2	52	CYS	H	H	8.2370	0.0000	1
877	2	52	CYS	HA	H	4.5010	0.0000	1
878	2	52	CYS	HB2	H	2.9500	0.0000	2
879	2	52	CYS	HB3	H	3.2500	0.0000	2
880	2	52	CYS	C	C	173.3690	0.0000	1
881	2	52	CYS	CA	C	55.9500	0.0000	1
882	2	52	CYS	CB	C	44.6200	0.0000	1
883	2	52	CYS	N	N	118.3130	0.0000	1
884	2	53	GLY	H	H	8.2200	0.0000	1
885	2	53	GLY	HA2	H	3.9000	0.0000	2
886	2	53	GLY	C	C	173.4550	0.0000	1
887	2	53	GLY	CA	C	45.2760	0.0000	1
888	2	53	GLY	N	N	108.6770	0.0000	1
889	2	54	LYS	H	H	8.2390	0.0000	1
890	2	54	LYS	HA	H	4.2700	0.0000	1
891	2	54	LYS	HB2	H	1.7500	0.0000	2
892	2	54	LYS	HG2	H	1.4200	0.0000	2
893	2	54	LYS	HE2	H	2.9900	0.0000	2
894	2	54	LYS	C	C	176.5970	0.0000	1
895	2	54	LYS	CA	C	56.4200	0.0000	1
896	2	54	LYS	CB	C	33.4700	0.0000	1
897	2	54	LYS	CG	C	26.2300	0.0000	1
898	2	54	LYS	CD	C	29.0100	0.0000	1
899	2	54	LYS	CE	C	42.1200	0.0000	1
900	2	54	LYS	N	N	121.3610	0.0000	1
901	2	55	LEU	H	H	8.3400	0.0000	1
902	2	55	LEU	HA	H	4.4100	0.0000	1
903	2	55	LEU	HB2	H	1.5900	0.0000	2
904	2	55	LEU	HD11	H	0.8800	0.0000	2
905	2	55	LEU	HD12	H	0.8800	0.0000	2
906	2	55	LEU	HD13	H	0.8800	0.0000	2
907	2	55	LEU	C	C	177.4040	0.0000	1
908	2	55	LEU	CA	C	55.1500	0.0000	1
909	2	55	LEU	CB	C	42.3490	0.0000	1
910	2	55	LEU	CG	C	26.9900	0.0000	1
911	2	55	LEU	CD1	C	24.8600	0.0000	2
912	2	55	LEU	CD2	C	23.5600	0.0000	2
913	2	55	LEU	N	N	123.9710	0.0000	1
914	2	56	THR	H	H	8.1500	0.0000	1
915	2	56	THR	HA	H	4.3100	0.0000	1
916	2	56	THR	HB	H	4.1300	0.0000	1
917	2	56	THR	HG21	H	1.1500	0.0000	1
918	2	56	THR	HG22	H	1.1500	0.0000	1
919	2	56	THR	HG23	H	1.1500	0.0000	1
920	2	56	THR	C	C	174.0820	0.0000	1
921	2	56	THR	CA	C	61.6760	0.0000	1
922	2	56	THR	CB	C	69.0900	0.0000	1
923	2	56	THR	CG2	C	21.7600	0.0000	1
924	2	56	THR	N	N	116.6530	0.0000	1
925	2	57	LYS	H	H	8.2900	0.0000	1
926	2	57	LYS	CA	C	54.1570	0.0000	1
927	2	57	LYS	CB	C	32.8200	0.0000	1
928	2	57	LYS	N	N	125.7700	0.0000	1

Release date

2024-05-09

Citation

NMR structure of alphaM I-domain of integrin Mac-1 in complex with the Cytokine Pleiotrophin
Wang, X., Nguyen, H.