BMRB: 26336

Solution Structure of the Corynebacterium diphtheriae SpaB

Authors

Sue, C.K., Cheung, N.A., Mahoney, B.J., Clubb, R.T.

Assembly

SpaB

Entity

1. SpaB (polymer, Thiol state: not present), 126 monomers, 13591.00 Da Detail

QEANTLVIDL EPPAAFADDQ PQGHNIDVTV AKLHNIDPED HERIRALQRN GVPSTISEEQ PHTARTDATG TATITNLPPG TYVIRDTNTT KPRFSPLVIP LGIDTTSPTM TLRPKLIDAT PGAPNV

Formula weight

13591.0 Da

Source organism

Corynebacterium diphtheriae NCTC 13129

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 749, ¹³C: 501, ¹⁵N: 119 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	2	GLU	H	H	8.5700	0.02	1
2	1	2	GLU	HA	H	4.2820	0.02	1
3	1	2	GLU	HB2	H	2.0550	0.02	2
4	1	2	GLU	HB3	H	1.9510	0.02	2
5	1	2	GLU	HG2	H	2.3000	0.02	2
6	1	2	GLU	CA	C	56.6200	0.3	1
7	1	2	GLU	CB	C	30.3000	0.3	1
8	1	2	GLU	CG	C	36.3000	0.3	1
9	1	2	GLU	N	N	118.2600	0.3	1
10	1	3	ALA	H	H	8.2500	0.02	1
11	1	3	ALA	HA	H	4.4280	0.02	1
12	1	3	ALA	HB1	H	1.4230	0.02	1
13	1	3	ALA	HB2	H	1.4230	0.02	1
14	1	3	ALA	HB3	H	1.4230	0.02	1
15	1	3	ALA	C	C	176.1100	0.3	1
16	1	3	ALA	CA	C	52.2000	0.3	1
17	1	3	ALA	CB	C	19.4000	0.3	1
18	1	3	ALA	N	N	122.7800	0.3	1
19	1	4	ASN	H	H	8.5220	0.02	1
20	1	4	ASN	HA	H	4.2000	0.02	1
21	1	4	ASN	HD21	H	7.0100	0.02	2
22	1	4	ASN	C	C	173.8500	0.3	1
23	1	4	ASN	CA	C	52.8400	0.3	1
24	1	4	ASN	CB	C	42.0300	0.3	1
25	1	4	ASN	N	N	119.1200	0.3	1
26	1	4	ASN	ND2	N	116.8400	0.3	1
27	1	5	THR	H	H	8.7100	0.02	1
28	1	5	THR	HA	H	4.9620	0.02	1
29	1	5	THR	HB	H	4.0610	0.02	1
30	1	5	THR	HG21	H	1.0310	0.02	1
31	1	5	THR	HG22	H	1.0310	0.02	1
32	1	5	THR	HG23	H	1.0310	0.02	1
33	1	5	THR	C	C	172.3000	0.3	1
34	1	5	THR	CA	C	61.6200	0.3	1
35	1	5	THR	CB	C	71.4700	0.3	1
36	1	5	THR	CG2	C	21.9200	0.3	1
37	1	5	THR	N	N	117.3800	0.3	1
38	1	6	LEU	H	H	9.0700	0.02	1
39	1	6	LEU	HA	H	5.1000	0.02	1
40	1	6	LEU	HB2	H	1.3240	0.02	2
41	1	6	LEU	HB3	H	1.2660	0.02	2
42	1	6	LEU	HD11	H	0.6140	0.02	2
43	1	6	LEU	HD12	H	0.6140	0.02	2
44	1	6	LEU	HD13	H	0.6140	0.02	2
45	1	6	LEU	HG	H	0.6240	0.02	1
46	1	6	LEU	C	C	173.9500	0.3	1
47	1	6	LEU	CA	C	52.7600	0.3	1
48	1	6	LEU	CB	C	45.8500	0.3	1
49	1	6	LEU	CD1	C	25.1800	0.3	2
50	1	6	LEU	CG	C	26.8700	0.3	1
51	1	6	LEU	N	N	127.2800	0.3	1
52	1	7	VAL	H	H	8.9500	0.02	1
53	1	7	VAL	HA	H	4.5660	0.02	1
54	1	7	VAL	HB	H	2.1070	0.02	1
55	1	7	VAL	HG11	H	0.7960	0.02	2
56	1	7	VAL	HG12	H	0.7960	0.02	2
57	1	7	VAL	HG13	H	0.7960	0.02	2
58	1	7	VAL	C	C	174.5200	0.3	1
59	1	7	VAL	CA	C	61.4900	0.3	1
60	1	7	VAL	CB	C	32.7100	0.3	1
61	1	7	VAL	CG1	C	20.6600	0.3	2
62	1	7	VAL	N	N	125.8600	0.3	1
63	1	8	ILE	H	H	9.3400	0.02	1
64	1	8	ILE	HA	H	4.4750	0.02	1
65	1	8	ILE	HB	H	1.7870	0.02	1
66	1	8	ILE	HD11	H	0.6510	0.02	1
67	1	8	ILE	HD12	H	0.6510	0.02	1
68	1	8	ILE	HD13	H	0.6510	0.02	1
69	1	8	ILE	HG12	H	1.2450	0.02	2
70	1	8	ILE	HG13	H	1.0260	0.02	2
71	1	8	ILE	HG21	H	0.4560	0.02	1
72	1	8	ILE	HG22	H	0.4560	0.02	1
73	1	8	ILE	HG23	H	0.4560	0.02	1
74	1	8	ILE	C	C	173.5300	0.3	1
75	1	8	ILE	CA	C	59.3500	0.3	1
76	1	8	ILE	CB	C	38.5400	0.3	1
77	1	8	ILE	CD1	C	14.2400	0.3	1
78	1	8	ILE	CG1	C	28.2700	0.3	1
79	1	8	ILE	CG2	C	18.0300	0.3	1
80	1	8	ILE	N	N	127.1600	0.3	1
81	1	9	ASP	H	H	8.6800	0.02	1
82	1	9	ASP	HA	H	4.9300	0.02	1
83	1	9	ASP	HB2	H	2.7220	0.02	2
84	1	9	ASP	HB3	H	2.2440	0.02	2
85	1	9	ASP	C	C	175.6900	0.3	1
86	1	9	ASP	CA	C	52.5300	0.3	1
87	1	9	ASP	CB	C	42.0200	0.3	1
88	1	9	ASP	N	N	126.7300	0.3	1
89	1	10	LEU	H	H	8.4700	0.02	1
90	1	10	LEU	HA	H	4.3000	0.02	1
91	1	10	LEU	HB2	H	1.8000	0.02	2
92	1	10	LEU	HB3	H	1.4600	0.02	2
93	1	10	LEU	HD11	H	0.6230	0.02	2
94	1	10	LEU	HD12	H	0.6230	0.02	2
95	1	10	LEU	HD13	H	0.6230	0.02	2
96	1	10	LEU	HD21	H	0.2060	0.02	2
97	1	10	LEU	HD22	H	0.2060	0.02	2
98	1	10	LEU	HD23	H	0.2060	0.02	2
99	1	10	LEU	C	C	176.0700	0.3	1
100	1	10	LEU	CA	C	54.1600	0.3	1
101	1	10	LEU	CB	C	42.2100	0.3	1
102	1	10	LEU	CD1	C	26.9300	0.3	2
103	1	10	LEU	CD2	C	23.4400	0.3	2
104	1	10	LEU	N	N	124.4300	0.3	1
105	1	11	GLU	H	H	8.3000	0.02	1
106	1	11	GLU	HA	H	4.6500	0.02	1
107	1	11	GLU	HB2	H	2.7600	0.02	2
108	1	11	GLU	HB3	H	2.5900	0.02	2
109	1	11	GLU	HG2	H	2.0500	0.02	2
110	1	11	GLU	C	C	174.3900	0.3	1
111	1	11	GLU	CA	C	54.2000	0.3	1
112	1	11	GLU	CB	C	34.2400	0.3	1
113	1	11	GLU	CG	C	32.8500	0.3	1
114	1	11	GLU	N	N	122.0500	0.3	1
115	1	13	PRO	HA	H	4.4700	0.02	1
116	1	13	PRO	HB3	H	1.3100	0.02	2
117	1	13	PRO	HD3	H	3.3550	0.02	2
118	1	13	PRO	HG2	H	1.3020	0.02	2
119	1	13	PRO	HG3	H	1.1010	0.02	2
120	1	13	PRO	C	C	176.4900	0.3	1
121	1	13	PRO	CA	C	62.2500	0.3	1
122	1	13	PRO	CB	C	32.3700	0.3	1
123	1	13	PRO	CD	C	49.7900	0.3	1
124	1	13	PRO	CG	C	26.9500	0.3	1
125	1	14	ALA	H	H	8.2820	0.02	1
126	1	14	ALA	HA	H	4.2460	0.02	1
127	1	14	ALA	HB1	H	1.3800	0.02	1
128	1	14	ALA	HB2	H	1.3800	0.02	1
129	1	14	ALA	HB3	H	1.3800	0.02	1
130	1	14	ALA	C	C	177.4800	0.3	1
131	1	14	ALA	CA	C	52.7500	0.3	1
132	1	14	ALA	CB	C	19.0200	0.3	1
133	1	14	ALA	N	N	123.3000	0.3	1
134	1	15	ALA	H	H	8.2400	0.02	1
135	1	15	ALA	HA	H	4.2500	0.02	1
136	1	15	ALA	HB1	H	1.3190	0.02	1
137	1	15	ALA	HB2	H	1.3190	0.02	1
138	1	15	ALA	HB3	H	1.3190	0.02	1
139	1	15	ALA	C	C	177.2200	0.3	1
140	1	15	ALA	CA	C	52.5700	0.3	1
141	1	15	ALA	CB	C	19.2300	0.3	1
142	1	15	ALA	N	N	121.5400	0.3	1
143	1	16	PHE	H	H	8.1140	0.02	1
144	1	16	PHE	HA	H	4.6300	0.02	1
145	1	16	PHE	HB2	H	3.2450	0.02	2
146	1	16	PHE	HB3	H	3.0510	0.02	2
147	1	16	PHE	HD1	H	7.2910	0.02	3
148	1	16	PHE	C	C	175.5400	0.3	1
149	1	16	PHE	CA	C	57.2800	0.3	1
150	1	16	PHE	CB	C	39.6000	0.3	1
151	1	16	PHE	N	N	118.3500	0.3	1
152	1	17	ALA	H	H	8.2000	0.02	1
153	1	17	ALA	HA	H	4.2910	0.02	1
154	1	17	ALA	HB1	H	1.4080	0.02	1
155	1	17	ALA	HB2	H	1.4080	0.02	1
156	1	17	ALA	HB3	H	1.4080	0.02	1
157	1	17	ALA	C	C	177.3100	0.3	1
158	1	17	ALA	CA	C	52.5300	0.3	1
159	1	17	ALA	CB	C	19.2300	0.3	1
160	1	17	ALA	N	N	124.5300	0.3	1
161	1	18	ASP	H	H	8.2440	0.02	1
162	1	18	ASP	HA	H	4.5870	0.02	1
163	1	18	ASP	HB2	H	2.7450	0.02	2
164	1	18	ASP	HB3	H	2.6520	0.02	2
165	1	18	ASP	C	C	175.8700	0.3	1
166	1	18	ASP	CA	C	54.4400	0.3	1
167	1	18	ASP	CB	C	40.9400	0.3	1
168	1	18	ASP	N	N	118.3700	0.3	1
169	1	19	ASP	H	H	8.2270	0.02	1
170	1	19	ASP	HA	H	4.6100	0.02	1
171	1	19	ASP	HB2	H	2.7260	0.02	2
172	1	19	ASP	HB3	H	2.6880	0.02	2
173	1	19	ASP	C	C	175.8400	0.3	1
174	1	19	ASP	CA	C	54.0900	0.3	1
175	1	19	ASP	CB	C	40.7200	0.3	1
176	1	19	ASP	N	N	118.4500	0.3	1
177	1	20	GLN	H	H	8.1000	0.02	1
178	1	20	GLN	HA	H	4.6200	0.02	1
179	1	20	GLN	HB2	H	2.1100	0.02	2
180	1	20	GLN	HB3	H	1.9500	0.02	2
181	1	20	GLN	HE21	H	6.8300	0.02	2
182	1	20	GLN	HE22	H	7.5700	0.02	2
183	1	20	GLN	HG2	H	2.3800	0.02	2
184	1	20	GLN	HG3	H	2.3600	0.02	2
185	1	20	GLN	C	C	173.9500	0.3	1
186	1	20	GLN	CA	C	53.5500	0.3	1
187	1	20	GLN	CB	C	28.9500	0.3	1
188	1	20	GLN	CG	C	33.4400	0.3	1
189	1	20	GLN	N	N	120.0600	0.3	1
190	1	20	GLN	NE2	N	112.7100	0.3	1
191	1	21	PRO	HA	H	4.4250	0.02	1
192	1	21	PRO	HB2	H	1.8310	0.02	2
193	1	21	PRO	HD2	H	3.7870	0.02	2
194	1	21	PRO	HD3	H	3.6420	0.02	2
195	1	21	PRO	HG2	H	1.9900	0.02	2
196	1	21	PRO	C	C	176.8800	0.3	1
197	1	21	PRO	CA	C	63.5000	0.3	1
198	1	21	PRO	CB	C	32.0400	0.3	1
199	1	21	PRO	CD	C	50.5600	0.3	1
200	1	21	PRO	CG	C	27.3600	0.3	1
201	1	22	GLN	H	H	8.7400	0.02	1
202	1	22	GLN	HA	H	4.4300	0.02	1
203	1	22	GLN	HB2	H	2.1500	0.02	2
204	1	22	GLN	HB3	H	1.8900	0.02	2
205	1	22	GLN	HE21	H	6.8900	0.02	2
206	1	22	GLN	HE22	H	7.6100	0.02	2
207	1	22	GLN	HG2	H	2.4100	0.02	2
208	1	22	GLN	C	C	176.4400	0.3	1
209	1	22	GLN	CA	C	55.4500	0.3	1
210	1	22	GLN	CB	C	30.3700	0.3	1
211	1	22	GLN	CG	C	33.7000	0.3	1
212	1	22	GLN	N	N	119.6900	0.3	1
213	1	22	GLN	NE2	N	112.2300	0.3	1
214	1	23	GLY	H	H	8.7600	0.02	1
215	1	23	GLY	HA2	H	4.0000	0.02	2
216	1	23	GLY	HA3	H	3.8000	0.02	2
217	1	23	GLY	C	C	173.7500	0.3	1
218	1	23	GLY	CA	C	45.7000	0.3	1
219	1	23	GLY	N	N	108.4200	0.3	1
220	1	24	HIS	H	H	8.1300	0.02	1
221	1	24	HIS	HA	H	4.7000	0.02	1
222	1	24	HIS	HB2	H	3.0700	0.02	2
223	1	24	HIS	HB3	H	3.0200	0.02	2
224	1	24	HIS	HD2	H	6.9100	0.02	1
225	1	24	HIS	C	C	174.4500	0.3	1
226	1	24	HIS	CA	C	55.0700	0.3	1
227	1	24	HIS	CB	C	31.9600	0.3	1
228	1	24	HIS	CD2	C	118.4400	0.3	1
229	1	24	HIS	N	N	119.1500	0.3	1
230	1	25	ASN	H	H	8.0200	0.02	1
231	1	25	ASN	HA	H	4.4200	0.02	1
232	1	25	ASN	HB2	H	2.9100	0.02	2
233	1	25	ASN	HB3	H	2.6800	0.02	2
234	1	25	ASN	HD21	H	6.8900	0.02	2
235	1	25	ASN	HD22	H	7.6100	0.02	2
236	1	25	ASN	C	C	174.0600	0.3	1
237	1	25	ASN	CA	C	53.7700	0.3	1
238	1	25	ASN	CB	C	37.5400	0.3	1
239	1	25	ASN	N	N	118.5900	0.3	1
240	1	25	ASN	ND2	N	112.3300	0.3	1
241	1	26	ILE	H	H	8.4000	0.02	1
242	1	26	ILE	HA	H	4.1400	0.02	1
243	1	26	ILE	HB	H	1.6590	0.02	1
244	1	26	ILE	HD11	H	0.7500	0.02	1
245	1	26	ILE	HD12	H	0.7500	0.02	1
246	1	26	ILE	HD13	H	0.7500	0.02	1
247	1	26	ILE	HG12	H	1.4800	0.02	2
248	1	26	ILE	HG13	H	1.0300	0.02	2
249	1	26	ILE	HG21	H	0.9400	0.02	1
250	1	26	ILE	HG22	H	0.9400	0.02	1
251	1	26	ILE	HG23	H	0.9400	0.02	1
252	1	26	ILE	C	C	174.5800	0.3	1
253	1	26	ILE	CA	C	61.0900	0.3	1
254	1	26	ILE	CB	C	39.4300	0.3	1
255	1	26	ILE	CD1	C	13.1400	0.3	1
256	1	26	ILE	CG1	C	27.8500	0.3	1
257	1	26	ILE	CG2	C	17.3800	0.3	1
258	1	26	ILE	N	N	120.5400	0.3	1
259	1	27	ASP	H	H	8.2500	0.02	1
260	1	27	ASP	HA	H	5.2200	0.02	1
261	1	27	ASP	HB2	H	2.7600	0.02	2
262	1	27	ASP	HB3	H	2.6000	0.02	2
263	1	27	ASP	C	C	173.9800	0.3	1
264	1	27	ASP	CA	C	54.4300	0.3	1
265	1	27	ASP	CB	C	42.2400	0.3	1
266	1	27	ASP	N	N	128.2900	0.3	1
267	1	28	VAL	H	H	9.0800	0.02	1
268	1	28	VAL	HA	H	4.7100	0.02	1
269	1	28	VAL	HB	H	2.0100	0.02	1
270	1	28	VAL	HG11	H	0.9000	0.02	2
271	1	28	VAL	HG12	H	0.9000	0.02	2
272	1	28	VAL	HG13	H	0.9000	0.02	2
273	1	28	VAL	HG21	H	0.8400	0.02	2
274	1	28	VAL	HG22	H	0.8400	0.02	2
275	1	28	VAL	HG23	H	0.8400	0.02	2
276	1	28	VAL	C	C	174.9100	0.3	1
277	1	28	VAL	CA	C	60.8500	0.3	1
278	1	28	VAL	CB	C	34.4900	0.3	1
279	1	28	VAL	CG1	C	22.2300	0.3	2
280	1	28	VAL	CG2	C	21.0700	0.3	2
281	1	28	VAL	N	N	122.7100	0.3	1
282	1	29	THR	H	H	9.4920	0.02	1
283	1	29	THR	HA	H	4.9600	0.02	1
284	1	29	THR	HB	H	3.7900	0.02	1
285	1	29	THR	HG21	H	1.0910	0.02	1
286	1	29	THR	HG22	H	1.0910	0.02	1
287	1	29	THR	HG23	H	1.0910	0.02	1
288	1	29	THR	C	C	172.3100	0.3	1
289	1	29	THR	CA	C	62.6800	0.3	1
290	1	29	THR	CB	C	71.5700	0.3	1
291	1	29	THR	CG2	C	20.8000	0.3	1
292	1	29	THR	N	N	121.3500	0.3	1
293	1	30	VAL	H	H	9.0300	0.02	1
294	1	30	VAL	HA	H	5.3300	0.02	1
295	1	30	VAL	HB	H	2.0300	0.02	1
296	1	30	VAL	HG11	H	0.9150	0.02	2
297	1	30	VAL	HG12	H	0.9150	0.02	2
298	1	30	VAL	HG13	H	0.9150	0.02	2
299	1	30	VAL	HG21	H	0.7450	0.02	2
300	1	30	VAL	HG22	H	0.7450	0.02	2
301	1	30	VAL	HG23	H	0.7450	0.02	2
302	1	30	VAL	C	C	175.1500	0.3	1
303	1	30	VAL	CA	C	60.3000	0.3	1
304	1	30	VAL	CB	C	34.2600	0.3	1
305	1	30	VAL	CG1	C	22.3100	0.3	2
306	1	30	VAL	CG2	C	21.4500	0.3	2
307	1	30	VAL	N	N	126.2100	0.3	1
308	1	31	ALA	H	H	9.1600	0.02	1
309	1	31	ALA	HA	H	5.1800	0.02	1
310	1	31	ALA	HB1	H	1.2500	0.02	1
311	1	31	ALA	HB2	H	1.2500	0.02	1
312	1	31	ALA	HB3	H	1.2500	0.02	1
313	1	31	ALA	C	C	174.5900	0.3	1
314	1	31	ALA	CA	C	50.5900	0.3	1
315	1	31	ALA	CB	C	22.1700	0.3	1
316	1	31	ALA	N	N	128.2300	0.3	1
317	1	32	LYS	H	H	9.1100	0.02	1
318	1	32	LYS	HA	H	3.6300	0.02	1
319	1	32	LYS	HB2	H	1.5590	0.02	2
320	1	32	LYS	HB3	H	1.3400	0.02	2
321	1	32	LYS	HD2	H	0.9690	0.02	2
322	1	32	LYS	HE2	H	3.1400	0.02	2
323	1	32	LYS	HE3	H	3.0600	0.02	2
324	1	32	LYS	HG2	H	0.7070	0.02	2
325	1	32	LYS	C	C	175.5400	0.3	1
326	1	32	LYS	CA	C	55.7700	0.3	1
327	1	32	LYS	CB	C	33.6700	0.3	1
328	1	32	LYS	CD	C	29.8000	0.3	1
329	1	32	LYS	CE	C	41.8400	0.3	1
330	1	32	LYS	CG	C	25.5100	0.3	1
331	1	32	LYS	N	N	125.8400	0.3	1
332	1	33	LEU	H	H	8.9900	0.02	1
333	1	33	LEU	HA	H	4.6200	0.02	1
334	1	33	LEU	HB3	H	1.5200	0.02	2
335	1	33	LEU	HD11	H	0.7960	0.02	2
336	1	33	LEU	HD12	H	0.7960	0.02	2
337	1	33	LEU	HD13	H	0.7960	0.02	2
338	1	33	LEU	HG	H	1.1000	0.02	1
339	1	33	LEU	C	C	177.1700	0.3	1
340	1	33	LEU	CA	C	53.0600	0.3	1
341	1	33	LEU	CB	C	40.9600	0.3	1
342	1	33	LEU	CD1	C	22.5600	0.3	2
343	1	33	LEU	CD2	C	22.3500	0.3	2
344	1	33	LEU	CG	C	27.8800	0.3	1
345	1	33	LEU	N	N	124.5000	0.3	1
346	1	34	HIS	H	H	8.8580	0.02	1
347	1	34	HIS	HA	H	4.2900	0.02	1
348	1	34	HIS	HB2	H	3.2200	0.02	2
349	1	34	HIS	HB3	H	2.9100	0.02	2
350	1	34	HIS	HD2	H	7.0900	0.02	1
351	1	34	HIS	C	C	175.0800	0.3	1
352	1	34	HIS	CA	C	57.4600	0.3	1
353	1	34	HIS	CB	C	29.6800	0.3	1
354	1	34	HIS	CD2	C	119.2400	0.3	1
355	1	34	HIS	N	N	125.8000	0.3	1
356	1	35	ASN	H	H	8.9300	0.02	1
357	1	35	ASN	HA	H	4.1400	0.02	1
358	1	35	ASN	HB2	H	3.0600	0.02	2
359	1	35	ASN	HB3	H	2.3800	0.02	2
360	1	35	ASN	HD21	H	6.6700	0.02	2
361	1	35	ASN	HD22	H	7.3700	0.02	2
362	1	35	ASN	C	C	173.9200	0.3	1
363	1	35	ASN	CA	C	53.7200	0.3	1
364	1	35	ASN	CB	C	37.0300	0.3	1
365	1	35	ASN	N	N	120.3100	0.3	1
366	1	35	ASN	ND2	N	110.6400	0.3	1
367	1	36	ILE	H	H	6.8400	0.02	1
368	1	36	ILE	HA	H	4.4100	0.02	1
369	1	36	ILE	HB	H	1.8200	0.02	1
370	1	36	ILE	HG12	H	1.0570	0.02	2
371	1	36	ILE	HG13	H	1.3800	0.02	2
372	1	36	ILE	HG21	H	0.7100	0.02	1
373	1	36	ILE	HG22	H	0.7100	0.02	1
374	1	36	ILE	HG23	H	0.7100	0.02	1
375	1	36	ILE	C	C	175.9700	0.3	1
376	1	36	ILE	CA	C	57.7400	0.3	1
377	1	36	ILE	CB	C	35.8600	0.3	1
378	1	36	ILE	CG1	C	26.7500	0.3	1
379	1	36	ILE	CG2	C	16.7800	0.3	1
380	1	36	ILE	N	N	116.0300	0.3	1
381	1	37	ASP	H	H	9.2100	0.02	1
382	1	37	ASP	HA	H	4.6800	0.02	1
383	1	37	ASP	HB2	H	2.9000	0.02	2
384	1	37	ASP	HB3	H	2.6500	0.02	2
385	1	37	ASP	CA	C	52.2100	0.3	1
386	1	37	ASP	CB	C	41.9900	0.3	1
387	1	37	ASP	N	N	120.7300	0.3	1
388	1	38	PRO	HA	H	4.4400	0.02	1
389	1	38	PRO	HB2	H	2.3000	0.02	2
390	1	38	PRO	HB3	H	1.9800	0.02	2
391	1	38	PRO	HD3	H	3.6400	0.02	2
392	1	38	PRO	HG2	H	2.0300	0.02	2
393	1	38	PRO	C	C	175.6200	0.3	1
394	1	38	PRO	CA	C	63.2200	0.3	1
395	1	38	PRO	CB	C	31.7300	0.3	1
396	1	38	PRO	CD	C	50.3800	0.3	1
397	1	38	PRO	CG	C	27.1400	0.3	1
398	1	39	GLU	H	H	8.2800	0.02	1
399	1	39	GLU	HA	H	4.1400	0.02	1
400	1	39	GLU	HB2	H	2.2130	0.02	2
401	1	39	GLU	HB3	H	1.8600	0.02	2
402	1	39	GLU	HG2	H	2.3100	0.02	2
403	1	39	GLU	C	C	176.7800	0.3	1
404	1	39	GLU	CA	C	55.9500	0.3	1
405	1	39	GLU	CB	C	29.1700	0.3	1
406	1	39	GLU	CG	C	37.4800	0.3	1
407	1	39	GLU	N	N	114.5900	0.3	1
408	1	40	ASP	H	H	7.9900	0.02	1
409	1	40	ASP	HA	H	4.6800	0.02	1
410	1	40	ASP	HB2	H	3.3400	0.02	2
411	1	40	ASP	HB3	H	2.4700	0.02	2
412	1	40	ASP	C	C	175.7100	0.3	1
413	1	40	ASP	CA	C	51.6900	0.3	1
414	1	40	ASP	CB	C	38.9800	0.3	1
415	1	40	ASP	N	N	121.5700	0.3	1
416	1	41	HIS	H	H	7.7100	0.02	1
417	1	41	HIS	HA	H	4.2100	0.02	1
418	1	41	HIS	HB2	H	3.2100	0.02	2
419	1	41	HIS	HB3	H	3.1500	0.02	2
420	1	41	HIS	HD2	H	7.2120	0.02	1
421	1	41	HIS	C	C	178.1100	0.3	1
422	1	41	HIS	CA	C	59.2600	0.3	1
423	1	41	HIS	CB	C	30.4900	0.3	1
424	1	41	HIS	N	N	122.4900	0.3	1
425	1	42	GLU	H	H	8.7000	0.02	1
426	1	42	GLU	HA	H	4.0900	0.02	1
427	1	42	GLU	HB2	H	2.0500	0.02	2
428	1	42	GLU	HG2	H	2.3200	0.02	2
429	1	42	GLU	C	C	179.1600	0.3	1
430	1	42	GLU	CA	C	59.2300	0.3	1
431	1	42	GLU	CB	C	29.1900	0.3	1
432	1	42	GLU	CG	C	36.1800	0.3	1
433	1	42	GLU	N	N	118.8800	0.3	1
434	1	43	ARG	H	H	7.4350	0.02	1
435	1	43	ARG	HA	H	4.1300	0.02	1
436	1	43	ARG	HB2	H	1.9000	0.02	2
437	1	43	ARG	HB3	H	1.7900	0.02	2
438	1	43	ARG	HD2	H	3.2500	0.02	2
439	1	43	ARG	HG2	H	1.6600	0.02	2
440	1	43	ARG	C	C	178.6700	0.3	1
441	1	43	ARG	CA	C	58.1600	0.3	1
442	1	43	ARG	CB	C	30.1700	0.3	1
443	1	43	ARG	CD	C	43.2500	0.3	1
444	1	43	ARG	CG	C	27.2000	0.3	1
445	1	43	ARG	N	N	121.4900	0.3	1
446	1	44	ILE	H	H	8.1450	0.02	1
447	1	44	ILE	HA	H	3.4500	0.02	1
448	1	44	ILE	HB	H	1.8900	0.02	1
449	1	44	ILE	HD11	H	0.7700	0.02	1
450	1	44	ILE	HD12	H	0.7700	0.02	1
451	1	44	ILE	HD13	H	0.7700	0.02	1
452	1	44	ILE	HG12	H	1.5300	0.02	2
453	1	44	ILE	HG21	H	0.8000	0.02	1
454	1	44	ILE	HG22	H	0.8000	0.02	1
455	1	44	ILE	HG23	H	0.8000	0.02	1
456	1	44	ILE	C	C	177.7700	0.3	1
457	1	44	ILE	CA	C	65.1700	0.3	1
458	1	44	ILE	CB	C	36.9800	0.3	1
459	1	44	ILE	CD1	C	13.3600	0.3	1
460	1	44	ILE	CG1	C	29.6800	0.3	1
461	1	44	ILE	CG2	C	17.4100	0.3	1
462	1	44	ILE	N	N	119.0300	0.3	1
463	1	45	ARG	H	H	8.2300	0.02	1
464	1	45	ARG	HA	H	4.1500	0.02	1
465	1	45	ARG	HB2	H	1.9690	0.02	2
466	1	45	ARG	HB3	H	1.9030	0.02	2
467	1	45	ARG	HD2	H	3.2500	0.02	2
468	1	45	ARG	HG2	H	1.6850	0.02	2
469	1	45	ARG	HG3	H	1.8290	0.02	2
470	1	45	ARG	C	C	178.9700	0.3	1
471	1	45	ARG	CA	C	59.3200	0.3	1
472	1	45	ARG	CB	C	29.9800	0.3	1
473	1	45	ARG	CD	C	43.4600	0.3	1
474	1	45	ARG	CG	C	27.5000	0.3	1
475	1	45	ARG	N	N	118.9800	0.3	1
476	1	46	ALA	H	H	7.5450	0.02	1
477	1	46	ALA	HA	H	4.1900	0.02	1
478	1	46	ALA	HB1	H	1.6200	0.02	1
479	1	46	ALA	HB2	H	1.6200	0.02	1
480	1	46	ALA	HB3	H	1.6200	0.02	1
481	1	46	ALA	C	C	180.3600	0.3	1
482	1	46	ALA	CA	C	55.3700	0.3	1
483	1	46	ALA	CB	C	17.9900	0.3	1
484	1	46	ALA	N	N	121.1900	0.3	1
485	1	47	LEU	H	H	8.2020	0.02	1
486	1	47	LEU	HA	H	4.1800	0.02	1
487	1	47	LEU	HB2	H	2.0900	0.02	2
488	1	47	LEU	HB3	H	1.2700	0.02	2
489	1	47	LEU	HD11	H	0.9800	0.02	2
490	1	47	LEU	HD12	H	0.9800	0.02	2
491	1	47	LEU	HD13	H	0.9800	0.02	2
492	1	47	LEU	HG	H	0.7970	0.02	1
493	1	47	LEU	C	C	179.9700	0.3	1
494	1	47	LEU	CA	C	57.0100	0.3	1
495	1	47	LEU	CB	C	42.1100	0.3	1
496	1	47	LEU	CD1	C	23.9000	0.3	2
497	1	47	LEU	CD2	C	23.7100	0.3	2
498	1	47	LEU	CG	C	26.2900	0.3	1
499	1	47	LEU	N	N	119.6700	0.3	1
500	1	48	GLN	H	H	8.4960	0.02	1
501	1	48	GLN	HA	H	4.0700	0.02	1
502	1	48	GLN	HB2	H	2.4200	0.02	2
503	1	48	GLN	HE21	H	6.9000	0.02	2
504	1	48	GLN	HE22	H	7.5300	0.02	2
505	1	48	GLN	HG2	H	2.7600	0.02	2
506	1	48	GLN	HG3	H	2.6000	0.02	2
507	1	48	GLN	C	C	178.1400	0.3	1
508	1	48	GLN	CA	C	58.2400	0.3	1
509	1	48	GLN	CB	C	28.3300	0.3	1
510	1	48	GLN	CG	C	34.4700	0.3	1
511	1	48	GLN	N	N	117.8700	0.3	1
512	1	48	GLN	NE2	N	112.8600	0.3	1
513	1	49	ARG	H	H	8.0800	0.02	1
514	1	49	ARG	HA	H	4.2640	0.02	1
515	1	49	ARG	HB2	H	1.9500	0.02	2
516	1	49	ARG	HB3	H	1.8700	0.02	2
517	1	49	ARG	HD2	H	3.2500	0.02	2
518	1	49	ARG	HD3	H	3.2300	0.02	2
519	1	49	ARG	HG2	H	1.8160	0.02	2
520	1	49	ARG	HG3	H	1.6970	0.02	2
521	1	49	ARG	C	C	177.9300	0.3	1
522	1	49	ARG	CA	C	58.5000	0.3	1
523	1	49	ARG	CB	C	31.0700	0.3	1
524	1	49	ARG	CD	C	43.5100	0.3	1
525	1	49	ARG	CG	C	27.3600	0.3	1
526	1	49	ARG	N	N	117.0200	0.3	1
527	1	50	ASN	H	H	8.4600	0.02	1
528	1	50	ASN	HA	H	4.9740	0.02	1
529	1	50	ASN	HB2	H	2.9970	0.02	2
530	1	50	ASN	HB3	H	2.9330	0.02	2
531	1	50	ASN	C	C	175.9900	0.3	1
532	1	50	ASN	CA	C	53.5200	0.3	1
533	1	50	ASN	CB	C	40.5200	0.3	1
534	1	50	ASN	N	N	113.7100	0.3	1
535	1	51	GLY	H	H	7.6800	0.02	1
536	1	51	GLY	HA2	H	4.3930	0.02	2
537	1	51	GLY	HA3	H	3.8790	0.02	2
538	1	51	GLY	C	C	172.0700	0.3	1
539	1	51	GLY	CA	C	43.6100	0.3	1
540	1	51	GLY	N	N	109.8700	0.3	1
541	1	52	VAL	H	H	8.4500	0.02	1
542	1	52	VAL	HA	H	4.2540	0.02	1
543	1	52	VAL	HB	H	2.0830	0.02	1
544	1	52	VAL	HG11	H	0.9300	0.02	2
545	1	52	VAL	HG12	H	0.9300	0.02	2
546	1	52	VAL	HG13	H	0.9300	0.02	2
547	1	52	VAL	HG21	H	1.0530	0.02	2
548	1	52	VAL	HG22	H	1.0530	0.02	2
549	1	52	VAL	HG23	H	1.0530	0.02	2
550	1	52	VAL	C	C	175.1300	0.3	1
551	1	52	VAL	CA	C	60.0300	0.3	1
552	1	52	VAL	CB	C	32.5500	0.3	1
553	1	52	VAL	CG1	C	22.1600	0.3	2
554	1	52	VAL	CG2	C	22.0400	0.3	2
555	1	52	VAL	N	N	119.8900	0.3	1
556	1	53	PRO	HA	H	4.7400	0.02	1
557	1	53	PRO	HB2	H	2.4200	0.02	2
558	1	53	PRO	HB3	H	2.0800	0.02	2
559	1	53	PRO	HD2	H	4.0700	0.02	2
560	1	53	PRO	HG2	H	2.1200	0.02	2
561	1	53	PRO	CA	C	62.5700	0.3	1
562	1	53	PRO	CB	C	33.0000	0.3	1
563	1	53	PRO	CD	C	50.8200	0.3	1
564	1	53	PRO	CG	C	27.4500	0.3	1
565	1	54	SER	H	H	8.8900	0.02	1
566	1	54	SER	HA	H	4.2900	0.02	1
567	1	54	SER	HB2	H	4.0600	0.02	2
568	1	54	SER	HB3	H	3.9600	0.02	2
569	1	54	SER	CA	C	60.3000	0.3	1
570	1	54	SER	CB	C	62.6000	0.3	1
571	1	54	SER	N	N	115.0400	0.3	1
572	1	55	THR	H	H	7.0500	0.02	1
573	1	55	THR	HA	H	4.1400	0.02	1
574	1	55	THR	HB	H	4.4600	0.02	1
575	1	55	THR	HG21	H	1.2800	0.02	1
576	1	55	THR	HG22	H	1.2800	0.02	1
577	1	55	THR	HG23	H	1.2800	0.02	1
578	1	55	THR	C	C	174.8100	0.3	1
579	1	55	THR	CA	C	61.5700	0.3	1
580	1	55	THR	CB	C	68.6600	0.3	1
581	1	55	THR	CG2	C	22.4500	0.3	1
582	1	55	THR	N	N	107.5200	0.3	1
583	1	56	ILE	H	H	7.5500	0.02	1
584	1	56	ILE	HA	H	4.3800	0.02	1
585	1	56	ILE	HB	H	1.8700	0.02	1
586	1	56	ILE	HD11	H	0.8900	0.02	1
587	1	56	ILE	HD12	H	0.8900	0.02	1
588	1	56	ILE	HD13	H	0.8900	0.02	1
589	1	56	ILE	HG12	H	1.2100	0.02	2
590	1	56	ILE	HG13	H	1.5200	0.02	2
591	1	56	ILE	HG21	H	0.9300	0.02	1
592	1	56	ILE	HG22	H	0.9300	0.02	1
593	1	56	ILE	HG23	H	0.9300	0.02	1
594	1	56	ILE	C	C	174.4200	0.3	1
595	1	56	ILE	CA	C	60.3000	0.3	1
596	1	56	ILE	CB	C	37.9100	0.3	1
597	1	56	ILE	CD1	C	13.5000	0.3	1
598	1	56	ILE	CG1	C	27.3300	0.3	1
599	1	56	ILE	CG2	C	18.4300	0.3	1
600	1	56	ILE	N	N	124.1400	0.3	1
601	1	57	SER	H	H	8.5900	0.02	1
602	1	57	SER	HA	H	4.5200	0.02	1
603	1	57	SER	HB2	H	3.8200	0.02	2
604	1	57	SER	HB3	H	3.7600	0.02	2
605	1	57	SER	C	C	173.4000	0.3	1
606	1	57	SER	CA	C	58.0900	0.3	1
607	1	57	SER	CB	C	64.3700	0.3	1
608	1	57	SER	N	N	121.7700	0.3	1
609	1	58	GLU	H	H	8.4200	0.02	1
610	1	58	GLU	HA	H	4.7240	0.02	1
611	1	58	GLU	HB2	H	1.8340	0.02	2
612	1	58	GLU	HG2	H	2.3100	0.02	2
613	1	58	GLU	HG3	H	2.1800	0.02	2
614	1	58	GLU	C	C	178.0000	0.3	1
615	1	58	GLU	CA	C	54.9100	0.3	1
616	1	58	GLU	CB	C	31.8800	0.3	1
617	1	58	GLU	CG	C	37.5200	0.3	1
618	1	58	GLU	N	N	121.4300	0.3	1
619	1	59	GLU	H	H	9.1500	0.02	1
620	1	59	GLU	HA	H	4.4800	0.02	1
621	1	59	GLU	HB2	H	2.2600	0.02	2
622	1	59	GLU	HB3	H	2.0600	0.02	2
623	1	59	GLU	HG3	H	2.2800	0.02	2
624	1	59	GLU	C	C	174.0900	0.3	1
625	1	59	GLU	CA	C	54.9700	0.3	1
626	1	59	GLU	CB	C	30.6200	0.3	1
627	1	59	GLU	CG	C	35.7500	0.3	1
628	1	59	GLU	N	N	122.0700	0.3	1
629	1	60	GLN	H	H	8.3100	0.02	1
630	1	60	GLN	HA	H	4.0400	0.02	1
631	1	60	GLN	HB3	H	1.4700	0.02	2
632	1	60	GLN	HE21	H	6.9100	0.02	2
633	1	60	GLN	HE22	H	7.5900	0.02	2
634	1	60	GLN	C	C	173.9500	0.3	1
635	1	60	GLN	CA	C	54.3900	0.3	1
636	1	60	GLN	CB	C	28.0900	0.3	1
637	1	60	GLN	N	N	117.0800	0.3	1
638	1	60	GLN	NE2	N	112.9700	0.3	1
639	1	61	PRO	HA	H	4.7180	0.02	1
640	1	61	PRO	HB2	H	2.2200	0.02	2
641	1	61	PRO	HB3	H	1.8690	0.02	2
642	1	61	PRO	HD2	H	3.7000	0.02	2
643	1	61	PRO	HG2	H	2.0670	0.02	2
644	1	61	PRO	C	C	177.1800	0.3	1
645	1	61	PRO	CA	C	63.2600	0.3	1
646	1	61	PRO	CB	C	33.1100	0.3	1
647	1	61	PRO	CD	C	50.4800	0.3	1
648	1	61	PRO	CG	C	27.0400	0.3	1
649	1	62	HIS	H	H	9.3170	0.02	1
650	1	62	HIS	HA	H	4.8900	0.02	1
651	1	62	HIS	HB2	H	3.2100	0.02	2
652	1	62	HIS	HD2	H	7.3000	0.02	1
653	1	62	HIS	C	C	174.4600	0.3	1
654	1	62	HIS	CA	C	55.1700	0.3	1
655	1	62	HIS	CB	C	31.6400	0.3	1
656	1	62	HIS	N	N	121.3100	0.3	1
657	1	63	THR	H	H	8.6200	0.02	1
658	1	63	THR	HA	H	5.6700	0.02	1
659	1	63	THR	HB	H	4.2800	0.02	1
660	1	63	THR	HG21	H	1.1900	0.02	1
661	1	63	THR	HG22	H	1.1900	0.02	1
662	1	63	THR	HG23	H	1.1900	0.02	1
663	1	63	THR	C	C	174.1000	0.3	1
664	1	63	THR	CA	C	59.7900	0.3	1
665	1	63	THR	CB	C	71.3200	0.3	1
666	1	63	THR	CG2	C	21.3900	0.3	1
667	1	63	THR	N	N	114.5300	0.3	1
668	1	64	ALA	H	H	9.0160	0.02	1
669	1	64	ALA	HA	H	4.7000	0.02	1
670	1	64	ALA	HB1	H	1.3340	0.02	1
671	1	64	ALA	HB2	H	1.3340	0.02	1
672	1	64	ALA	HB3	H	1.3340	0.02	1
673	1	64	ALA	C	C	174.5200	0.3	1
674	1	64	ALA	CA	C	51.2100	0.3	1
675	1	64	ALA	CB	C	23.0900	0.3	1
676	1	64	ALA	N	N	125.1800	0.3	1
677	1	65	ARG	H	H	8.5600	0.02	1
678	1	65	ARG	HA	H	5.4500	0.02	1
679	1	65	ARG	HB2	H	1.8540	0.02	2
680	1	65	ARG	HB3	H	1.7600	0.02	2
681	1	65	ARG	HD2	H	3.1700	0.02	2
682	1	65	ARG	HG2	H	1.4600	0.02	2
683	1	65	ARG	C	C	177.4400	0.3	1
684	1	65	ARG	CA	C	54.2100	0.3	1
685	1	65	ARG	CB	C	32.7000	0.3	1
686	1	65	ARG	CD	C	43.4100	0.3	1
687	1	65	ARG	CG	C	27.0400	0.3	1
688	1	65	ARG	N	N	121.7800	0.3	1
689	1	66	THR	H	H	9.1400	0.02	1
690	1	66	THR	HA	H	4.2900	0.02	1
691	1	66	THR	HB	H	4.2800	0.02	1
692	1	66	THR	HG21	H	1.1610	0.02	1
693	1	66	THR	HG22	H	1.1610	0.02	1
694	1	66	THR	HG23	H	1.1610	0.02	1
695	1	66	THR	C	C	175.1300	0.3	1
696	1	66	THR	CA	C	61.8900	0.3	1
697	1	66	THR	CB	C	69.6800	0.3	1
698	1	66	THR	CG2	C	23.3100	0.3	1
699	1	66	THR	N	N	117.3100	0.3	1
700	1	67	ASP	H	H	8.2900	0.02	1
701	1	67	ASP	HA	H	4.3000	0.02	1
702	1	67	ASP	C	C	177.9800	0.3	1
703	1	67	ASP	CA	C	52.7300	0.3	1
704	1	67	ASP	CB	C	42.1700	0.3	1
705	1	67	ASP	N	N	122.3200	0.3	1
706	1	69	THR	H	H	8.4500	0.02	1
707	1	69	THR	HA	H	4.4700	0.02	1
708	1	69	THR	HB	H	4.1900	0.02	1
709	1	69	THR	HG21	H	1.2400	0.02	1
710	1	69	THR	HG22	H	1.2400	0.02	1
711	1	69	THR	HG23	H	1.2400	0.02	1
712	1	69	THR	C	C	175.4600	0.3	1
713	1	69	THR	CA	C	61.6400	0.3	1
714	1	69	THR	CB	C	69.7300	0.3	1
715	1	69	THR	CG2	C	21.6100	0.3	1
716	1	69	THR	N	N	107.6100	0.3	1
717	1	70	GLY	H	H	8.3800	0.02	1
718	1	70	GLY	HA2	H	4.3700	0.02	2
719	1	70	GLY	HA3	H	3.7500	0.02	2
720	1	70	GLY	C	C	172.5700	0.3	1
721	1	70	GLY	CA	C	45.5100	0.3	1
722	1	70	GLY	N	N	109.4400	0.3	1
723	1	71	THR	H	H	7.7000	0.02	1
724	1	71	THR	HA	H	5.7300	0.02	1
725	1	71	THR	HB	H	3.8600	0.02	1
726	1	71	THR	HG21	H	1.0310	0.02	1
727	1	71	THR	HG22	H	1.0310	0.02	1
728	1	71	THR	HG23	H	1.0310	0.02	1
729	1	71	THR	C	C	174.2900	0.3	1
730	1	71	THR	CA	C	60.4200	0.3	1
731	1	71	THR	CB	C	71.5100	0.3	1
732	1	71	THR	CG2	C	21.4500	0.3	1
733	1	71	THR	N	N	111.6900	0.3	1
734	1	72	ALA	H	H	9.1100	0.02	1
735	1	72	ALA	HA	H	4.8100	0.02	1
736	1	72	ALA	HB1	H	1.1000	0.02	1
737	1	72	ALA	HB2	H	1.1000	0.02	1
738	1	72	ALA	HB3	H	1.1000	0.02	1
739	1	72	ALA	C	C	174.9500	0.3	1
740	1	72	ALA	CA	C	50.6400	0.3	1
741	1	72	ALA	CB	C	22.1500	0.3	1
742	1	72	ALA	N	N	126.7100	0.3	1
743	1	73	THR	H	H	8.4800	0.02	1
744	1	73	THR	HA	H	5.1700	0.02	1
745	1	73	THR	HB	H	3.8400	0.02	1
746	1	73	THR	HG21	H	1.0200	0.02	1
747	1	73	THR	HG22	H	1.0200	0.02	1
748	1	73	THR	HG23	H	1.0200	0.02	1
749	1	73	THR	C	C	173.3500	0.3	1
750	1	73	THR	CA	C	61.9100	0.3	1
751	1	73	THR	CB	C	70.7500	0.3	1
752	1	73	THR	CG2	C	21.2000	0.3	1
753	1	73	THR	N	N	116.8400	0.3	1
754	1	74	ILE	H	H	9.2700	0.02	1
755	1	74	ILE	HA	H	4.4400	0.02	1
756	1	74	ILE	HB	H	1.6300	0.02	1
757	1	74	ILE	HD11	H	0.7100	0.02	1
758	1	74	ILE	HD12	H	0.7100	0.02	1
759	1	74	ILE	HD13	H	0.7100	0.02	1
760	1	74	ILE	HG12	H	1.3100	0.02	2
761	1	74	ILE	HG13	H	1.1200	0.02	2
762	1	74	ILE	HG21	H	0.7960	0.02	1
763	1	74	ILE	HG22	H	0.7960	0.02	1
764	1	74	ILE	HG23	H	0.7960	0.02	1
765	1	74	ILE	C	C	174.2100	0.3	1
766	1	74	ILE	CA	C	60.6600	0.3	1
767	1	74	ILE	CB	C	40.4200	0.3	1
768	1	74	ILE	CD1	C	16.9100	0.3	1
769	1	74	ILE	CG1	C	32.5400	0.3	1
770	1	74	ILE	CG2	C	19.5400	0.3	1
771	1	74	ILE	N	N	128.1400	0.3	1
772	1	75	THR	H	H	8.2940	0.02	1
773	1	75	THR	HA	H	4.9100	0.02	1
774	1	75	THR	HB	H	4.1600	0.02	1
775	1	75	THR	HG21	H	1.1500	0.02	1
776	1	75	THR	HG22	H	1.1500	0.02	1
777	1	75	THR	HG23	H	1.1500	0.02	1
778	1	75	THR	C	C	173.5600	0.3	1
779	1	75	THR	CA	C	59.7200	0.3	1
780	1	75	THR	CB	C	71.1500	0.3	1
781	1	75	THR	CG2	C	21.1400	0.3	1
782	1	75	THR	N	N	116.5000	0.3	1
783	1	76	ASN	H	H	8.5900	0.02	1
784	1	76	ASN	HA	H	4.1500	0.02	1
785	1	76	ASN	HB2	H	3.1200	0.02	2
786	1	76	ASN	HB3	H	2.7500	0.02	2
787	1	76	ASN	HD21	H	6.8100	0.02	2
788	1	76	ASN	HD22	H	7.5500	0.02	2
789	1	76	ASN	C	C	174.9300	0.3	1
790	1	76	ASN	CA	C	54.0500	0.3	1
791	1	76	ASN	CB	C	36.9800	0.3	1
792	1	76	ASN	N	N	114.0100	0.3	1
793	1	76	ASN	ND2	N	112.1700	0.3	1
794	1	77	LEU	H	H	8.8850	0.02	1
795	1	77	LEU	HA	H	4.6190	0.02	1
796	1	77	LEU	HB2	H	1.3300	0.02	2
797	1	77	LEU	HB3	H	0.9500	0.02	2
798	1	77	LEU	HD11	H	0.1050	0.02	2
799	1	77	LEU	HD12	H	0.1050	0.02	2
800	1	77	LEU	HD13	H	0.1050	0.02	2
801	1	77	LEU	HD21	H	0.1400	0.02	2
802	1	77	LEU	HD22	H	0.1400	0.02	2
803	1	77	LEU	HD23	H	0.1400	0.02	2
804	1	77	LEU	HG	H	1.1000	0.02	1
805	1	77	LEU	C	C	175.7100	0.3	1
806	1	77	LEU	CA	C	52.6600	0.3	1
807	1	77	LEU	CB	C	41.9100	0.3	1
808	1	77	LEU	CD1	C	26.0400	0.3	2
809	1	77	LEU	CD2	C	21.4700	0.3	2
810	1	77	LEU	CG	C	25.9400	0.3	1
811	1	77	LEU	N	N	120.0300	0.3	1
812	1	79	PRO	HA	H	4.4600	0.02	1
813	1	79	PRO	HB2	H	2.3100	0.02	2
814	1	79	PRO	HB3	H	1.9600	0.02	2
815	1	79	PRO	HD2	H	3.8000	0.02	2
816	1	79	PRO	HD3	H	3.6900	0.02	2
817	1	79	PRO	HG2	H	2.0400	0.02	2
818	1	79	PRO	C	C	176.3100	0.3	1
819	1	79	PRO	CA	C	63.1300	0.3	1
820	1	79	PRO	CB	C	32.0200	0.3	1
821	1	79	PRO	CD	C	50.4300	0.3	1
822	1	79	PRO	CG	C	27.9800	0.3	1
823	1	80	GLY	H	H	8.7500	0.02	1
824	1	80	GLY	HA2	H	3.9400	0.02	2
825	1	80	GLY	HA3	H	3.8900	0.02	2
826	1	80	GLY	C	C	170.3000	0.3	1
827	1	80	GLY	CA	C	44.9800	0.3	1
828	1	80	GLY	N	N	106.4400	0.3	1
829	1	81	THR	H	H	9.0930	0.02	1
830	1	81	THR	HA	H	4.7600	0.02	1
831	1	81	THR	HB	H	3.7900	0.02	1
832	1	81	THR	HG21	H	0.8800	0.02	1
833	1	81	THR	HG22	H	0.8800	0.02	1
834	1	81	THR	HG23	H	0.8800	0.02	1
835	1	81	THR	C	C	173.1200	0.3	1
836	1	81	THR	CA	C	62.7200	0.3	1
837	1	81	THR	CB	C	67.9900	0.3	1
838	1	81	THR	CG2	C	22.7300	0.3	1
839	1	81	THR	N	N	119.7200	0.3	1
840	1	82	TYR	H	H	9.1500	0.02	1
841	1	82	TYR	HA	H	5.2300	0.02	1
842	1	82	TYR	HB2	H	2.6000	0.02	2
843	1	82	TYR	HD1	H	6.8310	0.02	3
844	1	82	TYR	HE1	H	6.7210	0.02	3
845	1	82	TYR	C	C	174.5200	0.3	1
846	1	82	TYR	CA	C	57.0800	0.3	1
847	1	82	TYR	CB	C	41.7900	0.3	1
848	1	82	TYR	N	N	125.3400	0.3	1
849	1	83	VAL	H	H	9.3100	0.02	1
850	1	83	VAL	HA	H	5.4600	0.02	1
851	1	83	VAL	HB	H	1.9100	0.02	1
852	1	83	VAL	HG11	H	1.1140	0.02	2
853	1	83	VAL	HG12	H	1.1140	0.02	2
854	1	83	VAL	HG13	H	1.1140	0.02	2
855	1	83	VAL	HG21	H	1.0400	0.02	2
856	1	83	VAL	HG22	H	1.0400	0.02	2
857	1	83	VAL	HG23	H	1.0400	0.02	2
858	1	83	VAL	C	C	172.8000	0.3	1
859	1	83	VAL	CA	C	58.6500	0.3	1
860	1	83	VAL	CB	C	34.9800	0.3	1
861	1	83	VAL	CG1	C	19.7100	0.3	2
862	1	83	VAL	CG2	C	22.0700	0.3	2
863	1	83	VAL	N	N	119.3000	0.3	1
864	1	84	ILE	H	H	9.0700	0.02	1
865	1	84	ILE	HA	H	5.0600	0.02	1
866	1	84	ILE	HB	H	1.9600	0.02	1
867	1	84	ILE	HD11	H	0.8200	0.02	1
868	1	84	ILE	HD12	H	0.8200	0.02	1
869	1	84	ILE	HD13	H	0.8200	0.02	1
870	1	84	ILE	HG12	H	1.5300	0.02	2
871	1	84	ILE	HG13	H	1.2000	0.02	2
872	1	84	ILE	HG21	H	0.8570	0.02	1
873	1	84	ILE	HG22	H	0.8570	0.02	1
874	1	84	ILE	HG23	H	0.8570	0.02	1
875	1	84	ILE	C	C	174.5900	0.3	1
876	1	84	ILE	CA	C	60.5200	0.3	1
877	1	84	ILE	CB	C	39.6500	0.3	1
878	1	84	ILE	CD1	C	16.2300	0.3	1
879	1	84	ILE	CG1	C	29.9500	0.3	1
880	1	84	ILE	CG2	C	19.3900	0.3	1
881	1	84	ILE	N	N	128.2200	0.3	1
882	1	85	ARG	H	H	9.2700	0.02	1
883	1	85	ARG	HA	H	5.0100	0.02	1
884	1	85	ARG	HB2	H	1.7340	0.02	2
885	1	85	ARG	HB3	H	1.6430	0.02	2
886	1	85	ARG	HD2	H	3.0200	0.02	2
887	1	85	ARG	HD3	H	2.9310	0.02	2
888	1	85	ARG	HE	H	7.0200	0.02	1
889	1	85	ARG	HG2	H	1.3400	0.02	2
890	1	85	ARG	C	C	173.7500	0.3	1
891	1	85	ARG	CA	C	53.6600	0.3	1
892	1	85	ARG	CB	C	33.6800	0.3	1
893	1	85	ARG	CD	C	43.2300	0.3	1
894	1	85	ARG	CG	C	26.3600	0.3	1
895	1	85	ARG	N	N	120.1100	0.3	1
896	1	86	ASP	H	H	8.8700	0.02	1
897	1	86	ASP	HA	H	4.5500	0.02	1
898	1	86	ASP	HB2	H	2.6800	0.02	2
899	1	86	ASP	HB3	H	1.7000	0.02	2
900	1	86	ASP	C	C	178.3400	0.3	1
901	1	86	ASP	CA	C	53.5500	0.3	1
902	1	86	ASP	CB	C	40.8700	0.3	1
903	1	86	ASP	N	N	123.8600	0.3	1
904	1	87	THR	H	H	8.8200	0.02	1
905	1	87	THR	HA	H	3.8680	0.02	1
906	1	87	THR	HB	H	3.9730	0.02	1
907	1	87	THR	HG21	H	1.2600	0.02	1
908	1	87	THR	HG22	H	1.2600	0.02	1
909	1	87	THR	HG23	H	1.2600	0.02	1
910	1	87	THR	C	C	175.5200	0.3	1
911	1	87	THR	CA	C	65.1500	0.3	1
912	1	87	THR	CB	C	69.2500	0.3	1
913	1	87	THR	CG2	C	22.3600	0.3	1
914	1	87	THR	N	N	126.6100	0.3	1
915	1	88	ASN	H	H	9.4830	0.02	1
916	1	88	ASN	HA	H	4.5910	0.02	1
917	1	88	ASN	HB2	H	3.1100	0.02	2
918	1	88	ASN	HB3	H	2.6000	0.02	2
919	1	88	ASN	HD21	H	6.8400	0.02	2
920	1	88	ASN	HD22	H	7.5300	0.02	2
921	1	88	ASN	C	C	174.8900	0.3	1
922	1	88	ASN	CA	C	52.5600	0.3	1
923	1	88	ASN	CB	C	37.3700	0.3	1
924	1	88	ASN	N	N	121.8600	0.3	1
925	1	88	ASN	ND2	N	112.6400	0.3	1
926	1	89	THR	H	H	7.8600	0.02	1
927	1	89	THR	HA	H	4.1900	0.02	1
928	1	89	THR	HB	H	4.3700	0.02	1
929	1	89	THR	HG21	H	1.2900	0.02	1
930	1	89	THR	HG22	H	1.2900	0.02	1
931	1	89	THR	HG23	H	1.2900	0.02	1
932	1	89	THR	C	C	176.1100	0.3	1
933	1	89	THR	CA	C	62.5400	0.3	1
934	1	89	THR	CB	C	68.5700	0.3	1
935	1	89	THR	CG2	C	22.0600	0.3	1
936	1	89	THR	N	N	113.9900	0.3	1
937	1	90	THR	H	H	8.1300	0.02	1
938	1	90	THR	HA	H	4.2500	0.02	1
939	1	90	THR	HB	H	3.9700	0.02	1
940	1	90	THR	HG21	H	1.2700	0.02	1
941	1	90	THR	HG22	H	1.2700	0.02	1
942	1	90	THR	HG23	H	1.2700	0.02	1
943	1	90	THR	C	C	174.8500	0.3	1
944	1	90	THR	CA	C	64.0400	0.3	1
945	1	90	THR	CB	C	69.4200	0.3	1
946	1	90	THR	CG2	C	22.2400	0.3	1
947	1	90	THR	N	N	116.8900	0.3	1
948	1	91	LYS	H	H	7.6100	0.02	1
949	1	91	LYS	HA	H	4.5400	0.02	1
950	1	91	LYS	HB2	H	1.8100	0.02	2
951	1	91	LYS	HB3	H	1.5200	0.02	2
952	1	91	LYS	HD2	H	1.7000	0.02	2
953	1	91	LYS	HE2	H	3.0020	0.02	2
954	1	91	LYS	HG2	H	1.3490	0.02	2
955	1	91	LYS	HG3	H	1.3210	0.02	2
956	1	91	LYS	C	C	170.8500	0.3	1
957	1	91	LYS	CA	C	53.6200	0.3	1
958	1	91	LYS	CB	C	32.6600	0.3	1
959	1	91	LYS	CD	C	28.9500	0.3	1
960	1	91	LYS	CE	C	41.9000	0.3	1
961	1	91	LYS	CG	C	24.8500	0.3	1
962	1	91	LYS	N	N	122.0100	0.3	1
963	1	92	PRO	HA	H	4.4400	0.02	1
964	1	92	PRO	HB2	H	2.3600	0.02	2
965	1	92	PRO	HB3	H	1.9100	0.02	2
966	1	92	PRO	HD2	H	3.5100	0.02	2
967	1	92	PRO	HD3	H	3.1870	0.02	2
968	1	92	PRO	HG2	H	1.9700	0.02	2
969	1	92	PRO	C	C	178.7000	0.3	1
970	1	92	PRO	CA	C	62.8800	0.3	1
971	1	92	PRO	CB	C	32.0900	0.3	1
972	1	92	PRO	CD	C	49.9700	0.3	1
973	1	92	PRO	CG	C	27.2500	0.3	1
974	1	93	ARG	H	H	10.5400	0.02	1
975	1	93	ARG	HA	H	4.3900	0.02	1
976	1	93	ARG	HB2	H	2.2600	0.02	2
977	1	93	ARG	HB3	H	2.0500	0.02	2
978	1	93	ARG	HD3	H	3.4500	0.02	2
979	1	93	ARG	HG2	H	1.9300	0.02	2
980	1	93	ARG	C	C	176.0200	0.3	1
981	1	93	ARG	CA	C	56.1600	0.3	1
982	1	93	ARG	CB	C	30.7700	0.3	1
983	1	93	ARG	CD	C	43.2700	0.3	1
984	1	93	ARG	CG	C	27.7700	0.3	1
985	1	93	ARG	N	N	120.1400	0.3	1
986	1	94	PHE	H	H	7.3900	0.02	1
987	1	94	PHE	HA	H	5.2000	0.02	1
988	1	94	PHE	HB2	H	2.9700	0.02	2
989	1	94	PHE	HD2	H	7.0680	0.02	3
990	1	94	PHE	C	C	173.2500	0.3	1
991	1	94	PHE	CA	C	55.0400	0.3	1
992	1	94	PHE	CB	C	41.3300	0.3	1
993	1	94	PHE	CD2	C	133.4500	0.3	3
994	1	94	PHE	N	N	112.5600	0.3	1
995	1	95	SER	H	H	9.0200	0.02	1
996	1	95	SER	HA	H	4.8500	0.02	1
997	1	95	SER	HB2	H	4.1400	0.02	2
998	1	95	SER	HB3	H	3.9700	0.02	2
999	1	95	SER	C	C	171.7300	0.3	1
1000	1	95	SER	CA	C	57.0900	0.3	1
1001	1	95	SER	CB	C	62.6900	0.3	1
1002	1	95	SER	N	N	119.8300	0.3	1
1003	1	96	PRO	HA	H	5.1300	0.02	1
1004	1	96	PRO	HB2	H	2.2930	0.02	2
1005	1	96	PRO	HB3	H	1.9010	0.02	2
1006	1	96	PRO	HD2	H	3.6900	0.02	2
1007	1	96	PRO	HG2	H	2.1200	0.02	2
1008	1	96	PRO	C	C	176.9300	0.3	1
1009	1	96	PRO	CA	C	63.3400	0.3	1
1010	1	96	PRO	CB	C	32.9700	0.3	1
1011	1	96	PRO	CD	C	50.5800	0.3	1
1012	1	96	PRO	CG	C	27.4200	0.3	1
1013	1	97	LEU	H	H	8.9200	0.02	1
1014	1	97	LEU	HA	H	5.1500	0.02	1
1015	1	97	LEU	HB2	H	1.7200	0.02	2
1016	1	97	LEU	HB3	H	1.6100	0.02	2
1017	1	97	LEU	HD11	H	1.0360	0.02	2
1018	1	97	LEU	HD12	H	1.0360	0.02	2
1019	1	97	LEU	HD13	H	1.0360	0.02	2
1020	1	97	LEU	HD21	H	0.9100	0.02	2
1021	1	97	LEU	HD22	H	0.9100	0.02	2
1022	1	97	LEU	HD23	H	0.9100	0.02	2
1023	1	97	LEU	HG	H	1.8700	0.02	1
1024	1	97	LEU	C	C	175.2500	0.3	1
1025	1	97	LEU	CA	C	53.4400	0.3	1
1026	1	97	LEU	CB	C	46.5000	0.3	1
1027	1	97	LEU	CD1	C	24.5200	0.3	2
1028	1	97	LEU	CD2	C	26.9100	0.3	2
1029	1	97	LEU	CG	C	27.2000	0.3	1
1030	1	97	LEU	N	N	120.8900	0.3	1
1031	1	98	VAL	H	H	8.4900	0.02	1
1032	1	98	VAL	HA	H	5.2600	0.02	1
1033	1	98	VAL	HB	H	1.8100	0.02	1
1034	1	98	VAL	HG11	H	0.8100	0.02	2
1035	1	98	VAL	HG12	H	0.8100	0.02	2
1036	1	98	VAL	HG13	H	0.8100	0.02	2
1037	1	98	VAL	HG21	H	0.7400	0.02	2
1038	1	98	VAL	HG22	H	0.7400	0.02	2
1039	1	98	VAL	HG23	H	0.7400	0.02	2
1040	1	98	VAL	CA	C	60.7500	0.3	1
1041	1	98	VAL	CB	C	33.6500	0.3	1
1042	1	98	VAL	CG1	C	21.3600	0.3	2
1043	1	98	VAL	CG2	C	21.6300	0.3	2
1044	1	98	VAL	N	N	120.9600	0.3	1
1045	1	99	ILE	H	H	9.3400	0.02	1
1046	1	99	ILE	HA	H	5.1000	0.02	1
1047	1	99	ILE	HB	H	1.8600	0.02	1
1048	1	99	ILE	HD11	H	0.8940	0.02	1
1049	1	99	ILE	HD12	H	0.8940	0.02	1
1050	1	99	ILE	HD13	H	0.8940	0.02	1
1051	1	99	ILE	HG12	H	1.5500	0.02	2
1052	1	99	ILE	HG13	H	1.1700	0.02	2
1053	1	99	ILE	HG21	H	0.9200	0.02	1
1054	1	99	ILE	HG22	H	0.9200	0.02	1
1055	1	99	ILE	HG23	H	0.9200	0.02	1
1056	1	99	ILE	C	C	173.0900	0.3	1
1057	1	99	ILE	CA	C	55.7100	0.3	1
1058	1	99	ILE	CB	C	42.3300	0.3	1
1059	1	99	ILE	CD1	C	14.1200	0.3	1
1060	1	99	ILE	CG1	C	26.5000	0.3	1
1061	1	99	ILE	CG2	C	18.6500	0.3	1
1062	1	99	ILE	N	N	122.8400	0.3	1
1063	1	100	PRO	HA	H	5.2700	0.02	1
1064	1	100	PRO	HB2	H	2.3400	0.02	2
1065	1	100	PRO	HB3	H	1.9700	0.02	2
1066	1	100	PRO	HD2	H	3.8200	0.02	2
1067	1	100	PRO	HD3	H	3.6800	0.02	2
1068	1	100	PRO	HG2	H	0.8700	0.02	2
1069	1	100	PRO	C	C	175.0600	0.3	1
1070	1	100	PRO	CA	C	61.5500	0.3	1
1071	1	100	PRO	CB	C	32.0600	0.3	1
1072	1	100	PRO	CD	C	50.5800	0.3	1
1073	1	100	PRO	CG	C	26.8500	0.3	1
1074	1	101	LEU	H	H	9.2000	0.02	1
1075	1	101	LEU	HA	H	4.7580	0.02	1
1076	1	101	LEU	HB2	H	1.6040	0.02	2
1077	1	101	LEU	HD11	H	0.5290	0.02	2
1078	1	101	LEU	HD12	H	0.5290	0.02	2
1079	1	101	LEU	HD13	H	0.5290	0.02	2
1080	1	101	LEU	HD21	H	0.6200	0.02	2
1081	1	101	LEU	HD22	H	0.6200	0.02	2
1082	1	101	LEU	HD23	H	0.6200	0.02	2
1083	1	101	LEU	HG	H	1.4770	0.02	1
1084	1	101	LEU	C	C	176.4900	0.3	1
1085	1	101	LEU	CA	C	53.9100	0.3	1
1086	1	101	LEU	CB	C	45.4700	0.3	1
1087	1	101	LEU	CD1	C	25.5500	0.3	2
1088	1	101	LEU	CD2	C	25.5800	0.3	2
1089	1	101	LEU	CG	C	26.8000	0.3	1
1090	1	101	LEU	N	N	123.0800	0.3	1
1091	1	102	GLY	H	H	8.2820	0.02	1
1092	1	102	GLY	HA2	H	3.9600	0.02	2
1093	1	102	GLY	C	C	174.6600	0.3	1
1094	1	102	GLY	CA	C	45.3000	0.3	1
1095	1	102	GLY	N	N	108.4800	0.3	1
1096	1	103	ILE	H	H	7.7900	0.02	1
1097	1	103	ILE	HA	H	4.4800	0.02	1
1098	1	103	ILE	HB	H	1.7900	0.02	1
1099	1	103	ILE	HD11	H	0.7200	0.02	1
1100	1	103	ILE	HD12	H	0.7200	0.02	1
1101	1	103	ILE	HD13	H	0.7200	0.02	1
1102	1	103	ILE	HG12	H	1.3930	0.02	2
1103	1	103	ILE	HG13	H	1.0400	0.02	2
1104	1	103	ILE	HG21	H	0.4600	0.02	1
1105	1	103	ILE	HG22	H	0.4600	0.02	1
1106	1	103	ILE	HG23	H	0.4600	0.02	1
1107	1	103	ILE	C	C	176.0800	0.3	1
1108	1	103	ILE	CA	C	59.5000	0.3	1
1109	1	103	ILE	CB	C	38.5000	0.3	1
1110	1	103	ILE	CD1	C	9.1900	0.3	1
1111	1	103	ILE	CG1	C	26.6600	0.3	1
1112	1	103	ILE	CG2	C	18.2400	0.3	1
1113	1	103	ILE	N	N	114.4700	0.3	1
1114	1	104	ASP	H	H	8.4900	0.02	1
1115	1	104	ASP	HA	H	5.2200	0.02	1
1116	1	104	ASP	HB2	H	2.7300	0.02	2
1117	1	104	ASP	HB3	H	2.6200	0.02	2
1118	1	104	ASP	C	C	177.1000	0.3	1
1119	1	104	ASP	CA	C	54.3100	0.3	1
1120	1	104	ASP	CB	C	41.5300	0.3	1
1121	1	104	ASP	N	N	121.2400	0.3	1
1122	1	105	THR	H	H	8.0800	0.02	1
1123	1	105	THR	HA	H	4.4200	0.02	1
1124	1	105	THR	HB	H	4.3700	0.02	1
1125	1	105	THR	HG21	H	1.3000	0.02	1
1126	1	105	THR	HG22	H	1.3000	0.02	1
1127	1	105	THR	HG23	H	1.3000	0.02	1
1128	1	105	THR	C	C	175.3000	0.3	1
1129	1	105	THR	CA	C	62.1000	0.3	1
1130	1	105	THR	CB	C	69.0400	0.3	1
1131	1	105	THR	CG2	C	21.5500	0.3	1
1132	1	105	THR	N	N	114.4100	0.3	1
1133	1	106	THR	H	H	8.2800	0.02	1
1134	1	106	THR	HA	H	4.4300	0.02	1
1135	1	106	THR	HB	H	4.3500	0.02	1
1136	1	106	THR	HG21	H	1.2800	0.02	1
1137	1	106	THR	HG22	H	1.2800	0.02	1
1138	1	106	THR	HG23	H	1.2800	0.02	1
1139	1	106	THR	C	C	174.7100	0.3	1
1140	1	106	THR	CA	C	62.4000	0.3	1
1141	1	106	THR	CB	C	69.5300	0.3	1
1142	1	106	THR	CG2	C	21.7600	0.3	1
1143	1	106	THR	N	N	113.8900	0.3	1
1144	1	107	SER	H	H	7.9200	0.02	1
1145	1	107	SER	HA	H	4.9500	0.02	1
1146	1	107	SER	HB2	H	3.9040	0.02	2
1147	1	107	SER	HB3	H	3.8400	0.02	2
1148	1	107	SER	C	C	172.6000	0.3	1
1149	1	107	SER	CA	C	55.5000	0.3	1
1150	1	107	SER	CB	C	63.8800	0.3	1
1151	1	107	SER	N	N	116.9000	0.3	1
1152	1	108	PRO	HA	H	4.6500	0.02	1
1153	1	108	PRO	HB2	H	2.2500	0.02	2
1154	1	108	PRO	HB3	H	1.9300	0.02	2
1155	1	108	PRO	HD2	H	3.9500	0.02	2
1156	1	108	PRO	HD3	H	3.7300	0.02	2
1157	1	108	PRO	HG2	H	0.9100	0.02	2
1158	1	108	PRO	C	C	176.2500	0.3	1
1159	1	108	PRO	CA	C	61.3700	0.3	1
1160	1	108	PRO	CB	C	30.9300	0.3	1
1161	1	108	PRO	CD	C	50.9000	0.3	1
1162	1	108	PRO	CG	C	26.8800	0.3	1
1163	1	109	THR	H	H	7.6400	0.02	1
1164	1	109	THR	HA	H	5.0900	0.02	1
1165	1	109	THR	HB	H	3.9000	0.02	1
1166	1	109	THR	HG21	H	1.0200	0.02	1
1167	1	109	THR	HG22	H	1.0200	0.02	1
1168	1	109	THR	HG23	H	1.0200	0.02	1
1169	1	109	THR	C	C	173.5600	0.3	1
1170	1	109	THR	CA	C	60.9900	0.3	1
1171	1	109	THR	CB	C	69.8900	0.3	1
1172	1	109	THR	CG2	C	21.4400	0.3	1
1173	1	109	THR	N	N	112.7900	0.3	1
1174	1	110	MET	H	H	8.5530	0.02	1
1175	1	110	MET	HA	H	4.7500	0.02	1
1176	1	110	MET	HB2	H	1.9900	0.02	2
1177	1	110	MET	HB3	H	1.9300	0.02	2
1178	1	110	MET	HG2	H	2.4500	0.02	2
1179	1	110	MET	C	C	173.7500	0.3	1
1180	1	110	MET	CA	C	54.1300	0.3	1
1181	1	110	MET	CB	C	35.3500	0.3	1
1182	1	110	MET	CG	C	31.8600	0.3	1
1183	1	110	MET	N	N	126.9300	0.3	1
1184	1	111	THR	H	H	8.5200	0.02	1
1185	1	111	THR	HA	H	5.3400	0.02	1
1186	1	111	THR	HB	H	3.9200	0.02	1
1187	1	111	THR	HG21	H	1.0750	0.02	1
1188	1	111	THR	HG22	H	1.0750	0.02	1
1189	1	111	THR	HG23	H	1.0750	0.02	1
1190	1	111	THR	C	C	173.7500	0.3	1
1191	1	111	THR	CA	C	61.4100	0.3	1
1192	1	111	THR	CB	C	69.5800	0.3	1
1193	1	111	THR	CG2	C	20.8200	0.3	1
1194	1	111	THR	N	N	120.8800	0.3	1
1195	1	112	LEU	H	H	9.3900	0.02	1
1196	1	112	LEU	HA	H	4.6900	0.02	1
1197	1	112	LEU	HB2	H	1.5200	0.02	2
1198	1	112	LEU	HB3	H	1.3600	0.02	2
1199	1	112	LEU	HD11	H	0.8900	0.02	2
1200	1	112	LEU	HD12	H	0.8900	0.02	2
1201	1	112	LEU	HD13	H	0.8900	0.02	2
1202	1	112	LEU	HD21	H	0.8800	0.02	2
1203	1	112	LEU	HD22	H	0.8800	0.02	2
1204	1	112	LEU	HD23	H	0.8800	0.02	2
1205	1	112	LEU	HG	H	1.3600	0.02	1
1206	1	112	LEU	C	C	175.0900	0.3	1
1207	1	112	LEU	CA	C	52.6700	0.3	1
1208	1	112	LEU	CB	C	45.4900	0.3	1
1209	1	112	LEU	CD1	C	23.8800	0.3	2
1210	1	112	LEU	CD2	C	26.2900	0.3	2
1211	1	112	LEU	CG	C	26.9100	0.3	1
1212	1	112	LEU	N	N	127.6500	0.3	1
1213	1	113	ARG	H	H	8.6900	0.02	1
1214	1	113	ARG	HA	H	5.3200	0.02	1
1215	1	113	ARG	HB2	H	1.8000	0.02	2
1216	1	113	ARG	HB3	H	1.6900	0.02	2
1217	1	113	ARG	HD2	H	3.2000	0.02	2
1218	1	113	ARG	HG2	H	1.5400	0.02	2
1219	1	113	ARG	C	C	173.3300	0.3	1
1220	1	113	ARG	CA	C	52.7000	0.3	1
1221	1	113	ARG	CB	C	30.8500	0.3	1
1222	1	113	ARG	CD	C	43.3400	0.3	1
1223	1	113	ARG	CG	C	27.0700	0.3	1
1224	1	113	ARG	N	N	121.6400	0.3	1
1225	1	114	PRO	HA	H	4.4300	0.02	1
1226	1	114	PRO	HB2	H	1.3200	0.02	2
1227	1	114	PRO	HD2	H	3.3550	0.02	2
1228	1	114	PRO	HD3	H	3.2120	0.02	2
1229	1	114	PRO	C	C	175.0600	0.3	1
1230	1	114	PRO	CA	C	62.2400	0.3	1
1231	1	114	PRO	CB	C	32.3400	0.3	1
1232	1	114	PRO	CD	C	49.7300	0.3	1
1233	1	114	PRO	CG	C	26.8500	0.3	1
1234	1	115	LYS	H	H	8.8900	0.02	1
1235	1	115	LYS	HA	H	4.4700	0.02	1
1236	1	115	LYS	HB2	H	2.2200	0.02	2
1237	1	115	LYS	HB3	H	1.8900	0.02	2
1238	1	115	LYS	HD3	H	1.8300	0.02	2
1239	1	115	LYS	HG2	H	1.9200	0.02	2
1240	1	115	LYS	C	C	176.7100	0.3	1
1241	1	115	LYS	CA	C	55.3900	0.3	1
1242	1	115	LYS	CB	C	32.9100	0.3	1
1243	1	115	LYS	CD	C	31.7100	0.3	1
1244	1	115	LYS	CG	C	24.7100	0.3	1
1245	1	115	LYS	N	N	121.7800	0.3	1
1246	1	116	LEU	H	H	8.5400	0.02	1
1247	1	116	LEU	HA	H	4.6560	0.02	1
1248	1	116	LEU	HB2	H	1.7500	0.02	2
1249	1	116	LEU	HB3	H	1.6100	0.02	2
1250	1	116	LEU	HD11	H	0.9500	0.02	2
1251	1	116	LEU	HD12	H	0.9500	0.02	2
1252	1	116	LEU	HD13	H	0.9500	0.02	2
1253	1	116	LEU	HD21	H	0.8800	0.02	2
1254	1	116	LEU	HD22	H	0.8800	0.02	2
1255	1	116	LEU	HD23	H	0.8800	0.02	2
1256	1	116	LEU	HG	H	1.7700	0.02	1
1257	1	116	LEU	C	C	177.6400	0.3	1
1258	1	116	LEU	CA	C	54.1300	0.3	1
1259	1	116	LEU	CB	C	42.1200	0.3	1
1260	1	116	LEU	CD1	C	23.6700	0.3	2
1261	1	116	LEU	CD2	C	25.5400	0.3	2
1262	1	116	LEU	CG	C	26.9200	0.3	1
1263	1	116	LEU	N	N	125.9300	0.3	1
1264	1	117	ILE	H	H	8.2000	0.02	1
1265	1	117	ILE	HA	H	4.1300	0.02	1
1266	1	117	ILE	HB	H	1.8900	0.02	1
1267	1	117	ILE	HD11	H	0.6500	0.02	1
1268	1	117	ILE	HD12	H	0.6500	0.02	1
1269	1	117	ILE	HD13	H	0.6500	0.02	1
1270	1	117	ILE	HG12	H	1.2600	0.02	2
1271	1	117	ILE	HG13	H	1.0500	0.02	2
1272	1	117	ILE	HG21	H	0.4600	0.02	1
1273	1	117	ILE	HG22	H	0.4600	0.02	1
1274	1	117	ILE	HG23	H	0.4600	0.02	1
1275	1	117	ILE	C	C	177.1500	0.3	1
1276	1	117	ILE	CA	C	61.0200	0.3	1
1277	1	117	ILE	CB	C	38.5600	0.3	1
1278	1	117	ILE	CD1	C	14.7100	0.3	1
1279	1	117	ILE	CG1	C	28.0700	0.3	1
1280	1	117	ILE	CG2	C	18.1100	0.3	1
1281	1	117	ILE	N	N	122.7000	0.3	1
1282	1	118	ASP	H	H	8.5200	0.02	1
1283	1	118	ASP	HA	H	4.6200	0.02	1
1284	1	118	ASP	HB2	H	2.7300	0.02	2
1285	1	118	ASP	C	C	175.4700	0.3	1
1286	1	118	ASP	CA	C	54.0400	0.3	1
1287	1	118	ASP	CB	C	41.1400	0.3	1
1288	1	118	ASP	N	N	124.9800	0.3	1
1289	1	119	ALA	H	H	8.4000	0.02	1
1290	1	119	ALA	HA	H	4.4300	0.02	1
1291	1	119	ALA	HB1	H	1.4200	0.02	1
1292	1	119	ALA	HB2	H	1.4200	0.02	1
1293	1	119	ALA	HB3	H	1.4200	0.02	1
1294	1	119	ALA	C	C	177.5000	0.3	1
1295	1	119	ALA	CA	C	52.0300	0.3	1
1296	1	119	ALA	CB	C	19.2300	0.3	1
1297	1	119	ALA	N	N	125.5400	0.3	1
1298	1	120	THR	H	H	8.3400	0.02	1
1299	1	120	THR	HA	H	4.5500	0.02	1
1300	1	120	THR	HB	H	4.1900	0.02	1
1301	1	120	THR	HG21	H	1.2800	0.02	1
1302	1	120	THR	HG22	H	1.2800	0.02	1
1303	1	120	THR	HG23	H	1.2800	0.02	1
1304	1	120	THR	C	C	173.0200	0.3	1
1305	1	120	THR	CA	C	60.0700	0.3	1
1306	1	120	THR	CB	C	69.5800	0.3	1
1307	1	120	THR	CG2	C	21.2600	0.3	1
1308	1	120	THR	N	N	116.5200	0.3	1
1309	1	121	PRO	HA	H	4.4400	0.02	1
1310	1	121	PRO	HB2	H	2.3300	0.02	2
1311	1	121	PRO	HB3	H	1.9800	0.02	2
1312	1	121	PRO	HD2	H	3.9100	0.02	2
1313	1	121	PRO	HD3	H	3.7300	0.02	2
1314	1	121	PRO	HG2	H	2.0600	0.02	2
1315	1	121	PRO	C	C	177.4700	0.3	1
1316	1	121	PRO	CA	C	63.2600	0.3	1
1317	1	121	PRO	CB	C	31.9700	0.3	1
1318	1	121	PRO	CD	C	50.9700	0.3	1
1319	1	121	PRO	CG	C	27.2500	0.3	1
1320	1	122	GLY	H	H	8.5200	0.02	1
1321	1	122	GLY	HA2	H	3.9600	0.02	2
1322	1	122	GLY	HA3	H	3.9100	0.02	2
1323	1	122	GLY	C	C	173.4500	0.3	1
1324	1	122	GLY	CA	C	44.8800	0.3	1
1325	1	122	GLY	N	N	109.5400	0.3	1
1326	1	123	ALA	H	H	8.1400	0.02	1
1327	1	123	ALA	HA	H	4.6400	0.02	1
1328	1	123	ALA	HB1	H	1.4200	0.02	1
1329	1	123	ALA	HB2	H	1.4200	0.02	1
1330	1	123	ALA	HB3	H	1.4200	0.02	1
1331	1	123	ALA	C	C	175.6100	0.3	1
1332	1	123	ALA	CA	C	50.3800	0.3	1
1333	1	123	ALA	CB	C	18.1700	0.3	1
1334	1	123	ALA	N	N	124.8300	0.3	1
1335	1	124	PRO	HA	H	4.4400	0.02	1
1336	1	124	PRO	HB2	H	2.2800	0.02	2
1337	1	124	PRO	HB3	H	1.9100	0.02	2
1338	1	124	PRO	HD2	H	3.8200	0.02	2
1339	1	124	PRO	HD3	H	3.6500	0.02	2
1340	1	124	PRO	HG2	H	2.0000	0.02	2
1341	1	124	PRO	C	C	176.6300	0.3	1
1342	1	124	PRO	CA	C	63.1000	0.3	1
1343	1	124	PRO	CB	C	32.0000	0.3	1
1344	1	124	PRO	CD	C	50.3400	0.3	1
1345	1	124	PRO	CG	C	27.2000	0.3	1
1346	1	125	ASN	H	H	8.5800	0.02	1
1347	1	125	ASN	HA	H	4.7900	0.02	1
1348	1	125	ASN	HB2	H	2.8700	0.02	2
1349	1	125	ASN	HB3	H	2.7830	0.02	2
1350	1	125	ASN	C	C	174.7600	0.3	1
1351	1	125	ASN	CA	C	53.1600	0.3	1
1352	1	125	ASN	CB	C	38.7800	0.3	1
1353	1	125	ASN	N	N	119.0900	0.3	1
1354	1	125	ASN	ND2	N	117.5900	0.3	1
1355	1	126	VAL	H	H	7.6700	0.02	1
1356	1	126	VAL	HA	H	4.2400	0.02	1
1357	1	126	VAL	HB	H	2.0700	0.02	1
1358	1	126	VAL	HG11	H	0.9300	0.02	2
1359	1	126	VAL	HG12	H	0.9300	0.02	2
1360	1	126	VAL	HG13	H	0.9300	0.02	2
1361	1	126	VAL	HG21	H	0.9100	0.02	2
1362	1	126	VAL	HG22	H	0.9100	0.02	2
1363	1	126	VAL	HG23	H	0.9100	0.02	2
1364	1	126	VAL	C	C	174.2600	0.3	1
1365	1	126	VAL	CA	C	63.4900	0.3	1
1366	1	126	VAL	CB	C	33.2900	0.3	1
1367	1	126	VAL	CG1	C	21.5300	0.3	2
1368	1	126	VAL	CG2	C	19.9500	0.3	2
1369	1	126	VAL	N	N	123.5800	0.3	1

Release date

2023-05-28

Citation

The basal and major pilins in the Corynebacterium diphtheriae SpaA pilus adopt similar structures that competitively react with the pilin polymerase
Sue, C.K., Cheung, N.A., Mahoney, B.J., McConnell, S.A., Scully, J.M., Fu, J.Y., Chang, C., Ton-That, H., Loo, J.A., Clubb, R.T.
Biopolymers (2023), e23539-e23539, PubMed 37227047 , DOI 10.1002/bip.23539 , Abstract