#	AA	SS3	SS8	ASA 	HSEa-u	HSEa-d	CN13	theta	tau 	phi 	psi 	P(3-C)	P(3-E)	P(3-H)	P(8-C)	P(8-S)	P(8-T)	P(8-H)	P(8-G)	P(8-I)	P(8-E)	P(8-B)	
0	A	C	C	59.41	7.99	12.89	21.75	107.87	-139.04	-77.35	124.20	99.59	0.12	0.29	99.42	0.13	0.13	0.22	0.01	0.00	0.05	0.03
1	G	C	C	43.64	4.10	12.05	17.30	109.13	54.32	-72.30	-31.71	70.23	1.11	28.66	63.24	1.15	4.36	29.46	0.84	0.00	0.40	0.54
2	R	H	H	163.53	1.72	11.22	13.61	95.34	49.68	-67.56	-36.29	23.54	0.52	75.94	14.47	4.17	5.31	74.52	1.12	0.01	0.20	0.21
3	I	H	H	103.35	2.94	11.95	15.86	93.68	52.73	-66.71	-39.43	8.06	0.14	91.80	4.26	1.20	2.58	91.04	0.81	0.00	0.06	0.04
4	A	H	H	52.08	3.94	12.33	17.74	92.70	52.07	-64.89	-40.69	2.39	0.03	97.58	1.19	0.34	0.88	97.00	0.56	0.00	0.02	0.01
5	S	H	H	58.00	2.34	14.39	17.13	92.37	51.28	-65.02	-40.67	0.97	0.01	99.01	0.40	0.12	0.42	98.72	0.32	0.00	0.01	0.00
6	F	H	H	111.59	2.70	14.61	17.90	92.34	50.29	-65.03	-41.70	0.50	0.01	99.50	0.15	0.06	0.25	99.37	0.16	0.00	0.00	0.00
7	L	H	H	79.92	5.08	14.08	20.41	92.54	49.28	-65.56	-40.97	0.48	0.01	99.52	0.12	0.05	0.27	99.43	0.13	0.00	0.00	0.00
8	K	H	H	116.16	2.97	15.66	19.17	92.22	50.62	-64.52	-41.05	0.71	0.01	99.28	0.14	0.06	0.46	99.18	0.16	0.00	0.00	0.00
9	N	H	H	91.86	1.95	16.58	17.94	92.74	48.96	-65.75	-39.86	1.61	0.01	98.38	0.20	0.11	1.22	98.17	0.29	0.00	0.00	0.00
10	A	H	H	45.47	4.98	13.66	20.34	92.52	50.78	-65.53	-39.67	3.82	0.01	96.16	0.37	0.26	3.00	95.10	1.25	0.01	0.00	0.00
11	W	H	H	121.89	6.91	12.65	20.94	92.71	51.62	-68.81	-30.28	14.51	0.05	85.44	1.18	0.93	12.01	81.95	3.86	0.03	0.02	0.03
12	A	H	H	75.67	2.82	13.97	17.47	93.04	58.46	-73.67	-20.37	41.64	0.12	58.25	2.54	2.63	35.43	56.25	2.99	0.03	0.04	0.08
13	K	C	T	143.38	1.97	14.16	16.22	101.10	56.29	-88.82	-15.39	60.07	0.35	39.58	6.17	10.38	42.34	37.81	2.88	0.04	0.12	0.26
14	E	C	S	98.83	6.03	11.48	19.04	115.91	14.22	-94.75	128.93	89.43	0.74	9.83	36.60	47.33	4.70	9.64	1.00	0.00	0.21	0.52
15	P	C	C	71.42	5.40	12.79	19.81	107.17	-116.57	-68.44	134.44	77.39	0.99	21.62	64.85	4.10	5.85	22.80	1.50	0.00	0.41	0.48
16	V	H	H	85.34	6.39	12.47	20.16	94.93	-140.92	-66.06	-35.58	17.26	0.63	82.11	9.38	3.37	5.51	79.64	1.58	0.02	0.27	0.22
17	L	H	H	100.81	3.11	14.76	18.61	93.06	54.35	-65.95	-39.08	6.32	0.30	93.39	2.68	0.98	2.98	91.50	1.57	0.02	0.18	0.07
18	V	H	H	79.74	2.88	16.07	19.22	92.51	49.26	-66.21	-41.14	2.69	0.13	97.18	1.16	0.38	1.28	95.75	1.30	0.01	0.09	0.02
19	A	H	H	43.36	6.01	14.85	22.34	92.06	50.57	-64.52	-41.60	1.45	0.05	98.51	0.52	0.19	0.73	97.57	0.94	0.01	0.03	0.01
20	S	H	H	45.96	6.48	14.96	22.92	92.01	51.16	-64.60	-40.71	1.48	0.03	98.50	0.37	0.15	0.87	97.78	0.80	0.01	0.01	0.00
21	F	H	H	121.04	2.68	17.51	20.23	92.31	49.75	-65.71	-40.54	1.93	0.02	98.05	0.34	0.17	1.31	97.29	0.86	0.01	0.01	0.00
22	A	H	H	57.12	3.49	17.32	21.03	92.24	49.94	-65.24	-41.51	3.17	0.03	96.79	0.47	0.27	2.30	95.91	1.01	0.01	0.02	0.01
23	I	H	H	78.63	6.26	16.28	23.40	92.74	48.65	-66.07	-41.17	4.94	0.04	95.02	0.62	0.44	3.75	93.56	1.56	0.02	0.02	0.01
24	G	H	H	33.03	5.27	15.43	22.01	92.26	52.31	-63.58	-41.27	10.26	0.05	89.69	0.83	0.71	8.56	85.05	4.76	0.04	0.02	0.02
25	G	H	H	40.40	2.39	16.92	19.15	92.16	50.48	-65.77	-39.38	19.96	0.06	79.98	1.10	1.08	17.60	72.69	7.42	0.05	0.03	0.04
26	L	H	H	87.10	4.07	15.72	20.54	92.99	51.17	-70.22	-33.19	12.71	0.09	87.21	1.49	1.18	9.29	72.29	15.61	0.05	0.05	0.05
27	A	H	H	45.65	8.16	11.88	21.59	92.47	59.36	-64.72	-35.91	12.84	0.20	86.96	1.72	1.14	8.34	58.64	29.91	0.05	0.12	0.08
28	I	H	H	120.01	2.11	14.90	17.34	92.75	52.73	-70.96	-28.17	23.05	0.21	76.74	1.35	1.49	17.80	49.14	29.88	0.10	0.12	0.12
29	I	H	H	120.68	1.78	14.29	15.97	95.86	49.80	-80.51	-21.78	32.48	0.42	67.10	2.16	3.67	24.98	47.72	20.63	0.34	0.21	0.31
30	L	C	C	80.73	6.70	10.19	18.44	106.72	72.07	-93.97	86.03	54.82	1.11	44.08	27.89	19.88	8.15	24.16	18.80	0.02	0.43	0.68
31	P	H	G	86.25	4.81	11.47	17.98	95.77	74.95	-65.26	-28.75	21.64	0.42	77.94	6.61	2.80	11.77	19.79	58.63	0.00	0.29	0.10
32	S	H	G	86.69	1.88	13.10	15.47	95.13	57.92	-74.67	-16.07	23.35	0.49	76.16	4.11	3.18	15.37	19.25	57.61	0.02	0.30	0.16
33	L	H	G	111.92	3.49	12.19	16.88	99.91	54.34	-90.73	1.96	34.14	1.36	64.49	8.40	8.12	19.23	15.47	47.35	0.06	0.71	0.66
34	S	C	C	47.16	9.20	9.09	19.58	114.84	102.00	-96.47	125.76	93.86	2.43	3.71	47.97	42.63	3.33	2.06	1.40	0.00	0.80	1.82
35	P	C	C	86.75	4.28	13.51	19.06	99.34	-141.28	-70.12	-13.37	85.81	1.76	12.43	32.08	27.40	27.02	7.32	4.42	0.01	0.76	1.00
36	Y	C	C	126.47	6.47	12.03	19.81	105.49	53.00	-90.09	43.46	75.42	3.06	21.52	38.60	16.53	20.79	15.89	5.12	0.03	1.33	1.71
37	T	C	H	64.43	6.04	12.63	20.25	112.15	111.76	-83.21	-38.12	50.46	1.47	48.07	36.02	8.64	6.44	44.71	2.88	0.01	0.55	0.76
38	N	H	H	110.95	2.33	14.92	17.38	93.77	-81.87	-65.09	-36.62	10.01	0.14	89.85	3.74	2.26	4.65	87.64	1.56	0.03	0.06	0.07
39	Y	H	H	122.82	3.40	15.41	19.53	92.87	51.20	-66.72	-39.57	3.91	0.07	96.03	1.24	0.60	2.11	94.84	1.15	0.01	0.03	0.02
40	A	H	H	30.08	9.08	12.48	23.47	92.51	51.80	-64.90	-40.68	1.61	0.03	98.36	0.66	0.20	0.72	97.70	0.70	0.00	0.02	0.01
41	I	H	H	79.41	4.72	15.25	21.25	92.24	50.42	-64.78	-41.18	0.86	0.02	99.12	0.30	0.09	0.42	98.76	0.41	0.00	0.01	0.00
42	R	H	H	129.69	2.08	16.97	18.67	92.17	50.21	-65.31	-41.10	0.80	0.02	99.18	0.21	0.07	0.46	98.81	0.44	0.00	0.01	0.00
43	I	H	H	74.42	5.55	14.79	21.72	92.51	48.73	-65.88	-40.74	1.11	0.01	98.87	0.20	0.09	0.72	98.45	0.53	0.00	0.01	0.00
44	N	H	H	66.02	9.32	12.34	22.81	92.32	52.03	-67.00	-33.29	4.14	0.02	95.84	0.49	0.29	3.14	94.99	1.06	0.00	0.01	0.01
45	R	H	H	164.28	2.11	15.10	17.75	92.68	55.19	-69.58	-27.18	16.22	0.03	83.74	0.67	0.77	14.87	82.32	1.32	0.02	0.01	0.02
46	A	H	H	78.21	2.30	13.86	16.46	95.91	48.57	-83.01	-13.79	30.19	0.13	69.68	1.71	3.30	25.05	68.53	1.21	0.07	0.04	0.09
47	T	C	S	57.29	8.43	9.56	19.55	119.51	66.31	-115.28	129.00	97.43	1.45	1.12	27.25	68.92	1.32	0.82	0.26	0.00	0.45	0.98
48	P	C	C	90.13	3.77	13.22	18.34	101.88	-130.65	-68.64	36.01	86.58	3.02	10.41	54.96	10.54	19.90	1.72	9.88	0.00	1.87	1.13
49	Y	C	C	120.74	8.93	10.81	20.61	115.00	91.05	-95.84	129.00	81.22	7.62	11.16	35.30	19.71	26.81	1.60	9.61	0.01	4.00	2.96
50	N	C	C	106.91	3.93	14.70	20.04	112.39	-157.30	-104.96	114.87	81.65	9.20	9.16	46.85	19.48	14.76	1.56	8.45	0.01	5.03	3.86
51	Y	C	C	97.62	10.85	9.58	21.20	117.30	-156.09	-101.41	128.66	91.25	7.83	0.92	64.15	24.30	2.76	0.30	0.70	0.00	4.15	3.65
52	P	C	C	95.26	3.66	14.04	18.81	98.01	-139.89	-72.97	-11.56	96.01	3.14	0.85	45.59	45.03	5.73	0.23	0.61	0.00	1.69	1.13
53	V	C	S	74.85	6.91	9.44	18.10	119.93	83.01	-107.58	136.30	91.14	6.45	2.41	34.05	52.17	5.33	0.88	1.28	0.01	2.99	3.30
54	P	C	C	88.08	3.70	11.80	17.06	112.06	-109.77	-67.30	148.72	89.14	5.06	5.80	66.28	13.97	8.64	1.64	4.25	0.00	2.96	2.25
55	L	C	C	117.73	3.73	9.69	15.34	113.37	-120.23	-89.32	134.27	78.39	10.85	10.75	50.31	16.51	11.23	3.40	7.31	0.03	5.33	5.88
56	R	C	C	154.27	3.71	9.70	15.25	112.50	-142.32	-91.66	128.50	78.88	10.50	10.61	46.87	17.60	14.35	2.86	7.71	0.02	5.43	5.15
57	D	C	C	93.67	4.59	9.18	15.49	110.12	-157.62	-94.76	107.81	82.86	8.33	8.82	47.26	19.16	16.24	1.98	6.91	0.01	3.96	4.47
58	D	C	T	108.07	2.89	10.82	15.19	99.71	-164.17	-87.77	8.56	88.25	3.07	8.68	28.43	20.29	39.56	1.43	7.16	0.01	1.47	1.67
59	G	C	T	49.24	4.43	10.32	16.36	100.69	-109.86	79.00	5.10	91.78	1.49	6.73	19.38	26.59	45.29	0.80	6.39	0.00	0.74	0.81
60	N	C	C	115.08	2.25	11.24	14.67	101.57	103.55	-88.87	12.82	90.43	4.18	5.39	35.74	34.21	20.14	0.73	5.00	0.00	1.85	2.32
61	M	C	C	89.29	7.02	8.40	16.93	109.90	69.15	-105.07	102.59	92.28	6.53	1.19	61.04	28.12	2.69	0.30	0.97	0.00	2.59	4.28
62	P	C	T	91.65	3.93	11.27	16.93	101.19	-135.80	-68.87	-9.41	94.61	2.86	2.53	26.59	13.83	54.14	0.33	2.37	0.00	1.74	1.00
63	D	C	T	120.13	1.88	12.96	15.62	99.35	32.00	-89.57	9.73	95.51	2.56	1.93	20.44	19.08	55.91	0.22	1.96	0.00	1.67	0.72
64	V	C	S	72.01	7.65	10.12	19.54	119.00	105.35	-104.11	134.88	92.20	7.17	0.63	41.11	49.91	1.61	0.18	0.41	0.00	2.94	3.84
65	P	C	C	72.87	6.23	12.66	20.59	114.00	-106.78	-66.93	149.72	93.16	5.84	1.00	81.71	7.51	3.41	0.23	0.88	0.00	2.97	3.30
66	S	C	C	73.12	5.96	12.51	19.96	104.23	-130.18	-81.60	17.42	95.14	3.72	1.14	51.86	38.64	4.50	0.26	0.91	0.00	1.46	2.38
67	H	C	C	99.32	6.27	12.34	20.15	115.01	-114.24	-107.33	119.79	95.63	3.24	1.13	61.92	29.46	3.76	0.23	0.96	0.00	1.11	2.56
68	P	C	T	76.22	7.63	10.57	19.66	101.25	-134.67	-66.16	-6.84	96.10	0.76	3.14	27.61	13.41	54.62	0.33	3.25	0.00	0.40	0.38
69	Q	C	T	141.41	1.78	12.66	15.19	98.65	46.66	-85.43	-5.64	95.45	1.23	3.32	19.24	20.54	55.26	0.39	3.33	0.00	0.66	0.58
70	D	C	C	79.38	4.84	11.01	17.65	111.65	84.97	-100.11	114.46	96.43	2.68	0.89	51.32	42.94	1.99	0.25	0.59	0.00	0.87	2.03
71	P	C	C	95.70	5.13	10.72	17.77	99.19	-152.51	-68.05	-10.15	96.37	1.19	2.44	39.31	21.84	35.15	0.37	2.19	0.00	0.61	0.54
72	Q	C	C	126.23	3.18	12.77	17.10	102.30	80.30	-91.89	3.33	88.20	7.93	3.88	35.95	23.30	29.53	0.91	2.85	0.01	3.50	3.95
73	G	C	S	27.67	7.77	12.77	21.93	128.61	83.30	109.80	-170.61	90.74	6.45	2.81	39.41	46.86	4.79	1.18	1.42	0.00	2.68	3.67
74	P	C	C	78.04	6.05	15.27	22.28	110.27	-39.41	-69.68	139.80	87.87	3.23	8.89	55.11	22.28	10.69	5.32	3.36	0.00	1.47	1.76
75	S	C	C	47.30	8.00	14.57	23.81	117.43	-121.37	-87.95	149.95	77.42	3.03	19.55	60.49	9.03	7.03	16.70	3.45	0.00	1.09	2.20
76	L	H	H	69.09	10.53	11.63	23.09	95.50	-128.54	-69.07	-23.74	20.99	0.51	78.50	12.03	4.06	6.44	66.19	10.77	0.02	0.27	0.22
77	E	H	H	114.38	2.29	15.39	18.05	92.71	76.08	-63.61	-37.69	8.21	0.17	91.63	2.32	1.13	4.39	74.06	17.93	0.02	0.11	0.04
78	W	H	H	103.76	5.92	12.40	20.21	92.51	54.39	-65.38	-38.08	5.83	0.11	94.06	1.35	0.71	3.27	74.37	20.20	0.01	0.08	0.02
79	L	H	H	61.79	10.45	9.91	21.27	93.34	52.87	-69.35	-32.53	8.49	0.18	91.33	2.39	1.21	4.47	72.97	18.78	0.02	0.10	0.06
80	K	H	H	135.74	3.06	11.54	16.13	93.51	60.31	-68.18	-28.69	33.16	0.55	66.28	5.48	3.90	23.41	55.59	10.92	0.11	0.27	0.33
81	N	C	T	124.61	1.25	12.05	13.41	97.51	51.93	-84.76	-0.66	60.70	0.30	39.00	18.23	1.67	40.66	33.86	5.22	0.00	0.12	0.23
82	L	C	C	85.83	9.20	9.47	19.39	102.39	111.30	-76.65	17.49	99.82	0.03	0.15	99.44	0.17	0.24	0.12	0.01	0.00	0.01	0.01