#	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	M	C	C	111.04	6.40	13.36	21.19	116.70	-159.15	-98.39	133.43	99.72	0.27	0.00	99.76	0.05	0.01	0.00	0.00	0.00	0.16	0.01
1	S	C	C	73.77	5.41	11.34	18.62	119.00	-152.99	-97.40	140.03	80.14	18.71	1.15	76.64	1.26	2.14	0.30	0.55	0.00	17.86	1.25
2	H	C	E	108.48	7.85	11.52	20.67	118.17	-164.64	-112.33	135.20	58.49	39.85	1.66	38.46	16.10	3.99	0.38	1.22	0.00	38.83	1.03
3	S	E	E	60.66	7.30	15.34	23.92	123.26	-156.10	-112.39	145.02	35.68	62.76	1.56	28.79	5.42	1.09	0.43	0.89	0.00	62.77	0.61
4	V	E	E	47.87	16.18	13.52	29.58	123.71	-160.81	-119.45	132.82	12.61	86.50	0.89	11.48	0.91	0.20	0.62	0.25	0.00	86.12	0.42
5	K	E	E	110.28	6.81	20.70	28.55	119.49	-155.87	-109.05	129.94	7.55	91.74	0.71	6.95	0.45	0.13	0.50	0.16	0.00	91.45	0.35
6	I	E	E	37.15	17.77	14.35	32.18	118.48	-158.55	-105.84	125.75	20.36	78.66	0.98	19.33	0.95	0.24	0.50	0.32	0.00	77.96	0.71
7	Y	C	C	91.03	10.22	17.90	28.75	114.99	-167.04	-98.93	149.14	58.65	37.10	4.26	37.14	16.55	4.79	1.06	2.84	0.00	36.67	0.94
8	D	C	S	96.58	6.07	20.13	26.62	102.10	-56.97	-84.33	-4.85	76.48	17.56	5.96	16.01	41.76	19.84	1.01	4.16	0.02	15.93	1.26
9	T	C	C	64.30	9.46	20.26	29.82	116.66	50.78	-110.39	113.48	76.65	15.72	7.63	39.76	19.57	18.52	1.75	5.63	0.02	12.90	1.85
10	C	C	C	17.03	22.10	14.34	35.62	113.35	118.29	-94.66	122.19	79.35	16.89	3.77	66.65	7.23	4.76	1.25	2.63	0.00	12.57	4.91
11	I	C	C	63.44	11.78	22.18	33.95	113.01	-156.69	-100.50	122.45	78.57	17.51	3.92	32.36	19.37	28.65	1.50	2.24	0.06	11.19	4.63
12	G	C	S	31.62	9.94	22.74	32.73	98.24	5.46	76.96	13.69	88.77	7.07	4.15	28.31	31.33	30.27	1.56	2.22	0.01	4.50	1.79
13	C	C	C	17.70	21.09	15.31	35.46	102.83	130.94	-84.45	16.13	76.77	2.28	20.95	56.79	13.00	5.65	20.21	2.22	0.00	0.88	1.25
14	T	H	H	70.63	8.13	21.59	30.06	94.40	72.20	-64.68	-35.70	32.13	0.70	67.17	10.10	11.08	12.83	63.12	2.16	0.09	0.25	0.37
15	Q	H	H	86.76	6.41	23.75	30.24	92.46	53.78	-67.27	-38.53	16.03	0.93	83.03	6.77	4.13	7.05	78.69	2.37	0.16	0.52	0.31
16	C	H	H	5.16	23.63	16.90	40.50	92.09	51.91	-64.88	-42.92	4.87	0.96	94.18	2.49	0.89	2.32	89.91	3.33	0.05	0.88	0.13
17	V	H	H	26.54	19.22	18.49	37.00	91.77	51.46	-64.57	-39.05	3.37	1.33	95.30	1.35	0.54	1.90	90.97	3.68	0.06	1.38	0.12
18	R	H	H	156.27	2.67	23.73	26.38	91.74	52.98	-66.81	-33.33	6.94	0.98	92.08	1.33	0.71	5.31	88.74	2.71	0.15	0.88	0.16
19	A	H	H	36.42	11.94	18.81	31.25	93.65	51.35	-79.82	-20.06	18.00	0.57	81.43	1.27	2.03	15.34	79.31	1.16	0.34	0.20	0.34
20	C	C	C	8.62	23.94	10.74	34.04	110.91	74.25	-99.33	108.42	97.56	1.51	0.93	66.66	29.47	1.36	0.87	0.15	0.00	0.62	0.86
21	P	C	T	90.59	3.97	20.69	25.48	93.46	-159.81	-66.74	-19.98	91.77	1.14	7.09	22.12	20.61	48.84	2.16	5.08	0.00	0.73	0.46
22	L	C	T	68.50	10.42	17.06	28.17	96.55	53.50	-92.86	-2.14	90.06	1.53	8.41	5.93	30.12	54.49	2.43	5.42	0.01	1.03	0.57
23	D	C	C	86.65	8.51	21.05	30.10	95.01	-118.73	59.04	44.12	84.95	6.60	8.45	47.41	20.93	16.49	1.84	6.90	0.01	5.44	0.98
24	V	C	C	12.63	20.50	18.12	38.90	97.51	144.71	-86.29	-23.42	73.97	21.70	4.33	40.51	28.70	4.64	1.57	2.43	0.01	21.15	0.99
25	L	E	E	7.63	24.66	16.28	41.17	127.24	45.54	-125.03	139.04	20.72	76.87	2.41	15.57	4.78	1.70	0.92	1.13	0.00	74.94	0.96
26	E	E	E	85.65	7.44	25.85	33.94	128.08	-170.73	-124.52	144.32	8.91	90.06	1.03	7.22	1.11	0.45	0.40	0.39	0.00	90.17	0.26
27	M	E	E	53.14	18.79	16.03	34.19	115.95	-128.74	-90.98	130.68	11.35	87.98	0.67	9.79	1.36	0.34	0.32	0.29	0.00	87.03	0.88
28	V	E	E	41.22	10.99	16.69	29.35	121.28	-162.82	-115.68	134.28	38.36	61.30	0.33	33.86	3.10	0.34	0.10	0.17	0.00	61.70	0.73
29	P	C	C	81.50	5.19	17.68	23.82	112.97	-109.12	-67.09	141.77	61.69	36.49	1.82	50.54	6.98	2.79	0.37	1.32	0.00	36.89	1.12
30	W	C	C	86.87	14.77	8.80	23.04	113.58	-150.99	-98.95	124.93	71.68	19.61	8.71	44.84	14.63	12.44	1.93	7.06	0.03	13.27	5.79
31	D	C	T	122.21	1.49	13.94	15.68	100.90	-20.51	-59.61	61.48	85.19	5.72	9.09	12.73	19.49	52.87	1.37	7.84	0.02	3.76	1.92
32	G	C	T	63.35	1.08	13.42	14.22	97.65	-50.70	81.88	1.90	89.91	1.76	8.33	10.65	22.23	56.76	1.16	7.39	0.00	1.13	0.67
33	C	C	C	47.60	11.71	7.29	19.23	121.69	111.72	-97.88	148.17	80.21	13.65	6.14	46.32	24.19	9.52	1.89	4.36	0.02	6.41	7.30
34	K	C	C	142.47	1.94	15.76	17.86	114.65	-124.43	-87.80	139.31	73.41	16.50	10.10	43.63	16.92	13.02	3.26	6.96	0.08	9.34	6.80
35	A	C	T	68.31	8.26	11.89	21.30	109.13	-98.72	-62.61	134.57	77.72	7.19	15.10	8.23	11.87	57.13	3.12	12.25	0.05	5.29	2.06
36	G	C	T	46.99	5.41	16.52	22.88	98.14	23.40	85.06	-3.49	79.00	7.01	13.99	12.23	12.13	54.34	2.16	12.02	0.01	6.05	1.04
37	Q	C	C	92.25	7.18	17.31	25.35	110.02	109.39	-91.14	97.65	64.92	22.72	12.36	43.66	13.01	8.70	2.93	9.54	0.02	19.47	2.67
38	I	E	E	50.42	17.14	13.41	29.81	117.11	140.60	-98.71	131.61	29.41	67.28	3.31	22.23	4.58	1.68	2.53	1.39	0.02	55.97	11.60
39	A	E	E	39.72	12.01	18.32	30.75	118.72	-153.51	-99.16	144.42	33.00	63.30	3.69	25.90	5.52	2.01	2.41	1.43	0.01	59.20	3.53
40	A	E	E	53.54	10.63	19.79	30.60	124.00	-124.93	-107.20	144.21	46.06	51.63	2.30	34.50	10.09	2.01	1.32	1.15	0.01	46.41	4.51
41	S	C	C	38.25	15.12	16.54	31.49	121.49	-138.08	-104.81	140.89	82.33	17.33	0.33	69.03	11.93	0.56	0.14	0.20	0.00	17.18	0.96
42	P	C	C	46.60	13.75	16.19	30.23	111.86	-105.60	-68.10	149.56	82.28	13.59	4.13	66.70	9.99	5.19	1.46	2.69	0.00	11.79	2.18
43	R	C	C	115.60	8.02	18.29	26.84	112.16	-117.89	-86.17	128.73	83.73	10.37	5.90	71.40	7.26	4.39	2.35	3.66	0.00	6.23	4.71
44	T	C	G	60.59	14.59	13.41	27.32	99.09	-155.91	-75.08	-21.17	48.65	5.15	46.20	29.84	9.35	10.37	4.94	40.96	0.00	3.56	0.98
45	E	H	G	136.16	3.10	18.46	22.16	95.33	69.54	-75.92	-20.79	40.80	6.53	52.67	12.81	11.27	20.09	5.01	44.58	0.03	5.10	1.11
46	D	H	G	83.29	6.94	18.34	25.97	100.60	50.66	-94.74	13.28	39.36	7.99	52.65	16.37	9.72	16.13	4.49	45.75	0.05	6.27	1.21
47	C	C	C	18.58	21.62	11.83	32.52	114.17	115.95	-88.00	127.94	68.95	22.78	8.27	56.20	7.75	4.00	3.59	5.11	0.02	17.44	5.88
48	V	C	T	63.25	9.29	22.33	31.95	116.47	-160.69	-103.69	130.46	59.60	34.08	6.32	23.99	14.07	24.41	3.62	2.88	0.26	23.70	7.07
49	G	C	T	25.59	10.98	21.48	32.67	102.45	2.08	88.71	4.82	78.14	16.65	5.21	19.63	28.80	31.27	2.33	2.54	0.08	12.49	2.85
50	C	C	C	16.95	20.80	13.87	33.93	102.16	147.39	-75.14	57.56	91.32	3.36	5.32	84.55	5.16	1.65	4.46	1.00	0.00	1.86	1.31
51	K	H	H	130.51	3.39	21.41	25.48	93.21	78.24	-61.83	-40.44	29.78	0.76	69.45	6.61	7.76	16.99	63.70	3.95	0.24	0.38	0.38
52	R	H	H	117.82	5.68	21.12	27.20	92.45	50.70	-66.63	-37.94	22.07	0.86	77.08	3.89	4.41	15.07	70.77	4.65	0.31	0.57	0.32
53	C	H	H	6.11	23.32	13.61	36.77	92.64	51.04	-68.17	-38.99	11.74	1.23	87.03	5.20	2.24	5.31	79.57	6.29	0.09	1.03	0.27
54	E	H	H	80.09	13.31	17.50	30.43	91.84	57.54	-63.58	-37.32	9.58	1.37	89.05	3.83	1.59	4.81	81.52	6.66	0.09	1.24	0.26
55	T	H	H	102.61	1.39	21.95	21.63	93.06	51.21	-72.05	-28.30	16.13	0.96	82.91	3.38	1.98	10.93	77.77	4.77	0.14	0.79	0.24
56	A	H	H	38.90	11.30	16.63	28.62	95.60	48.16	-83.83	-23.60	27.23	1.01	71.76	3.91	5.21	19.58	67.31	2.66	0.33	0.48	0.53
57	C	C	C	13.07	21.41	9.65	30.07	113.78	56.40	-111.57	114.12	98.20	1.00	0.81	65.84	31.10	1.21	0.66	0.17	0.00	0.35	0.67
58	P	C	T	94.79	3.25	17.93	21.89	93.85	-159.83	-66.93	-20.29	89.67	1.01	9.32	24.27	19.91	45.59	4.73	4.45	0.00	0.69	0.36
59	T	C	T	75.44	5.61	16.14	22.73	101.09	46.73	-97.27	-0.55	83.20	2.49	14.31	8.67	26.72	48.72	7.32	5.89	0.03	2.00	0.67
60	D	C	C	90.06	8.00	17.61	26.40	96.97	-117.08	54.52	48.29	78.78	6.41	14.81	44.28	17.87	16.64	7.30	7.65	0.01	4.89	1.35
61	F	C	C	49.83	15.56	16.02	31.70	98.48	146.32	-90.27	-17.14	66.51	17.77	15.72	41.11	16.85	8.56	9.59	6.15	0.03	15.96	1.75
62	L	E	E	32.11	20.11	14.83	34.13	122.03	63.40	-114.58	128.83	31.97	53.99	14.04	22.04	6.55	4.89	9.55	4.81	0.09	49.48	2.59
63	S	E	E	50.55	7.99	21.85	30.45	125.52	-171.07	-120.28	140.06	25.64	65.74	8.62	20.14	3.24	1.86	6.12	2.45	0.01	65.28	0.92
64	I	E	E	52.00	17.98	14.19	31.60	121.97	-157.93	-116.18	130.78	21.32	71.55	7.13	17.45	1.88	0.98	5.87	1.35	0.00	71.89	0.58
65	R	E	E	122.07	6.10	18.30	25.74	121.14	-166.64	-115.53	132.08	17.56	76.17	6.28	14.50	1.35	0.79	5.39	1.14	0.00	76.38	0.44
66	V	E	E	57.83	12.32	13.09	26.33	119.32	-158.93	-109.99	129.04	19.73	74.17	6.10	16.11	1.78	1.04	4.87	1.36	0.00	74.29	0.56
67	Y	E	E	116.78	6.26	13.52	21.54	117.59	-159.67	-108.16	126.94	29.56	64.59	5.86	23.36	3.85	2.14	4.50	1.74	0.00	63.30	1.09
68	L	C	E	99.41	5.84	10.88	18.49	113.56	-164.10	-104.67	122.21	52.61	40.80	6.59	28.82	12.64	12.23	3.82	2.90	0.02	38.20	1.36
69	G	C	T	51.55	2.58	11.83	15.39	116.80	-49.48	97.49	-164.62	82.62	10.99	6.39	29.50	23.25	29.93	3.24	3.01	0.01	10.04	1.02
70	A	C	T	91.54	1.86	10.45	13.27	107.58	-35.77	-88.45	94.67	82.77	5.48	11.75	27.72	26.15	29.46	5.72	5.45	0.01	4.43	1.06
71	E	C	C	136.24	2.66	9.77	14.18	117.44	101.49	-96.82	135.25	65.45	18.45	16.11	31.17	20.07	15.11	9.40	6.19	0.09	15.58	2.38
72	T	C	C	89.43	4.54	9.47	16.02	120.24	-155.13	-107.63	138.06	56.27	27.25	16.48	40.23	9.56	6.18	11.83	5.19	0.05	24.39	2.57
73	T	C	C	86.43	5.06	9.63	16.63	117.80	-157.27	-105.58	134.32	46.96	30.92	22.13	32.90	7.56	6.22	16.47	6.44	0.07	27.86	2.47
74	R	C	E	156.52	3.46	10.65	15.97	116.78	-156.64	-101.96	133.15	44.39	30.25	25.37	27.00	8.80	9.20	17.32	8.14	0.12	27.43	1.99
75	S	C	C	78.27	3.87	9.65	15.40	116.62	-146.58	-98.64	136.36	47.78	27.21	25.01	27.91	9.01	11.41	16.07	8.94	0.14	24.43	2.09
76	M	C	C	130.08	3.71	9.41	14.74	109.69	-155.46	-97.36	93.87	55.86	23.77	20.37	28.72	11.47	16.37	12.90	7.46	0.17	20.60	2.31
77	G	C	C	51.56	3.28	10.17	14.99	113.20	-111.89	89.61	147.80	65.16	24.09	10.75	30.83	15.25	20.25	5.09	5.02	0.07	21.70	1.79
78	L	C	C	116.04	3.80	8.00	13.67	114.34	-129.75	-94.74	131.38	59.86	28.76	11.39	41.16	9.70	9.40	5.86	5.29	0.05	25.96	2.58
79	A	C	C	80.05	3.12	8.67	13.69	117.46	-157.92	-102.83	137.12	65.56	25.96	8.49	54.50	3.42	7.03	4.95	3.10	0.01	23.47	3.52
80	Y	C	C	150.67	5.00	11.03	17.72	116.88	-144.96	-104.54	134.90	98.30	1.56	0.14	98.30	0.18	0.13	0.08	0.01	0.00	1.19	0.11