#	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	71.29	5.96	14.95	22.19	110.49	-165.68	-90.80	114.13	99.78	0.21	0.01	99.71	0.11	0.03	0.00	0.00	0.00	0.14	0.01
1	H	C	C	98.17	9.88	11.96	22.72	117.79	-169.41	-104.27	133.35	77.41	21.59	1.00	73.10	1.93	1.44	0.33	0.51	0.00	21.52	1.17
2	S	C	E	62.70	6.11	16.29	23.70	121.72	-155.57	-110.20	143.31	51.28	47.56	1.16	40.38	8.64	1.55	0.29	0.79	0.00	47.46	0.90
3	V	E	E	38.89	18.39	12.51	30.46	122.98	-160.09	-116.77	133.48	18.34	80.76	0.90	16.70	1.43	0.31	0.54	0.33	0.00	80.02	0.68
4	K	E	E	110.78	6.07	21.61	28.66	120.14	-159.80	-111.73	130.72	11.18	87.89	0.93	10.24	0.77	0.23	0.62	0.26	0.00	87.30	0.58
5	V	E	E	33.30	18.38	13.97	32.24	117.71	-158.88	-105.59	124.58	23.41	75.14	1.45	21.87	1.27	0.39	0.77	0.52	0.00	74.15	1.02
6	Y	C	E	92.95	9.93	17.83	28.43	111.22	-170.84	-95.14	132.57	56.28	38.89	4.83	33.40	17.87	5.77	1.20	3.34	0.01	37.35	1.06
7	D	C	S	98.15	5.18	20.82	26.32	104.85	-27.84	-89.44	-16.15	73.66	21.37	4.97	12.67	41.93	19.86	0.78	3.64	0.03	19.85	1.25
8	T	C	C	64.20	9.48	20.71	30.28	118.19	37.59	-107.27	131.57	74.36	19.51	6.13	38.53	19.33	17.56	1.31	4.80	0.02	16.80	1.65
9	C	C	C	13.29	22.98	14.17	36.61	113.67	-158.95	-95.03	127.59	73.41	24.26	2.33	64.21	5.35	2.90	0.77	1.65	0.00	18.52	6.59
10	I	C	C	63.39	11.29	23.00	34.39	112.67	-159.43	-95.23	124.28	74.21	23.33	2.47	32.42	17.40	26.12	0.89	1.62	0.04	16.50	5.01
11	G	C	S	31.27	10.10	22.99	33.23	98.05	6.35	76.33	12.98	89.17	8.41	2.42	25.25	35.20	29.69	0.77	1.48	0.01	5.96	1.66
12	C	C	C	16.29	21.46	15.32	35.93	107.53	128.23	-88.00	85.58	84.22	1.94	13.84	65.95	12.71	4.34	13.44	1.68	0.00	0.77	1.10
13	T	H	H	72.44	7.82	21.94	30.19	94.40	68.71	-64.00	-36.37	33.39	0.52	66.09	7.12	11.41	16.20	62.17	2.50	0.11	0.18	0.32
14	Q	H	H	86.55	6.57	23.97	30.65	92.63	52.92	-67.12	-38.24	16.48	0.78	82.73	4.44	4.24	9.95	76.93	3.45	0.26	0.42	0.30
15	C	H	H	4.81	23.99	16.86	40.85	92.56	52.30	-65.73	-42.52	5.01	1.07	93.92	2.49	0.94	2.44	88.03	4.88	0.07	1.00	0.14
16	V	H	H	26.77	19.37	18.62	37.22	91.64	52.07	-64.30	-38.85	3.50	1.77	94.73	1.37	0.59	1.97	88.97	4.99	0.07	1.89	0.14
17	R	H	H	157.12	2.56	23.96	26.52	91.62	53.85	-66.97	-32.29	7.40	1.57	91.04	1.41	0.79	5.62	86.56	3.68	0.20	1.51	0.23
18	A	H	H	36.63	11.93	19.17	31.61	93.75	52.02	-82.12	-19.22	19.78	0.96	79.26	1.65	2.48	16.57	76.40	1.56	0.48	0.38	0.49
19	C	C	C	7.60	24.63	10.31	34.29	109.73	89.09	-88.76	118.47	97.38	1.76	0.86	70.66	25.10	1.52	0.79	0.16	0.00	0.80	0.97
20	P	C	T	92.25	3.73	21.28	25.70	92.82	-162.49	-67.83	-19.24	94.26	0.93	4.81	19.61	21.47	53.04	2.09	2.84	0.00	0.61	0.34
21	C	C	T	48.60	11.32	16.85	28.87	97.13	51.84	-93.42	-2.71	92.00	1.25	6.75	6.42	32.46	53.39	2.99	3.48	0.01	0.73	0.52
22	D	C	C	88.33	8.31	21.42	30.28	94.69	-121.75	59.55	41.48	87.39	5.20	7.41	53.11	22.69	11.36	2.28	5.57	0.00	3.71	1.29
23	V	C	C	12.93	20.59	18.23	39.06	96.30	140.76	-83.78	-24.01	75.12	17.79	7.08	39.26	29.85	6.11	2.51	4.50	0.01	16.57	1.17
24	L	E	E	6.80	24.84	16.37	41.44	126.79	44.30	-124.77	137.70	28.86	63.79	7.35	20.01	8.04	3.53	2.74	3.79	0.01	60.55	1.32
25	E	E	E	88.25	7.19	26.08	33.97	127.04	-170.77	-124.29	141.93	15.75	80.17	4.08	12.80	2.37	1.24	1.71	1.76	0.00	79.31	0.80
26	M	E	E	56.78	18.58	16.17	34.06	115.64	-130.64	-91.08	129.35	19.43	78.65	1.91	16.90	2.38	0.71	1.08	0.86	0.00	75.90	2.17
27	V	C	E	39.69	11.65	16.07	29.37	121.04	-163.07	-112.55	133.67	52.22	47.24	0.53	45.19	5.38	0.58	0.19	0.31	0.00	47.23	1.12
28	P	C	C	81.44	4.90	18.08	23.77	112.75	-109.65	-67.71	142.75	72.13	25.52	2.34	56.80	9.36	4.37	0.55	1.73	0.00	26.03	1.16
29	W	C	C	98.90	14.07	8.94	22.59	111.01	-137.22	-93.29	120.37	75.56	14.23	10.21	45.49	14.73	15.65	2.45	7.95	0.02	9.32	4.39
30	D	C	T	121.21	1.45	13.82	15.39	102.63	-30.23	-81.91	53.67	84.83	5.07	10.10	19.54	18.51	47.00	2.37	7.51	0.02	3.30	1.75
31	G	C	T	60.83	1.43	13.29	14.78	98.88	-51.22	82.76	0.60	86.25	2.67	11.08	16.43	23.09	47.29	2.80	7.71	0.01	1.62	1.04
32	C	C	C	48.53	10.88	8.24	19.85	118.62	118.99	-92.67	143.59	77.09	13.08	9.84	51.31	17.73	7.56	6.14	4.18	0.03	7.01	6.05
33	K	C	C	122.21	3.22	16.76	20.25	113.25	-125.55	-85.35	145.33	63.43	13.59	22.98	43.41	11.04	8.07	17.57	6.52	0.07	9.19	4.13
34	A	H	H	51.36	12.35	11.55	24.01	95.08	-115.46	-63.05	-33.06	34.62	9.88	55.50	15.85	7.91	12.14	31.09	23.46	0.38	7.47	1.70
35	K	H	H	134.41	3.41	16.62	20.90	94.33	61.79	-68.66	-25.01	27.35	15.67	56.98	13.41	5.83	9.26	34.03	22.11	0.28	13.57	1.51
36	Q	H	H	90.08	6.74	16.77	24.38	97.00	59.78	-77.97	-22.44	22.88	21.02	56.10	13.85	4.42	5.82	35.20	20.05	0.15	18.94	1.55
37	I	H	H	35.41	18.40	12.41	29.70	98.52	62.69	-78.74	-26.72	23.60	32.50	43.90	15.04	4.26	5.30	33.69	10.35	0.21	27.98	3.18
38	A	H	H	55.96	9.55	17.49	27.36	97.53	72.00	-72.39	-22.99	35.70	28.42	35.88	17.03	7.04	12.68	26.09	9.99	0.35	24.27	2.55
39	S	C	T	71.28	5.05	19.86	25.33	100.77	51.25	-93.12	4.24	53.12	19.39	27.49	18.42	12.72	23.46	16.64	10.42	0.51	15.12	2.70
40	A	C	C	31.75	16.37	14.52	30.68	118.29	109.18	-85.44	139.16	92.54	6.65	0.81	53.57	38.93	0.85	0.55	0.29	0.00	4.83	0.98
41	P	C	C	44.58	13.47	16.41	30.44	113.12	-106.27	-66.90	149.20	87.54	8.96	3.50	78.07	6.18	2.68	2.00	1.51	0.00	5.79	3.76
42	R	C	C	107.72	9.02	19.32	28.66	112.70	-118.19	-86.10	129.84	85.84	9.43	4.73	76.72	5.68	2.62	2.51	2.16	0.00	4.29	6.03
43	T	H	G	52.18	16.70	14.00	29.63	96.61	-147.33	-69.13	-27.98	38.44	3.06	58.51	20.73	7.84	11.33	7.39	49.93	0.01	2.07	0.70
44	E	H	G	134.08	3.41	19.55	23.71	92.86	67.86	-71.47	-21.22	31.89	2.74	65.37	7.70	7.35	18.76	8.63	54.96	0.02	2.07	0.51
45	D	H	G	78.83	7.72	18.97	27.29	97.57	49.50	-93.89	8.21	30.83	3.45	65.72	10.49	7.07	15.26	7.08	56.80	0.03	2.58	0.68
46	C	C	C	14.26	22.84	12.55	34.56	111.67	109.56	-85.20	119.88	67.37	20.23	12.40	53.53	8.18	4.86	5.33	7.56	0.03	14.08	6.43
47	I	C	C	66.62	10.48	22.63	33.26	118.21	-166.86	-106.91	130.69	62.21	30.52	7.27	26.23	14.47	23.93	4.13	3.33	0.28	20.35	7.28
48	G	C	T	27.00	10.94	21.98	33.02	100.85	11.85	84.87	5.73	76.73	17.86	5.41	22.25	25.19	31.03	2.32	2.82	0.09	12.06	4.24
49	C	C	C	16.00	20.99	14.13	34.54	103.78	142.20	-75.60	71.73	93.83	3.35	2.82	88.65	4.26	1.10	2.21	0.59	0.00	1.74	1.44
50	K	H	H	128.90	3.71	21.76	26.26	93.36	80.24	-62.34	-38.73	35.97	0.70	63.34	6.97	9.24	20.50	59.04	3.33	0.21	0.32	0.40
51	R	H	H	114.69	6.16	21.65	28.17	92.34	52.03	-66.35	-37.82	22.99	0.59	76.42	3.08	4.54	16.40	71.21	3.88	0.28	0.33	0.27
52	C	H	H	4.84	23.95	14.03	37.95	92.30	51.43	-66.21	-40.51	8.80	0.76	90.44	3.35	1.67	4.47	83.33	6.32	0.08	0.61	0.17
53	E	H	H	75.67	14.00	17.96	31.43	91.74	56.09	-63.71	-36.61	6.37	0.85	92.78	1.98	0.94	3.69	85.18	7.18	0.07	0.82	0.13
54	T	H	H	100.09	1.58	22.59	22.68	92.78	51.38	-70.65	-29.37	11.23	0.64	88.13	1.94	1.17	8.33	82.74	5.02	0.11	0.55	0.15
55	A	H	H	35.20	12.08	17.17	29.86	95.40	48.23	-83.61	-23.68	22.89	0.66	76.45	2.52	3.80	17.94	72.46	2.26	0.31	0.27	0.43
56	C	C	C	11.19	22.02	10.05	31.24	112.80	62.36	-109.99	106.81	98.63	0.78	0.58	69.62	27.90	1.06	0.47	0.13	0.00	0.25	0.58
57	P	C	T	92.26	3.60	18.20	22.68	93.24	-165.77	-66.68	-21.50	91.72	1.09	7.18	19.16	21.19	51.45	3.89	3.20	0.00	0.75	0.36
58	T	C	T	74.73	5.94	16.52	23.38	98.50	48.80	-94.85	-4.06	87.20	2.54	10.25	6.41	29.74	51.51	5.77	3.77	0.03	2.21	0.56
59	D	C	C	88.41	8.65	17.69	27.05	96.22	-118.85	57.75	41.78	81.12	7.97	10.91	45.25	22.08	13.65	5.99	5.29	0.01	6.17	1.57
60	F	C	C	50.97	15.09	16.66	31.95	97.68	146.56	-88.43	-20.48	67.52	19.97	12.51	45.37	16.00	6.13	8.47	4.10	0.01	18.05	1.87
61	L	E	E	26.17	21.11	15.10	35.34	122.59	57.56	-116.84	131.19	33.95	53.33	12.72	24.03	6.98	4.07	8.76	3.64	0.06	49.98	2.48
62	S	E	E	46.88	8.77	22.72	31.93	127.63	-172.95	-122.54	143.36	23.90	66.83	9.27	19.09	2.82	1.69	6.51	2.25	0.01	66.76	0.87
63	V	E	E	37.94	18.94	14.74	33.12	121.87	-156.26	-115.79	130.47	21.09	71.26	7.65	17.35	1.90	0.95	6.14	1.27	0.00	71.82	0.57
64	R	E	E	118.60	6.55	18.78	26.51	120.04	-164.62	-112.83	131.87	17.51	76.04	6.46	14.28	1.47	0.75	5.46	1.05	0.00	76.53	0.44
65	V	E	E	53.04	12.49	13.06	26.53	119.49	-159.98	-110.44	130.05	19.13	74.89	5.98	15.59	1.76	0.93	4.86	1.15	0.00	75.18	0.53
66	Y	E	E	118.62	6.21	13.28	21.24	116.29	-156.41	-105.67	125.02	28.28	65.70	6.03	22.12	3.73	2.05	4.54	1.66	0.00	64.96	0.94
67	L	E	E	93.94	6.47	10.15	18.24	114.02	-171.03	-108.23	117.01	43.15	48.62	8.22	19.96	11.08	14.46	4.74	3.50	0.03	44.75	1.50
68	G	C	T	61.03	1.57	11.76	13.79	104.74	-33.36	71.74	0.95	82.94	10.57	6.49	18.26	17.43	46.82	3.60	2.90	0.01	10.16	0.81
69	G	C	T	61.57	1.47	10.90	13.02	104.69	-22.85	84.99	5.63	86.54	7.47	5.99	23.06	24.05	39.37	2.66	3.23	0.00	6.89	0.74
70	E	C	C	130.33	3.05	9.42	14.45	118.71	121.07	-99.03	139.80	60.48	32.83	6.69	34.28	17.00	10.02	3.71	2.99	0.02	29.78	2.19
71	T	C	E	95.46	3.80	9.75	15.62	119.95	-151.76	-109.19	137.02	50.23	43.63	6.14	37.16	8.43	4.51	3.61	2.52	0.01	41.87	1.89
72	T	E	E	84.52	5.85	9.66	17.37	121.75	-163.66	-114.69	138.96	43.87	48.82	7.31	32.86	6.98	4.13	4.29	2.95	0.01	47.08	1.71
73	R	E	E	155.77	3.56	11.17	16.80	121.00	-159.09	-112.47	138.94	41.83	48.57	9.60	28.70	8.06	5.81	5.50	3.94	0.02	46.32	1.64
74	S	C	E	75.19	4.77	10.09	16.71	119.10	-142.32	-100.27	140.85	50.76	39.15	10.10	34.74	8.74	7.42	5.17	4.61	0.02	37.49	1.81
75	L	C	C	113.50	4.74	9.55	15.97	111.73	-153.44	-96.62	119.75	62.19	27.66	10.15	34.10	13.46	15.18	5.13	4.77	0.03	25.29	2.03
76	G	C	C	51.50	3.43	10.67	15.49	112.86	-118.33	86.21	155.60	68.99	23.39	7.62	33.39	18.73	17.97	3.26	4.07	0.02	20.83	1.73
77	L	C	C	115.47	3.92	8.34	14.05	114.93	-131.98	-96.31	129.88	66.67	23.45	9.88	44.65	11.84	10.63	4.43	5.23	0.03	20.66	2.53
78	A	C	C	79.10	3.48	8.61	13.97	115.15	-154.94	-98.58	133.95	72.83	19.32	7.85	59.83	4.13	8.63	4.22	3.14	0.00	16.98	3.06
79	Y	C	C	146.59	5.73	10.88	18.13	115.25	-158.26	-103.05	129.20	98.89	0.92	0.19	98.68	0.23	0.19	0.11	0.02	0.00	0.69	0.08