#	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	112.98	5.63	12.14	19.11	113.71	-136.96	-92.41	132.35	99.74	0.17	0.09	99.66	0.12	0.05	0.06	0.01	0.00	0.06	0.04
1	A	C	C	60.23	5.80	9.88	17.26	113.05	-123.00	-78.88	141.45	77.86	0.79	21.35	73.37	0.77	2.98	21.59	0.65	0.00	0.31	0.34
2	P	C	C	88.25	3.39	10.85	15.64	104.14	-113.31	-69.40	107.12	58.00	0.87	41.12	42.62	5.92	7.32	41.96	1.46	0.00	0.35	0.37
3	R	H	H	158.27	2.15	11.78	14.79	95.33	-39.88	-67.17	-36.20	18.95	0.40	80.65	12.46	3.17	4.07	78.71	1.27	0.00	0.17	0.14
4	V	H	H	79.75	4.28	12.52	17.90	93.54	52.19	-66.63	-39.75	6.26	0.13	93.61	3.78	0.90	1.81	92.52	0.89	0.00	0.06	0.03
5	A	H	H	46.02	4.96	12.93	19.70	92.48	52.25	-64.49	-40.58	2.24	0.04	97.72	1.16	0.30	0.83	97.09	0.59	0.00	0.02	0.01
6	A	H	H	52.18	2.98	15.05	18.82	92.30	51.32	-64.62	-40.81	0.96	0.01	99.02	0.38	0.12	0.43	98.72	0.34	0.00	0.01	0.00
7	F	H	H	105.09	3.45	15.50	19.74	92.39	50.37	-64.88	-41.63	0.56	0.01	99.43	0.16	0.06	0.29	99.27	0.21	0.00	0.00	0.00
8	L	H	H	72.65	6.51	14.42	22.22	92.40	49.95	-65.46	-40.93	0.57	0.01	99.42	0.15	0.05	0.33	99.28	0.19	0.00	0.00	0.00
9	K	H	H	112.79	3.68	16.08	20.59	92.15	50.61	-64.68	-41.02	0.92	0.01	99.07	0.17	0.07	0.62	98.87	0.27	0.00	0.00	0.00
10	N	H	H	91.26	2.20	16.83	18.63	92.65	49.18	-66.01	-39.76	2.33	0.01	97.66	0.25	0.14	1.84	97.24	0.51	0.00	0.00	0.00
11	V	H	H	61.41	5.60	14.12	21.30	92.64	49.99	-66.48	-39.75	6.57	0.02	93.42	0.57	0.44	5.35	92.12	1.49	0.01	0.01	0.01
12	W	H	H	111.72	8.28	12.40	21.95	92.87	51.93	-69.54	-29.90	24.42	0.15	75.43	2.81	2.00	19.45	72.06	3.46	0.06	0.06	0.10
13	A	C	H	75.06	2.98	13.87	17.75	93.10	59.75	-74.71	-17.18	53.05	0.36	46.58	7.01	5.12	39.68	44.65	3.14	0.03	0.15	0.22
14	K	C	T	141.05	2.16	13.62	16.35	102.71	62.16	-88.57	-13.44	67.89	0.79	31.31	12.77	19.32	35.35	28.69	3.04	0.04	0.29	0.51
15	E	C	S	107.40	4.94	11.97	18.36	117.36	-28.55	-98.36	134.91	89.40	0.97	9.63	32.56	50.29	5.86	9.19	1.17	0.00	0.32	0.60
16	P	C	C	73.42	5.28	12.43	19.28	108.26	-96.53	-68.92	132.09	83.39	1.34	15.27	71.08	4.49	6.14	15.34	1.69	0.00	0.62	0.64
17	V	H	H	83.15	6.81	11.92	20.10	96.21	-155.50	-67.02	-34.76	30.12	2.35	67.53	18.99	5.44	7.27	63.51	2.76	0.04	1.11	0.88
18	L	H	H	105.17	2.84	14.26	17.78	93.21	56.79	-66.13	-38.73	15.54	1.29	83.17	6.45	2.72	7.34	79.25	2.96	0.10	0.87	0.31
19	V	H	H	84.82	2.46	15.72	18.15	93.02	49.79	-66.75	-40.35	7.88	0.64	91.47	3.68	1.18	3.54	88.40	2.56	0.03	0.49	0.12
20	A	H	H	42.61	6.07	14.19	21.91	92.14	51.50	-64.75	-41.38	2.76	0.14	97.09	1.28	0.40	1.19	95.61	1.38	0.01	0.10	0.02
21	S	H	H	45.07	6.67	14.52	22.68	92.15	51.38	-64.70	-40.51	2.01	0.06	97.93	0.70	0.23	1.04	96.89	1.08	0.01	0.04	0.01
22	F	H	H	121.19	2.49	17.37	19.75	92.35	50.10	-65.86	-40.30	1.88	0.03	98.08	0.44	0.19	1.16	97.16	1.01	0.01	0.02	0.01
23	A	H	H	56.14	3.50	16.92	20.84	92.23	50.54	-65.18	-41.19	2.70	0.04	97.26	0.54	0.25	1.79	96.37	1.00	0.01	0.02	0.01
24	I	H	H	76.45	6.70	15.83	23.47	92.72	49.13	-65.80	-40.85	3.14	0.03	96.83	0.48	0.28	2.25	95.79	1.16	0.01	0.02	0.01
25	A	H	H	53.36	5.08	15.78	21.89	91.94	51.87	-63.94	-40.95	5.26	0.03	94.72	0.50	0.36	4.28	91.69	3.13	0.01	0.02	0.01
26	G	H	H	39.83	2.33	16.88	18.99	92.03	50.51	-65.42	-39.22	12.23	0.03	87.75	0.64	0.57	11.09	82.62	5.03	0.02	0.01	0.02
27	L	H	H	83.95	4.36	15.33	20.63	92.83	50.75	-69.04	-34.77	7.89	0.04	92.07	0.80	0.60	6.04	81.53	10.96	0.02	0.02	0.02
28	A	H	H	45.95	8.06	12.02	21.60	92.58	58.92	-64.80	-35.53	10.06	0.11	89.83	1.04	0.73	7.10	68.55	22.43	0.04	0.07	0.04
29	V	H	H	104.83	2.08	15.03	17.32	93.39	52.53	-72.25	-27.47	23.42	0.12	76.46	0.93	1.13	20.04	56.19	21.51	0.07	0.06	0.08
30	I	H	H	117.31	1.99	14.29	16.32	95.93	48.71	-81.65	-23.41	31.87	0.27	67.87	1.73	3.10	26.09	53.10	15.38	0.25	0.13	0.21
31	L	H	H	78.14	7.29	10.00	18.76	107.24	74.99	-86.20	90.43	44.71	0.91	54.38	22.80	14.15	8.65	28.87	24.65	0.02	0.38	0.49
32	P	H	G	86.71	4.78	11.84	18.18	95.26	60.95	-67.27	-26.14	20.43	0.41	79.16	6.25	2.72	10.75	25.08	54.81	0.01	0.27	0.10
33	T	H	G	103.76	2.00	13.24	15.79	94.72	57.15	-77.63	-11.77	22.16	0.57	77.27	4.35	3.14	13.68	25.55	52.71	0.03	0.35	0.18
34	L	H	G	108.01	3.97	12.32	17.51	100.65	54.12	-90.90	1.09	36.84	1.98	61.18	10.15	9.30	18.71	20.41	39.31	0.13	0.99	1.01
35	S	C	C	46.84	9.27	9.43	19.99	114.54	101.79	-99.88	119.52	93.31	2.60	4.09	51.73	38.32	3.33	2.41	1.48	0.00	0.89	1.85
36	P	C	C	84.41	4.69	13.52	19.55	99.12	-141.87	-69.49	-16.56	82.70	1.88	15.42	30.72	25.97	26.80	9.28	5.35	0.02	0.81	1.04
37	Y	C	C	127.36	6.54	12.14	19.96	104.53	56.55	-90.70	28.21	73.50	3.36	23.14	33.89	18.82	21.66	16.51	5.84	0.06	1.45	1.76
38	T	C	C	63.43	5.90	12.66	20.13	114.67	111.69	-85.69	158.98	55.83	2.27	41.90	39.81	10.21	6.55	37.87	3.48	0.02	0.86	1.20
39	K	H	H	144.45	2.17	14.66	17.11	93.33	-94.64	-63.17	-37.00	8.75	0.12	91.13	3.07	2.04	4.17	89.19	1.41	0.02	0.05	0.06
40	Y	H	H	130.41	3.08	15.53	19.18	92.77	51.18	-67.18	-39.54	4.15	0.07	95.78	1.24	0.63	2.32	94.57	1.15	0.02	0.04	0.02
41	S	H	H	30.54	9.13	12.67	23.65	92.50	51.84	-65.29	-40.45	1.95	0.03	98.02	0.78	0.24	0.88	97.30	0.78	0.00	0.01	0.01
42	L	H	H	73.45	5.44	15.15	22.02	92.19	51.40	-64.70	-40.83	0.94	0.02	99.05	0.30	0.10	0.46	98.66	0.46	0.00	0.01	0.00
43	M	H	H	96.81	2.42	17.12	19.35	92.14	50.09	-65.08	-41.02	0.84	0.02	99.14	0.21	0.07	0.48	98.74	0.47	0.00	0.01	0.00
44	I	H	H	71.17	5.73	15.07	22.25	92.38	49.16	-65.67	-40.88	1.07	0.01	98.91	0.20	0.09	0.68	98.48	0.54	0.00	0.01	0.00
45	N	H	H	62.51	9.89	12.49	23.48	92.44	51.81	-66.62	-34.96	3.47	0.02	96.51	0.41	0.23	2.65	95.68	1.02	0.00	0.01	0.00
46	R	H	H	162.79	2.26	15.39	18.28	92.29	53.88	-70.14	-27.68	12.54	0.02	87.44	0.45	0.54	11.76	86.03	1.18	0.01	0.01	0.01
47	A	H	H	77.53	2.34	14.16	16.80	96.47	47.82	-83.77	-13.90	24.10	0.08	75.81	1.10	2.29	20.80	74.73	0.95	0.05	0.02	0.06
48	T	C	S	54.49	8.54	9.80	19.95	119.29	63.13	-115.58	125.91	97.90	1.38	0.72	34.38	62.64	0.92	0.50	0.18	0.00	0.41	0.97
49	P	C	C	90.73	4.09	13.42	18.92	97.87	-140.32	-69.51	-12.57	85.28	2.58	12.14	36.05	12.93	35.64	1.37	11.65	0.00	1.52	0.85
50	Y	C	T	121.98	8.24	11.67	20.94	112.69	73.16	-94.10	115.19	81.62	6.60	11.77	25.32	17.80	38.94	1.26	10.76	0.01	3.77	2.14
51	N	C	C	98.38	5.27	14.93	21.63	111.72	-150.89	-101.82	113.30	80.44	8.48	11.08	47.30	19.35	12.86	1.63	10.61	0.01	4.70	3.55
52	Y	C	C	94.45	11.28	10.72	22.76	116.59	-151.00	-102.56	126.30	90.33	8.66	1.00	62.99	24.46	2.85	0.33	0.76	0.00	4.56	4.05
53	P	C	C	88.05	4.90	14.95	21.01	98.57	-145.25	-72.99	-7.02	95.18	4.01	0.80	46.59	43.93	5.09	0.21	0.58	0.00	2.21	1.38
54	V	C	S	71.85	7.85	10.32	19.73	120.02	85.27	-107.43	135.72	90.66	7.33	2.01	35.51	51.02	4.55	0.75	1.07	0.00	3.49	3.60
55	P	C	C	81.49	4.70	12.37	18.67	112.39	-108.31	-66.66	148.20	89.60	5.50	4.89	70.23	11.82	7.22	1.40	3.59	0.00	3.35	2.39
56	L	C	C	116.28	4.16	10.23	16.27	112.79	-123.72	-88.51	133.23	79.24	10.68	10.08	51.13	16.57	11.12	3.13	6.94	0.02	5.15	5.93
57	R	C	C	150.64	4.07	9.87	15.69	112.72	-136.42	-91.83	130.87	79.12	10.16	10.72	46.72	17.26	15.04	2.82	7.88	0.02	5.15	5.12
58	D	C	C	97.04	4.31	9.36	15.36	109.04	-137.53	-92.33	100.26	82.35	7.37	10.28	42.64	19.73	20.12	2.09	8.09	0.01	3.48	3.83
59	D	C	T	108.03	2.92	10.68	15.01	100.47	-157.23	-89.15	10.22	87.60	2.98	9.42	28.10	22.22	37.29	1.50	7.80	0.01	1.40	1.69
60	G	C	T	49.52	4.29	10.43	16.28	101.71	-106.25	79.23	4.29	91.14	1.78	7.08	21.24	29.31	40.07	0.81	6.76	0.00	0.86	0.95
61	N	C	C	114.47	2.41	11.19	14.87	102.75	103.08	-89.73	18.47	90.27	4.65	5.08	37.56	33.10	19.31	0.71	4.71	0.00	2.06	2.55
62	M	C	C	89.42	7.09	8.56	17.16	110.69	72.35	-101.22	105.20	91.70	7.09	1.21	61.84	26.68	2.71	0.31	1.00	0.00	2.84	4.61
63	P	C	T	91.34	3.94	11.44	17.08	103.04	-135.78	-68.68	44.15	94.33	3.08	2.59	28.22	14.21	51.86	0.34	2.44	0.00	1.86	1.07
64	D	C	T	118.38	2.09	12.76	15.83	100.53	-9.32	-90.16	16.23	95.35	2.62	2.03	22.05	19.46	53.78	0.23	2.06	0.00	1.65	0.77
65	V	C	C	73.37	7.68	10.07	19.48	119.00	111.91	-103.34	133.97	92.12	7.17	0.71	45.45	45.13	1.83	0.20	0.49	0.00	2.86	4.03
66	P	C	C	73.05	6.28	12.31	20.31	114.24	-106.97	-67.30	150.16	93.66	5.31	1.02	80.55	8.72	3.89	0.24	0.92	0.00	2.69	3.00
67	S	C	C	75.30	5.35	12.42	19.32	105.11	-126.96	-81.92	121.17	94.91	3.88	1.21	53.34	36.79	4.57	0.28	0.96	0.00	1.53	2.52
68	H	C	C	103.32	6.06	11.98	19.62	117.21	-119.07	-104.20	128.23	95.29	3.19	1.52	60.53	29.86	4.40	0.28	1.33	0.00	1.14	2.46
69	P	C	T	77.20	7.34	10.68	19.50	103.98	-122.82	-67.06	91.10	95.63	0.84	3.53	29.31	13.28	52.42	0.33	3.81	0.00	0.45	0.40
70	Q	C	T	139.05	2.12	12.49	15.62	101.34	-48.68	-87.48	-0.01	94.61	1.65	3.73	23.34	18.67	52.12	0.40	3.85	0.00	0.84	0.78
71	D	C	C	72.02	5.95	10.19	18.07	113.11	99.01	-91.96	123.17	96.07	3.03	0.90	55.21	38.49	2.04	0.25	0.60	0.00	0.93	2.47
72	P	C	T	101.54	3.97	11.31	17.24	96.70	-146.18	-67.86	-11.99	97.26	0.79	1.95	25.72	24.14	47.30	0.29	1.76	0.00	0.42	0.37
73	Q	C	T	125.22	3.24	12.80	17.18	101.36	66.68	-89.91	-1.67	89.97	6.72	3.31	24.83	25.00	40.84	0.71	2.48	0.01	3.28	2.85
74	G	C	S	26.60	7.99	13.12	22.47	128.79	-117.46	113.64	-170.68	91.79	6.47	1.74	32.71	55.89	3.42	0.73	0.86	0.00	2.68	3.70
75	P	C	C	74.24	6.40	15.62	22.99	111.03	-38.20	-69.85	143.56	91.20	3.53	5.27	62.97	20.59	7.65	2.98	2.15	0.00	1.61	2.06
76	S	C	C	43.36	8.98	14.67	24.86	116.64	-136.84	-86.38	149.40	79.85	3.71	16.44	65.02	8.84	4.97	14.68	2.38	0.00	1.20	2.91
77	L	H	H	68.90	10.15	12.48	23.67	95.01	-124.23	-67.37	-25.79	18.41	0.43	81.16	10.47	3.77	5.88	72.81	6.64	0.02	0.22	0.20
78	E	H	H	108.62	2.49	15.83	18.66	92.37	72.74	-63.50	-38.07	6.41	0.12	93.47	1.93	0.90	3.51	82.05	11.47	0.02	0.09	0.04
79	W	H	H	92.56	6.69	12.42	21.09	92.40	53.50	-64.97	-39.59	3.81	0.06	96.13	0.91	0.45	2.23	82.50	13.84	0.01	0.05	0.01
80	L	H	H	62.35	10.19	10.40	21.59	92.92	52.73	-67.47	-35.03	4.82	0.06	95.12	1.13	0.59	2.83	81.59	13.81	0.01	0.03	0.02
81	K	H	H	136.99	2.76	11.95	16.07	92.78	56.67	-67.82	-29.61	24.56	0.20	75.24	2.88	2.20	18.84	65.37	10.42	0.06	0.09	0.13
82	R	C	H	171.07	1.39	12.25	13.84	96.33	52.57	-82.05	-8.81	53.37	0.19	46.44	12.99	1.28	38.80	41.55	5.15	0.00	0.07	0.16
83	L	C	C	85.35	9.30	9.94	19.95	101.01	93.78	-73.34	11.07	99.66	0.04	0.30	98.83	0.30	0.53	0.29	0.02	0.00	0.02	0.02