#	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	110.05	6.70	12.16	20.31	113.92	165.40	-94.24	127.39	99.73	0.26	0.01	99.69	0.11	0.04	0.00	0.00	0.00	0.13	0.03
1	T	C	C	84.01	5.39	10.56	17.73	116.97	-153.97	-96.70	140.12	90.71	8.08	1.21	88.56	1.36	1.40	0.58	0.40	0.00	4.02	3.68
2	K	C	C	146.79	3.02	11.66	16.39	110.52	-129.95	-87.47	124.58	86.92	8.61	4.46	52.29	20.25	14.91	1.73	2.56	0.00	4.97	3.29
3	G	C	C	39.57	7.13	11.73	20.01	115.71	6.00	90.07	-170.82	87.15	5.14	7.71	37.10	32.28	18.75	3.44	3.69	0.01	2.74	1.98
4	T	C	C	73.79	7.37	12.57	20.98	107.77	-61.26	-84.14	105.18	78.22	5.60	16.18	53.71	16.71	7.40	11.01	5.48	0.01	2.67	3.01
5	T	C	C	88.89	4.74	13.95	19.91	98.08	76.92	-74.79	-23.74	53.13	3.46	43.40	28.56	11.09	14.46	25.85	16.68	0.08	2.00	1.28
6	S	H	H	63.89	5.42	14.48	20.99	98.70	57.34	-81.44	-13.06	46.38	3.08	50.54	20.78	9.66	16.97	31.16	18.33	0.14	1.82	1.13
7	M	H	H	78.31	9.79	12.55	23.21	99.18	65.32	-79.55	-19.81	40.90	3.40	55.70	15.66	9.64	16.72	35.24	19.16	0.28	1.97	1.33
8	G	H	H	32.83	8.27	13.64	23.00	102.74	51.37	-37.35	-39.67	47.95	3.77	48.28	21.38	10.95	17.26	32.34	14.22	0.19	2.20	1.47
9	Q	C	H	117.18	3.91	13.97	19.05	100.50	52.00	-83.86	-8.00	49.23	6.33	44.44	23.61	11.39	16.00	28.44	14.21	0.26	3.96	2.13
10	R	C	H	133.99	5.57	11.42	18.43	107.37	73.99	-87.54	83.41	52.63	8.11	39.26	24.17	12.01	18.10	24.26	13.26	0.32	4.79	3.09
11	H	C	T	131.69	4.36	11.42	17.32	104.34	52.52	-81.42	66.26	73.30	3.04	23.65	19.52	14.36	39.23	14.36	9.35	0.07	1.64	1.47
12	G	C	T	53.35	3.39	13.63	18.26	101.55	-7.37	79.00	7.45	89.44	1.68	8.89	22.25	22.76	44.98	3.52	4.85	0.00	0.95	0.69
13	R	C	C	127.21	7.02	12.14	20.47	113.50	117.63	-92.42	126.24	82.48	9.85	7.67	47.98	24.62	10.06	3.79	3.85	0.02	5.60	4.09
14	T	C	C	77.16	7.07	14.65	22.77	110.81	-154.45	-97.47	113.34	75.57	16.44	8.00	51.68	16.18	7.27	4.38	3.89	0.02	11.71	4.87
15	H	C	C	79.91	11.90	14.77	27.01	109.61	84.72	-101.99	88.56	68.35	23.66	7.99	47.77	14.46	6.16	4.38	3.78	0.03	18.90	4.51
16	I	C	C	62.67	10.65	17.79	29.30	118.16	110.21	-103.17	135.59	55.54	36.51	7.95	38.78	12.04	4.36	5.19	3.26	0.07	30.31	6.00
17	L	E	E	64.43	10.69	18.53	29.75	115.88	-127.65	-86.86	132.91	39.79	53.87	6.34	26.47	9.44	2.42	5.37	1.93	0.11	32.14	22.11
18	C	C	C	18.10	17.56	12.07	29.76	109.85	-120.58	-81.74	119.50	65.56	29.82	4.62	53.99	6.96	2.42	3.39	1.70	0.02	20.96	10.56
19	R	C	T	148.65	4.32	17.67	23.25	94.29	-148.72	-68.96	-29.48	84.61	1.48	13.91	3.72	10.83	70.49	3.31	9.82	0.07	1.04	0.73
20	R	C	T	133.55	5.55	16.82	23.23	96.85	46.80	-75.91	-36.23	86.16	0.53	13.30	1.12	7.45	79.15	2.87	8.70	0.02	0.34	0.35
21	C	C	T	47.19	10.24	13.64	25.00	102.46	24.73	-105.48	-12.60	87.25	1.10	11.66	2.33	9.38	76.41	2.88	7.61	0.02	0.66	0.70
22	G	C	C	39.67	4.79	16.83	22.77	101.83	-112.82	83.92	2.11	90.26	8.12	1.62	48.35	25.99	16.39	0.31	1.54	0.00	5.07	2.33
23	R	C	S	118.96	6.85	17.05	24.80	122.05	77.41	-109.16	156.18	87.23	11.70	1.07	21.58	52.99	12.34	0.08	1.22	0.00	10.41	1.38
24	N	C	C	81.30	9.05	18.87	28.37	113.30	-104.20	-92.35	125.07	65.10	33.85	1.05	36.73	22.04	6.78	0.11	1.26	0.00	31.36	1.71
25	A	E	E	16.50	16.38	15.98	33.00	130.35	161.90	-126.70	151.66	37.00	62.84	0.16	32.26	3.70	0.30	0.03	0.14	0.00	62.28	1.29
26	Y	E	E	56.58	11.82	18.98	32.17	129.66	-162.10	-126.76	146.82	4.11	95.85	0.04	3.68	0.45	0.04	0.02	0.02	0.00	91.61	4.18
27	H	E	E	44.28	11.19	17.03	29.94	110.71	-118.19	-82.48	125.11	12.05	87.88	0.07	10.89	0.83	0.11	0.03	0.05	0.00	84.86	3.24
28	V	C	T	65.97	10.90	14.66	26.62	93.81	-144.53	-66.13	-32.13	90.71	1.00	8.29	2.43	6.17	82.22	0.66	7.49	0.00	0.81	0.21
29	Q	C	T	121.22	2.81	16.75	19.87	96.02	48.38	-75.26	-35.86	88.40	0.84	10.76	2.91	7.02	78.70	1.85	8.63	0.00	0.59	0.29
30	W	C	T	130.39	5.79	16.09	22.58	101.54	21.68	-106.46	-2.01	88.22	1.25	10.54	5.94	8.13	74.16	1.82	8.69	0.01	0.86	0.40
31	E	C	T	91.31	10.90	16.10	27.68	96.61	-131.53	58.49	33.83	94.68	3.10	2.22	9.71	7.21	77.98	0.84	1.17	0.00	2.73	0.35
32	R	E	E	94.72	6.86	21.53	29.49	134.61	108.52	-133.90	153.83	9.54	90.06	0.40	6.57	2.33	0.97	0.23	0.21	0.01	74.71	14.96
33	C	E	E	10.96	20.00	13.53	34.29	111.55	-109.20	-73.65	132.18	13.68	86.25	0.07	12.99	0.43	0.07	0.05	0.03	0.00	72.16	14.27
34	A	C	T	46.82	9.52	18.94	29.66	93.74	-144.46	-68.12	-28.54	98.43	0.70	0.87	0.88	2.94	94.89	0.07	0.65	0.00	0.46	0.13
35	A	C	T	61.12	6.98	19.61	27.20	98.45	45.49	-81.91	-39.62	99.28	0.09	0.62	0.09	1.43	98.05	0.03	0.33	0.00	0.04	0.02
36	C	C	T	52.01	8.66	17.34	27.20	102.51	20.24	-109.55	-8.74	99.43	0.09	0.48	0.26	2.26	97.09	0.02	0.30	0.00	0.04	0.03
37	A	C	C	50.65	9.19	18.06	28.23	94.51	-122.77	75.23	11.88	97.61	2.01	0.39	72.20	11.58	13.58	0.18	0.19	0.00	0.86	1.41
38	Y	C	C	60.75	12.70	15.19	29.14	115.75	143.87	-80.61	137.32	89.77	9.65	0.58	77.48	11.45	0.57	0.42	0.23	0.00	6.22	3.63
39	P	E	B	53.52	9.25	18.65	28.79	112.50	-106.90	-67.01	149.84	41.25	48.42	10.34	27.72	6.65	3.63	6.15	4.41	0.25	20.22	30.97
40	R	C	C	107.54	10.49	16.27	27.10	108.49	-107.34	-72.14	135.76	62.56	4.65	32.79	45.21	8.89	8.42	9.54	23.57	0.00	3.17	1.20
41	A	C	G	44.78	11.15	13.53	25.45	105.95	-120.20	-74.99	127.08	48.67	4.03	47.29	29.37	8.89	10.89	14.25	32.93	0.01	2.64	1.03
42	Q	C	G	107.33	5.48	14.56	21.24	104.05	69.68	-83.44	4.38	46.42	7.96	45.62	26.01	9.67	12.11	16.17	28.65	0.07	5.34	1.98
43	R	C	C	128.52	6.29	12.79	20.31	104.93	69.71	-86.84	38.38	55.54	12.24	32.21	35.70	10.80	8.84	16.06	16.61	0.09	7.51	4.38
44	R	C	C	117.95	8.23	9.99	19.29	109.75	92.78	-86.68	115.51	75.37	8.93	15.70	54.98	11.01	8.51	11.25	5.11	0.01	5.80	3.33
45	R	C	C	168.13	2.21	12.70	15.84	101.44	102.58	-82.22	-14.69	78.52	7.24	14.24	38.09	22.38	18.40	9.62	4.60	0.05	4.46	2.40
46	Y	C	S	141.48	4.32	10.95	16.66	105.33	45.03	-92.35	73.56	82.24	2.50	15.25	23.28	29.96	29.47	10.36	4.39	0.04	1.28	1.22
47	N	C	C	108.82	3.71	12.46	17.49	101.35	-88.42	-64.58	39.13	74.87	3.35	21.78	27.73	22.58	25.24	16.48	4.81	0.06	1.64	1.46
48	W	C	C	124.35	7.79	11.45	20.53	100.65	124.63	-84.65	-5.38	58.25	5.90	35.85	32.15	11.67	15.36	30.49	4.80	0.09	3.33	2.11
49	S	H	H	42.91	7.64	12.50	21.83	107.68	97.24	-78.41	121.31	47.31	3.44	49.25	34.76	6.71	6.49	46.07	2.93	0.01	2.02	1.02
50	V	H	H	90.44	3.14	16.35	19.93	94.26	-124.90	-65.09	-38.66	4.89	0.26	94.86	2.56	0.89	1.72	93.53	1.05	0.01	0.19	0.04
51	K	H	H	102.96	4.59	17.58	22.88	92.91	51.80	-66.17	-40.19	2.41	0.16	97.43	1.00	0.32	1.16	96.26	1.10	0.01	0.14	0.02
52	A	H	H	18.39	10.64	13.48	26.31	92.18	51.75	-64.60	-41.28	1.95	0.15	97.90	0.74	0.25	0.98	96.67	1.21	0.01	0.13	0.01
53	I	H	H	70.90	4.95	17.12	23.28	92.24	50.69	-63.95	-41.74	2.61	0.20	97.19	0.93	0.34	1.36	96.18	0.99	0.01	0.16	0.02
54	K	H	H	101.83	3.15	17.43	20.92	92.09	50.39	-65.04	-40.57	4.83	0.28	94.89	1.59	0.61	2.71	93.96	0.86	0.02	0.20	0.05
55	R	H	H	91.00	8.36	13.78	23.50	92.53	50.90	-66.53	-38.28	5.52	0.17	94.31	2.14	0.71	2.75	93.36	0.88	0.01	0.09	0.04
56	R	H	H	129.91	6.58	14.45	22.23	92.96	51.55	-68.12	-35.65	6.85	0.13	93.02	1.73	0.77	4.25	91.93	1.18	0.02	0.07	0.04
57	R	H	H	161.70	1.89	16.15	17.87	96.58	45.03	-76.86	-33.85	11.03	0.14	88.83	1.45	1.32	8.08	88.01	0.98	0.05	0.05	0.06
58	T	H	H	83.10	3.04	14.79	18.23	101.41	31.94	-98.84	-14.55	20.80	0.33	78.87	3.24	5.25	12.79	77.67	0.66	0.08	0.09	0.21
59	G	C	C	35.90	6.71	12.78	21.06	107.95	-122.39	79.95	38.32	94.61	0.82	4.57	44.87	32.57	17.21	2.85	1.68	0.00	0.36	0.46
60	T	C	C	70.86	6.23	14.12	21.40	111.66	126.45	-100.97	115.11	84.02	2.01	13.97	47.02	25.32	11.51	10.35	3.71	0.01	0.80	1.29
61	G	C	H	33.34	6.54	15.88	23.46	110.36	-104.02	69.33	-130.41	59.38	1.34	39.28	28.85	17.76	13.95	29.41	8.69	0.04	0.56	0.75
62	R	H	H	125.27	6.45	16.08	23.27	94.23	-9.01	-67.49	-30.68	39.77	1.02	59.21	16.91	8.11	15.76	46.30	11.85	0.06	0.54	0.46
63	C	H	H	54.68	9.08	14.15	24.21	94.38	57.07	-73.66	-17.03	30.68	0.92	68.40	16.28	4.60	10.44	55.40	12.37	0.03	0.55	0.35
64	R	H	H	125.85	4.35	16.91	22.29	92.91	84.26	-64.11	-38.01	18.97	0.58	80.45	8.55	3.14	7.78	70.51	9.44	0.03	0.36	0.19
65	Y	H	H	104.86	6.45	16.44	23.79	92.42	51.16	-67.94	-35.81	12.27	0.40	87.34	4.93	1.77	5.77	79.34	7.79	0.02	0.28	0.10
66	L	H	H	60.61	9.63	14.99	25.56	92.29	56.82	-64.52	-39.65	6.32	0.23	93.44	2.66	0.95	2.84	88.13	5.18	0.01	0.17	0.04
67	K	H	H	107.04	3.85	17.44	21.86	92.06	52.72	-64.94	-40.38	7.63	0.23	92.13	2.48	0.97	4.35	88.52	3.44	0.02	0.18	0.05
68	V	H	H	69.47	3.52	17.29	21.39	92.08	49.52	-65.38	-41.35	6.33	0.21	93.46	1.90	0.91	3.75	90.92	2.30	0.03	0.15	0.05
69	V	H	H	49.59	7.41	14.84	23.97	91.88	50.53	-64.11	-42.66	4.36	0.17	95.47	2.28	0.71	1.64	93.88	1.33	0.01	0.11	0.03
70	H	H	H	86.41	6.41	14.88	22.38	91.86	50.98	-64.09	-40.46	3.97	0.15	95.88	1.86	0.42	1.79	93.82	1.94	0.01	0.14	0.02
71	R	H	H	133.02	2.06	15.93	17.85	91.97	50.61	-65.30	-40.15	3.68	0.10	96.22	1.05	0.40	2.16	93.25	3.03	0.01	0.09	0.02
72	R	H	H	126.79	2.99	14.71	18.41	92.68	50.14	-66.94	-38.70	6.19	0.13	93.68	1.53	0.67	3.84	90.81	3.00	0.02	0.09	0.03
73	I	H	H	73.70	6.64	11.61	19.75	96.68	46.16	-79.36	-28.73	14.42	0.33	85.24	4.14	1.98	8.51	81.87	3.14	0.04	0.19	0.13
74	R	H	H	144.22	3.27	12.56	16.98	94.07	62.34	-65.24	-36.08	23.94	0.53	75.53	7.38	3.74	13.59	70.44	4.27	0.07	0.26	0.26
75	N	H	H	111.50	1.83	12.92	15.01	96.52	47.29	-75.96	-10.06	39.77	0.48	59.76	7.87	5.23	26.52	53.29	6.54	0.08	0.23	0.26
76	H	H	H	118.70	3.85	11.39	16.60	98.38	68.10	-77.12	-7.80	49.29	0.91	49.80	14.37	7.52	27.66	40.38	9.09	0.06	0.43	0.47
77	F	C	H	117.55	5.42	9.65	16.69	105.87	72.19	-88.45	19.37	53.63	3.88	42.49	26.88	10.86	17.13	31.71	9.65	0.11	2.05	1.61
78	K	C	C	129.63	3.75	9.75	15.26	109.66	105.16	-93.55	106.63	63.23	5.06	31.71	39.97	8.42	14.50	24.64	7.47	0.03	2.97	1.99
79	T	C	T	98.81	2.88	9.53	14.11	109.10	-157.41	-90.49	97.57	71.42	3.77	24.81	27.36	13.79	30.82	17.99	6.46	0.06	2.13	1.39
80	D	C	T	117.65	1.72	9.54	12.47	103.17	26.19	-83.09	40.95	81.52	3.28	15.20	31.25	16.70	34.50	9.55	4.97	0.02	1.94	1.07
81	I	C	C	109.97	4.09	7.11	13.15	114.90	144.29	-94.31	130.13	86.15	7.20	6.65	63.71	17.36	5.03	4.45	2.26	0.01	4.65	2.52
82	K	C	C	161.32	1.27	9.93	12.33	114.70	-136.07	-90.92	133.14	88.09	10.02	1.89	86.18	1.29	1.20	1.19	0.45	0.00	6.22	3.47
83	A	C	C	77.10	4.72	9.65	16.36	111.03	-107.36	-70.93	141.13	99.86	0.12	0.02	99.80	0.08	0.04	0.01	0.00	0.00	0.06	0.01