#	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	P	C	C	85.23	5.15	12.71	19.32	113.11	-112.93	-69.83	143.96	99.92	0.04	0.04	99.74	0.13	0.08	0.02	0.00	0.00	0.02	0.01
1	K	C	C	135.58	4.14	10.19	16.15	114.00	-120.19	-86.83	133.16	86.98	5.94	7.07	83.36	1.64	2.45	4.93	1.51	0.00	2.73	3.39
2	K	C	C	135.99	3.54	10.31	15.56	112.73	-128.15	-81.50	136.45	74.38	9.55	16.08	56.26	11.15	6.08	10.91	5.64	0.02	5.26	4.68
3	R	C	C	145.51	5.05	10.35	16.91	103.25	-110.33	-76.83	0.60	64.81	9.07	26.11	45.55	10.42	8.71	14.99	11.10	0.03	5.34	3.86
4	A	C	C	66.34	5.48	11.84	18.77	103.49	62.43	-78.33	-8.03	60.36	6.84	32.79	32.47	13.36	15.41	15.92	15.99	0.09	4.08	2.68
5	S	C	C	61.23	7.04	11.98	20.33	104.51	51.55	-90.63	32.23	63.84	6.08	30.08	27.66	15.35	22.12	13.02	15.67	0.14	3.17	2.87
6	N	C	T	95.21	5.79	13.87	20.85	100.57	68.42	-85.24	17.15	76.68	3.43	19.88	23.07	20.43	34.23	7.85	10.79	0.06	1.65	1.91
7	G	C	T	37.24	8.46	12.45	21.80	104.90	-105.03	76.37	5.90	84.22	3.49	12.30	26.41	25.53	33.33	3.19	8.15	0.01	1.79	1.58
8	R	C	C	138.21	5.00	14.41	20.58	108.25	120.89	-89.70	76.61	73.92	15.01	11.07	41.85	21.51	10.30	4.59	6.00	0.06	5.67	10.01
9	N	C	C	65.07	8.91	10.13	20.34	114.11	89.43	-91.81	128.19	82.52	9.49	7.98	61.86	11.50	8.13	2.96	5.20	0.00	4.77	5.58
10	K	C	T	153.41	2.76	12.67	16.84	97.04	-150.68	-74.14	-20.49	80.68	4.66	14.65	21.24	25.14	35.09	2.73	11.08	0.02	2.30	2.39
11	K	C	T	153.22	1.72	12.40	14.66	103.16	55.07	-91.65	11.00	84.56	2.73	12.70	8.77	26.87	48.91	1.72	10.75	0.01	1.46	1.52
12	G	C	S	42.59	5.20	11.38	18.03	114.29	-46.34	95.17	141.58	87.57	3.16	9.27	22.73	33.96	30.30	0.91	8.96	0.00	1.52	1.62
13	R	C	T	151.61	4.06	12.51	18.03	104.32	-58.40	-81.41	70.67	85.32	5.59	9.10	26.01	21.32	37.77	1.12	8.28	0.01	2.70	2.79
14	G	C	T	41.62	7.25	13.68	21.90	100.73	-7.59	79.31	-1.17	87.39	5.64	6.97	23.67	26.31	37.34	0.72	6.66	0.01	3.08	2.21
15	H	C	C	104.11	6.89	15.35	23.33	104.83	101.17	-89.24	47.48	84.00	12.10	3.90	47.56	26.62	9.67	0.77	3.43	0.01	5.01	6.94
16	V	C	C	50.67	13.64	12.91	26.97	118.96	116.79	-99.47	136.38	83.23	16.19	0.57	64.13	17.57	1.37	0.21	0.39	0.00	6.30	10.02
17	K	C	C	115.89	5.58	20.26	26.64	119.03	-136.21	-93.69	140.23	92.50	7.45	0.04	82.32	10.20	0.22	0.01	0.04	0.00	6.26	0.96
18	P	C	C	54.52	13.38	16.97	30.45	115.84	-104.45	-68.13	147.73	81.84	18.11	0.06	77.34	3.92	0.20	0.01	0.06	0.00	17.44	1.04
19	V	E	E	25.08	17.03	16.92	34.47	124.72	-157.01	-116.95	140.86	9.55	90.43	0.02	8.60	0.62	0.03	0.01	0.01	0.00	86.81	3.92
20	R	E	E	116.13	7.60	21.71	29.88	116.99	-131.26	-95.56	132.11	7.09	92.89	0.03	6.82	0.27	0.02	0.02	0.01	0.00	83.76	9.10
21	C	C	C	11.90	20.06	11.88	32.42	111.86	-120.86	-74.85	131.84	67.47	32.42	0.10	66.69	1.25	0.18	0.02	0.08	0.00	29.35	2.43
22	V	C	T	81.14	7.19	18.60	26.80	93.50	-141.46	-68.76	-25.22	98.17	1.03	0.80	2.17	21.09	74.83	0.03	0.92	0.00	0.79	0.18
23	N	C	T	93.96	6.09	17.66	24.35	100.07	40.38	-93.98	-21.78	98.68	0.43	0.89	0.98	19.34	78.32	0.03	0.97	0.00	0.27	0.09
24	C	C	S	45.52	10.32	13.86	25.14	116.49	22.20	-122.10	75.56	95.69	2.91	1.40	19.10	48.15	28.14	0.09	1.75	0.00	1.68	1.09
25	S	C	S	73.66	6.09	16.53	23.71	95.16	-131.72	-70.51	0.05	97.07	2.62	0.31	44.57	44.57	8.08	0.04	0.36	0.00	1.78	0.61
26	K	C	C	100.72	5.87	19.50	26.55	120.99	114.65	-86.73	147.80	81.73	18.15	0.12	59.15	21.77	1.00	0.02	0.14	0.00	16.81	1.12
27	S	E	E	41.02	14.74	16.95	31.56	118.79	-126.06	-91.71	140.18	15.25	84.68	0.07	13.41	1.50	0.10	0.04	0.04	0.00	72.68	12.24
28	I	E	E	19.66	16.81	16.00	33.81	128.98	-170.16	-129.22	144.67	12.20	87.78	0.01	11.53	0.64	0.02	0.01	0.01	0.00	82.24	5.56
29	P	E	E	48.85	6.07	20.74	27.87	113.47	-100.33	-64.01	143.47	35.95	64.01	0.04	36.07	0.68	0.03	0.02	0.02	0.00	61.01	2.16
30	K	H	G	88.54	14.62	12.30	26.78	90.97	-118.02	-57.67	-35.80	32.65	0.35	67.00	1.83	3.16	27.04	16.17	51.35	0.06	0.25	0.12
31	D	H	G	120.07	1.30	18.57	19.11	90.64	61.24	-69.36	-19.37	30.80	0.36	68.85	1.29	2.65	25.82	20.09	49.68	0.09	0.22	0.16
32	K	H	G	112.18	6.01	16.89	23.92	96.68	53.58	-95.49	-3.44	26.22	1.10	72.68	3.97	4.35	17.67	23.26	49.60	0.09	0.70	0.37
33	A	C	C	19.11	20.30	10.14	29.23	115.11	97.88	-82.41	137.59	57.44	19.32	23.24	40.20	11.44	5.66	18.24	5.65	0.11	14.17	4.55
34	I	C	E	73.01	9.82	15.15	26.00	117.75	-139.58	-101.01	131.83	46.38	44.21	9.41	36.74	6.76	2.49	8.49	2.00	0.04	38.16	5.32
35	K	E	E	134.97	5.11	15.18	21.80	110.47	-146.69	-89.05	128.32	41.58	49.30	9.11	34.39	4.20	1.98	7.53	1.82	0.01	48.62	1.45
36	R	E	E	144.40	4.99	13.48	20.12	121.86	-150.34	-116.38	137.69	37.69	50.84	11.47	30.80	3.97	2.01	9.28	2.31	0.02	50.41	1.21
37	M	E	E	102.67	7.76	10.28	19.60	120.22	-158.54	-110.45	133.86	37.17	52.72	10.11	32.28	2.59	1.45	8.17	1.91	0.01	52.05	1.54
38	A	E	E	69.95	4.53	11.99	18.32	119.08	-160.95	-109.50	134.51	40.72	49.51	9.77	33.64	3.91	1.77	8.43	1.73	0.02	48.99	1.52
39	I	C	C	100.35	6.21	9.64	17.62	115.23	-149.66	-98.87	127.24	48.04	40.41	11.54	40.09	4.17	2.07	10.15	1.91	0.02	39.73	1.87
40	R	C	C	159.64	2.93	11.14	15.69	105.42	-165.05	-92.15	21.56	66.86	20.35	12.80	48.62	12.50	3.95	12.02	2.16	0.04	18.80	1.91
41	N	C	C	92.70	3.62	10.52	15.56	114.06	14.00	-99.05	127.94	74.80	10.44	14.76	57.58	11.68	3.98	14.83	1.95	0.01	7.95	2.01
42	I	H	H	123.83	2.10	11.41	14.51	94.48	-129.66	-65.34	-35.97	12.32	0.79	86.88	7.56	2.44	3.02	84.99	1.35	0.01	0.47	0.14
43	V	H	H	98.09	1.92	13.46	15.52	93.37	51.99	-66.95	-40.00	5.42	0.34	94.24	2.83	0.88	2.11	92.64	1.22	0.02	0.25	0.05
44	E	H	H	87.14	5.42	13.44	20.33	93.35	50.47	-68.08	-39.08	3.34	0.19	96.47	1.92	0.48	1.28	94.98	1.15	0.01	0.14	0.03
45	A	H	H	44.55	5.23	13.92	20.95	92.52	52.89	-64.62	-40.95	1.65	0.05	98.30	0.81	0.20	0.67	97.74	0.55	0.00	0.03	0.01
46	A	H	H	54.14	2.61	17.11	19.76	91.94	50.86	-64.43	-40.93	1.23	0.03	98.74	0.45	0.13	0.60	98.44	0.36	0.00	0.02	0.00
47	A	H	H	46.10	4.52	15.99	21.80	92.17	51.03	-64.90	-41.12	1.51	0.05	98.44	0.49	0.14	0.80	98.18	0.34	0.00	0.03	0.01
48	V	H	H	60.36	6.87	15.36	23.70	92.14	50.19	-64.89	-41.41	1.30	0.04	98.65	0.45	0.14	0.66	98.45	0.28	0.00	0.02	0.01
49	R	H	H	129.70	2.98	17.25	20.68	92.06	51.14	-64.18	-41.01	1.62	0.04	98.34	0.56	0.16	0.83	98.11	0.30	0.00	0.02	0.01
50	D	H	H	82.23	2.54	17.00	19.54	92.28	50.09	-65.60	-40.04	2.78	0.05	97.17	0.86	0.28	1.57	96.81	0.44	0.00	0.02	0.01
51	L	H	H	71.67	6.70	14.05	22.17	92.53	50.90	-65.69	-39.78	2.91	0.04	97.05	0.79	0.28	1.72	96.30	0.88	0.00	0.02	0.01
52	S	H	H	58.20	6.12	14.18	21.59	92.77	52.77	-66.53	-36.57	6.51	0.06	93.43	1.06	0.56	4.63	92.53	1.15	0.02	0.02	0.02
53	E	H	H	138.40	1.60	15.58	16.95	93.10	52.74	-71.84	-26.47	19.39	0.13	80.49	1.67	1.61	15.78	79.43	1.34	0.05	0.05	0.07
54	A	H	H	63.78	4.78	12.16	18.37	98.39	63.51	-80.67	-10.14	47.75	0.89	51.36	9.98	8.66	29.46	49.15	1.83	0.10	0.31	0.50
55	S	C	C	59.40	7.37	10.01	18.81	111.82	114.84	-84.88	126.77	81.66	7.22	11.13	47.35	15.85	18.49	8.25	2.95	0.03	3.38	3.70
56	V	C	C	102.13	3.79	12.28	17.27	99.44	-157.61	-84.76	-18.43	87.14	8.50	4.36	39.90	37.91	9.85	2.45	1.85	0.01	3.83	4.21
57	Y	C	C	110.18	6.20	9.21	17.24	112.15	65.91	-105.24	107.74	92.48	5.13	2.39	60.49	29.17	2.80	1.32	1.08	0.00	2.09	3.04
58	P	C	G	102.08	3.02	11.07	15.79	96.39	-158.66	-66.37	-23.57	50.47	1.19	48.34	11.97	8.32	29.89	8.15	40.46	0.01	0.70	0.49
59	E	H	G	148.35	1.51	12.23	14.00	98.29	58.47	-81.02	-14.14	48.63	1.45	49.92	7.21	8.27	32.41	9.54	41.01	0.03	0.86	0.66
60	Y	H	G	122.12	6.83	9.89	18.06	108.35	49.70	-102.22	72.25	44.20	5.75	50.06	18.32	11.21	17.89	9.68	37.50	0.07	3.57	1.76
61	A	C	C	61.44	6.17	12.27	19.99	111.33	145.05	-87.09	121.91	72.51	10.33	17.16	42.86	21.80	7.82	11.18	5.98	0.09	4.72	5.55
62	L	C	C	73.46	9.76	10.16	21.10	117.04	-122.01	-91.79	136.88	81.19	6.50	12.31	45.62	31.67	4.08	9.88	2.63	0.03	2.96	3.15
63	P	C	C	66.44	5.73	12.73	20.24	112.37	-106.72	-66.03	148.00	73.63	2.60	23.77	61.17	5.76	6.59	15.93	7.95	0.00	1.59	1.01
64	K	H	H	145.60	3.54	12.50	17.80	94.72	-117.14	-62.99	-28.80	43.52	1.90	54.58	12.08	9.50	21.37	28.72	26.34	0.16	1.05	0.78
65	T	H	H	86.71	3.96	13.44	18.57	95.11	61.93	-73.59	-21.95	40.05	5.78	54.17	11.34	8.16	20.02	29.28	25.39	0.43	3.98	1.39
66	Y	H	H	92.20	10.79	12.31	23.75	99.02	56.69	-89.31	-10.74	37.69	14.07	48.23	18.15	8.28	12.33	27.11	20.65	0.38	10.69	2.42
67	N	C	C	69.07	11.31	14.50	26.18	102.83	74.63	-82.03	7.67	50.64	21.10	28.26	31.11	10.85	8.72	22.10	6.68	0.17	17.64	2.72
68	K	C	E	103.79	8.53	18.89	27.77	109.88	79.49	-93.32	103.64	44.71	31.99	23.30	27.76	9.78	7.33	18.31	5.24	0.09	29.32	2.17
69	L	E	E	50.05	15.56	17.98	33.30	115.82	67.36	-96.71	128.23	37.22	42.43	20.35	25.95	6.31	4.29	17.04	3.99	0.05	40.67	1.71
70	H	E	E	54.07	15.88	21.17	36.50	119.65	-164.90	-107.10	132.26	29.06	53.99	16.95	20.83	4.09	3.25	14.75	3.21	0.07	50.74	3.05
71	Y	E	E	45.48	17.99	22.22	39.31	121.15	-167.18	-108.69	135.27	30.70	53.95	15.35	23.71	3.51	2.44	13.96	2.40	0.04	49.63	4.30
72	C	C	C	20.20	18.72	23.36	41.05	114.24	-149.20	-89.78	140.37	48.44	31.72	19.84	42.85	2.85	1.83	19.57	1.38	0.01	29.29	2.21
73	V	H	H	26.50	20.19	21.79	40.84	94.71	-122.13	-65.25	-36.35	13.07	1.47	85.45	5.53	2.34	5.60	83.05	1.91	0.04	1.35	0.17
74	S	H	H	35.96	10.50	23.78	34.74	91.65	55.24	-63.50	-41.15	6.13	1.00	92.87	2.52	0.97	2.88	90.50	1.99	0.04	1.00	0.10
75	C	H	H	25.64	12.08	21.74	34.73	91.99	50.78	-65.19	-41.11	2.74	0.67	96.59	1.18	0.46	1.28	93.91	2.36	0.02	0.74	0.06
76	A	H	H	8.39	18.13	17.51	36.33	91.85	52.04	-64.29	-41.81	2.31	0.77	96.92	0.93	0.33	1.16	94.67	1.99	0.02	0.86	0.05
77	I	H	H	58.55	11.60	18.25	30.19	92.50	49.84	-65.16	-42.46	2.83	0.79	96.37	0.73	0.33	1.85	94.67	1.53	0.05	0.78	0.06
78	H	H	H	111.12	5.90	18.37	24.81	91.68	51.30	-66.77	-33.45	8.29	0.22	91.50	0.72	0.54	7.06	90.23	1.17	0.09	0.13	0.06
79	A	C	T	46.78	8.38	14.82	24.71	93.08	49.57	-86.79	-2.22	79.47	0.08	20.46	1.06	2.01	74.28	21.77	0.80	0.00	0.03	0.05
80	R	C	T	164.42	4.05	17.07	22.61	92.85	-123.05	60.56	32.89	95.04	0.15	4.81	2.53	3.51	88.60	4.83	0.41	0.00	0.08	0.05
81	I	C	S	61.68	11.15	16.22	28.15	99.51	132.58	-90.98	-16.32	86.90	7.61	5.49	35.03	44.34	7.71	4.52	1.41	0.02	3.99	2.98
82	V	C	S	34.69	17.88	13.41	30.62	127.53	42.77	-123.77	143.04	82.43	12.06	5.51	33.18	44.11	6.14	3.94	1.81	0.04	7.49	3.31
83	R	C	C	128.54	6.68	20.35	27.78	118.49	-146.49	-104.35	131.23	82.48	12.83	4.68	65.03	13.72	3.34	3.45	1.62	0.00	9.67	3.17
84	V	C	C	57.90	15.19	14.51	29.43	115.98	-148.54	-97.62	127.25	87.27	8.50	4.22	78.14	7.07	1.84	3.35	1.11	0.00	6.10	2.39
85	R	C	C	91.81	9.55	14.43	25.17	122.33	-153.88	-101.18	149.83	93.10	3.72	3.19	80.38	10.89	1.71	2.63	0.78	0.00	2.17	1.44
86	S	C	C	48.88	4.98	15.57	21.88	117.28	-104.10	-74.32	155.32	94.15	1.74	4.11	89.18	3.79	1.32	3.51	0.59	0.00	0.83	0.77
87	R	H	H	135.27	6.43	11.90	19.92	92.74	-115.03	-60.72	-36.57	12.82	0.19	86.98	5.91	3.24	4.76	82.49	3.42	0.02	0.08	0.08
88	E	H	H	127.45	1.32	14.80	15.48	92.12	53.97	-64.59	-40.41	8.42	0.11	91.48	1.96	1.34	5.18	86.35	5.05	0.03	0.06	0.04
89	D	H	H	67.83	4.22	12.89	18.73	92.14	49.57	-66.85	-37.21	7.88	0.15	91.96	2.46	1.17	4.39	85.41	6.40	0.02	0.11	0.04
90	R	H	H	81.64	10.90	10.05	21.73	92.04	54.35	-66.45	-35.85	8.24	0.19	91.56	3.10	1.36	4.12	85.67	5.56	0.02	0.12	0.06
91	K	H	H	133.82	2.84	13.34	17.46	91.97	57.48	-68.10	-28.20	20.26	0.35	79.39	4.43	2.96	13.32	74.55	4.30	0.10	0.18	0.17
92	N	H	H	120.45	1.35	13.72	14.82	95.93	51.67	-88.21	-2.54	46.33	0.56	53.11	9.36	6.95	30.27	49.95	2.84	0.07	0.21	0.33
93	R	C	C	117.68	7.62	8.75	17.70	112.32	97.07	-84.13	134.82	80.05	2.66	17.29	43.12	21.36	15.10	15.34	2.18	0.01	0.83	2.05
94	A	C	C	76.84	2.96	10.25	15.05	118.34	-135.00	-90.80	140.93	97.98	1.82	0.20	70.53	26.98	0.50	0.12	0.07	0.00	0.64	1.15
95	P	C	C	94.98	3.46	9.87	15.27	114.79	-96.83	-66.40	148.22	99.87	0.11	0.02	99.16	0.64	0.10	0.01	0.00	0.00	0.05	0.03
96	P	C	C	102.38	3.16	11.73	16.59	110.22	-94.28	-67.09	146.88	99.95	0.03	0.02	99.67	0.20	0.10	0.01	0.00	0.00	0.01	0.01