#	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	S	C	C	68.66	5.73	12.86	19.98	117.95	-159.23	-98.13	144.66	99.64	0.22	0.13	99.34	0.25	0.15	0.08	0.02	0.00	0.12	0.05
1	N	C	C	102.17	4.36	10.33	16.30	111.70	-144.69	-91.27	124.44	77.70	3.17	19.13	71.02	1.58	5.68	15.78	2.85	0.00	1.73	1.36
2	A	C	C	70.58	4.47	10.13	16.18	100.89	-156.69	-75.34	-15.01	60.76	5.35	33.89	39.51	9.68	11.99	26.85	6.78	0.04	3.50	1.65
3	M	C	C	107.11	5.48	10.14	17.01	101.57	65.91	-78.26	-16.87	55.69	7.26	37.05	36.89	9.47	9.98	28.67	7.93	0.06	5.08	1.92
4	S	C	C	66.70	4.01	11.94	17.30	101.68	76.08	-75.90	-23.31	51.80	7.47	40.74	34.86	9.51	8.25	32.36	7.81	0.05	5.37	1.79
5	E	C	C	116.33	4.61	11.98	17.91	100.65	56.35	-78.27	-15.80	52.17	5.92	41.91	35.22	9.10	8.61	34.71	6.64	0.04	4.32	1.36
6	A	C	H	60.44	7.04	11.28	19.59	100.44	71.58	-74.77	-20.06	51.38	5.52	43.11	35.38	8.20	8.51	35.69	6.84	0.03	4.14	1.21
7	K	C	H	123.74	4.74	13.36	19.42	102.85	64.77	-79.17	4.19	51.24	7.94	40.81	31.48	9.48	10.96	33.06	7.31	0.07	6.09	1.55
8	K	C	C	118.22	6.06	14.65	21.70	105.57	61.24	-81.81	56.01	55.32	11.23	33.45	36.06	8.62	10.59	26.78	6.97	0.07	8.75	2.16
9	L	C	C	68.51	12.55	11.93	24.60	107.55	-150.52	-84.08	101.37	62.82	12.46	24.72	44.26	10.07	7.81	20.56	5.20	0.05	9.53	2.53
10	N	C	C	95.01	5.73	15.88	22.57	105.28	70.28	-89.87	61.19	70.46	12.34	17.20	52.25	8.43	8.54	13.84	4.48	0.02	9.62	2.84
11	I	C	T	83.57	10.40	12.53	23.59	109.33	111.56	-83.31	116.98	76.46	11.00	12.55	25.06	12.97	39.14	8.71	3.78	0.08	7.96	2.30
12	G	C	T	46.25	6.51	15.58	22.78	103.87	18.48	83.55	1.64	83.79	8.71	7.51	25.10	16.50	43.22	4.15	2.89	0.02	6.81	1.31
13	R	C	C	125.69	6.63	14.94	22.87	117.25	121.35	-93.42	138.53	79.27	15.85	4.88	59.41	14.59	4.82	3.02	2.19	0.01	12.75	3.21
14	E	C	C	121.76	6.27	16.53	23.98	115.20	-125.48	-87.21	133.48	69.01	27.89	3.10	58.55	6.22	2.20	2.14	1.27	0.00	19.39	10.22
15	L	C	C	34.21	17.64	10.52	27.80	120.25	-148.00	-99.10	142.28	85.60	13.41	0.99	80.44	5.06	0.43	0.80	0.29	0.00	9.24	3.73
16	T	C	C	62.92	3.68	20.47	23.84	122.66	-128.52	-83.26	164.75	92.38	6.32	1.30	90.44	2.48	0.30	1.14	0.22	0.00	3.34	2.08
17	D	H	H	74.17	11.61	13.75	25.86	91.96	-102.55	-58.72	-38.52	3.88	0.25	95.87	1.60	1.05	1.87	93.64	1.60	0.02	0.16	0.06
18	E	H	H	121.20	2.51	18.04	20.70	92.11	52.73	-65.15	-39.33	1.74	0.26	98.00	0.43	0.34	1.16	95.83	1.96	0.03	0.23	0.03
19	E	H	H	70.20	7.56	17.29	26.07	92.17	49.81	-65.99	-40.43	1.01	0.34	98.65	0.28	0.20	0.71	96.21	2.21	0.02	0.33	0.03
20	L	H	H	19.81	17.94	13.98	32.16	92.19	50.84	-64.55	-41.77	1.13	0.45	98.41	0.31	0.22	0.81	96.44	1.71	0.03	0.42	0.06
21	M	H	H	66.30	10.25	16.52	27.66	92.18	51.45	-65.06	-40.23	3.38	0.65	95.97	0.92	0.43	2.32	93.98	1.59	0.09	0.52	0.15
22	E	H	H	122.79	2.98	19.63	22.55	92.43	50.96	-66.89	-37.02	8.45	0.55	91.00	1.48	0.82	6.54	88.77	1.63	0.17	0.37	0.21
23	M	H	H	70.55	11.70	16.61	28.55	94.31	51.62	-71.98	-33.45	16.36	0.49	83.15	1.85	1.60	13.08	81.39	1.32	0.24	0.22	0.29
24	T	H	H	40.03	14.34	14.72	29.10	99.76	38.19	-95.66	-3.32	38.35	1.74	59.91	5.91	7.03	26.50	57.07	1.52	0.35	0.62	0.99
25	G	C	T	47.67	4.78	17.21	22.86	99.53	-110.95	75.73	12.92	91.43	2.25	6.32	33.47	17.29	41.19	3.87	2.14	0.00	1.25	0.79
26	G	C	C	40.55	7.66	14.93	23.48	109.01	-60.66	87.76	2.60	82.47	5.25	12.28	38.53	24.69	20.45	6.02	5.57	0.02	2.96	1.76
27	S	C	C	57.08	8.23	15.72	24.88	117.15	131.16	-93.56	144.44	68.41	9.53	22.06	37.07	19.36	12.72	12.53	9.43	0.06	6.84	2.01
28	T	C	C	73.27	8.83	17.77	27.09	116.42	-135.92	-98.63	135.03	48.96	22.84	28.20	27.88	11.70	10.05	18.35	9.76	0.19	19.68	2.40
29	F	E	E	59.35	16.79	13.71	30.05	115.78	-146.34	-102.42	130.26	32.95	35.05	32.00	20.49	7.26	6.50	24.31	7.90	0.29	30.36	2.90
30	S	E	E	55.73	8.43	17.61	26.79	116.91	-157.97	-101.67	135.05	31.76	37.46	30.78	21.12	5.86	5.06	24.84	6.41	0.19	34.03	2.49
31	I	H	E	72.13	11.21	13.91	25.72	116.40	-159.94	-99.11	136.16	29.87	33.38	36.75	19.19	6.04	5.62	27.64	8.62	0.21	30.55	2.13
32	Q	H	H	106.10	6.02	15.45	22.41	107.36	-135.13	-82.95	105.04	33.93	27.50	38.57	19.85	6.67	8.46	26.11	11.67	0.23	25.03	1.98
33	C	C	H	60.71	9.95	11.86	22.58	111.15	66.49	-93.96	117.98	42.11	20.74	37.15	21.77	8.96	12.54	22.86	13.69	0.37	17.36	2.46
34	Q	C	C	112.30	5.85	12.93	20.03	103.19	-151.44	-89.08	4.47	53.29	17.50	29.22	29.65	11.49	13.00	17.56	11.61	0.21	13.69	2.80
35	K	C	T	118.67	5.71	12.38	19.55	110.51	96.16	-88.58	130.58	66.70	13.28	20.02	20.54	15.27	32.15	10.63	8.69	0.26	10.05	2.41
36	D	C	T	104.37	3.89	13.74	19.02	106.39	-105.30	-88.47	85.47	72.47	13.98	13.55	24.44	15.43	34.38	4.95	7.39	0.06	11.58	1.78
37	Y	C	C	94.33	11.65	10.06	22.13	118.75	147.36	-103.87	135.69	64.15	28.04	7.81	42.06	14.18	9.01	3.24	4.43	0.04	23.86	3.17
38	T	C	C	95.27	3.75	14.76	19.59	109.41	-152.13	-95.09	101.10	62.42	32.54	5.04	38.82	16.37	9.01	2.02	3.06	0.04	26.94	3.74
39	Y	C	C	102.01	10.73	11.31	22.82	117.57	-147.97	-101.63	130.17	69.69	27.90	2.40	40.92	25.57	4.67	0.90	1.61	0.02	21.68	4.64
40	K	C	C	126.04	5.47	15.23	22.12	115.06	-138.96	-94.43	127.81	82.68	14.33	2.99	63.79	15.17	3.18	0.65	2.58	0.00	12.96	1.66
41	P	C	C	65.82	10.42	13.64	24.71	112.09	-118.20	-73.06	146.87	82.56	10.59	6.84	54.18	14.28	13.95	1.43	5.60	0.01	9.14	1.40
42	S	C	C	65.55	7.53	16.63	24.88	107.01	-126.69	-83.61	99.18	73.47	18.61	7.92	44.79	16.53	12.61	2.27	5.97	0.04	14.04	3.75
43	L	C	C	55.08	14.68	14.08	28.78	119.77	-132.56	-101.23	133.90	72.62	21.26	6.12	46.84	23.27	3.37	3.28	2.90	0.05	16.96	3.33
44	P	C	C	55.49	10.97	18.47	29.91	111.50	-115.76	-71.70	144.26	72.76	20.90	6.35	58.25	9.52	4.03	3.33	2.83	0.02	20.42	1.60
45	V	C	E	55.64	13.89	19.03	32.66	116.55	-145.94	-100.41	131.00	45.05	44.86	10.09	33.77	7.88	3.95	6.38	3.96	0.07	40.82	3.16
46	V	E	E	28.48	19.38	16.89	35.80	115.64	-144.96	-94.15	126.83	37.03	53.76	9.21	29.78	4.54	2.85	5.81	3.60	0.04	50.83	2.55
47	K	E	E	87.05	11.84	21.91	33.30	109.76	-159.61	-94.61	105.57	34.65	55.86	9.49	22.45	7.82	6.71	5.00	4.26	0.06	51.51	2.20
48	Y	E	E	64.59	16.31	20.49	35.88	111.74	-123.75	-102.18	112.03	38.61	54.09	7.30	18.79	11.27	11.65	3.05	3.73	0.08	49.59	1.85
49	G	E	E	11.85	17.43	21.13	37.70	125.06	-115.23	117.09	168.85	45.98	50.94	3.08	26.24	12.91	8.64	0.88	1.80	0.02	48.37	1.15
50	V	E	E	23.66	19.50	19.00	38.18	119.08	-93.80	-105.33	131.92	35.07	62.97	1.96	28.66	4.81	1.79	0.94	1.03	0.01	59.50	3.27
51	V	E	E	56.29	11.72	21.44	33.40	116.53	-148.71	-100.43	127.62	37.33	61.05	1.61	31.52	4.08	1.54	0.95	0.87	0.01	56.76	4.26
52	I	C	C	39.15	16.79	13.30	30.07	121.07	-163.25	-111.02	134.89	58.78	40.19	1.04	49.55	6.17	2.10	0.37	0.67	0.00	39.24	1.90
53	D	C	C	100.82	4.42	17.03	22.44	105.81	-156.57	-95.83	19.54	84.50	14.51	0.99	53.23	25.79	5.57	0.26	0.75	0.00	13.10	1.30
54	E	C	C	101.24	6.54	13.47	21.42	119.58	61.46	-106.90	133.82	89.89	6.46	3.66	46.32	32.95	11.35	1.26	2.19	0.00	4.53	1.39
55	P	C	T	86.66	6.14	13.99	21.29	103.66	-95.62	-71.86	38.42	88.36	3.01	8.63	33.61	21.06	34.59	3.34	4.57	0.01	2.07	0.74
56	E	C	C	111.75	6.17	16.56	23.52	109.94	54.53	-87.49	108.79	76.74	13.45	9.81	35.88	17.02	25.00	4.04	5.10	0.04	11.40	1.52
57	V	C	C	34.45	17.93	12.86	30.40	117.73	-152.64	-100.87	129.64	56.59	36.25	7.16	45.34	6.98	3.25	4.12	3.08	0.02	35.00	2.20
58	V	E	E	60.65	9.70	21.87	32.08	121.27	-164.58	-111.53	132.16	33.26	61.39	5.34	27.78	3.70	1.62	3.95	1.90	0.02	58.66	2.37
59	I	E	E	37.69	19.69	16.85	35.92	111.99	-124.14	-78.27	128.43	24.03	70.37	5.59	21.14	1.80	1.22	3.69	2.01	0.01	68.31	1.82
60	K	E	E	77.53	11.70	22.30	33.68	101.11	-168.43	-91.27	-31.91	30.40	61.93	7.67	18.24	8.40	6.48	3.10	3.74	0.04	58.88	1.12
61	Y	E	E	59.72	14.71	22.43	36.63	137.18	2.90	-147.81	151.91	26.41	67.45	6.14	14.19	7.92	7.43	2.19	3.31	0.04	63.45	1.47
62	G	E	E	16.51	18.59	19.91	37.27	128.29	-157.42	-123.16	151.20	38.66	58.07	3.27	24.66	10.45	6.26	1.05	2.03	0.02	53.79	1.74
63	V	C	E	25.52	18.14	18.84	36.93	121.16	-140.55	-113.06	135.03	54.57	44.25	1.18	37.49	15.55	2.88	0.48	0.81	0.01	39.39	3.39
64	G	C	C	27.02	10.36	21.54	31.81	122.21	-128.93	-90.56	154.82	77.98	20.83	1.19	53.14	20.65	3.93	0.41	0.79	0.00	19.75	1.33
65	P	C	C	57.76	12.42	16.98	29.38	104.71	-91.27	-70.16	120.78	77.16	17.16	5.68	46.87	18.70	12.29	1.94	3.54	0.02	14.75	1.89
66	I	C	C	74.41	12.30	15.57	27.80	107.85	113.68	-91.51	98.55	68.79	23.59	7.62	43.78	14.95	10.71	3.37	4.35	0.06	18.22	4.56
67	V	C	C	87.35	7.33	16.61	24.56	106.07	-125.82	-84.04	87.15	68.98	21.35	9.67	29.59	19.54	22.07	4.03	4.99	0.20	16.78	2.81
68	G	C	C	42.11	7.37	18.13	25.81	102.95	7.17	81.17	-2.60	69.04	22.27	8.69	27.15	22.27	22.01	3.14	4.70	0.16	18.29	2.29
69	I	C	C	50.13	16.17	13.91	29.70	114.24	109.19	-95.67	126.50	61.76	29.31	8.93	42.30	11.38	8.84	3.53	5.07	0.06	25.87	2.97
70	K	C	E	98.10	10.08	19.57	29.61	110.01	-159.74	-91.47	113.81	52.45	38.55	9.00	29.21	13.82	12.70	3.35	5.21	0.15	32.36	3.20
71	Y	E	E	78.86	14.30	18.96	32.74	117.22	-138.82	-108.23	130.23	44.72	47.97	7.31	20.45	12.81	15.27	2.48	4.41	0.14	41.57	2.88
72	G	E	E	17.74	14.11	19.54	33.62	122.21	-87.34	125.27	167.37	45.15	51.16	3.70	25.94	11.87	10.29	0.99	2.58	0.02	46.13	2.18
73	V	E	E	33.77	17.45	16.66	34.00	121.23	-98.49	-109.33	135.06	43.86	54.99	1.14	33.34	8.15	1.90	0.54	0.81	0.01	48.19	7.06
74	E	C	C	98.10	7.99	19.94	28.66	118.35	-146.29	-102.01	131.04	66.40	33.26	0.34	54.07	10.40	1.04	0.09	0.28	0.00	32.17	1.94
75	P	C	C	55.50	13.68	12.50	26.29	113.31	-114.79	-68.99	142.95	74.10	24.94	0.96	61.07	8.59	3.25	0.22	0.84	0.00	24.03	2.00
76	I	C	C	104.97	6.38	14.19	21.63	108.25	-144.97	-92.29	79.88	86.91	11.45	1.64	45.55	29.97	12.27	0.31	1.41	0.00	8.33	2.16
77	G	C	S	43.13	3.71	14.47	19.09	127.64	-8.18	144.95	176.16	90.43	8.00	1.56	25.84	47.67	17.34	0.20	1.43	0.00	6.02	1.48
78	P	C	C	102.65	3.11	14.87	18.84	108.97	-47.33	-73.67	131.52	89.87	8.87	1.26	47.63	30.18	12.56	0.19	1.23	0.00	6.86	1.34
79	I	C	C	68.67	12.99	10.86	24.14	117.98	-125.11	-98.42	131.71	75.54	23.30	1.16	55.80	15.99	3.15	0.40	0.96	0.01	17.31	6.38
80	Q	C	C	96.97	6.79	18.52	26.25	118.52	-156.20	-108.02	131.28	75.85	23.60	0.55	62.54	11.58	1.01	0.22	0.41	0.00	20.77	3.47
81	P	C	C	48.19	15.11	15.20	30.26	113.93	-112.10	-68.75	145.07	65.16	30.17	4.67	54.52	5.58	4.15	1.43	3.44	0.00	25.97	4.90
82	M	C	C	72.92	13.06	17.76	30.50	103.30	-142.36	-84.49	3.50	64.44	23.03	12.53	33.32	17.60	16.84	1.99	9.56	0.08	16.98	3.63
83	Y	C	E	93.94	12.17	18.79	30.62	114.40	21.44	-101.78	124.64	55.42	32.64	11.94	22.28	16.65	21.50	2.18	8.71	0.19	23.90	4.61
84	G	C	C	24.91	13.34	18.16	31.14	119.49	-69.30	94.71	150.42	63.26	29.75	6.99	31.45	20.00	15.31	1.21	5.47	0.04	23.43	3.10
85	I	C	C	46.15	15.86	15.79	31.78	120.58	-117.35	-104.07	134.39	67.44	31.71	0.84	50.31	15.44	1.60	0.35	0.64	0.00	24.96	6.71
86	K	C	C	115.52	6.60	20.10	27.42	116.18	-126.01	-84.31	137.57	83.01	16.79	0.19	76.05	5.78	0.45	0.06	0.14	0.00	16.37	1.15
87	P	C	C	51.25	15.11	12.49	27.33	113.13	-108.18	-67.48	144.64	77.11	21.32	1.57	69.86	4.65	1.87	0.57	1.04	0.00	18.27	3.73
88	V	C	C	85.38	7.55	13.89	22.41	107.98	-141.48	-92.86	100.43	71.01	23.08	5.90	51.04	14.00	6.31	1.94	4.10	0.02	18.13	4.45
89	E	C	C	124.96	4.15	12.51	18.01	115.21	-140.06	-100.89	131.15	63.88	28.78	7.34	39.28	18.76	7.36	2.22	4.76	0.04	25.15	2.43
90	T	C	C	95.04	4.12	10.09	16.04	115.02	-144.60	-100.98	127.23	59.64	31.93	8.43	44.25	9.92	5.93	3.09	5.09	0.03	28.91	2.79
91	L	C	C	105.76	5.35	7.89	14.98	114.02	-153.07	-96.76	127.62	69.87	26.21	3.93	63.97	2.27	3.08	1.73	1.80	0.00	23.54	3.62
92	K	C	C	152.04	2.27	11.62	15.44	113.09	-140.20	-89.62	129.25	99.09	0.85	0.07	98.80	0.27	0.15	0.03	0.01	0.00	0.67	0.07