#	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	108.25	6.84	14.07	22.18	115.85	-158.02	-93.70	130.39	99.50	0.50	0.01	99.56	0.07	0.02	0.00	0.00	0.00	0.33	0.03
1	S	C	C	68.78	6.69	12.10	20.40	119.01	-155.87	-100.73	141.66	77.97	21.20	0.83	74.72	1.29	1.56	0.19	0.43	0.00	20.66	1.15
2	H	C	E	99.80	9.26	12.40	22.62	119.46	-169.62	-109.96	135.86	53.49	45.39	1.12	36.67	13.69	3.21	0.20	0.92	0.00	44.32	1.00
3	S	E	E	53.66	8.29	16.94	26.18	124.04	-147.74	-111.00	146.68	33.62	65.37	1.02	27.27	4.96	0.89	0.24	0.62	0.00	65.50	0.52
4	V	E	E	39.22	17.81	14.33	31.89	124.02	-157.89	-118.48	133.84	10.68	88.80	0.52	9.74	0.73	0.14	0.32	0.15	0.00	88.64	0.30
5	K	E	E	101.54	7.94	21.79	30.45	120.36	-156.90	-111.05	129.87	4.56	95.10	0.35	4.22	0.26	0.07	0.22	0.07	0.00	94.91	0.25
6	I	E	E	33.50	17.86	15.43	33.52	116.61	-157.38	-104.65	122.91	13.16	86.29	0.55	12.44	0.57	0.13	0.24	0.18	0.00	85.85	0.58
7	Y	C	E	79.87	11.62	17.91	30.08	111.31	-170.04	-92.61	143.28	50.84	40.93	8.23	34.88	11.14	5.84	1.18	6.70	0.00	39.24	1.02
8	D	C	S	100.63	4.89	21.05	26.35	99.85	-23.56	-84.09	-17.96	70.68	21.84	7.48	11.33	35.62	25.17	0.69	6.04	0.02	19.89	1.24
9	T	C	C	66.43	8.82	20.31	29.27	116.65	41.66	-109.52	123.32	72.21	17.65	10.14	30.55	19.67	23.47	1.14	9.11	0.01	14.44	1.61
10	C	C	C	15.22	22.54	13.29	35.09	115.45	-152.08	-98.67	127.94	78.00	19.68	2.32	68.94	5.54	2.72	0.70	1.71	0.00	14.76	5.64
11	I	C	C	69.91	10.27	22.43	32.89	115.50	-159.27	-96.52	127.91	76.49	21.28	2.22	30.69	17.73	30.13	0.81	1.44	0.04	14.32	4.84
12	G	C	T	34.50	8.86	22.53	31.61	96.44	6.89	77.48	11.51	91.21	6.96	1.83	24.09	33.76	34.08	0.59	1.12	0.00	4.93	1.43
13	C	C	C	16.16	21.66	14.12	34.96	101.07	131.10	-84.10	17.11	88.12	1.87	10.02	77.79	7.49	2.20	9.68	1.02	0.00	0.70	1.11
14	T	H	H	72.86	7.39	21.21	29.20	93.69	114.74	-64.58	-38.58	21.39	0.36	78.25	8.74	8.64	5.55	75.67	1.06	0.03	0.10	0.21
15	Q	H	H	90.93	5.46	23.48	28.93	92.35	52.25	-66.57	-40.05	8.39	0.44	91.17	4.13	2.21	3.22	88.44	1.56	0.05	0.22	0.17
16	C	H	H	6.18	22.64	16.51	39.28	92.15	50.93	-65.19	-42.24	2.55	0.42	97.03	1.14	0.48	1.36	94.42	2.14	0.03	0.34	0.07
17	V	H	H	28.21	18.77	17.97	36.07	91.92	52.00	-64.07	-39.77	2.27	0.52	97.22	0.86	0.34	1.33	94.83	2.04	0.03	0.49	0.07
18	R	H	H	159.02	2.35	23.29	25.46	91.57	53.01	-66.70	-32.80	6.71	0.36	92.93	1.12	0.53	5.41	91.10	1.38	0.08	0.28	0.11
19	A	H	H	39.57	11.04	18.67	30.26	93.55	52.10	-80.27	-21.53	19.29	0.28	80.42	1.13	1.84	16.49	79.51	0.63	0.13	0.09	0.20
20	C	C	C	10.28	23.18	10.52	33.00	110.64	73.38	-105.07	111.18	98.52	0.66	0.82	63.20	34.19	1.01	0.76	0.13	0.00	0.18	0.52
21	P	C	T	89.38	4.21	19.85	25.03	93.89	-165.21	-66.69	-22.01	85.45	0.86	13.69	29.22	15.48	40.62	6.83	6.93	0.00	0.43	0.48
22	T	C	T	67.56	8.26	18.11	26.94	101.84	50.96	-98.46	-1.17	81.02	1.12	17.86	6.54	22.79	51.79	8.89	8.69	0.03	0.65	0.61
23	D	C	C	78.64	10.69	20.09	30.77	96.69	-113.33	55.86	46.63	74.36	6.00	19.64	36.16	16.76	21.38	8.28	11.78	0.02	4.46	1.16
24	V	C	C	15.95	20.42	18.55	38.75	96.92	149.67	-80.76	-26.68	57.04	22.10	20.87	31.02	17.33	10.05	9.75	10.56	0.06	19.45	1.76
25	L	E	E	11.74	23.87	17.33	40.93	118.58	50.79	-114.50	124.65	25.50	54.32	20.18	15.70	6.86	6.01	10.89	8.58	0.17	49.89	1.90
26	E	E	E	85.20	8.78	24.85	33.95	124.52	125.30	-114.78	139.47	21.55	63.15	15.30	15.62	4.32	3.29	7.67	6.32	0.03	61.70	1.05
27	M	E	E	60.09	17.07	17.66	34.05	115.62	-130.17	-93.35	129.84	25.16	66.26	8.58	18.65	5.31	3.02	5.51	3.51	0.03	61.29	2.67
28	I	C	E	36.93	14.00	15.56	30.79	119.88	-161.68	-109.57	132.21	51.62	46.99	1.40	41.61	8.50	1.24	0.70	0.71	0.00	45.38	1.87
29	P	C	C	72.84	5.79	18.91	25.46	111.54	-112.43	-67.99	141.53	70.56	26.01	3.43	56.43	8.00	4.46	1.04	2.15	0.00	26.67	1.24
30	W	C	C	94.01	14.78	10.06	24.32	105.89	-150.57	-95.16	65.73	69.45	16.18	14.38	35.99	15.10	19.90	4.24	9.62	0.05	10.89	4.21
31	D	C	T	115.85	2.14	14.62	17.37	100.86	38.94	-69.99	50.41	80.65	4.31	15.03	14.79	16.01	49.77	4.59	10.26	0.04	2.93	1.60
32	G	C	T	56.47	2.37	14.11	17.07	99.42	-55.77	84.00	0.30	81.67	2.74	15.59	15.39	20.24	46.52	4.83	10.20	0.02	1.72	1.07
33	C	C	C	44.23	12.54	9.13	22.01	118.25	120.98	-91.68	142.04	71.05	16.00	12.95	46.68	15.25	8.56	8.64	5.14	0.09	9.80	5.85
34	K	C	C	119.54	4.18	17.53	22.19	113.11	-136.65	-87.17	135.36	58.87	18.82	22.31	39.23	10.89	8.08	17.42	6.02	0.11	14.00	4.25
35	A	H	H	46.41	13.27	12.28	25.49	97.47	-115.55	-66.13	-32.74	40.18	15.98	43.84	20.87	9.17	11.45	29.13	13.90	0.38	12.92	2.17
36	K	H	H	126.13	4.51	17.21	22.60	95.45	62.28	-70.48	-27.30	32.27	21.35	46.37	17.34	6.87	9.33	31.95	13.67	0.25	18.74	1.85
37	Q	H	H	88.38	7.34	17.30	25.39	97.13	59.38	-78.81	-23.29	26.70	26.33	46.97	16.76	4.94	6.00	32.98	13.52	0.13	23.88	1.79
38	I	H	H	35.28	18.47	12.60	29.98	98.39	60.35	-76.70	-28.69	24.53	32.35	43.12	15.63	4.34	5.28	33.45	9.73	0.17	28.82	2.59
39	A	H	H	56.77	9.24	17.21	26.88	97.88	66.11	-73.01	-25.35	35.20	28.14	36.66	18.10	6.92	10.97	27.56	9.36	0.29	24.47	2.33
40	S	C	C	74.31	4.32	18.98	23.81	101.76	52.40	-91.68	5.69	52.94	19.03	28.03	20.91	12.87	20.38	18.40	9.43	0.48	14.77	2.76
41	A	C	C	31.85	16.09	13.00	28.92	118.35	109.24	-84.59	140.94	94.44	4.72	0.84	56.59	37.58	0.83	0.59	0.27	0.00	3.35	0.79
42	P	C	C	56.24	10.45	16.54	27.93	112.46	-105.59	-66.92	149.40	89.02	5.12	5.86	78.03	6.34	4.48	3.21	2.56	0.00	3.64	1.74
43	R	C	C	121.11	9.19	17.21	26.84	111.19	-117.50	-83.80	126.32	83.15	8.02	8.83	69.71	7.55	5.01	4.43	4.51	0.00	4.27	4.52
44	T	C	C	50.36	15.49	13.43	28.18	101.92	-158.25	-82.40	-16.19	53.80	5.34	40.85	36.31	9.00	9.14	7.61	33.07	0.00	3.49	1.38
45	E	H	G	132.75	3.83	18.58	23.22	97.68	79.32	-76.03	-20.20	44.41	5.75	49.85	16.37	12.11	19.23	8.18	38.73	0.04	4.14	1.20
46	D	H	G	85.90	6.56	18.87	26.02	103.63	48.78	-94.94	35.93	44.65	7.17	48.18	20.59	10.06	16.86	7.17	38.59	0.03	5.35	1.35
47	C	C	C	18.88	21.47	12.53	33.05	111.80	143.29	-86.48	125.34	72.74	13.14	14.13	58.49	7.74	5.74	5.74	8.95	0.01	9.10	4.23
48	V	C	T	59.91	10.46	21.69	32.39	114.36	-164.71	-95.76	130.43	74.14	17.21	8.65	24.50	12.79	38.02	4.79	3.61	0.19	11.09	5.01
49	G	C	T	26.84	10.87	20.98	32.04	103.57	15.07	90.98	-0.03	84.05	9.12	6.83	17.58	25.15	42.42	3.01	3.35	0.07	6.17	2.25
50	C	C	C	21.63	18.99	13.87	32.28	112.12	133.33	-76.08	128.97	94.36	2.17	3.48	84.70	8.60	1.04	3.00	0.56	0.00	0.84	1.25
51	K	H	H	136.72	2.85	20.84	24.14	93.60	-127.80	-62.74	-40.11	14.29	0.20	85.51	2.31	3.22	9.50	81.43	3.24	0.10	0.09	0.11
52	R	H	H	119.07	5.62	20.28	26.45	92.52	50.96	-66.57	-38.31	13.07	0.40	86.53	1.91	2.26	9.71	81.35	4.22	0.16	0.25	0.14
53	C	H	H	7.56	22.31	13.12	35.25	92.77	49.71	-67.34	-40.18	8.41	0.70	90.89	2.87	1.52	4.72	84.62	5.46	0.07	0.59	0.15
54	E	H	H	85.97	12.27	17.03	29.18	91.97	56.65	-63.69	-37.13	8.10	0.65	91.25	2.55	1.21	4.83	85.88	4.77	0.07	0.55	0.14
55	S	H	H	85.92	1.27	21.08	20.62	92.68	52.04	-71.93	-25.73	17.83	0.30	81.87	2.23	1.66	13.99	78.57	3.17	0.07	0.20	0.11
56	A	H	H	41.46	10.88	16.16	27.75	96.70	49.72	-84.88	-23.45	28.79	0.43	70.78	3.02	4.64	21.99	67.98	1.80	0.15	0.17	0.25
57	C	C	C	17.52	19.60	10.07	28.96	114.13	52.35	-117.20	107.72	98.30	0.75	0.96	63.59	33.69	0.96	0.81	0.18	0.00	0.25	0.52
58	P	C	T	89.92	4.12	17.14	22.31	95.28	-160.52	-67.80	-19.38	85.08	1.10	13.83	31.80	16.84	36.29	6.71	7.22	0.00	0.76	0.37
59	T	C	T	78.23	5.77	15.60	22.40	107.95	52.57	-101.33	4.34	76.74	2.94	20.31	13.82	23.52	39.89	10.46	9.25	0.03	2.17	0.87
60	D	C	C	91.05	7.03	17.07	24.88	103.61	-113.63	-74.30	75.33	77.19	4.94	17.87	49.89	13.88	13.05	8.66	9.62	0.00	3.87	1.02
61	F	C	C	67.13	14.44	13.95	28.37	105.16	146.22	-90.65	18.42	63.63	14.86	21.50	48.81	8.74	5.62	14.68	6.95	0.01	13.26	1.95
62	L	C	C	60.02	14.25	14.35	28.57	114.28	88.53	-100.00	126.67	44.33	32.87	22.80	32.05	7.10	5.30	16.39	6.35	0.05	30.64	2.12
63	S	E	E	60.43	6.99	18.07	26.03	120.18	-161.76	-113.07	134.19	37.65	41.82	20.53	30.03	4.35	3.23	14.83	4.97	0.01	41.46	1.12
64	V	E	E	59.25	13.69	12.56	26.50	122.05	-164.36	-117.78	131.17	37.93	44.34	17.73	31.83	3.33	1.94	14.48	2.73	0.00	44.80	0.88
65	R	E	E	136.58	5.39	15.45	22.44	119.26	-161.04	-109.40	130.62	36.99	46.13	16.88	31.46	2.67	1.76	14.00	2.27	0.00	47.16	0.68
66	V	E	E	70.64	10.02	12.02	23.27	118.98	-160.37	-109.63	130.00	37.75	45.09	17.16	32.29	2.66	1.82	13.83	2.50	0.00	46.19	0.71
67	Y	C	E	123.81	6.27	12.63	20.63	117.96	-158.39	-105.87	128.68	42.62	40.55	16.82	35.80	3.35	2.48	13.52	2.68	0.01	41.25	0.91
68	L	C	C	98.07	6.18	11.24	19.11	114.18	-163.04	-103.42	127.97	51.70	31.78	16.52	40.78	5.79	4.22	13.01	3.21	0.01	31.83	1.14
69	W	C	C	157.21	4.73	10.33	16.82	118.59	-160.48	-107.81	139.98	61.74	22.85	15.42	44.44	9.92	6.50	12.13	3.28	0.02	22.42	1.28
70	H	C	C	137.70	3.32	10.19	15.19	115.23	-147.46	-102.02	130.26	66.09	18.18	15.74	46.90	11.14	7.25	12.05	3.82	0.02	17.38	1.43
71	E	C	C	129.46	3.65	9.47	15.03	117.39	-151.75	-99.16	137.30	65.31	15.24	19.45	45.19	11.96	7.53	15.16	4.67	0.04	13.74	1.71
72	T	C	C	94.84	3.63	9.25	14.79	117.85	-154.47	-103.91	137.25	65.21	14.67	20.12	47.73	9.76	6.82	15.97	4.64	0.03	13.24	1.81
73	T	C	C	95.00	3.66	8.89	14.42	118.46	-154.91	-106.77	134.49	62.72	13.95	23.33	46.11	9.02	6.90	18.15	5.50	0.03	12.30	1.98
74	R	C	C	164.03	2.66	9.17	13.64	115.64	-155.78	-100.40	134.98	61.07	12.60	26.34	39.69	10.89	10.17	18.84	7.67	0.06	10.87	1.81
75	S	C	C	80.81	3.07	8.64	13.45	117.18	-142.37	-100.62	138.11	64.08	11.25	24.67	40.82	10.31	12.64	16.40	8.34	0.03	9.63	1.83
76	M	C	C	138.62	2.77	8.33	12.60	107.84	-135.28	-88.93	102.37	69.69	8.55	21.76	32.48	13.61	24.14	13.65	7.78	0.06	6.59	1.69
77	G	C	C	55.77	2.33	9.27	12.90	110.43	-71.77	89.20	107.47	76.37	10.55	13.09	33.79	16.58	27.21	6.55	5.72	0.03	8.54	1.58
78	L	C	C	118.47	3.15	7.20	12.20	114.27	-137.74	-93.12	132.79	69.00	18.63	12.38	48.80	10.71	9.73	6.30	5.78	0.03	15.71	2.95
79	A	C	C	82.70	2.53	8.07	12.40	116.08	-153.79	-98.41	135.47	73.84	16.85	9.31	63.06	3.07	7.65	5.47	3.07	0.00	14.10	3.57
80	Y	C	C	153.03	4.72	10.05	16.43	113.78	-139.79	-94.21	125.96	99.42	0.45	0.14	99.31	0.13	0.11	0.09	0.01	0.00	0.31	0.04