#	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	64.81	14.96	16.65	31.08	118.66	-162.26	-99.33	135.31	99.75	0.22	0.03	99.71	0.10	0.04	0.01	0.00	0.00	0.10	0.03
1	D	C	C	85.37	6.91	18.57	26.21	107.99	-142.81	-87.75	100.14	84.90	9.15	5.95	79.29	1.83	3.95	3.80	1.81	0.00	5.58	3.75
2	C	C	C	34.73	16.51	14.01	30.07	103.26	146.34	-92.18	10.18	72.40	13.51	14.09	50.38	11.10	10.35	7.53	6.64	0.02	9.00	4.98
3	A	C	C	36.12	13.92	14.57	28.55	107.68	80.69	-78.97	101.56	68.55	14.39	17.06	44.91	13.24	10.39	8.74	8.24	0.04	9.74	4.71
4	K	C	C	122.31	5.16	17.79	23.77	108.78	-123.91	-87.73	111.62	68.79	11.68	19.53	43.81	13.70	11.73	9.80	9.44	0.05	7.72	3.76
5	E	C	T	111.48	8.08	15.54	24.43	108.02	-86.21	-70.37	120.88	74.08	7.97	17.95	18.14	14.32	42.03	8.71	8.67	0.12	5.25	2.75
6	G	C	T	38.86	9.18	16.90	26.37	102.87	15.92	85.30	-1.75	82.09	6.13	11.77	22.57	16.61	44.06	4.71	6.19	0.03	4.43	1.39
7	E	C	C	80.06	10.47	17.02	28.06	116.60	125.71	-88.59	138.18	74.79	17.64	7.57	55.63	12.29	6.20	3.45	4.19	0.01	14.06	4.16
8	V	C	C	63.12	11.93	18.11	30.27	115.81	-138.61	-96.81	129.72	53.38	41.28	5.34	38.48	9.00	3.35	3.50	2.21	0.07	24.60	18.80
9	C	C	C	26.63	17.23	14.02	31.10	116.77	-146.52	-95.82	139.95	72.71	22.89	4.39	56.92	9.08	5.64	2.07	2.32	0.01	19.42	4.54
10	S	C	C	63.09	6.98	18.72	26.19	105.64	-143.53	-86.48	4.35	78.54	14.95	6.51	40.12	19.44	20.05	2.22	3.96	0.02	11.18	3.01
11	W	C	T	129.80	9.66	15.58	25.64	102.99	8.87	-84.02	49.98	85.81	5.49	8.70	14.49	23.14	48.51	2.90	5.35	0.03	3.75	1.84
12	G	C	T	39.70	8.35	16.41	25.18	104.99	-11.62	83.89	-4.54	87.40	3.02	9.58	18.28	27.22	42.66	3.31	5.57	0.01	1.81	1.13
13	K	C	C	104.28	8.92	16.69	26.17	110.37	90.49	-91.73	118.13	69.70	12.78	17.53	33.19	21.29	16.67	7.04	9.63	0.10	8.67	3.41
14	K	C	C	105.85	9.37	19.38	28.90	108.33	-114.31	-87.28	96.50	50.85	29.09	20.07	27.38	13.57	12.12	8.60	10.82	0.52	19.77	7.23
15	C	C	C	25.86	17.16	17.00	34.00	115.23	158.62	-102.13	132.83	46.19	32.11	21.70	26.44	11.50	10.53	9.61	11.42	0.47	22.55	7.48
16	C	C	C	23.95	16.96	16.66	33.68	116.64	-139.14	-99.40	131.51	51.10	31.83	17.07	31.50	11.59	9.33	8.34	8.36	0.49	21.82	8.58
17	D	C	C	68.53	9.23	18.90	28.60	108.63	-151.04	-93.69	94.67	69.00	20.71	10.28	47.16	12.82	9.53	4.50	5.62	0.04	15.97	4.36
18	L	C	T	72.00	11.85	14.79	26.89	101.67	100.95	-82.04	6.07	70.36	14.83	14.81	25.24	19.12	27.73	4.74	9.15	0.16	9.12	4.74
19	D	C	T	90.04	5.94	17.14	23.83	99.80	39.77	-84.41	20.53	86.05	3.27	10.68	10.07	17.75	58.29	2.25	8.09	0.01	2.24	1.30
20	N	C	T	91.90	8.34	17.15	26.02	97.24	-69.81	54.17	27.10	87.66	4.81	7.53	19.60	20.79	47.82	1.19	6.00	0.00	3.55	1.05
21	F	C	C	60.94	14.95	16.14	31.01	115.93	134.61	-101.21	134.47	66.74	30.24	3.02	44.92	13.58	7.99	0.98	2.31	0.02	21.78	8.41
22	Y	C	C	95.19	11.86	21.74	33.36	114.56	-148.63	-101.24	124.69	61.57	35.51	2.92	40.38	14.98	6.05	1.26	1.89	0.04	24.90	10.50
23	C	C	C	12.68	21.37	16.38	37.57	120.09	-160.39	-105.49	135.14	78.59	20.18	1.24	57.01	19.77	2.17	0.50	0.76	0.01	15.79	3.98
24	P	C	C	32.69	11.77	19.93	32.97	111.01	-110.72	-66.41	143.55	79.15	17.68	3.17	72.05	4.46	2.26	1.58	1.55	0.00	11.04	7.06
25	M	H	G	88.43	11.14	17.00	28.47	93.79	-119.63	-61.83	-31.55	29.23	1.60	69.17	5.98	5.02	19.19	7.55	60.69	0.02	1.06	0.49
26	E	H	G	110.28	5.20	19.89	25.71	92.24	61.13	-68.17	-26.11	27.12	1.23	71.65	2.90	3.70	20.56	9.22	62.39	0.04	0.86	0.33
27	F	H	G	37.42	16.98	16.29	33.00	97.22	46.83	-84.95	-25.15	23.93	1.56	74.51	4.51	4.13	15.66	14.32	59.80	0.04	1.08	0.46
28	I	H	G	26.54	19.47	14.74	33.54	94.58	67.69	-65.03	-38.96	33.64	3.67	62.70	15.27	7.89	11.36	24.79	37.15	0.18	2.18	1.18
29	P	H	G	70.91	5.65	19.53	25.83	92.31	61.63	-66.16	-27.43	38.88	2.58	58.54	9.76	5.50	22.95	21.09	38.01	0.14	1.77	0.78
30	H	H	G	89.52	8.52	17.43	26.76	96.60	51.13	-88.77	-8.45	41.10	3.94	54.96	9.98	7.08	23.95	18.82	35.87	0.39	2.49	1.40
31	C	C	C	21.47	19.17	10.09	28.37	108.60	93.02	-85.67	112.32	64.87	9.72	25.41	42.85	13.82	7.61	14.97	11.03	0.06	4.81	4.85
32	K	C	T	148.44	2.89	17.26	20.91	96.49	-159.58	-70.32	-22.11	63.47	6.37	30.15	13.70	14.56	35.54	12.75	16.68	0.30	4.20	2.27
33	K	C	T	122.85	5.09	17.10	23.02	99.19	53.61	-87.44	-4.59	62.45	9.78	27.78	14.38	13.37	35.46	10.59	16.35	0.26	7.18	2.42
34	Y	C	C	56.90	18.44	11.24	28.61	114.58	108.35	-92.00	129.24	63.58	16.52	19.90	35.32	15.73	13.24	8.15	11.25	0.16	10.53	5.61
35	K	C	C	103.41	7.44	18.35	26.74	121.45	-160.96	-109.43	138.46	79.80	15.02	5.19	54.41	19.75	5.69	2.48	2.71	0.01	11.52	3.42
36	P	C	C	72.86	9.11	18.00	27.51	107.24	-105.07	-69.66	142.39	80.63	13.66	5.71	49.96	16.59	14.36	1.92	3.71	0.01	11.39	2.06
37	Y	C	C	95.70	13.66	16.60	29.77	112.61	-121.28	-96.99	118.69	72.88	20.59	6.53	46.24	16.87	9.90	2.95	3.73	0.07	13.85	6.38
38	V	C	C	39.90	14.87	15.27	30.56	118.09	-146.29	-101.64	131.98	79.35	16.74	3.91	55.09	21.66	2.78	2.60	1.43	0.03	12.80	3.60
39	P	C	C	63.79	8.50	18.16	27.56	109.95	-109.83	-67.56	141.25	77.77	14.60	7.63	59.77	10.32	7.08	4.50	3.33	0.01	12.47	2.51
40	V	C	C	67.61	12.73	14.65	27.16	106.22	-148.30	-84.61	43.21	70.06	15.54	14.40	42.32	15.51	12.56	7.96	6.65	0.08	10.94	3.98
41	T	C	C	77.17	7.99	16.95	25.32	101.97	73.08	-88.88	-3.57	71.63	12.70	15.67	39.29	19.63	13.39	8.24	7.30	0.07	9.35	2.72
42	T	C	C	65.57	9.31	17.25	26.99	113.60	73.10	-102.98	129.67	70.55	13.47	15.99	34.11	24.03	13.68	8.31	7.17	0.14	9.62	2.94
43	N	C	C	79.65	10.02	19.13	29.21	104.26	-115.76	-85.26	66.50	72.89	13.56	13.55	43.45	17.02	13.21	6.50	6.71	0.06	9.62	3.43
44	C	C	C	25.54	17.80	16.10	33.47	110.37	155.84	-95.41	100.43	67.28	20.70	12.02	47.38	11.16	7.53	6.98	5.40	0.06	12.81	8.68
45	A	C	C	28.46	15.70	16.54	31.95	112.75	52.13	-81.97	140.15	68.87	19.87	11.26	46.97	13.62	7.76	6.78	4.78	0.05	11.38	8.65
46	K	C	C	114.72	6.36	19.44	26.37	115.87	-130.81	-92.78	135.87	72.94	14.94	12.12	41.75	18.16	13.44	5.94	5.82	0.08	8.79	6.04
47	E	C	T	124.30	6.18	16.50	23.84	107.06	-76.15	-63.70	118.81	87.40	4.85	7.75	8.95	11.98	66.47	3.09	4.35	0.04	3.35	1.77
48	G	C	T	42.11	8.07	17.55	26.05	98.27	8.81	85.07	-0.14	92.64	2.73	4.63	12.95	14.32	65.68	1.32	2.95	0.01	2.10	0.67
49	E	C	C	70.14	11.72	17.35	29.67	118.57	123.01	-91.38	140.83	77.91	18.41	3.68	61.01	12.19	3.82	2.00	1.84	0.00	14.05	5.09
50	V	E	C	54.34	13.24	19.18	32.59	115.16	-134.85	-96.56	130.74	47.37	49.56	3.08	35.60	7.68	2.54	1.98	1.30	0.04	27.65	23.21
51	C	C	C	23.98	17.57	16.11	33.43	117.52	-162.40	-101.30	140.50	73.74	23.52	2.75	59.77	9.01	4.83	1.25	1.58	0.00	19.16	4.41
52	G	C	C	30.57	10.65	19.70	30.09	116.61	-137.38	-89.71	-163.52	83.39	13.91	2.70	43.32	24.78	15.91	0.69	2.16	0.01	10.00	3.14
53	W	C	T	142.33	9.34	17.37	26.84	103.84	-35.17	-77.40	71.98	90.67	5.68	3.65	10.38	27.37	53.26	0.59	2.94	0.01	3.75	1.69
54	G	C	T	42.78	7.80	18.23	26.23	100.51	-7.46	85.80	-0.79	93.05	3.90	3.05	14.98	34.11	44.29	0.43	2.56	0.00	2.72	0.90
55	S	C	C	37.19	12.83	16.41	29.72	120.87	117.62	-93.56	146.55	80.94	16.13	2.93	53.40	20.40	7.69	0.84	2.22	0.01	12.01	3.43
56	K	C	C	96.06	10.49	20.83	31.29	113.63	-130.17	-95.28	132.76	54.08	42.10	3.82	39.24	10.37	4.02	1.90	2.22	0.07	28.09	14.09
57	C	C	C	23.05	18.48	16.05	33.97	114.83	-150.30	-96.15	140.58	59.11	37.16	3.73	46.41	8.61	4.67	1.53	2.39	0.04	29.48	6.87
58	C	C	C	36.67	14.49	17.07	31.55	110.73	-87.93	-99.40	118.02	62.85	33.27	3.88	36.54	17.27	10.93	1.18	2.88	0.07	23.54	7.60
59	H	C	T	116.96	6.86	18.25	25.72	100.08	-7.03	-33.49	46.70	89.56	7.73	2.71	9.71	17.95	62.20	0.54	2.17	0.01	5.48	1.95
60	G	C	T	48.62	5.50	18.66	24.90	96.99	-59.77	77.98	9.63	94.44	4.39	1.17	17.65	20.44	56.58	0.13	1.09	0.00	3.55	0.55
61	L	C	C	38.95	16.43	14.54	31.11	121.26	128.46	-100.31	141.37	56.93	42.54	0.53	45.71	8.24	1.83	0.19	0.45	0.00	34.47	9.12
62	D	E	E	72.22	9.09	23.02	32.27	111.31	-133.27	-93.56	120.96	49.55	49.77	0.68	37.75	8.49	1.76	0.28	0.53	0.01	39.91	11.27
63	C	C	C	11.97	22.62	14.75	37.06	121.85	-159.79	-107.11	141.18	71.67	27.80	0.54	58.70	11.19	1.16	0.22	0.41	0.00	24.51	3.81
64	P	C	C	33.10	11.08	19.02	31.56	112.75	-105.54	-65.48	145.22	73.44	25.47	1.09	70.04	2.56	0.80	0.45	0.65	0.00	17.75	7.74
65	L	H	G	98.10	7.87	16.80	25.77	92.64	-117.92	-60.86	-31.69	19.41	0.88	79.71	4.59	3.03	11.60	4.55	75.43	0.00	0.69	0.11
66	A	H	G	66.08	4.95	19.09	24.80	90.92	62.93	-68.21	-21.85	17.95	0.43	81.61	1.98	2.05	13.42	4.51	77.65	0.00	0.33	0.06
67	F	H	G	31.19	18.43	14.91	33.09	97.53	45.42	-93.19	-16.15	14.26	0.36	85.38	2.60	2.04	9.22	7.33	78.45	0.00	0.29	0.06
68	I	H	H	36.92	17.70	14.77	31.93	95.52	80.10	-63.65	-41.84	30.47	1.11	68.43	17.06	8.24	6.58	44.62	22.44	0.02	0.61	0.43
69	P	H	H	73.79	3.42	20.48	23.71	91.92	55.25	-63.77	-35.63	30.35	1.44	68.21	11.96	3.86	13.39	43.72	25.57	0.06	1.06	0.38
70	Y	H	H	77.71	9.35	17.48	27.96	93.89	50.94	-72.84	-29.30	23.52	2.31	74.18	7.59	3.58	11.78	47.45	27.22	0.13	1.68	0.56
71	C	H	H	11.65	20.14	11.28	30.92	95.02	60.19	-71.43	-32.55	25.18	4.56	70.26	16.36	4.65	6.14	51.76	16.74	0.11	2.85	1.38
72	E	H	H	111.36	5.06	15.75	21.97	93.10	60.65	-66.08	-33.93	32.37	4.31	63.32	14.49	4.57	12.81	45.45	18.26	0.18	3.18	1.06
73	K	H	H	140.95	2.03	15.23	17.56	93.50	54.50	-72.08	-26.10	41.14	3.58	55.28	12.99	4.79	21.67	41.21	15.64	0.10	2.70	0.89
74	Y	C	C	92.53	11.44	10.38	22.16	100.32	51.30	-90.41	-1.01	56.52	2.33	41.15	34.22	2.53	20.19	31.99	8.53	0.01	1.30	1.23
75	R	C	C	139.08	7.49	13.65	22.41	107.74	127.90	-76.87	98.52	99.60	0.14	0.26	98.99	0.27	0.34	0.26	0.02	0.00	0.07	0.05