#	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	132.15	3.05	10.47	15.52	116.59	-157.89	-102.12	131.12	99.62	0.36	0.03	99.62	0.09	0.04	0.01	0.00	0.00	0.20	0.03
1	L	C	C	122.13	2.88	7.92	12.97	117.25	-153.66	-100.08	133.86	74.17	17.66	8.18	70.32	1.38	2.74	6.34	1.75	0.00	13.36	4.11
2	S	C	C	83.60	2.50	8.01	12.45	118.48	-154.50	-103.17	139.53	68.37	21.84	9.79	53.70	8.50	4.83	7.02	3.30	0.01	19.34	3.30
3	V	C	C	113.86	3.11	8.59	13.63	114.42	-150.74	-100.04	128.63	54.86	22.24	22.91	37.57	10.38	7.14	13.83	8.94	0.07	19.01	3.07
4	A	C	C	78.11	3.59	9.87	15.17	116.90	-156.17	-102.78	137.21	55.97	19.19	24.83	37.08	10.60	8.88	13.62	10.70	0.06	16.77	2.30
5	S	C	C	78.63	3.81	9.80	15.46	116.39	-145.46	-101.34	134.42	60.63	17.17	22.20	41.27	10.24	9.63	10.65	11.21	0.05	14.36	2.58
6	R	C	C	151.28	4.55	9.58	16.01	112.96	-157.73	-100.32	119.48	68.37	17.41	14.22	45.76	12.23	10.03	7.82	6.72	0.05	12.76	4.62
7	S	C	C	87.81	2.12	10.26	13.72	113.99	-143.15	-101.01	132.02	81.48	11.75	6.77	52.42	19.57	9.27	3.92	3.08	0.01	7.76	3.97
8	G	C	S	44.05	3.08	11.19	15.75	128.90	68.87	117.66	-177.53	86.21	4.96	8.83	34.38	38.17	14.34	3.59	4.72	0.01	2.74	2.05
9	P	C	T	113.40	1.96	11.78	14.59	96.60	-62.10	-70.84	-17.66	84.62	1.58	13.81	12.35	18.98	53.40	5.60	7.93	0.02	0.96	0.76
10	F	C	T	133.76	4.74	10.55	16.72	102.38	55.91	-92.36	8.81	75.80	4.69	19.51	19.59	13.61	42.78	10.16	9.07	0.12	2.65	2.02
11	A	H	C	56.96	7.59	10.01	19.15	107.94	111.16	-78.44	113.08	44.83	4.95	50.22	28.39	7.93	8.83	27.40	22.80	0.03	3.43	1.20
12	P	H	H	96.29	3.61	12.88	17.66	99.26	57.63	-76.00	-0.57	39.81	10.85	49.35	23.77	6.17	9.61	27.81	21.69	0.08	9.56	1.31
13	V	H	H	97.32	4.89	12.42	18.56	103.16	60.01	-89.92	-0.12	26.20	24.85	48.95	15.21	5.17	6.78	28.45	20.08	0.11	22.48	1.72
14	L	E	E	97.88	7.64	10.80	19.57	114.40	84.93	-97.83	122.40	31.02	36.77	32.21	20.20	5.87	5.25	26.33	6.79	0.11	31.39	4.06
15	S	C	E	75.00	4.30	12.93	18.76	118.75	103.59	-108.43	135.50	44.73	32.73	22.54	29.18	7.69	6.81	19.82	4.07	0.05	29.90	2.48
16	A	C	C	72.49	6.24	10.83	18.62	115.39	-132.16	-89.98	135.37	55.58	26.41	18.01	35.43	10.02	8.77	14.82	3.97	0.05	24.77	2.17
17	T	C	C	86.32	5.73	10.82	18.05	116.42	-160.02	-104.86	136.31	62.14	23.36	14.50	39.08	12.28	10.01	10.71	4.29	0.06	20.85	2.73
18	S	C	C	83.12	3.74	11.46	16.83	111.42	-155.68	-100.87	107.29	66.14	23.65	10.20	30.55	23.25	13.16	5.81	4.06	0.06	20.95	2.16
19	R	C	C	154.58	3.76	12.22	17.65	117.60	133.04	-109.82	131.01	60.54	32.08	7.38	30.53	20.34	10.52	3.64	3.37	0.04	29.34	2.22
20	G	C	C	48.30	5.50	11.62	18.75	118.94	-136.23	-100.83	145.96	57.34	38.05	4.62	42.45	9.75	4.89	2.39	2.37	0.01	34.94	3.20
21	V	C	C	80.56	8.84	9.45	19.44	117.65	-141.41	-102.94	131.98	52.17	43.70	4.12	42.24	5.75	2.47	2.67	1.80	0.01	35.13	9.93
22	A	C	C	88.47	2.10	12.52	15.78	112.35	-137.25	-83.77	131.37	73.62	21.87	4.51	35.86	24.07	14.60	1.49	2.84	0.01	19.47	1.66
23	G	C	S	51.33	2.46	13.20	16.63	122.74	13.73	116.69	-176.20	81.19	14.35	4.46	20.21	44.08	17.42	0.99	3.07	0.01	12.94	1.26
24	A	C	C	80.13	3.32	13.18	17.74	114.70	-56.20	-84.25	142.85	80.98	14.33	4.69	56.06	17.47	7.24	1.07	3.61	0.00	13.25	1.30
25	L	C	C	85.15	11.68	9.11	21.11	116.37	-129.86	-90.59	133.60	65.81	31.25	2.94	55.75	7.32	2.18	1.11	1.85	0.00	28.88	2.90
26	R	E	E	150.01	3.47	15.65	20.42	120.56	-160.72	-113.74	134.05	49.16	49.59	1.25	41.32	6.67	0.78	0.76	0.56	0.00	46.77	3.13
27	P	E	E	84.68	8.05	12.18	21.60	113.39	-110.91	-68.34	139.18	39.55	57.97	2.48	35.66	2.46	0.85	1.29	1.14	0.00	53.23	5.35
28	L	C	C	97.45	7.30	13.22	21.53	100.68	-161.61	-89.15	-25.50	69.72	24.11	6.17	35.36	30.46	5.30	2.68	3.25	0.03	21.01	1.90
29	V	C	C	73.02	8.50	12.40	22.00	126.53	17.26	-131.20	139.16	60.58	32.11	7.31	30.39	27.56	5.28	3.29	3.87	0.05	25.59	3.98
30	Q	C	C	126.91	3.57	15.25	20.03	114.19	-130.82	-91.31	133.73	69.15	21.78	9.07	58.00	7.01	3.84	3.01	5.99	0.01	19.87	2.27
31	A	C	C	57.28	10.36	11.30	22.30	115.65	-123.96	-84.38	141.74	73.58	17.07	9.34	50.06	15.94	8.14	2.59	6.77	0.02	14.03	2.45
32	A	C	C	65.24	6.30	13.92	21.61	117.48	-139.81	-100.81	135.13	73.99	18.78	7.23	51.18	16.87	6.14	2.08	5.39	0.02	13.49	4.83
33	L	C	C	94.45	7.12	12.04	20.82	118.88	-137.66	-100.98	133.31	89.55	9.58	0.88	70.10	18.46	1.12	0.32	0.62	0.00	7.53	1.86
34	P	C	C	74.42	7.10	10.97	19.72	113.42	-109.41	-67.81	146.83	89.56	6.94	3.50	76.73	7.24	5.26	0.92	2.66	0.00	5.12	2.07
35	A	C	C	81.52	3.46	11.10	16.26	107.77	-120.02	-80.31	116.68	88.27	6.09	5.64	61.65	15.35	10.82	1.27	4.74	0.00	3.60	2.56
36	T	C	C	99.69	3.20	10.20	14.97	112.50	22.11	-98.42	124.64	89.03	4.38	6.59	56.95	17.56	14.06	1.26	5.76	0.00	2.33	2.07
37	S	C	C	78.88	3.65	9.73	15.10	107.88	-156.26	-88.40	78.48	91.13	2.21	6.66	33.85	28.93	28.43	0.93	5.85	0.00	1.23	0.79
38	E	C	C	148.96	2.00	12.26	14.97	105.15	42.36	-89.72	34.06	91.38	3.30	5.32	35.94	31.62	23.93	0.70	4.85	0.00	2.00	0.97
39	S	C	C	63.66	6.46	11.76	19.75	118.11	51.07	-100.69	135.15	91.21	7.27	1.52	63.81	25.84	1.88	0.44	1.11	0.00	5.09	1.83
40	P	C	C	64.01	10.29	11.62	22.91	113.94	-115.67	-71.67	145.47	85.19	12.74	2.07	80.27	3.48	1.34	0.78	1.20	0.00	10.18	2.74
41	V	C	C	88.25	6.52	15.64	23.57	116.71	-141.94	-100.26	131.56	63.52	33.28	3.20	49.91	10.75	1.75	2.07	1.50	0.03	21.70	12.29
42	L	C	C	58.93	14.33	10.58	25.00	118.47	-147.44	-99.46	134.73	67.11	29.44	3.45	54.83	10.26	1.45	2.24	1.52	0.01	20.68	9.01
43	D	C	C	81.08	4.32	16.62	21.87	109.18	-131.32	-86.23	115.40	87.99	9.21	2.80	83.33	3.37	1.31	1.26	1.22	0.00	7.57	1.93
44	A	C	T	61.47	10.07	10.14	21.15	94.48	-156.15	-65.88	-18.65	68.39	3.68	27.93	26.14	10.90	32.14	7.90	19.34	0.02	2.61	0.94
45	K	C	T	156.06	1.70	14.39	16.23	94.55	63.89	-78.48	-12.00	65.76	5.19	29.06	19.38	13.08	34.66	8.04	19.86	0.08	3.48	1.42
46	R	C	C	130.76	5.63	12.85	19.84	111.94	65.24	-91.62	118.44	65.20	7.68	27.12	31.69	25.54	9.78	8.78	17.06	0.05	5.21	1.90
47	S	C	C	58.21	9.29	13.63	23.72	113.53	-123.68	-86.35	132.59	71.09	13.79	15.12	55.95	8.94	6.03	7.43	7.77	0.01	11.26	2.60
48	F	C	C	89.86	11.36	13.88	25.80	113.82	-153.15	-98.97	126.06	57.57	29.15	13.28	43.36	8.42	5.42	7.76	5.97	0.09	21.81	7.18
49	L	C	C	84.10	8.81	15.60	25.23	113.60	-158.54	-97.66	123.39	57.62	30.29	12.09	41.49	9.94	5.78	7.39	5.21	0.09	23.09	7.00
50	C	C	C	45.66	12.91	11.73	25.02	121.74	-157.36	-109.68	146.82	67.70	20.84	11.47	48.49	11.78	7.12	6.79	4.97	0.04	17.30	3.51
51	R	C	C	161.14	3.85	16.42	21.28	99.43	-153.53	-90.25	-8.55	65.13	15.43	19.45	31.19	23.38	11.84	12.49	6.54	0.24	11.29	3.03
52	E	C	C	111.67	4.69	15.92	21.87	121.76	75.21	-104.44	145.52	58.16	17.71	24.14	26.71	20.89	12.08	15.33	8.21	0.43	12.93	3.41
53	S	C	C	51.78	9.51	13.70	24.13	117.24	-117.01	-91.06	144.00	64.12	14.35	21.53	48.33	8.01	7.47	13.38	8.33	0.03	10.41	4.04
54	L	C	C	67.75	12.56	12.06	24.95	97.83	-135.73	-82.50	-0.79	58.70	9.71	31.59	33.38	10.21	15.42	16.42	14.74	0.15	5.42	4.24
55	S	C	T	66.15	6.77	14.32	22.03	99.50	79.78	-78.08	7.10	59.91	4.83	35.26	14.55	12.29	32.89	15.82	18.74	0.45	2.55	2.72
56	G	C	T	53.17	3.45	14.49	19.04	99.88	-58.76	78.12	0.31	65.20	2.73	32.07	13.16	15.33	37.14	12.15	18.96	0.19	1.42	1.65
57	Q	C	T	112.56	4.73	13.28	19.33	103.51	93.56	-90.07	-3.58	68.30	5.57	26.12	21.76	20.72	27.15	10.95	13.22	0.31	2.59	3.30
58	A	C	C	49.57	9.52	9.46	19.90	115.11	74.72	-97.75	128.74	79.00	8.96	12.04	42.48	21.56	14.88	5.09	6.35	0.05	3.26	6.34
59	A	C	T	80.94	3.53	11.93	16.90	105.76	-119.24	-70.02	105.05	93.20	1.53	5.27	13.93	13.54	65.52	1.53	3.66	0.00	0.87	0.96
60	G	C	T	61.44	1.56	13.93	15.66	101.30	11.74	69.33	2.20	95.23	1.56	3.22	11.22	20.28	63.60	0.52	2.77	0.00	1.04	0.57
61	R	C	S	125.72	5.70	12.03	19.49	123.60	86.90	-112.50	142.06	92.82	6.66	0.52	41.93	50.08	1.30	0.14	0.34	0.00	3.14	3.08
62	P	C	C	85.12	4.98	15.07	21.30	114.40	-104.83	-69.31	148.61	92.71	7.06	0.23	84.01	7.64	0.93	0.05	0.21	0.00	5.83	1.33
63	L	C	C	67.17	14.48	11.94	26.34	115.41	-111.09	-85.50	135.76	72.77	26.58	0.65	67.76	3.94	0.62	0.19	0.40	0.00	24.89	2.19
64	V	E	E	71.88	8.40	17.86	27.49	124.21	-165.33	-119.05	136.40	32.67	66.45	0.88	28.47	3.29	0.36	0.52	0.30	0.00	61.71	5.36
65	A	E	E	40.89	14.90	14.59	29.65	124.20	-163.03	-116.70	138.53	25.27	73.03	1.70	21.06	2.85	0.49	0.99	0.47	0.00	71.26	2.89
66	S	E	E	50.68	9.15	17.59	27.85	128.45	-171.91	-124.70	146.56	32.88	65.82	1.30	27.54	3.57	0.73	0.68	0.54	0.00	63.51	3.44
67	V	C	C	72.74	10.20	14.47	25.60	125.81	-166.82	-121.71	140.94	63.76	35.18	1.06	47.28	14.43	1.89	0.37	0.66	0.00	32.87	2.50
68	G	C	C	31.76	7.05	15.12	23.31	127.84	9.61	-99.89	172.46	83.04	16.25	0.71	61.64	18.35	3.15	0.15	0.68	0.00	12.83	3.19
69	L	C	T	118.88	4.71	13.01	18.93	96.63	-83.45	-70.93	-20.28	94.26	4.47	1.27	10.49	23.70	60.02	0.14	1.30	0.00	3.44	0.90
70	N	C	T	125.30	2.11	15.18	17.39	99.69	33.35	-96.31	11.66	96.56	2.60	0.84	10.29	24.18	61.94	0.06	0.98	0.00	2.15	0.41
71	V	C	S	61.57	10.02	10.13	21.44	119.80	104.54	-101.43	136.98	90.70	8.86	0.45	38.37	51.59	1.31	0.12	0.32	0.00	4.60	3.69
72	P	C	C	88.55	3.88	15.63	20.51	113.02	-115.95	-68.63	148.10	92.68	6.53	0.79	76.27	11.77	4.28	0.12	0.90	0.00	5.40	1.27
73	A	C	C	52.28	11.19	12.15	23.93	116.11	-126.57	-90.44	141.69	81.35	17.13	1.52	61.03	13.89	5.82	0.21	1.64	0.00	15.36	2.06
74	S	E	E	55.20	8.44	15.43	25.06	127.96	-166.78	-128.76	148.57	49.04	49.35	1.61	38.52	7.80	2.72	0.35	1.41	0.00	44.01	5.17
75	V	E	E	65.70	11.79	13.01	25.68	123.19	-156.86	-119.66	134.87	38.14	60.88	0.99	32.48	4.06	0.98	0.43	0.66	0.00	55.06	6.33
76	R	E	E	129.66	6.09	14.46	22.15	121.69	-154.92	-109.47	136.58	47.93	51.59	0.48	45.20	1.20	0.55	0.19	0.26	0.00	47.72	4.87
77	Y	C	C	107.86	11.04	13.31	24.85	115.46	-141.60	-91.60	132.51	99.16	0.82	0.02	99.23	0.11	0.04	0.00	0.00	0.00	0.57	0.05