#	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	122.41	4.34	10.58	16.62	113.10	-166.52	-94.99	122.84	99.35	0.26	0.39	99.16	0.19	0.18	0.26	0.03	0.00	0.12	0.05
1	A	C	C	83.68	2.34	9.26	13.13	109.43	-141.69	-82.19	126.19	67.27	5.04	27.69	60.32	1.65	5.96	22.49	4.57	0.00	3.45	1.56
2	A	C	C	85.90	2.07	7.75	11.41	108.91	-127.84	-85.52	109.41	56.43	8.33	35.25	38.26	8.76	9.62	26.81	8.57	0.05	5.95	1.98
3	L	C	C	125.06	2.42	7.94	12.00	108.92	-135.82	-89.11	100.10	49.31	7.86	42.83	32.05	8.03	9.43	29.83	13.06	0.05	5.76	1.78
4	A	C	H	82.88	2.54	8.65	12.84	110.05	-140.25	-90.56	118.17	48.32	5.56	46.12	25.80	8.33	14.27	30.14	16.01	0.08	3.87	1.48
5	G	C	H	55.03	2.53	9.47	13.34	111.59	-145.74	-94.62	128.25	55.63	4.61	39.76	24.72	10.54	20.75	25.49	13.92	0.15	2.95	1.48
6	F	C	C	154.24	2.52	8.94	13.02	110.88	-58.31	-93.42	115.35	53.74	6.22	40.04	31.90	12.01	10.92	30.37	8.96	0.11	3.83	1.89
7	M	H	H	127.29	3.06	8.80	13.72	114.00	-149.40	-95.11	132.20	43.82	4.00	52.18	30.37	8.84	6.01	42.55	8.55	0.03	2.79	0.86
8	P	H	H	98.43	3.01	9.50	14.18	112.46	-118.67	-80.55	139.12	39.61	4.98	55.41	28.04	5.43	6.73	43.68	11.17	0.02	4.10	0.83
9	A	H	H	80.75	3.04	9.27	14.02	112.24	-129.90	-86.47	129.32	32.77	8.40	58.83	21.01	5.59	7.20	44.37	13.41	0.08	7.09	1.25
10	I	H	H	123.28	3.06	8.92	13.78	112.46	-152.51	-95.27	120.64	32.95	12.81	54.23	20.70	6.06	7.80	42.30	10.34	0.15	10.72	1.93
11	L	H	H	124.54	2.56	9.46	13.72	114.09	-152.01	-96.86	126.98	41.75	13.29	44.97	25.64	7.83	9.69	36.52	7.41	0.19	10.20	2.51
12	S	C	C	81.60	3.08	9.86	14.63	114.50	-154.69	-98.10	131.30	56.07	9.75	34.17	31.40	11.75	13.30	28.41	5.91	0.15	6.88	2.20
13	S	C	C	81.05	3.69	9.92	15.38	112.49	-145.33	-94.80	122.00	62.37	7.78	29.85	32.54	15.34	14.93	23.42	6.53	0.12	5.15	1.97
14	T	C	C	99.44	3.28	11.21	16.19	112.37	-161.66	-98.29	116.18	63.29	8.02	28.69	36.58	14.73	12.25	21.96	6.97	0.08	5.49	1.94
15	A	C	C	71.75	5.27	11.20	18.11	115.16	-142.17	-91.64	136.43	60.91	10.57	28.52	40.50	10.50	9.63	20.85	8.28	0.05	8.07	2.12
16	A	C	C	69.62	6.19	11.34	19.09	117.44	-150.75	-100.15	137.09	54.86	18.08	27.06	35.19	10.39	9.37	19.38	8.10	0.13	14.64	2.80
17	V	C	C	94.08	5.43	12.27	19.46	118.27	-159.40	-105.08	134.15	47.80	28.51	23.70	31.58	9.04	7.50	17.84	6.37	0.28	22.78	4.62
18	A	C	C	61.42	7.53	12.19	21.20	118.08	-151.17	-99.94	137.04	56.85	25.29	17.86	40.71	8.85	6.51	13.79	5.03	0.12	21.47	3.52
19	T	C	C	75.87	7.04	12.18	20.72	117.39	-161.74	-103.67	132.76	63.01	23.67	13.32	43.11	11.34	8.17	9.55	4.57	0.08	18.99	4.21
20	E	C	C	123.76	4.64	12.92	19.06	110.11	-133.16	-88.91	115.88	70.47	17.15	12.38	30.39	17.05	24.66	6.75	5.25	0.15	12.29	3.46
21	G	C	C	45.05	5.48	12.07	18.78	109.46	11.06	84.04	6.38	84.01	8.58	7.41	31.38	23.65	30.31	2.37	4.48	0.02	5.71	2.09
22	T	C	C	86.18	4.61	10.93	17.05	107.05	65.99	-90.91	45.77	80.33	11.63	8.04	34.76	24.76	22.28	2.42	5.07	0.03	6.79	3.90
23	N	C	C	115.18	3.11	11.48	15.88	102.13	44.96	-76.36	27.68	81.49	10.32	8.19	34.91	26.92	21.07	2.21	5.57	0.03	5.75	3.55
24	E	C	T	114.39	4.48	10.56	16.63	115.87	119.26	-90.33	137.42	65.05	10.35	24.60	21.66	20.88	25.22	4.73	17.98	0.15	5.61	3.77
25	W	C	T	188.97	2.39	11.86	15.35	100.18	-99.27	-76.69	-16.75	69.84	6.42	23.74	10.69	15.00	44.47	3.88	19.38	0.08	4.32	2.17
26	F	C	T	126.84	4.90	12.50	18.53	103.94	45.07	-95.97	12.63	66.16	12.11	21.73	14.96	14.83	37.60	4.19	16.67	0.16	8.25	3.35
27	G	C	C	29.02	8.68	14.05	23.83	119.28	-141.51	82.49	167.26	68.36	24.25	7.38	37.29	19.50	13.40	2.61	4.76	0.08	15.83	6.53
28	V	C	C	63.92	10.32	12.26	23.58	115.91	-81.55	-104.32	129.99	55.96	37.13	6.91	35.14	12.18	7.60	3.84	3.41	0.28	21.44	16.12
29	D	C	C	95.67	4.70	15.32	21.15	103.22	-163.44	-95.59	12.05	76.39	16.57	7.04	46.45	19.14	10.94	3.64	3.45	0.04	11.87	4.47
30	D	C	C	58.56	7.20	12.98	21.95	120.57	95.89	-114.86	137.15	85.59	4.35	10.06	51.87	29.30	4.17	9.29	1.56	0.01	1.84	1.96
31	L	H	H	114.41	3.49	13.71	18.63	93.20	-132.99	-64.52	-30.98	15.01	0.42	84.57	3.88	4.12	8.21	81.57	1.73	0.10	0.19	0.19
32	R	H	H	145.54	2.25	15.36	17.97	92.19	55.82	-65.87	-39.79	7.48	0.41	92.11	1.80	1.18	4.94	89.94	1.65	0.10	0.26	0.13
33	L	H	H	53.69	8.87	13.20	23.56	92.61	50.22	-65.83	-41.30	2.83	0.27	96.90	0.88	0.39	1.69	95.45	1.31	0.03	0.22	0.04
34	L	H	H	71.51	6.31	14.82	22.68	91.94	51.77	-64.30	-41.21	1.30	0.15	98.55	0.48	0.16	0.68	97.91	0.63	0.01	0.12	0.02
35	A	H	H	58.75	2.15	17.26	18.93	91.77	50.59	-63.97	-42.01	0.63	0.05	99.33	0.17	0.06	0.37	98.96	0.41	0.00	0.04	0.00
36	V	H	H	73.26	3.69	16.41	20.82	91.99	49.53	-64.83	-42.05	0.49	0.06	99.45	0.09	0.04	0.33	99.06	0.43	0.00	0.05	0.00
37	L	H	H	69.32	7.21	14.50	23.05	91.91	50.25	-65.14	-41.18	0.88	0.05	99.07	0.09	0.05	0.68	98.54	0.60	0.00	0.03	0.00
38	F	H	H	120.98	2.66	16.40	19.29	92.46	48.74	-65.73	-40.04	3.45	0.08	96.47	0.23	0.20	3.02	95.68	0.78	0.02	0.05	0.02
39	L	H	H	100.50	1.75	16.55	17.46	92.64	49.46	-66.35	-39.16	8.16	0.09	91.75	0.65	0.61	6.71	91.33	0.60	0.03	0.04	0.03
40	G	H	H	31.10	4.77	14.47	20.60	93.39	51.07	-65.77	-40.48	8.52	0.13	91.35	2.11	1.25	4.84	91.14	0.55	0.01	0.06	0.05
41	H	H	H	98.46	4.81	14.88	20.85	92.69	52.04	-64.53	-40.66	2.69	0.04	97.27	0.63	0.29	1.66	96.77	0.61	0.00	0.02	0.01
42	W	H	H	155.27	2.04	16.31	18.11	92.50	50.11	-65.41	-40.72	0.89	0.01	99.10	0.14	0.07	0.63	98.66	0.49	0.00	0.00	0.00
43	A	H	H	58.64	2.66	15.83	18.64	92.35	50.01	-65.09	-41.61	0.75	0.01	99.25	0.11	0.06	0.55	98.81	0.46	0.00	0.01	0.00
44	I	H	H	83.57	3.99	15.28	20.09	92.06	49.36	-64.63	-42.19	0.41	0.01	99.58	0.05	0.03	0.31	99.30	0.30	0.00	0.00	0.00
45	L	H	H	84.21	3.69	15.25	19.90	91.83	49.77	-64.15	-41.33	0.30	0.00	99.70	0.03	0.01	0.23	99.37	0.36	0.00	0.00	0.00
46	S	H	H	58.93	2.45	15.02	17.87	91.98	50.96	-64.30	-40.89	0.58	0.00	99.42	0.04	0.03	0.49	98.96	0.49	0.00	0.00	0.00
47	L	H	H	96.16	2.31	15.27	17.60	92.13	50.09	-65.25	-40.76	1.18	0.00	98.82	0.06	0.05	1.06	98.29	0.54	0.00	0.00	0.00
48	W	H	H	131.15	3.88	13.83	18.77	92.83	49.14	-66.70	-38.82	3.07	0.01	96.91	0.23	0.21	2.56	95.99	0.98	0.01	0.01	0.00
49	L	H	H	91.01	3.94	12.65	17.99	93.90	50.93	-67.96	-34.57	8.93	0.09	90.98	1.15	1.00	6.88	88.83	2.00	0.05	0.04	0.04
50	G	H	H	49.62	2.20	13.21	15.99	95.10	53.70	-69.18	-29.50	22.42	0.22	77.36	3.01	2.47	17.20	73.80	3.20	0.10	0.10	0.13
51	S	H	H	79.67	2.27	12.12	14.94	98.06	54.47	-79.99	-19.44	36.87	0.57	62.56	6.75	5.43	25.54	57.74	3.80	0.15	0.25	0.34
52	Y	C	H	149.22	3.37	10.62	15.39	104.00	49.61	-97.80	6.68	55.36	2.49	42.14	18.26	12.68	26.73	35.85	3.93	0.19	1.04	1.30
53	G	C	C	46.90	4.02	10.49	16.10	116.89	98.61	-97.11	171.71	84.74	2.17	13.09	36.36	16.88	32.29	8.90	3.51	0.01	1.02	1.02
54	D	C	C	114.12	2.13	11.10	14.55	112.13	-95.33	-93.51	118.54	90.57	2.06	7.37	51.29	20.57	19.14	3.50	3.42	0.00	0.97	1.13
55	S	C	C	72.43	5.03	8.40	15.19	111.98	-149.72	-91.19	126.28	92.51	1.83	5.66	58.31	22.59	11.68	2.29	3.18	0.00	0.86	1.09
56	N	C	C	113.42	2.66	10.07	14.14	107.40	-144.88	-92.35	99.51	90.73	1.67	7.60	65.02	14.72	10.85	3.10	4.48	0.00	0.84	0.99
57	E	C	C	131.35	3.39	9.00	14.15	105.28	101.32	-84.72	56.25	77.64	1.90	20.47	44.75	14.57	18.20	7.63	12.84	0.00	0.93	1.08
58	D	C	C	109.41	2.47	9.73	13.64	106.55	70.60	-89.76	68.26	74.50	1.94	23.56	41.28	13.97	19.22	9.16	14.35	0.01	0.97	1.04
59	E	C	C	120.75	4.12	9.43	15.38	112.54	139.95	-91.48	126.53	69.47	2.52	28.02	41.61	14.80	13.01	12.45	15.62	0.01	1.30	1.20
60	D	C	C	99.18	3.63	10.49	15.75	111.71	-150.44	-91.39	119.37	72.07	3.64	24.30	47.45	12.26	11.97	13.47	11.24	0.01	2.10	1.51
61	F	C	C	128.38	5.47	9.20	16.20	106.41	-169.36	-93.20	34.53	65.97	8.58	25.46	41.17	12.04	12.88	16.19	9.40	0.07	5.14	3.12
62	F	C	C	139.40	3.62	9.91	15.12	108.21	103.13	-97.16	74.86	59.28	11.27	29.46	30.10	11.53	18.50	19.94	9.11	0.20	7.38	3.24
63	G	C	C	47.55	3.62	11.08	16.16	114.88	42.90	90.58	-105.52	62.36	8.97	28.67	28.08	15.71	19.76	18.80	9.17	0.16	6.17	2.14
64	E	C	C	137.73	2.46	11.85	15.34	109.23	-64.37	-88.07	103.26	54.73	11.33	33.94	30.97	12.74	11.78	24.62	9.04	0.17	8.22	2.47
65	I	C	H	100.12	5.40	9.30	16.43	114.98	-140.07	-93.46	128.59	48.72	14.01	37.27	28.64	11.73	9.80	29.16	7.09	0.25	9.90	3.45
66	D	C	C	84.56	4.26	10.53	16.42	109.12	-147.12	-89.41	108.55	59.29	7.13	33.57	42.36	8.53	8.45	27.80	5.82	0.03	5.26	1.76
67	Y	H	H	140.20	4.13	9.66	15.59	97.64	-161.56	-75.06	-20.09	46.07	4.72	49.21	24.63	8.75	14.22	35.28	12.45	0.13	2.99	1.55
68	S	H	H	72.54	2.74	9.65	13.86	96.31	67.32	-72.61	-26.19	47.41	2.61	49.98	19.09	9.68	19.81	33.59	15.13	0.13	1.46	1.10
69	A	C	H	77.89	2.59	8.20	12.40	98.42	65.40	-78.17	-11.33	53.58	3.31	43.11	23.26	11.45	20.23	26.81	14.92	0.12	1.80	1.41
70	R	C	C	166.73	2.10	7.97	11.67	103.85	76.54	-84.26	18.74	70.76	3.03	26.22	52.44	3.36	15.72	18.44	6.78	0.00	1.73	1.52
71	K	C	C	150.89	2.20	10.18	13.89	108.01	74.52	-85.45	105.68	99.77	0.11	0.11	99.50	0.16	0.18	0.08	0.01	0.00	0.06	0.02