#	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	117.63	5.30	10.97	18.01	114.70	-154.42	-95.11	129.82	99.71	0.28	0.01	99.70	0.09	0.03	0.00	0.00	0.00	0.14	0.03
1	T	C	C	89.83	4.24	9.36	15.51	117.65	-157.02	-98.84	140.09	89.20	9.13	1.67	86.78	1.36	1.70	0.84	0.58	0.00	4.85	3.88
2	K	C	C	155.61	2.07	10.12	13.75	110.95	-128.55	-87.79	126.08	84.89	9.55	5.56	50.36	19.47	15.65	2.34	3.03	0.01	5.84	3.30
3	G	C	C	45.42	4.93	10.26	16.71	115.32	0.42	97.91	-42.71	85.37	5.80	8.83	35.16	31.86	19.43	4.16	4.05	0.02	3.26	2.06
4	T	C	C	82.77	5.27	10.74	17.36	109.86	-59.48	-85.20	124.73	76.93	5.58	17.49	53.71	15.38	7.40	12.10	5.79	0.01	2.76	2.84
5	Q	C	H	129.70	2.88	12.01	16.22	98.08	-116.21	-74.67	-23.66	48.29	3.62	48.10	24.48	9.96	14.66	27.33	20.10	0.11	2.14	1.22
6	S	H	H	71.40	3.98	11.99	17.23	101.38	59.23	-87.13	-4.28	42.84	3.19	53.98	18.67	8.48	16.42	31.74	21.51	0.15	1.98	1.05
7	F	H	H	105.75	7.40	10.97	19.58	99.50	72.73	-85.22	-16.61	38.47	3.28	58.26	16.39	8.57	14.54	35.91	21.23	0.20	1.96	1.19
8	G	H	H	36.20	6.38	12.27	20.03	101.88	57.66	4.78	-50.08	47.42	3.05	49.54	22.90	10.54	15.79	33.95	13.76	0.12	1.71	1.24
9	M	H	H	123.53	3.28	12.88	17.26	99.84	39.18	-79.47	-15.22	47.79	4.24	47.98	22.72	11.46	15.65	32.04	13.86	0.19	2.43	1.64
10	R	C	H	143.84	4.24	11.64	17.36	105.49	64.86	-83.05	38.20	51.83	4.94	43.23	25.20	11.85	16.60	28.57	12.78	0.18	2.73	2.09
11	H	C	C	121.66	5.53	11.16	18.03	104.31	72.75	-87.07	33.11	66.16	4.14	29.69	32.33	13.33	21.13	19.91	9.16	0.07	2.07	1.99
12	N	C	C	99.15	4.77	12.40	18.63	108.91	86.50	-97.43	82.56	80.68	3.22	16.09	37.27	19.46	24.56	9.07	6.48	0.02	1.57	1.56
13	K	C	C	126.06	5.97	12.66	20.04	104.06	-149.20	-86.99	37.77	85.34	5.18	9.48	38.94	26.86	20.53	3.46	5.33	0.01	2.75	2.11
14	S	C	C	64.06	6.40	14.31	21.86	105.52	111.85	-95.38	24.18	84.98	9.87	5.16	48.00	23.33	14.23	1.21	3.87	0.00	7.06	2.30
15	H	C	C	84.99	10.74	14.48	25.86	120.75	82.24	-108.97	136.20	70.60	27.60	1.80	53.12	13.51	3.71	0.39	1.49	0.00	25.72	2.06
16	T	E	E	44.59	11.35	16.65	29.16	122.97	-159.17	-111.77	139.22	39.64	59.78	0.59	32.93	6.09	0.97	0.16	0.45	0.00	57.71	1.68
17	I	E	E	74.56	8.80	18.92	28.66	117.61	-136.26	-98.68	134.29	7.56	92.33	0.11	6.32	0.48	0.03	0.11	0.03	0.00	54.55	38.47
18	C	C	C	13.15	17.96	11.04	29.86	109.54	-117.20	-73.72	125.48	79.99	19.96	0.04	81.15	0.47	0.05	0.01	0.02	0.00	16.12	2.18
19	R	C	T	148.76	4.15	17.12	22.63	93.38	-153.28	-68.50	-27.39	99.68	0.09	0.23	0.26	2.79	96.69	0.01	0.19	0.00	0.05	0.02
20	R	C	T	134.00	4.93	15.85	21.95	99.59	45.68	-81.45	-40.07	99.73	0.03	0.24	0.05	1.41	98.38	0.00	0.14	0.00	0.01	0.00
21	C	C	T	59.54	6.60	14.04	22.24	102.23	21.18	-108.30	-13.77	99.78	0.04	0.18	0.16	1.90	97.79	0.00	0.13	0.00	0.02	0.00
22	G	C	C	44.12	4.60	15.60	21.50	94.77	-118.81	82.50	6.20	99.07	0.79	0.13	83.23	8.88	6.93	0.04	0.10	0.00	0.44	0.39
23	K	C	C	84.64	7.88	14.82	24.46	119.23	138.21	-79.10	147.06	93.16	6.81	0.04	84.87	8.21	0.23	0.01	0.03	0.00	5.57	1.08
24	R	E	E	123.96	8.58	18.58	27.98	116.83	-131.66	-97.65	134.45	11.82	88.14	0.04	10.80	0.97	0.04	0.03	0.02	0.00	65.04	23.10
25	S	E	E	20.21	15.01	17.42	33.03	136.11	166.42	-141.46	158.51	31.10	68.87	0.03	27.91	2.25	0.07	0.00	0.03	0.00	69.34	0.40
26	F	E	E	55.94	12.39	18.88	32.37	127.65	-145.32	-126.41	143.80	12.35	87.54	0.11	10.46	1.72	0.15	0.04	0.08	0.00	76.49	11.06
27	H	E	E	51.97	11.32	16.66	29.42	112.59	-123.19	-88.06	127.48	26.95	72.78	0.27	24.29	1.52	0.25	0.13	0.15	0.00	63.38	10.29
28	I	C	T	80.85	10.07	15.11	26.15	96.14	-151.10	-72.91	-27.68	81.19	14.71	4.10	10.78	22.28	49.18	0.37	3.94	0.02	12.18	1.25
29	Q	C	T	122.48	2.80	16.85	19.75	100.83	46.72	-87.89	-25.63	78.95	15.65	5.41	7.74	20.00	52.11	0.73	4.82	0.02	12.02	2.55
30	K	C	T	106.26	5.43	16.67	22.62	120.57	18.63	-114.32	137.70	94.31	1.50	4.19	7.75	16.63	69.16	0.66	4.35	0.00	1.10	0.35
31	S	C	T	50.40	11.33	15.79	27.69	99.59	-121.00	-77.72	52.75	96.22	3.18	0.61	9.15	14.88	72.04	0.06	0.66	0.00	2.98	0.22
32	T	E	E	49.08	7.89	20.79	29.77	131.16	110.07	-126.52	151.84	6.94	93.02	0.05	5.49	1.19	0.09	0.03	0.02	0.00	59.68	33.49
33	C	E	E	12.32	18.72	13.26	32.80	112.25	-110.04	-76.44	131.73	25.12	74.85	0.03	25.13	0.38	0.03	0.02	0.01	0.00	60.46	13.97
34	A	C	T	52.30	8.67	18.29	28.16	93.16	-144.26	-68.64	-27.90	99.59	0.18	0.23	0.39	1.88	97.40	0.00	0.18	0.00	0.11	0.03
35	C	C	T	76.81	6.05	18.76	25.58	98.91	45.16	-83.43	-38.95	99.76	0.03	0.21	0.04	0.76	99.06	0.00	0.12	0.00	0.01	0.01
36	C	C	T	57.80	7.55	16.53	25.34	102.67	20.17	-109.47	-11.01	99.76	0.04	0.20	0.09	1.18	98.60	0.00	0.10	0.00	0.02	0.01
37	G	C	C	36.82	7.24	16.78	25.27	95.26	-116.19	82.19	6.81	98.43	1.46	0.11	77.69	10.51	10.31	0.03	0.07	0.00	0.69	0.71
38	Y	C	C	76.35	10.28	14.38	26.23	117.95	140.59	-77.61	142.65	89.13	10.72	0.14	79.87	9.39	0.21	0.10	0.07	0.00	7.83	2.53
39	P	E	B	69.43	6.58	18.88	26.16	113.61	-102.92	-66.38	149.85	15.29	83.89	0.82	11.32	1.23	0.32	0.56	0.24	0.01	22.19	64.13
40	A	C	C	41.65	13.34	12.50	26.07	113.96	-106.63	-71.78	145.91	79.89	6.53	13.58	68.38	7.55	4.01	3.65	10.14	0.00	4.92	1.35
41	A	C	C	61.87	8.03	13.71	22.77	107.84	-120.79	-77.14	129.99	67.24	5.09	27.67	44.22	12.70	10.56	7.08	20.62	0.01	3.25	1.56
42	K	C	C	138.91	3.26	13.83	18.42	115.39	-127.56	-94.61	134.49	60.67	9.47	29.86	35.27	13.97	12.41	8.72	20.69	0.05	5.97	2.93
43	T	C	C	89.44	5.29	10.80	17.77	112.42	-119.15	-92.64	127.42	65.88	12.96	21.16	45.61	11.77	8.14	8.69	12.83	0.03	8.42	4.52
44	R	C	C	137.31	5.91	9.73	17.34	116.42	-160.84	-101.34	132.69	80.75	10.31	8.95	60.77	12.70	6.49	5.50	3.79	0.01	6.79	3.94
45	S	C	C	81.83	2.79	11.41	15.72	114.94	-142.88	-99.00	132.56	85.09	7.72	7.19	56.54	19.16	9.28	4.50	2.88	0.01	4.84	2.80
46	Y	C	C	147.49	4.72	9.81	16.22	108.11	-145.82	-93.34	81.81	82.07	3.94	13.99	35.05	27.60	19.66	10.32	3.62	0.03	2.08	1.64
47	N	C	C	111.71	2.97	11.61	15.90	103.93	-112.03	-88.07	62.89	77.35	2.65	20.00	39.66	18.90	18.94	16.02	3.98	0.02	1.21	1.26
48	W	C	H	143.70	5.85	10.35	17.64	99.40	142.24	-83.48	-7.52	55.43	1.55	43.02	25.06	10.75	19.99	38.49	4.22	0.04	0.73	0.72
49	G	H	H	33.12	5.30	12.72	19.54	102.81	67.30	-64.66	-57.46	39.08	1.02	59.89	21.26	8.41	10.89	54.98	3.54	0.03	0.47	0.43
50	A	H	H	65.31	2.58	14.51	17.54	93.84	46.73	-65.98	-39.43	9.28	0.39	90.33	4.38	2.01	3.88	86.15	3.20	0.04	0.25	0.10
51	K	H	H	107.86	3.78	14.84	19.62	92.85	51.83	-66.29	-39.11	6.56	0.47	92.97	3.04	1.14	3.13	88.85	3.36	0.03	0.35	0.08
52	A	H	H	33.14	7.55	12.00	21.75	92.54	52.15	-64.92	-40.17	6.22	0.46	93.32	2.91	1.02	2.94	89.25	3.42	0.03	0.37	0.07
53	K	H	H	117.73	2.74	15.68	18.91	92.46	51.69	-65.93	-39.47	8.94	0.60	90.46	3.59	1.46	4.63	86.61	3.11	0.05	0.43	0.13
54	R	H	H	134.66	2.50	15.11	18.03	93.34	50.68	-66.92	-38.06	15.00	0.77	84.23	5.36	2.44	8.20	80.46	2.76	0.08	0.46	0.24
55	R	H	H	113.62	6.72	12.56	20.64	94.23	55.46	-68.84	-33.89	22.40	1.10	76.49	11.30	3.62	8.76	72.52	2.76	0.05	0.59	0.41
56	R	H	H	148.22	3.75	13.91	18.92	94.75	58.36	-70.78	-30.05	27.64	1.11	71.26	12.49	4.39	11.54	67.42	3.10	0.05	0.60	0.42
57	T	H	H	89.44	2.86	14.19	17.66	99.56	50.03	-83.23	-29.25	36.17	1.16	62.67	11.87	7.95	17.07	59.09	2.86	0.10	0.54	0.52
58	T	C	H	79.08	4.43	13.63	19.07	103.21	41.21	-92.53	-12.62	50.70	1.33	47.97	15.08	16.44	19.37	45.70	2.12	0.08	0.47	0.74
59	G	C	C	38.21	6.22	12.63	20.32	107.26	-125.32	73.33	-5.69	79.58	1.14	19.28	40.64	20.17	18.21	16.64	3.24	0.00	0.47	0.62
60	T	C	H	83.90	4.36	14.19	19.41	103.40	20.93	-84.85	-5.26	55.83	1.29	42.88	25.90	14.41	15.92	38.47	4.10	0.03	0.54	0.63
61	G	H	H	36.55	5.06	15.34	21.41	101.45	37.20	0.05	-41.40	42.36	0.99	56.66	19.44	10.91	13.34	50.87	4.52	0.05	0.43	0.44
62	R	H	H	115.29	6.96	14.60	22.39	94.09	49.37	-67.32	-37.34	20.75	0.71	78.54	11.61	3.87	6.58	71.86	5.41	0.02	0.40	0.25
63	M	H	H	91.27	5.49	15.05	21.60	92.83	53.13	-67.57	-36.58	12.06	0.55	87.39	6.46	2.03	4.45	80.49	6.05	0.02	0.37	0.14
64	S	H	H	56.94	3.10	16.45	20.01	92.26	52.94	-64.69	-40.89	10.62	0.49	88.89	4.77	1.72	4.72	82.44	5.84	0.03	0.35	0.12
65	Y	H	H	103.73	5.43	15.45	22.08	92.56	50.31	-66.08	-40.37	9.54	0.39	90.07	3.95	1.46	4.68	84.24	5.28	0.03	0.27	0.10
66	L	H	H	70.26	7.50	14.13	22.92	92.42	52.92	-64.95	-40.35	6.62	0.24	93.14	2.87	1.01	3.07	89.06	3.78	0.02	0.15	0.05
67	K	H	H	117.20	2.83	16.30	19.62	92.34	52.61	-65.24	-39.60	9.20	0.26	90.55	2.58	1.09	5.61	87.48	2.98	0.03	0.17	0.06
68	K	H	H	115.29	2.64	16.56	19.33	92.74	49.94	-67.22	-39.77	10.77	0.35	88.88	2.95	1.57	6.57	85.93	2.61	0.05	0.22	0.10
69	V	H	H	61.41	6.37	14.09	21.95	92.66	51.83	-65.14	-42.04	11.91	0.65	87.44	6.20	2.39	4.11	84.35	2.37	0.03	0.39	0.16
70	H	H	H	95.53	4.61	14.84	20.62	92.87	50.86	-64.95	-39.08	11.35	0.70	87.95	6.64	1.38	3.89	83.41	3.98	0.02	0.55	0.14
71	R	H	H	127.92	2.51	15.20	18.03	92.51	51.91	-66.08	-39.31	9.24	0.45	90.31	3.25	1.34	4.81	82.30	7.82	0.04	0.34	0.10
72	S	H	H	56.69	4.23	13.33	18.98	93.00	51.36	-68.39	-36.67	11.99	0.42	87.58	3.54	1.59	6.83	80.00	7.59	0.05	0.29	0.12
73	F	H	H	106.99	6.14	11.39	18.85	97.32	49.06	-79.91	-23.28	21.99	0.83	77.18	7.54	3.36	11.68	69.21	7.33	0.08	0.48	0.33
74	K	H	H	140.44	2.56	12.70	16.11	95.38	65.35	-71.31	-28.84	35.95	1.48	62.57	9.69	6.37	21.22	56.09	4.96	0.19	0.70	0.78
75	N	C	T	112.73	2.06	12.66	15.19	99.95	38.08	-92.08	6.57	63.40	0.85	35.75	10.00	10.28	42.13	31.91	4.72	0.06	0.36	0.54
76	G	C	T	44.02	4.86	11.49	17.85	104.42	-110.89	78.53	4.88	79.52	1.27	19.21	22.19	16.09	41.71	11.43	7.22	0.02	0.60	0.75
77	F	C	C	126.64	5.19	11.08	17.80	108.53	78.54	-83.46	99.74	76.01	7.28	16.70	40.45	16.72	19.39	8.56	7.71	0.05	3.78	3.34
78	R	C	C	139.18	5.17	10.15	16.88	109.41	137.36	-99.12	89.42	80.96	7.94	11.10	55.63	12.08	12.94	5.74	5.42	0.01	4.46	3.72
79	S	C	T	84.55	2.77	10.69	15.10	112.26	-159.10	-87.66	127.55	89.41	4.24	6.36	34.92	16.33	38.94	3.11	2.71	0.01	2.38	1.60
80	G	C	T	58.57	1.61	12.09	14.04	105.87	13.40	86.60	-11.14	93.44	1.83	4.72	22.27	32.09	39.56	2.03	2.34	0.00	0.99	0.72
81	K	C	C	136.94	2.89	10.74	15.19	117.07	110.36	-93.47	138.59	92.43	2.37	5.20	61.59	29.04	1.82	4.41	0.84	0.00	0.91	1.40
82	P	C	C	90.36	3.93	10.45	16.06	113.52	-106.02	-66.58	147.45	75.06	3.75	21.18	65.66	4.65	4.51	17.58	3.74	0.00	1.88	1.99
83	A	C	C	75.84	4.17	9.40	15.33	108.78	-108.62	-69.04	142.37	52.05	2.23	45.72	37.72	7.11	7.80	33.10	12.14	0.01	1.28	0.85
84	A	H	H	83.39	2.30	10.50	13.99	110.41	-111.27	-79.12	132.44	43.69	2.83	53.48	28.71	7.57	8.23	38.02	14.83	0.02	1.81	0.81
85	A	H	H	76.19	3.39	9.10	14.24	110.87	-116.06	-80.69	133.14	42.04	4.13	53.84	29.39	6.47	7.16	38.55	14.58	0.02	2.81	1.01
86	V	H	H	105.06	3.46	8.41	13.64	110.95	-135.56	-90.08	126.50	46.52	5.27	48.21	31.06	9.48	7.41	38.51	8.69	0.04	3.12	1.69
87	A	C	C	82.39	2.39	8.32	12.43	114.37	-131.18	-88.95	134.20	58.57	3.70	37.73	38.11	12.44	8.30	32.49	5.29	0.02	2.09	1.25
88	A	C	C	87.94	2.00	8.00	11.63	110.08	-116.87	-80.38	130.69	65.56	3.62	30.82	40.92	10.41	14.12	25.27	5.83	0.02	2.11	1.31
89	S	C	C	92.61	1.46	7.75	10.65	112.31	-123.87	-87.99	130.86	77.96	2.36	19.69	63.05	2.00	13.33	15.67	3.45	0.00	1.41	1.07
90	A	C	C	85.10	2.80	9.29	13.69	107.50	-125.70	-83.83	110.62	99.85	0.07	0.08	99.72	0.09	0.10	0.05	0.00	0.00	0.03	0.01