#	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	A	C	C	60.76	8.08	12.40	21.47	114.83	-163.78	-84.82	143.30	99.32	0.54	0.13	99.01	0.33	0.15	0.07	0.02	0.00	0.31	0.12
1	S	C	C	82.47	2.97	12.43	16.66	108.91	-149.21	-92.51	82.60	83.66	8.49	7.85	77.93	2.17	3.40	6.48	1.27	0.00	4.48	4.26
2	A	C	C	57.96	8.01	8.77	17.80	111.03	-138.30	-88.66	128.34	79.36	7.90	12.74	54.72	18.99	5.16	11.09	2.27	0.03	3.51	4.22
3	T	C	C	68.29	4.79	12.13	18.18	114.61	-119.09	-80.53	155.29	83.29	4.03	12.68	71.57	8.41	2.08	12.89	1.19	0.00	1.78	2.07
4	R	H	H	153.52	3.17	13.08	17.37	94.24	-117.30	-63.08	-36.89	5.68	0.16	94.16	2.30	1.41	2.52	92.88	0.74	0.02	0.08	0.05
5	F	H	H	120.90	3.77	14.04	18.46	92.54	51.26	-65.13	-41.15	2.63	0.10	97.27	0.72	0.48	1.63	96.36	0.71	0.02	0.06	0.02
6	I	H	H	68.53	7.16	14.54	22.48	92.56	48.93	-65.66	-41.08	1.09	0.10	98.81	0.27	0.19	0.69	98.10	0.65	0.01	0.08	0.01
7	Q	H	H	76.91	6.81	15.70	23.45	91.92	51.63	-63.86	-41.31	0.40	0.05	99.55	0.09	0.07	0.24	99.25	0.29	0.00	0.04	0.00
8	W	H	H	116.28	5.85	17.15	23.85	91.90	50.31	-64.36	-41.65	0.31	0.05	99.63	0.05	0.05	0.23	99.40	0.22	0.00	0.04	0.01
9	L	H	H	69.79	6.71	17.85	25.03	91.82	50.01	-64.21	-41.91	0.32	0.05	99.63	0.04	0.04	0.27	99.39	0.21	0.00	0.04	0.01
10	R	H	H	90.12	7.80	17.78	26.09	92.03	50.15	-64.35	-41.37	0.62	0.05	99.33	0.08	0.07	0.53	98.99	0.28	0.01	0.04	0.01
11	N	H	H	54.32	6.68	16.40	24.57	92.06	50.11	-64.51	-41.34	2.07	0.09	97.83	0.28	0.20	1.73	97.09	0.58	0.03	0.07	0.03
12	W	H	H	116.80	6.71	16.28	23.87	92.34	50.35	-64.52	-41.53	3.03	0.06	96.91	0.24	0.23	2.76	95.52	1.15	0.04	0.04	0.02
13	A	H	H	59.59	7.32	15.19	23.43	91.57	52.49	-67.71	-30.31	9.55	0.07	90.38	0.36	0.47	8.96	88.43	1.64	0.08	0.03	0.05
14	S	C	T	62.02	5.38	14.46	20.99	92.87	52.90	-86.29	-3.37	62.06	0.18	37.76	1.34	2.78	56.07	37.51	2.08	0.03	0.06	0.14
15	G	C	T	55.31	2.52	14.63	18.10	95.01	-112.98	79.41	12.51	97.34	0.45	2.21	12.56	8.53	76.58	1.31	0.63	0.00	0.22	0.17
16	R	C	C	108.23	7.28	11.04	20.04	118.61	142.35	-90.43	141.77	93.21	3.17	3.62	75.28	14.38	3.05	2.36	1.33	0.00	1.31	2.28
17	D	C	C	101.71	3.08	16.14	20.01	109.21	-127.72	-85.84	115.21	90.03	2.71	7.26	77.11	7.72	5.09	4.80	2.38	0.00	1.47	1.42
18	L	C	C	51.51	14.24	10.39	24.86	100.95	-175.27	-91.88	4.53	66.40	3.85	29.76	52.38	6.30	7.48	22.97	6.96	0.01	2.01	1.90
19	Q	H	H	99.05	6.56	13.95	21.69	96.67	97.72	-66.28	-37.63	35.08	2.75	62.18	19.10	6.99	10.50	44.56	16.18	0.10	1.63	0.94
20	A	H	H	69.17	3.19	14.90	18.68	94.07	54.34	-69.13	-32.07	27.29	1.51	71.20	9.18	5.33	12.45	48.91	22.57	0.14	0.94	0.48
21	K	H	H	118.04	4.68	14.76	20.32	96.19	49.98	-81.87	-25.28	27.62	1.50	70.88	9.49	5.22	12.54	48.88	22.30	0.15	0.93	0.50
22	L	H	H	52.07	12.58	10.75	23.74	99.10	57.27	-86.27	-4.04	34.81	2.86	62.33	16.13	7.00	11.98	40.83	21.23	0.17	1.60	1.06
23	Q	H	H	104.37	5.73	13.41	20.51	94.41	89.34	-66.62	-25.96	42.02	3.67	54.31	14.98	7.01	19.04	29.33	25.85	0.24	2.26	1.29
24	L	C	G	101.81	4.65	13.77	19.40	96.05	59.26	-80.88	-0.72	48.56	4.18	47.26	15.48	8.92	23.81	20.70	26.79	0.23	2.54	1.52
25	R	C	C	112.86	8.27	12.26	21.54	104.48	73.17	-83.78	22.67	57.79	7.40	34.81	30.12	13.19	14.98	14.89	19.49	0.16	3.94	3.23
26	Y	C	C	102.88	9.05	10.93	20.86	108.31	54.93	-99.58	91.05	71.56	8.54	19.91	47.75	14.70	8.40	13.07	6.98	0.06	3.63	5.42
27	Q	C	T	118.47	4.18	13.05	18.54	97.69	99.53	-67.76	-35.04	52.75	1.96	45.28	12.56	11.38	28.80	25.26	19.61	0.25	1.04	1.10
28	E	C	T	137.71	2.21	14.20	16.70	95.84	48.37	-74.02	-23.80	53.89	1.55	44.56	12.13	10.37	31.07	24.88	19.56	0.26	0.81	0.93
29	I	C	H	80.73	8.04	11.88	20.92	100.66	46.26	-89.26	-24.33	51.63	4.83	43.54	18.33	12.12	22.86	24.31	17.09	0.50	2.52	2.29
30	S	C	C	39.82	11.11	10.14	21.96	110.35	63.57	-92.43	104.97	69.61	8.51	21.89	45.67	16.17	7.78	16.02	5.71	0.08	3.68	4.90
31	K	C	C	124.05	4.06	15.02	20.06	107.39	60.59	-79.58	113.19	76.24	7.57	16.19	55.43	10.61	9.49	9.50	6.76	0.02	3.63	4.56
32	R	C	C	145.57	6.42	11.37	19.08	97.70	-126.60	-73.98	-11.81	85.70	3.43	10.87	36.71	27.21	22.79	4.36	5.49	0.02	1.51	1.91
33	T	C	C	94.18	3.91	12.63	17.53	101.06	61.44	-91.91	2.49	91.10	3.14	5.76	47.95	23.53	19.75	1.79	3.65	0.00	1.27	2.06
34	Q	C	C	88.31	7.19	9.77	18.66	119.01	102.72	-89.11	142.30	97.78	1.91	0.31	59.41	37.97	0.54	0.13	0.13	0.00	0.61	1.21
35	P	C	C	95.23	2.67	13.80	17.36	116.73	-98.26	-66.24	150.62	99.29	0.63	0.08	91.89	7.21	0.20	0.03	0.03	0.00	0.25	0.38
36	P	C	C	95.60	4.67	12.71	19.35	114.09	-92.54	-64.32	144.32	99.48	0.45	0.06	97.50	1.90	0.13	0.02	0.02	0.00	0.18	0.24
37	P	C	C	55.50	13.26	9.51	22.97	114.23	-107.89	-67.25	148.00	98.48	1.34	0.18	95.94	2.19	0.42	0.06	0.08	0.00	0.53	0.78
38	K	C	C	160.16	1.48	18.18	19.22	112.89	-127.92	-94.58	125.83	90.25	9.55	0.21	80.19	8.51	0.39	0.10	0.10	0.00	2.11	8.61
39	L	C	C	62.82	15.73	9.95	25.12	118.01	-136.76	-83.21	140.11	97.77	2.10	0.13	89.11	8.54	0.27	0.05	0.07	0.00	0.95	1.01
40	P	C	C	54.97	8.30	13.77	23.67	115.59	-107.16	-65.69	151.23	98.66	1.00	0.35	94.24	3.36	1.10	0.10	0.17	0.00	0.43	0.58
41	V	C	C	114.51	2.97	15.15	19.26	116.52	-109.43	-83.96	144.41	96.71	2.55	0.74	63.31	30.70	1.89	0.30	0.40	0.00	0.68	2.73
42	G	C	S	31.77	6.34	14.56	22.08	130.86	47.82	97.77	-167.20	78.17	1.91	19.92	27.23	39.88	11.77	6.17	12.55	0.01	0.68	1.71
43	P	H	G	80.92	6.13	15.02	22.13	92.77	-44.27	-66.55	-23.57	40.68	0.44	58.88	4.15	4.65	30.32	8.66	51.71	0.01	0.24	0.24
44	S	H	G	38.24	11.92	12.89	25.66	92.17	63.60	-73.47	-15.68	31.39	0.51	68.10	4.06	3.44	22.46	10.46	59.05	0.01	0.30	0.22
45	H	H	G	78.79	11.65	13.32	25.57	93.53	74.88	-71.14	-17.05	29.15	1.05	69.80	10.37	5.43	14.06	13.22	55.94	0.01	0.61	0.37
46	K	H	G	134.51	4.06	16.97	21.35	97.00	64.52	-82.19	-11.19	45.39	2.08	52.53	11.44	8.83	25.69	11.85	40.00	0.06	1.13	1.00
47	L	C	S	73.49	9.63	12.74	23.25	110.78	81.34	-91.65	107.69	57.83	10.41	31.76	19.13	20.90	18.83	8.90	20.51	0.26	3.74	7.72
48	S	C	T	60.57	7.44	14.23	22.47	109.93	-97.92	-80.08	120.51	83.75	2.23	14.03	8.16	10.35	65.04	3.68	10.18	0.03	1.31	1.25
49	N	C	T	107.86	4.78	16.65	22.35	97.40	-5.34	46.45	30.41	89.38	1.31	9.31	13.54	12.82	62.71	1.57	7.98	0.00	0.77	0.62
50	N	C	C	41.20	12.27	12.02	25.53	108.39	144.84	-93.38	101.93	87.84	6.82	5.35	71.18	12.41	2.87	3.08	2.23	0.00	2.34	5.89
51	Y	C	H	105.91	7.79	16.58	25.66	94.36	-166.80	-69.05	-25.80	50.59	3.60	45.81	16.60	9.03	24.87	27.16	17.94	0.35	1.78	2.28
52	Y	H	T	91.16	11.33	14.69	26.48	93.36	60.31	-72.97	-23.14	44.62	1.15	54.24	4.27	5.57	32.14	31.37	24.88	0.38	0.64	0.75
53	C	H	H	59.14	9.29	14.57	24.52	100.60	45.15	-90.89	-23.37	41.77	1.37	56.86	4.49	6.14	28.63	31.91	26.81	0.44	0.79	0.78
54	T	C	H	83.20	4.35	17.23	21.99	103.53	35.89	-100.93	-8.30	48.56	3.31	48.13	10.84	11.02	26.24	28.20	19.41	0.75	1.70	1.84
55	R	C	C	100.23	9.80	12.52	23.15	118.84	97.08	-96.96	139.42	77.48	8.73	13.79	36.36	29.25	12.25	8.50	4.52	0.13	3.16	5.83
56	D	C	C	57.50	7.86	14.17	23.62	113.78	-143.37	-100.02	121.87	89.38	6.41	4.20	70.30	13.56	4.63	2.51	1.71	0.00	2.67	4.61
57	G	C	H	32.50	9.74	13.05	24.14	93.33	-148.15	-67.10	-22.90	49.85	1.87	48.27	14.55	10.64	24.47	24.96	23.13	0.19	0.94	1.12
58	R	H	H	125.53	7.26	14.33	22.37	93.67	64.72	-69.95	-22.10	41.01	1.39	57.60	7.23	6.97	24.71	30.63	28.65	0.27	0.79	0.74
59	R	H	H	132.98	5.92	14.53	21.35	94.93	58.85	-75.65	-20.76	37.13	2.74	60.13	9.08	7.46	19.41	31.90	29.06	0.32	1.77	1.00
60	E	H	H	114.82	5.16	14.17	20.38	97.81	55.19	-88.23	-2.15	45.36	6.33	48.30	16.51	10.11	19.52	27.18	20.01	0.52	3.92	2.23
61	A	C	C	51.89	9.87	10.74	21.53	111.43	92.93	-88.51	124.97	67.77	14.79	17.44	37.31	21.98	8.97	11.14	5.61	0.26	6.17	8.56
62	M	C	C	117.13	4.14	14.40	19.98	120.96	-148.51	-107.75	134.22	90.69	8.60	0.72	49.84	40.95	0.99	0.41	0.30	0.00	4.26	3.25
63	P	C	C	82.98	6.21	13.00	20.54	116.39	-100.74	-66.96	150.23	97.62	1.95	0.42	88.78	8.30	0.73	0.19	0.18	0.00	1.26	0.56
64	P	C	C	72.84	9.73	10.79	21.59	113.27	-102.38	-66.32	146.81	91.47	4.79	3.74	78.60	9.17	3.78	1.78	1.80	0.00	3.55	1.31
65	S	C	E	74.47	4.43	13.65	19.47	116.01	-145.00	-99.99	134.40	47.10	43.71	9.19	34.25	9.71	4.33	5.95	4.04	0.15	35.60	5.98
66	I	E	E	104.34	6.76	11.69	19.86	114.38	-137.38	-93.89	126.47	31.61	57.51	10.88	25.57	4.11	2.46	8.38	3.44	0.04	52.11	3.89
67	V	E	E	85.90	6.56	12.20	19.92	105.06	-169.17	-95.06	-9.46	36.98	49.36	13.67	27.06	6.51	4.49	9.76	4.29	0.07	45.42	2.40
68	M	C	C	93.31	6.87	12.15	20.31	126.38	-0.69	-128.35	140.99	50.24	37.60	12.16	34.88	9.56	6.29	8.34	4.02	0.09	34.46	2.38
69	S	C	C	65.26	5.11	12.72	19.06	117.69	-142.72	-91.41	154.32	70.88	16.41	12.71	49.58	12.96	7.45	9.17	4.08	0.03	14.81	1.91
70	S	C	C	74.85	5.29	12.19	18.65	97.79	-114.61	-71.75	-18.46	56.80	7.66	35.54	28.83	14.97	13.57	26.25	8.98	0.22	5.56	1.63
71	Q	C	H	114.63	4.35	13.21	18.61	104.02	71.01	-84.97	6.93	43.96	13.64	42.39	23.81	10.01	10.92	31.29	10.46	0.31	11.27	1.93
72	K	H	H	111.53	6.45	13.64	20.99	104.76	61.98	-80.07	21.38	32.72	24.79	42.49	21.35	5.62	6.31	32.39	9.73	0.16	22.28	2.16
73	V	H	H	66.55	9.40	13.23	23.50	108.96	67.88	-88.36	82.20	26.58	31.31	42.12	18.03	4.20	4.62	35.20	6.73	0.13	28.71	2.37
74	L	H	H	82.56	8.25	13.35	22.55	107.40	-148.15	-83.71	89.30	30.19	31.52	38.29	19.38	5.21	5.93	32.32	6.06	0.17	28.48	2.46
75	V	C	H	88.14	5.76	14.15	20.78	109.33	-165.11	-86.77	96.55	42.18	24.22	33.60	25.57	7.04	9.40	28.31	5.70	0.28	20.77	2.93
76	A	C	T	65.89	6.87	11.77	19.79	107.37	-107.45	-75.88	120.09	72.63	9.55	17.82	25.05	11.75	35.41	14.64	4.08	0.12	7.02	1.94
77	G	C	T	51.78	3.79	13.19	18.15	105.53	12.19	86.10	-0.82	89.89	4.55	5.57	26.93	21.91	42.05	2.59	2.39	0.01	3.14	0.98
78	K	C	C	122.84	4.40	11.30	17.47	117.60	113.85	-93.10	140.01	93.03	5.66	1.32	56.08	35.60	1.99	0.69	0.60	0.00	3.07	1.99
79	P	C	C	88.78	4.24	11.46	17.20	111.87	-105.40	-68.13	147.95	85.70	5.90	8.40	66.71	10.19	8.29	3.97	4.63	0.00	3.61	2.59
80	A	C	C	76.90	4.56	9.59	15.82	102.79	-111.27	-71.50	-3.50	72.89	3.77	23.34	37.65	16.16	19.60	10.28	12.69	0.02	2.05	1.54
81	E	C	C	140.27	2.44	11.46	15.00	103.39	58.84	-82.24	20.21	67.66	4.39	27.95	34.82	14.35	18.93	13.92	13.76	0.06	2.43	1.73
82	S	C	C	68.88	5.47	10.11	17.00	105.21	88.50	-84.06	28.75	63.22	3.50	33.29	39.57	12.25	11.24	20.05	13.55	0.03	1.98	1.32
83	S	C	C	76.39	3.82	12.01	17.18	104.56	64.12	-84.75	21.93	59.56	4.69	35.75	38.16	11.19	10.38	25.94	9.90	0.04	2.94	1.45
84	A	C	C	66.57	5.15	11.69	18.27	108.72	75.73	-83.82	116.50	51.67	9.68	38.65	35.31	9.31	7.65	29.93	8.43	0.08	7.20	2.09
85	V	C	C	79.08	7.66	10.59	19.42	110.45	-154.50	-89.96	122.66	44.28	16.13	39.58	33.00	6.81	5.35	32.87	6.03	0.10	12.74	3.10
86	A	C	C	67.91	4.59	12.98	18.81	108.74	-128.36	-81.62	123.22	45.45	16.56	37.99	33.26	6.82	5.95	31.83	5.69	0.11	13.45	2.88
87	A	C	C	71.58	4.89	11.62	17.88	104.38	-103.51	-79.32	15.78	48.96	14.80	36.24	32.10	9.05	8.47	29.39	6.45	0.17	11.66	2.72
88	S	C	C	69.57	5.55	11.07	17.96	102.94	66.43	-84.40	3.53	61.72	10.96	27.32	37.33	13.08	11.30	21.49	6.30	0.11	8.00	2.40
89	E	C	C	126.73	4.05	12.31	17.74	104.88	68.56	-85.42	46.01	70.94	11.15	17.92	45.67	14.63	10.26	13.14	5.50	0.05	7.97	2.78
90	K	C	C	128.93	5.18	11.41	18.23	111.10	69.02	-88.52	120.29	77.88	12.47	9.65	57.81	13.16	6.12	6.71	3.52	0.02	8.24	4.42
91	K	C	C	120.78	6.12	12.06	19.61	115.65	-143.41	-95.64	132.94	83.00	12.23	4.77	66.03	12.55	3.70	2.94	2.07	0.00	8.41	4.29
92	A	C	C	66.75	6.03	13.01	20.40	113.31	-117.88	-73.54	144.22	87.48	10.10	2.42	76.96	7.73	2.41	1.25	1.15	0.00	7.29	3.21
93	V	C	C	92.06	7.30	11.35	19.86	113.23	-118.22	-87.98	127.70	85.55	12.32	2.13	67.04	14.44	3.23	1.04	1.13	0.00	6.59	6.53
94	S	C	C	62.46	6.08	11.65	19.32	125.38	-162.18	-114.76	153.25	90.17	9.09	0.73	61.72	25.81	2.81	0.28	0.48	0.00	4.21	4.68
95	P	C	C	98.16	4.34	11.97	17.68	110.18	-88.90	-72.91	139.76	96.29	2.98	0.73	45.73	43.17	7.63	0.16	0.58	0.00	1.54	1.20
96	A	C	S	62.52	5.83	10.02	17.39	121.75	-99.89	-87.01	159.63	96.81	2.61	0.57	40.26	53.77	2.98	0.16	0.38	0.00	1.13	1.33
97	P	C	C	103.51	2.24	13.78	16.75	114.51	-80.91	-68.39	146.86	97.32	1.93	0.75	70.89	24.26	2.23	0.30	0.44	0.00	0.99	0.88
98	P	C	C	90.44	5.63	10.27	17.74	114.50	-104.09	-67.66	146.35	93.76	3.93	2.31	83.96	6.98	2.71	1.13	1.09	0.00	2.04	2.10
99	I	C	C	88.40	8.47	8.25	17.94	113.36	-111.17	-79.45	137.15	84.49	9.17	6.34	73.78	6.40	3.36	3.55	2.81	0.00	4.90	5.20
100	K	C	C	146.52	2.34	12.06	15.71	113.03	-128.18	-85.03	134.48	76.00	7.92	16.08	61.51	8.47	5.61	7.24	8.95	0.00	5.18	3.04
101	R	C	C	162.01	3.60	10.72	15.92	103.10	-117.83	-74.08	17.36	54.41	5.73	39.86	35.08	10.29	9.88	12.01	27.40	0.02	3.83	1.49
102	W	C	C	147.93	6.72	8.77	16.79	108.37	57.72	-85.49	111.49	51.71	5.87	42.42	32.47	9.90	10.37	11.50	30.39	0.01	4.00	1.36
103	E	C	C	133.93	2.68	12.99	16.78	107.51	90.10	-89.50	91.68	53.14	9.62	37.24	37.82	8.13	8.11	12.02	24.77	0.02	6.80	2.32
104	L	C	C	81.49	9.22	9.23	19.42	116.92	139.51	-91.16	138.44	68.38	12.49	19.13	46.85	13.27	7.41	11.21	8.36	0.05	7.11	5.73
105	S	C	C	49.63	6.44	9.69	18.07	114.61	-113.64	-79.87	143.44	83.84	7.65	8.51	69.42	6.85	7.01	4.26	4.15	0.00	4.42	3.89
106	Q	C	T	143.59	2.06	11.07	14.50	96.28	-140.40	-74.86	-19.51	93.04	2.74	4.22	18.45	23.20	51.87	1.40	2.42	0.01	1.52	1.14
107	D	C	T	114.54	1.63	10.72	13.11	97.84	61.99	-88.82	-2.47	95.40	1.98	2.62	19.12	26.13	50.36	0.56	1.94	0.00	1.15	0.73
108	E	C	C	82.86	7.60	7.31	16.36	115.20	98.99	-90.84	129.28	93.98	3.67	2.35	50.70	38.40	4.83	0.44	2.04	0.00	1.55	2.04
109	P	C	T	101.46	2.44	11.03	14.79	98.82	-134.68	-67.30	-16.46	93.31	2.13	4.55	33.67	17.26	42.35	0.66	4.10	0.00	1.26	0.69
110	Y	C	C	132.95	5.97	9.31	16.72	104.15	64.65	-86.75	9.33	90.30	4.67	5.03	54.64	5.41	30.76	1.10	3.39	0.00	2.91	1.78
111	L	C	C	80.83	9.35	11.17	21.36	104.59	71.13	-87.05	37.74	98.32	1.47	0.21	97.63	0.56	0.30	0.08	0.07	0.00	1.03	0.32