#	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	T	C	C	85.46	4.94	11.69	18.17	117.83	-155.92	-98.09	140.43	99.92	0.06	0.02	99.85	0.08	0.03	0.01	0.00	0.00	0.02	0.01
1	K	C	C	136.34	3.64	9.93	15.34	114.15	-128.33	-92.84	132.07	85.62	7.10	7.28	81.66	1.87	2.40	5.59	1.36	0.00	3.62	3.50
2	K	C	C	137.51	3.22	9.37	14.40	111.34	-131.53	-83.09	136.86	76.13	9.64	14.23	57.91	11.38	6.08	9.80	4.88	0.01	5.94	3.99
3	R	C	C	151.00	4.24	9.51	15.44	108.23	-125.56	-81.24	119.48	68.53	10.24	21.23	48.00	11.18	8.77	11.56	10.01	0.02	6.69	3.78
4	R	C	C	150.84	3.64	11.41	16.57	111.24	-132.19	-88.28	123.52	65.18	10.71	24.10	36.87	14.78	14.00	11.66	11.90	0.10	6.87	3.82
5	N	C	C	83.87	7.30	10.16	18.83	109.92	-127.56	-94.80	104.23	70.55	8.93	20.53	37.71	15.87	17.55	9.18	10.52	0.08	5.35	3.73
6	N	C	C	98.35	4.95	12.32	18.64	102.20	-162.81	-94.36	24.89	80.38	5.03	14.59	34.36	20.72	26.44	6.35	7.18	0.03	2.55	2.37
7	G	C	T	43.98	5.93	12.28	19.38	102.40	-110.55	72.80	0.87	79.79	2.79	17.41	21.21	25.97	33.85	5.78	10.31	0.03	1.40	1.46
8	R	C	C	146.62	3.82	13.76	18.69	105.51	105.59	-89.61	18.55	67.01	8.68	24.31	28.22	20.45	19.76	8.87	13.85	0.19	4.58	4.07
9	A	C	C	50.28	8.82	10.08	20.16	113.14	91.43	-86.81	134.31	64.76	11.76	23.48	36.78	14.39	14.16	8.59	14.46	0.09	7.58	3.96
10	K	C	C	133.79	3.95	12.10	17.60	114.20	-137.01	-95.04	131.24	63.64	16.40	19.96	35.51	14.99	13.55	7.78	11.92	0.16	10.10	5.98
11	K	C	T	146.55	2.82	10.81	15.18	113.54	-115.62	-89.61	133.56	71.43	13.03	15.54	21.88	20.60	30.10	4.76	10.00	0.23	7.90	4.53
12	G	C	T	54.88	2.45	11.40	14.76	109.18	7.53	83.16	-97.96	87.23	3.82	8.96	16.97	25.44	44.42	1.27	8.08	0.01	2.57	1.23
13	R	C	T	173.30	2.08	10.85	14.12	105.32	21.13	-90.25	48.13	85.91	4.77	9.32	21.94	27.31	36.59	1.22	8.22	0.01	2.57	2.14
14	G	C	S	46.91	4.40	12.16	17.94	104.34	-76.07	84.43	-2.55	86.26	8.45	5.28	26.00	33.69	26.58	0.59	5.00	0.01	5.71	2.41
15	H	C	C	103.56	6.60	12.59	20.68	115.32	110.86	-93.32	134.84	79.14	18.05	2.81	43.06	26.50	9.60	0.60	2.52	0.01	10.72	6.99
16	V	C	C	65.23	10.93	12.77	24.63	115.00	-149.32	-98.90	128.74	78.89	20.46	0.65	64.18	12.25	1.38	0.23	0.46	0.00	10.27	11.24
17	Q	C	C	95.24	6.49	18.20	25.58	120.09	-147.87	-98.86	141.21	91.17	8.80	0.04	84.02	7.29	0.14	0.01	0.03	0.00	7.54	0.99
18	P	C	C	56.53	11.94	17.09	29.45	115.89	-103.60	-67.95	148.30	86.11	13.86	0.03	82.47	3.54	0.13	0.00	0.03	0.00	13.09	0.73
19	I	E	E	28.90	16.84	16.46	33.92	122.75	-151.63	-113.01	137.15	11.69	88.29	0.01	11.07	0.67	0.02	0.00	0.01	0.00	85.69	2.54
20	R	E	E	110.63	7.78	21.89	30.22	116.73	-133.19	-96.79	131.27	4.52	95.46	0.01	4.53	0.13	0.00	0.01	0.00	0.00	81.10	14.23
21	C	C	C	11.94	19.75	12.14	32.64	109.46	-120.80	-73.46	125.75	74.77	25.20	0.03	76.28	0.47	0.04	0.01	0.01	0.00	21.63	1.56
22	T	C	T	70.86	7.51	18.58	27.28	93.62	-152.55	-71.64	-23.97	99.37	0.32	0.31	0.85	9.98	88.47	0.01	0.38	0.00	0.24	0.07
23	N	C	T	91.55	5.93	17.56	24.25	100.68	42.57	-88.23	-38.92	99.48	0.15	0.37	0.23	5.98	93.26	0.01	0.41	0.00	0.09	0.04
24	C	C	T	57.35	7.13	15.86	24.11	103.03	17.02	-112.37	-10.05	99.37	0.25	0.39	3.41	16.32	79.48	0.02	0.53	0.00	0.15	0.09
25	A	C	C	58.13	9.07	15.59	25.70	95.49	-129.10	70.97	11.63	98.98	0.90	0.12	82.38	11.87	4.74	0.02	0.12	0.00	0.52	0.36
26	R	C	C	106.56	6.11	20.03	27.22	122.16	131.44	-86.10	150.18	86.52	13.45	0.02	81.60	5.36	0.11	0.00	0.02	0.00	11.80	1.10
27	C	E	E	50.46	13.70	18.16	31.96	115.38	-114.11	-82.71	137.11	2.78	97.21	0.01	2.52	0.29	0.01	0.00	0.00	0.00	81.08	16.09
28	V	E	E	15.02	17.94	15.40	34.09	129.59	-174.55	-130.77	148.24	23.16	76.83	0.00	22.31	0.67	0.01	0.00	0.00	0.00	75.78	1.22
29	P	E	C	51.03	5.79	21.11	27.78	113.31	-100.22	-64.03	143.39	49.88	50.11	0.02	51.54	0.54	0.02	0.00	0.01	0.00	46.14	1.75
30	K	H	G	88.84	14.97	12.32	27.02	91.20	-120.35	-58.08	-36.03	21.76	0.34	77.90	0.86	2.00	17.32	1.08	78.46	0.00	0.24	0.03
31	D	H	G	119.26	1.35	19.23	19.78	90.22	61.75	-69.60	-16.97	22.82	0.40	76.78	0.46	1.78	19.63	1.40	76.42	0.00	0.26	0.05
32	K	H	G	104.07	7.17	17.17	25.39	96.62	52.83	-97.48	-0.50	20.53	0.78	78.70	1.79	3.05	14.67	2.44	77.42	0.00	0.55	0.07
33	A	C	C	15.08	21.21	10.86	31.21	116.30	99.43	-82.13	138.43	65.22	31.27	3.51	54.13	9.19	1.51	1.58	1.97	0.00	28.66	2.95
34	I	E	E	65.82	10.01	18.44	29.36	121.29	-153.12	-111.25	132.59	12.62	87.26	0.13	11.43	1.17	0.12	0.09	0.06	0.00	84.39	2.73
35	K	E	E	111.15	9.56	16.24	26.69	116.86	-147.93	-98.69	132.62	12.44	87.47	0.09	10.75	1.14	0.09	0.04	0.04	0.00	87.73	0.22
36	K	E	E	102.53	7.52	15.68	24.66	126.53	-169.09	-125.72	141.94	12.13	87.65	0.22	10.66	0.97	0.12	0.10	0.08	0.00	87.89	0.18
37	F	E	E	98.91	9.79	13.06	24.09	121.22	-154.14	-113.33	134.95	6.81	93.07	0.12	6.48	0.28	0.04	0.08	0.03	0.00	92.86	0.24
38	V	E	E	70.45	6.90	14.68	23.40	119.33	-159.63	-112.83	128.58	7.29	92.62	0.09	6.87	0.31	0.04	0.07	0.02	0.00	92.38	0.30
39	I	E	E	85.95	7.86	12.12	21.77	115.83	-149.65	-99.31	127.14	19.42	80.36	0.22	18.03	0.96	0.12	0.13	0.08	0.00	80.16	0.52
40	R	C	E	125.96	5.87	12.28	19.80	117.47	-165.22	-103.21	139.92	49.92	49.03	1.05	39.20	9.21	1.02	0.69	0.41	0.00	48.51	0.97
41	N	C	C	86.32	4.39	12.20	18.04	116.41	-117.95	-89.82	140.38	74.35	23.44	2.22	63.07	9.38	1.04	2.00	0.56	0.00	21.87	2.08
42	I	H	H	111.81	3.79	11.61	16.97	94.43	-121.22	-63.02	-37.13	10.39	0.64	88.98	5.14	2.49	3.75	85.55	2.46	0.02	0.46	0.12
43	V	H	H	99.85	1.77	13.67	15.39	93.40	53.61	-66.09	-39.81	6.98	0.62	92.39	3.10	1.29	3.28	88.36	3.28	0.04	0.56	0.10
44	E	H	H	93.96	4.07	13.43	18.79	93.46	50.26	-67.78	-38.00	5.45	0.76	93.79	2.77	0.94	2.43	88.61	4.38	0.03	0.76	0.09
45	A	H	H	38.54	7.19	11.33	20.52	93.29	54.17	-65.11	-39.41	5.72	0.55	93.74	2.61	0.89	2.64	89.43	3.82	0.03	0.52	0.07
46	A	H	H	61.47	2.86	14.61	18.10	92.89	54.11	-66.66	-37.30	13.23	0.91	85.86	3.60	1.51	8.30	81.02	4.53	0.08	0.82	0.16
47	A	H	H	64.80	2.84	13.63	17.26	93.68	55.42	-70.25	-29.78	23.20	1.73	75.07	5.66	2.42	14.73	70.54	4.68	0.11	1.56	0.29
48	V	H	H	74.33	6.75	11.08	19.21	100.17	55.74	-83.44	-9.79	29.42	6.81	63.77	13.66	4.76	11.69	57.94	5.03	0.12	5.72	1.07
49	R	H	H	152.65	3.19	13.04	17.59	97.37	88.40	-70.48	-30.75	41.71	6.38	51.91	17.46	7.40	16.34	46.90	5.44	0.13	5.24	1.10
50	D	C	H	92.42	2.83	12.92	16.56	100.88	50.32	-92.14	10.99	52.53	3.99	43.48	27.57	5.68	18.47	39.22	5.14	0.03	3.00	0.90
51	I	H	H	83.19	7.37	9.64	18.45	96.86	108.43	-68.62	-31.83	29.22	2.17	68.61	17.16	5.23	8.39	56.65	10.45	0.06	1.48	0.58
52	S	H	H	77.29	2.80	12.35	16.31	94.76	60.00	-68.98	-31.58	27.17	1.77	71.06	10.59	4.41	12.33	56.35	14.45	0.14	1.25	0.48
53	E	H	H	141.28	1.44	13.19	14.63	95.14	51.92	-78.64	-18.66	29.50	1.29	69.21	7.84	5.37	16.43	54.20	14.66	0.22	0.81	0.47
54	A	H	H	54.46	6.37	10.02	18.01	104.75	66.32	-84.57	13.28	48.08	2.11	49.81	15.50	14.39	19.90	40.12	7.86	0.22	1.03	0.99
55	S	C	C	62.67	4.70	11.95	18.08	106.51	-131.81	-80.77	97.08	65.69	7.16	27.15	34.28	12.46	19.53	19.42	7.52	0.11	4.02	2.65
56	V	C	C	85.26	5.71	11.31	18.53	97.50	121.34	-73.86	-24.96	58.07	10.66	31.27	23.38	14.74	21.12	20.25	10.11	0.53	6.60	3.26
57	F	C	C	122.62	4.78	11.40	17.61	98.02	58.23	-77.00	-23.53	56.83	12.65	30.52	22.08	14.79	21.40	18.58	10.67	0.78	7.51	4.19
58	D	C	C	99.28	3.20	12.28	16.66	99.42	55.62	-83.14	-5.79	61.52	6.62	31.85	28.13	14.61	19.72	17.59	13.55	0.21	3.71	2.47
59	A	C	T	66.83	4.72	11.22	17.29	100.98	64.84	-83.31	-12.77	64.93	3.36	31.71	13.57	16.57	35.04	15.42	15.69	0.22	1.89	1.60
60	Y	C	T	145.53	4.59	11.57	17.59	106.63	48.50	-95.22	32.44	63.63	10.14	26.22	20.36	16.85	28.05	11.67	13.22	0.45	6.18	3.22
61	V	C	C	92.05	4.97	11.95	18.48	110.18	87.23	-95.43	102.50	62.72	20.51	16.77	35.92	16.57	11.09	9.47	7.28	0.45	11.73	7.49
62	L	C	C	78.27	8.88	10.06	20.25	116.50	130.57	-94.68	131.42	79.37	14.75	5.88	53.50	22.07	3.94	3.79	2.50	0.02	9.83	4.35
63	P	C	C	77.24	5.62	12.76	19.99	107.97	-112.29	-67.29	145.30	78.84	8.69	12.46	52.55	12.53	13.73	3.48	9.05	0.01	6.95	1.70
64	K	C	S	139.22	3.99	14.06	19.30	100.78	-117.72	-74.91	5.84	73.43	9.97	16.61	19.29	29.17	27.31	3.17	11.77	0.06	7.64	1.60
65	L	C	C	77.51	9.07	13.46	23.45	109.18	81.62	-96.69	78.98	57.79	25.41	16.80	23.19	17.33	20.43	3.47	11.45	0.05	22.64	1.44
66	Y	E	E	87.54	11.41	14.83	27.03	122.77	137.03	-111.22	138.67	30.37	63.56	6.07	23.37	5.84	2.68	2.18	3.18	0.01	61.47	1.27
67	V	E	E	43.51	13.59	16.35	30.72	123.10	-167.38	-118.03	135.77	12.58	86.59	0.83	10.84	1.38	0.34	0.53	0.27	0.00	86.12	0.51
68	K	E	E	89.54	10.78	20.37	31.41	118.39	-144.04	-101.02	130.27	6.52	93.03	0.45	5.91	0.42	0.10	0.33	0.11	0.00	92.80	0.33
69	L	E	E	32.10	17.92	17.98	35.76	120.95	-157.88	-108.32	131.65	8.99	90.50	0.50	8.08	0.58	0.15	0.34	0.16	0.00	90.44	0.25
70	H	E	E	53.55	13.60	21.86	35.62	122.92	-163.22	-114.20	135.58	11.59	87.74	0.66	10.03	1.23	0.34	0.41	0.27	0.00	87.13	0.59
71	Y	E	E	40.44	18.16	19.83	37.64	124.20	-161.75	-115.44	138.92	25.56	73.21	1.23	22.37	2.12	0.50	0.87	0.45	0.00	72.37	1.32
72	C	C	C	23.40	14.78	21.17	36.33	111.78	-132.57	-89.91	123.99	60.84	36.94	2.23	58.36	1.86	0.50	1.61	0.55	0.00	35.21	1.91
73	V	H	H	40.79	15.81	19.14	34.91	94.71	-150.41	-67.03	-32.46	21.47	3.45	75.09	11.13	3.98	7.17	55.81	18.28	0.11	3.00	0.51
74	S	H	H	46.80	7.34	21.24	29.45	91.67	60.55	-64.58	-36.80	13.94	2.11	83.95	4.66	2.49	6.80	61.11	22.62	0.10	1.93	0.28
75	C	H	H	33.08	10.61	18.25	30.15	92.31	52.67	-67.93	-35.08	9.23	1.44	89.33	3.27	1.64	4.30	64.02	25.18	0.04	1.38	0.16
76	A	H	H	16.40	16.28	14.21	31.02	92.45	56.84	-65.67	-38.51	13.27	3.59	83.14	6.00	2.49	5.45	66.01	16.24	0.11	3.15	0.54
77	I	H	H	83.44	7.50	16.31	24.65	92.96	51.95	-68.17	-38.07	22.67	7.70	69.63	8.30	4.35	11.36	58.52	9.35	0.66	5.96	1.49
78	H	H	H	128.63	2.95	15.84	19.37	95.77	48.34	-78.27	-26.65	37.80	5.26	56.94	11.42	6.69	20.35	50.17	5.69	0.61	3.44	1.63
79	S	C	T	52.84	7.30	12.04	20.76	98.50	52.09	-89.67	-1.33	68.89	1.33	29.77	13.71	13.20	40.10	27.63	3.99	0.08	0.66	0.62
80	K	C	T	152.00	2.99	14.46	18.91	96.09	-126.85	60.09	26.35	72.73	2.53	24.74	16.50	14.53	40.24	22.00	4.18	0.12	1.47	0.96
81	V	C	C	71.00	7.86	13.90	23.02	100.83	124.83	-91.42	-17.07	63.55	11.19	25.26	25.39	20.19	18.66	20.99	4.28	0.47	6.61	3.41
82	V	C	C	58.83	12.67	11.56	24.43	119.98	55.08	-109.72	132.59	63.63	13.50	22.87	35.15	18.22	10.63	19.25	4.10	0.18	8.96	3.51
83	R	C	C	139.80	4.99	15.63	21.98	116.69	-151.82	-94.28	133.15	71.17	11.00	17.82	48.52	14.07	7.86	15.37	3.58	0.04	7.90	2.65
84	N	C	C	92.22	8.12	13.21	22.43	110.69	-127.43	-85.29	121.75	79.21	6.46	14.32	60.69	11.24	6.25	12.67	2.82	0.01	4.41	1.91
85	R	C	C	107.38	8.82	11.63	21.60	117.09	127.81	-95.39	141.72	82.84	3.36	13.80	65.31	11.80	4.42	13.44	1.85	0.00	1.91	1.28
86	S	C	C	51.79	4.72	13.23	19.55	114.31	-107.37	-74.07	149.87	82.85	1.67	15.48	74.01	5.11	2.67	15.51	1.23	0.00	0.72	0.75
87	R	H	H	153.29	3.26	12.07	16.93	93.59	-122.03	-61.72	-37.11	9.88	0.17	89.95	4.75	2.30	3.61	86.63	2.57	0.01	0.08	0.06
88	E	H	H	120.70	1.44	14.36	15.34	92.01	53.35	-64.83	-40.35	6.43	0.22	93.35	2.37	1.16	3.37	89.03	3.84	0.02	0.15	0.05
89	A	H	H	37.78	5.77	11.44	19.46	92.02	50.54	-64.65	-39.61	5.59	0.27	94.14	2.27	0.88	2.79	88.95	4.83	0.02	0.22	0.04
90	R	H	H	101.04	7.32	11.09	19.96	92.17	52.56	-65.34	-37.90	7.45	0.24	92.31	2.70	1.14	3.94	87.53	4.46	0.02	0.16	0.06
91	K	H	H	140.19	1.77	13.55	15.77	91.98	53.17	-67.96	-32.41	20.12	0.32	79.56	3.95	2.62	13.48	76.27	3.31	0.06	0.15	0.15
92	D	H	H	104.26	1.95	12.94	15.38	95.41	51.15	-85.90	-6.84	47.01	0.45	52.54	9.59	7.15	29.83	50.70	2.26	0.04	0.16	0.26
93	R	C	C	127.69	7.11	9.45	17.84	102.86	79.89	-81.18	43.54	83.63	2.15	14.22	49.11	18.05	15.90	12.56	2.07	0.01	0.75	1.56
94	T	C	C	88.46	3.38	10.99	16.14	116.44	103.66	-99.31	132.66	96.80	2.67	0.53	68.04	27.65	1.01	0.34	0.15	0.00	0.78	2.04
95	P	C	C	92.95	3.50	10.08	15.57	116.97	-106.41	-68.06	149.34	99.57	0.37	0.06	86.23	12.96	0.40	0.02	0.03	0.00	0.14	0.22
96	P	C	C	86.83	4.63	8.44	15.11	115.00	-101.67	-65.77	150.00	99.82	0.12	0.06	93.22	6.04	0.57	0.02	0.03	0.00	0.04	0.09
97	P	C	C	107.82	2.13	9.38	13.15	111.19	-99.25	-66.07	146.24	99.49	0.33	0.18	97.12	0.98	1.44	0.04	0.07	0.00	0.08	0.26
98	R	C	C	182.84	1.83	10.09	13.49	108.21	-111.50	-79.88	127.44	99.89	0.08	0.02	99.70	0.14	0.09	0.01	0.00	0.00	0.03	0.03