A0A087XL00_POEFO Loading...

SAM domain, SH3 domain and nuclear localisation signals 1a

AlphaFold DB , UniProt , Accession A0A087XL00, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 665 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	42	Very low	221 Å²	221	122 Å²	122	100%	1.089	67%	0.666	S	S	*	*				0	129.4	0	-155	69.3	88.6	0	0	107.5
2	N	35.7	Very low	41.3	Very low	135 Å²	135	125.5 Å²	125.5	72%	0.722	68%	0.678	S	S	*	*			trans	19.2	149.9	147.7	-57.1	4.9	0	0	0	120.6
3	L	46.4	Very low	40.9	Very low	140 Å²	140	126 Å²	126	73%	0.733	68%	0.68	S	S	*	*			cis	176.6	-175.2	-23	-124.4	159.8	0	0	0	107.2
4	F	41.1	Very low	41	Very low	175 Å²	175	124 Å²	124	77%	0.768	68%	0.68	S	S	*	*			trans	76.5	163.4	163.8	-80.3	-74.6	0	0	0	121.5
5	C	44.8	Very low	40.8	Very low	101 Å²	101	125.7 Å²	125.7	68%	0.682	69%	0.687	S	S	*	*			trans	-130.9	-147.7	-152.3	-62.9	0	0	0	0	113.7
6	F	37.6	Very low	40.4	Very low	144 Å²	144	130.4 Å²	130.4	63%	0.632	69%	0.694	S	S	*	*			trans	73.6	159.3	177.5	-58.7	-82.2	0	0	0	117.3	K395 L397	F6-K395 WeakPolarHBondContact O-CD 3.33Å; F6-K395 PolarHBondContact O-NZ 3.23Å; F6-L397 HydrophobicContact CD1-CD1 3.9Å; F6-L397 HydrophobicContact CE1-CD1 4.12Å
7	S	47.4	Very low	40.3	Very low	46 Å²	46	132.7 Å²	132.7	32%	0.322	70%	0.699	S	S	.	*			cis	-163.8	-163.9	-39.4	-95.8	0	0	0	0	113.3	S396 L397	S7-S396 VanDerWaalsContact C-N 3.35Å; S7-S396 WeakPolarHBondContact CA-O 3.26Å; S7-S396 VanDerWaalsContact CB-O 3.26Å; S7-S396 WeakPolarHBondContact CB-O 3.46Å; S7-S396 PolarHBondContact OG-O 3.08Å; S7-L397 VanDerWaalsContact OG-CD1 3.31Å; S7-L397 WeakPolarHBondContact OG-CD1 3.24Å; S7-L397 WeakPolarHBondContact OG-CG 3.3Å
8	L	51.8	Low	40.3	Very low	82 Å²	82	129.4 Å²	129.4	43%	0.429	70%	0.695	S	S	.	*			trans	-77.4	177.6	-174.6	-121.8	167.8	0	0	0	112.9	K395 S396 L397	L8-K395 WeakPolarHBondContact CG-O 3.33Å; L8-S396 VanDerWaalsContact N-N 3.11Å; L8-L397 HydrophobicContact CB-CB 4.45Å; L8-L397 VanDerWaalsContact CD1-O 3.28Å; L8-L397 WeakPolarHBondContact CD1-O 3.42Å
9	E	43.4	Very low	40	Very low	130 Å²	130	129.2 Å²	129.2	61%	0.607	70%	0.698	S	S	*	*				-168.7	162	74.3	-164.9	44.7	-102.2	0	0	114.1	S398	E9-S398 WeakPolarHBondContact OE2-CB 3.18Å; E9-S398 PolarHBondContact OE2-OG 3.29Å
10	G	39.8	Very low	39.9	Very low	51 Å²	51	131.4 Å²	131.4	53%	0.526	70%	0.703	S	S	.	*			trans	80	142.5	168.3	0	0	0	0	0	116.1
11	S	39.3	Very low	39.5	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	71%	0.712	S	S	*	*			cis	78.3	112.4	17.2	-157.2	0	0	0	0	117.4
12	M	34.5	Very low	39.5	Very low	164 Å²	164	125.9 Å²	125.9	81%	0.808	70%	0.697	S	S	*	*				169.3	136.1	123.6	-90.8	179.7	72	0	0	114.7
13	D	35.1	Very low	39.4	Very low	132 Å²	132	125.7 Å²	125.7	71%	0.706	70%	0.701	S	S	*	*			trans	28.3	117.1	147.5	-58.7	-59	0	0	0	125.4
14	S	42.9	Very low	38.8	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	71%	0.705	S	S	*	*				43.3	118.2	106.5	-158	0	0	0	0	121.4
15	L	37.3	Very low	38.5	Very low	150 Å²	150	121.2 Å²	121.2	79%	0.785	70%	0.701	S	S	*	*				179.7	164.1	104.2	-100	174.5	0	0	0	114.8
16	Y	34.8	Very low	38.2	Very low	201 Å²	201	122.3 Å²	122.3	79%	0.788	71%	0.707	S	S	*	*			trans	87	132.9	163.7	-91.2	-77.5	0	0	0	123.4
17	E	38.6	Very low	38	Very low	169 Å²	169	120.1 Å²	120.1	79%	0.79	72%	0.715	S	S	*	*			trans	-65.2	174.7	179.4	-74.9	-179.2	91.9	0	0	116.9
18	A	41.2	Very low	38.1	Very low	74 Å²	74	123.6 Å²	123.6	61%	0.612	74%	0.737	S	S	*	*			cis	-175.9	-158.4	-23	0	0	0	0	0	108.5
19	V	34.7	Very low	37.4	Very low	124 Å²	124	125.7 Å²	125.7	75%	0.752	76%	0.755	S	S	*	*			trans	77.4	132.8	167.2	-178.9	0	0	0	0	116.3
20	Q	36.8	Very low	37.2	Very low	173 Å²	173	127 Å²	127	81%	0.808	77%	0.765	S	S	*	*			cis	-160.1	135.2	-21.5	-111.2	-179.1	57.4	0	0	108.4
21	S	32	Very low	37	Very low	128 Å²	128	130.3 Å²	130.3	90%	0.895	78%	0.777	S	S	*	*			trans	170.7	128.3	138.7	40.9	0	0	0	0	110
22	S	34.2	Very low	36.5	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	77%	0.774	S	S	*	*			trans	-110.2	170.6	178.4	67.9	0	0	0	0	109.9
23	T	33.9	Very low	36.3	Very low	131 Å²	131	133.2 Å²	133.2	80%	0.804	78%	0.778	S	S	*	*			cis	-148.6	139.8	15.3	-37.4	0	0	0	0	109.4
24	D	32.8	Very low	35.9	Very low	156 Å²	156	132.4 Å²	132.4	83%	0.834	78%	0.782	S	S	*	*			trans	-131.1	150.7	171	-167.5	10.5	0	0	0	109.7
25	G	36.4	Very low	35.1	Very low	65 Å²	65	132.8 Å²	132.8	67%	0.67	79%	0.785	S	S	*	*			trans	-109.8	112.7	-165.2	0	0	0	0	0	113.9
26	P	37.9	Very low	34.7	Very low	124 Å²	124	130.2 Å²	130.2	81%	0.805	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-86.9	153	-178.4	34.2	-35.2	0	0	0	113.7
27	A	34.3	Very low	34.5	Very low	98 Å²	98	128.9 Å²	128.9	81%	0.81	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-84.5	145.9	170.5	0	0	0	0	0	112.4
28	P	48	Very low	34.1	Very low	120 Å²	120	125.8 Å²	125.8	78%	0.779	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-84.4	162.3	176	34.3	-35.3	0	0	0	113.7
29	P	37.8	Very low	33.4	Very low	125 Å²	125	128.7 Å²	128.7	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-92.4	171.2	-171.6	37	-37.5	0	0	0	115.8
30	I	40	Very low	33.2	Very low	158 Å²	158	127.8 Å²	127.8	81%	0.81	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-92.5	134.8	-179.2	-58.5	164.6	0	0	0	111.8
31	P	35.2	Very low	33.3	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-102.4	153.6	154	35.8	-29.4	0	0	0	112.2
32	S	27.8	Very low	33.2	Very low	109 Å²	109	123.3 Å²	123.3	76%	0.762	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-99.7	142	-177	-75.2	0	0	0	0	114.2
33	R	30.7	Very low	33.3	Very low	233 Å²	233	124.1 Å²	124.1	88%	0.879	77%	0.774	S	S	*	*			trans	31.4	117.2	146.2	-66	174.1	141.3	-137.9	-1.9	118.4
34	S	27	Very low	33.2	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	77%	0.77	S	S	*	*				165.7	143.8	101	-72.4	0	0	0	0	115.9
35	S	26.3	Very low	33.2	Very low	106 Å²	106	123.9 Å²	123.9	74%	0.741	77%	0.766	S	S	*	*			trans	70.3	95.6	141.5	-156.7	0	0	0	0	123.1
36	S	27.8	Very low	33.1	Very low	96 Å²	96	126.8 Å²	126.8	67%	0.671	77%	0.766	S	S	*	*				90.8	156.1	120	80	0	0	0	0	123
37	R	30.7	Very low	32.9	Very low	173 Å²	173	126.8 Å²	126.8	65%	0.653	76%	0.76	S	S	*	*			trans	83.3	80.8	161.1	-61.8	-178.2	-172.6	-78.9	-3.3	120.5
38	S	29.8	Very low	32.8	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	75%	0.745	S	S	*	*				17.4	132.2	117.6	62.2	0	0	0	0	120.7
39	C	27.6	Very low	32.1	Very low	136 Å²	136	130 Å²	130	92%	0.919	75%	0.752	S	S	*	*			trans	-136.7	156	144.5	-90	0	0	0	0	110
40	S	30.3	Very low	31.9	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	75%	0.75	S	S	*	*			trans	-117.7	169	-172.7	-54.9	0	0	0	0	112.3
41	P	38.1	Very low	31.7	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	76%	0.758	S	S	*	*				-123.3	144.3	113.7	35.2	-30.9	0	0	0	110.8
42	A	30.4	Very low	31.5	Very low	83 Å²	83	143.3 Å²	143.3	69%	0.686	76%	0.761	S	S	*	*			cis	73.3	124.9	14.9	0	0	0	0	0	113.8
43	V	35.9	Very low	31.6	Very low	126 Å²	126	141.5 Å²	141.5	76%	0.764	76%	0.759	S	S	*	*			cis	-152.3	170	16.4	-159.8	0	0	0	0	110
44	L	32.2	Very low	31.6	Very low	139 Å²	139	136.5 Å²	136.5	73%	0.728	76%	0.76	S	S	*	*			trans	77.5	139.9	163.8	-54.9	176.3	0	0	0	116.7
45	L	33.8	Very low	31.8	Very low	142 Å²	142	134.2 Å²	134.2	74%	0.743	75%	0.754	S	S	*	*			cis	-143.4	123.7	-3.6	-128.5	139.3	0	0	0	105.6
46	D	33.4	Very low	32.3	Very low	127 Å²	127	140.3 Å²	140.3	68%	0.679	76%	0.761	S	S	*	*				56.5	133.2	76.8	-82.4	-30.9	0	0	0	114.3
47	D	34.7	Very low	32.6	Very low	124 Å²	124	141.7 Å²	141.7	66%	0.663	77%	0.771	S	S	*	*			cis	-166.3	176.3	-4.9	-172.1	13.7	0	0	0	110.6
48	N	30.5	Very low	32.9	Very low	96 Å²	96	140.5 Å²	140.5	51%	0.513	78%	0.776	S	S	.	*			trans	75.3	110.4	155.5	-69.2	-67.5	0	0	0	121.2	R50	N48-R50 WeakPolarHBondContact OD1-CD 3.05Å; N48-R50 WeakPolarHBondContact OD1-CG 3.49Å
49	M	35.2	Very low	32.9	Very low	188 Å²	188	140.6 Å²	140.6	93%	0.926	78%	0.777	S	S	*	*				-150.8	68.8	99.2	-149.1	171.9	-171.6	0	0	114.9
50	R	32.8	Very low	33.3	Very low	200 Å²	200	142.1 Å²	142.1	76%	0.755	77%	0.772	S	S	*	*			trans	11.1	112.9	148.2	-38	178.8	83.1	179.2	9.8	118.2	N48	N48-R50 WeakPolarHBondContact OD1-CD 3.05Å; N48-R50 WeakPolarHBondContact OD1-CG 3.49Å
51	W	35.6	Very low	33.4	Very low	260 Å²	260	143.8 Å²	143.8	99%	0.985	77%	0.773	S	S	*	*			trans	-74.2	133	157.5	-77.3	80.7	0	0	0	111.3
52	R	30.8	Very low	33.4	Very low	224 Å²	224	145.4 Å²	145.4	85%	0.845	77%	0.772	S	S	*	*			trans	-144.7	112.2	156.2	-167.5	-160.3	-62.8	-94.8	9.1	108.5
53	G	30.7	Very low	33.9	Very low	70 Å²	70	146.6 Å²	146.6	72%	0.722	77%	0.773	S	S	*	*			trans	-89	170.8	-179.7	0	0	0	0	0	113.9
54	S	30.1	Very low	33.9	Very low	129 Å²	129	148.6 Å²	148.6	90%	0.902	77%	0.773	S	S	*	*			trans	-154.9	148.7	147	-166.2	0	0	0	0	108.9
55	G	30.6	Very low	34.1	Very low	66 Å²	66	148.1 Å²	148.1	68%	0.68	78%	0.777	S	S	*	*			trans	-85.8	169.4	-164.5	0	0	0	0	0	115.6
56	R	37.1	Very low	34	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	78%	0.779	S	S	*	*			trans	-158.5	89.7	150.6	-108	162.4	-170.4	-95.1	-1.1	109.6	I58	R56-I58 PolarHBondContact O-N 2.81Å
57	S	34	Very low	34	Very low	126 Å²	126	147.2 Å²	147.2	88%	0.881	79%	0.785	S	S	*	*			trans	-70.5	108.1	164.9	49.4	0	0	0	0	108.7
58	I	36.6	Very low	33.9	Very low	147 Å²	147	145.2 Å²	145.2	75%	0.754	79%	0.786	S	S	*	*			trans	-86.4	116.1	178.6	-57.3	177	0	0	0	108.3	R56 M60	R56-I58 PolarHBondContact O-N 2.81Å; I58-M60 PolarHBondContact O-N 3.35Å
59	S	31.4	Very low	34	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	80%	0.801	S	S	*	*			trans	-69.4	123.6	169.9	-169	0	0	0	0	109.4	D61	S59-D61 PolarHBondContact O-N 3.06Å
60	M	35.3	Very low	34	Very low	168 Å²	168	143.5 Å²	143.5	83%	0.828	79%	0.789	S	S	*	*			trans	-87.9	94.6	169.9	-78.7	-102.8	57.2	0	0	108.7	I58	I58-M60 PolarHBondContact O-N 3.35Å
61	D	31.5	Very low	34.2	Very low	140 Å²	140	142 Å²	142	75%	0.749	80%	0.795	S	S	*	*			trans	-70.5	149.3	174	-144.4	-41.4	0	0	0	111.1	S59	S59-D61 PolarHBondContact O-N 3.06Å
62	M	38	Very low	34.4	Very low	159 Å²	159	139.1 Å²	139.1	78%	0.783	79%	0.79	S	S	*	*			trans	-103.3	119.2	-170.7	-170.5	70.1	70.6	0	0	110.2	Q64	M62-Q64 PolarHBondContact O-N 2.69Å
63	P	42.3	Very low	34.8	Very low	108 Å²	108	140.4 Å²	140.4	70%	0.701	79%	0.794	S	S	*	*			trans	-68.2	105.1	-171.5	25.7	-34	0	0	0	112.8	T65	P63-T65 PolarHBondContact O-N 2.64Å
64	Q	35.2	Very low	35	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	79%	0.793	S	S	*	*			trans	-72.7	85.9	175.6	-174	-179.3	4.1	0	0	111.5	M62 H66	M62-Q64 PolarHBondContact O-N 2.69Å; Q64-H66 PolarHBondContact O-N 3.12Å
65	T	35.6	Very low	35.2	Very low	130 Å²	130	147.3 Å²	147.3	80%	0.798	79%	0.789	S	S	*	*			trans	-76.3	108	177.4	55.3	0	0	0	0	112	P63 G67	P63-T65 PolarHBondContact O-N 2.64Å; T65-G67 PolarHBondContact O-N 3.23Å
66	H	32.8	Very low	35.4	Very low	170 Å²	170	153.9 Å²	153.9	79%	0.787	79%	0.793	S	S	*	*			trans	-69.1	122	170.1	-85.9	-101.3	0	0	0	111.6	Q64	Q64-H66 PolarHBondContact O-N 3.12Å
67	G	32.5	Very low	35.3	Very low	79 Å²	79	149.1 Å²	149.1	81%	0.814	79%	0.79	S	S	*	*			trans	-119.7	116.6	164.8	0	0	0	0	0	110	T65	T65-G67 PolarHBondContact O-N 3.23Å
68	A	34	Very low	35.1	Very low	83 Å²	83	150.9 Å²	150.9	69%	0.686	78%	0.784	S	S	*	*			trans	-109.5	134.2	-178.2	0	0	0	0	0	111.4
69	N	31.1	Very low	34.9	Very low	152 Å²	152	150.8 Å²	150.8	81%	0.813	78%	0.784	S	S	*	*				-178.4	148.9	108	-94.9	-43.8	0	0	0	114.8
70	S	36.5	Very low	34.8	Very low	96 Å²	96	151.6 Å²	151.6	67%	0.671	79%	0.789	S	S	*	*			trans	35.6	121.8	152.2	63	0	0	0	0	120.7
71	N	36.1	Very low	34.7	Very low	167 Å²	167	152.5 Å²	152.5	89%	0.893	79%	0.789	S	S	*	*				-151.4	133	108.2	-101.9	-45.2	0	0	0	112
72	K	39.7	Very low	34.5	Very low	200 Å²	200	151.1 Å²	151.1	87%	0.87	79%	0.79	S	S	*	*			trans	-76.2	134.3	178.4	-68	176.9	178.3	176.2	0	110.8
73	R	39.8	Very low	34	Very low	251 Å²	251	151.2 Å²	151.2	95%	0.947	79%	0.793	S	S	*	*			trans	-139.3	133.2	132.4	-66.9	-163.6	-179.2	-172.5	1.6	108.5
74	D	34.3	Very low	33.3	Very low	131 Å²	131	150.5 Å²	150.5	70%	0.701	79%	0.791	S	S	*	*			trans	-95.4	176.7	-176.1	-148.1	-38.6	0	0	0	110.7
75	R	34.8	Very low	33	Very low	214 Å²	214	149 Å²	149	81%	0.808	79%	0.788	S	S	*	*			trans	-38.6	156.8	171.7	-63.1	154.8	175.8	136.1	-12.3	112.8
76	R	34.5	Very low	32.7	Very low	203 Å²	203	149.9 Å²	149.9	77%	0.766	79%	0.788	S	S	*	*			cis	-168.1	159.2	49.9	-157.3	173.9	-168.8	155.3	2.9	112.9	H78	R76-H78 PolarHBondContact O-CD2 3.46Å; R76-H78 VanDerWaalsContact O-CD2 3.31Å
77	T	34.4	Very low	32.6	Very low	134 Å²	134	149.8 Å²	149.8	82%	0.822	79%	0.788	S	S	*	*			trans	-70.4	130.8	162.8	44.4	0	0	0	0	110.7
78	H	30.6	Very low	32.7	Very low	164 Å²	164	151.4 Å²	151.4	76%	0.759	78%	0.782	S	S	*	*			trans	-110.6	120.2	177.1	-76.3	-90.6	0	0	0	111.5	R76	R76-H78 PolarHBondContact O-CD2 3.46Å; R76-H78 VanDerWaalsContact O-CD2 3.31Å
79	I	31.6	Very low	32.3	Very low	144 Å²	144	155.4 Å²	155.4	74%	0.738	79%	0.791	S	S	*	*			trans	-68.2	145.6	167.4	-66.6	162.8	0	0	0	108.9	K81	I79-K81 HydrophobicContact CG2-CG 3.95Å
80	S	30.8	Very low	32.2	Very low	123 Å²	123	155.8 Å²	155.8	86%	0.86	79%	0.793	S	S	*	*			trans	-120.4	132.6	157.5	-69.8	0	0	0	0	109.3
81	K	31.9	Very low	32	Very low	188 Å²	188	157.9 Å²	157.9	82%	0.817	80%	0.796	S	S	*	*			trans	-135.8	126	176.4	-83.7	-173	175.4	-172.8	0	109.7	I79	I79-K81 HydrophobicContact CG2-CG 3.95Å
82	S	28.8	Very low	32.5	Very low	111 Å²	111	156.1 Å²	156.1	78%	0.776	79%	0.794	S	S	*	*			trans	-143.8	129.9	154.5	-57	0	0	0	0	104.8
83	L	27.1	Very low	31.9	Very low	160 Å²	160	149.7 Å²	149.7	84%	0.838	78%	0.784	S	S	*	*				59.3	123.7	63.3	-57.8	169.9	0	0	0	110.2
84	S	27.9	Very low	31.3	Very low	94 Å²	94	143.2 Å²	143.2	66%	0.657	78%	0.776	S	S	*	*			cis	-154.1	-171.5	7.3	-143.9	0	0	0	0	109
85	D	28.1	Very low	31.2	Very low	135 Å²	135	144.6 Å²	144.6	72%	0.722	78%	0.784	S	S	*	*			cis	-152.2	169.1	15.9	-92.6	-49.3	0	0	0	111.5
86	N	29.5	Very low	31	Very low	149 Å²	149	139 Å²	139	80%	0.797	78%	0.783	S	S	*	*			trans	76.1	129.9	169.6	97.9	67.9	0	0	0	116.5
87	E	31.3	Very low	30.8	Very low	168 Å²	168	133.4 Å²	133.4	79%	0.785	78%	0.78	S	S	*	*			cis	67.4	140.8	16.1	-53.8	-156.4	127.7	0	0	116.8
88	T	33.3	Very low	30.6	Very low	112 Å²	112	139.1 Å²	139.1	69%	0.687	79%	0.787	S	S	*	*			cis	-158.5	144.4	-18.9	21.9	0	0	0	0	107
89	L	26.7	Very low	30.4	Very low	167 Å²	167	138.2 Å²	138.2	87%	0.874	78%	0.783	S	S	*	*			trans	-148.1	122.5	158.3	-72.1	180	0	0	0	106.2
90	D	29.5	Very low	30	Very low	161 Å²	161	141.2 Å²	141.2	86%	0.861	79%	0.785	S	S	*	*				-138.8	147.6	58.4	-114.8	-41.8	0	0	0	113.9
91	N	30.5	Very low	29.8	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	77%	0.773	S	S	*	*			trans	-147.2	117.6	173	-176.9	23.5	0	0	0	108.9	G93	N91-G93 PolarHBondContact O-N 3.12Å; N91-G93 VanDerWaalsContact O-N 3.07Å
92	P	46.7	Very low	29.6	Very low	131 Å²	131	140.9 Å²	140.9	85%	0.851	78%	0.775	S	S	*	*			trans	-75.8	101.3	-169.7	29.1	-34.6	0	0	0	112.4
93	G	27.6	Very low	29.6	Very low	64 Å²	64	140.8 Å²	140.8	66%	0.66	78%	0.775	S	S	*	*			trans	-152.5	82	-176.6	0	0	0	0	0	115.8	N91	N91-G93 PolarHBondContact O-N 3.12Å; N91-G93 VanDerWaalsContact O-N 3.07Å
94	C	28.2	Very low	29.6	Very low	116 Å²	116	142.7 Å²	142.7	78%	0.784	77%	0.771	S	S	*	*			trans	63.1	110.5	155.2	-64.9	0	0	0	0	121.3
95	N	30.6	Very low	29.6	Very low	159 Å²	159	143.7 Å²	143.7	85%	0.85	77%	0.765	S	S	*	*			trans	80.6	154.9	136.1	-65.1	-37.3	0	0	0	122.6
96	A	31.3	Very low	29.6	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	77%	0.769	S	S	*	*			trans	70.2	69.1	157	0	0	0	0	0	119.7
97	A	30.6	Very low	29.6	Very low	86 Å²	86	144.3 Å²	144.3	71%	0.711	77%	0.767	S	S	*	*				27.1	153.1	118.2	0	0	0	0	0	122.9
98	W	29.3	Very low	29.8	Very low	254 Å²	254	142.3 Å²	142.3	96%	0.962	76%	0.761	S	S	*	*			trans	108.2	133.7	162.7	-66.5	95.2	0	0	0	117.9
99	Q	27.3	Very low	29.7	Very low	145 Å²	145	144.5 Å²	144.5	68%	0.678	76%	0.763	S	S	*	*			trans	-93.8	164.5	168.3	-59.4	179.5	9.8	0	0	109.5
100	R	24	Very low	29.9	Very low	208 Å²	208	144.4 Å²	144.4	79%	0.785	76%	0.762	S	S	*	*				145.6	129.4	97	-161.1	145.6	-175.4	89.4	5.6	115.6
101	A	25.5	Very low	30.2	Very low	72 Å²	72	142.4 Å²	142.4	60%	0.595	76%	0.755	S	S	*	*			trans	47	132.5	141.9	0	0	0	0	0	124.4
102	R	28.9	Very low	30.1	Very low	232 Å²	232	143 Å²	143	88%	0.875	76%	0.759	S	S	*	*				66.1	143.8	129.3	-72.7	-179.1	176.5	-158.3	-0.8	121.5
103	S	27.9	Very low	29.4	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	76%	0.755	S	S	*	*			trans	65.4	161.1	165.5	63.9	0	0	0	0	114.1
104	R	26.6	Very low	29.6	Very low	200 Å²	200	147.9 Å²	147.9	76%	0.755	76%	0.757	S	S	*	*			cis	-155.9	158.1	29	-175.6	81.8	-160.2	-59.6	-16.1	111.3
105	E	28.4	Very low	29.5	Very low	114 Å²	114	148.1 Å²	148.1	53%	0.533	75%	0.751	S	S	.	*			trans	-52	147	172.4	-48.9	79	-97.3	0	0	117
106	D	28.3	Very low	29.6	Very low	151 Å²	151	147.6 Å²	147.6	81%	0.807	74%	0.743	S	S	*	*			trans	69.8	166	141.5	-65.1	-18.8	0	0	0	124.3
107	L	30.2	Very low	29.7	Very low	146 Å²	146	148.8 Å²	148.8	76%	0.764	73%	0.732	S	S	*	*			trans	78.9	111.8	171.2	-90.8	46.8	0	0	0	117.2
108	I	33.6	Very low	29.7	Very low	127 Å²	127	150.3 Å²	150.3	65%	0.651	73%	0.726	S	S	*	*				89.9	137.1	75.2	-91.8	179.9	0	0	0	112.1
109	H	31.2	Very low	29.8	Very low	157 Å²	157	149.3 Å²	149.3	73%	0.727	72%	0.722	S	S	*	*			cis	-151.5	169.3	-3.2	-96.3	-47.3	0	0	0	107.6
110	I	32.8	Very low	30.2	Very low	165 Å²	165	150.3 Å²	150.3	85%	0.846	72%	0.724	S	S	*	*			trans	-168.2	158.4	130.5	-101.6	156.2	0	0	0	111
111	T	33.8	Very low	31.4	Very low	119 Å²	119	145.5 Å²	145.5	73%	0.73	72%	0.72	S	S	*	*			trans	-80.7	-179	-177.3	53.2	0	0	0	0	111.4
112	N	29.4	Very low	31.7	Very low	152 Å²	152	150.9 Å²	150.9	81%	0.813	73%	0.73	S	S	*	*			cis	-162	-171.4	33.6	-154.7	3.1	0	0	0	114.2
113	N	32	Very low	31.8	Very low	144 Å²	144	148.7 Å²	148.7	77%	0.77	73%	0.729	S	S	*	*			trans	-111.6	157.3	-157.1	-119.5	-43.1	0	0	0	115.8
114	H	32.3	Very low	31.7	Very low	153 Å²	153	154.8 Å²	154.8	71%	0.708	74%	0.736	S	S	*	*			trans	65.9	114.2	140.3	-153.1	69.1	0	0	0	122.9
115	N	26.2	Very low	31.9	Very low	121 Å²	121	150 Å²	150	65%	0.647	74%	0.739	S	S	*	*				44	163.3	123.3	-153.5	26.3	0	0	0	124.2
116	E	32.1	Very low	32	Very low	149 Å²	149	150.8 Å²	150.8	70%	0.696	75%	0.747	S	S	*	*			trans	76.5	146.6	160.7	-64	-131.8	131.3	0	0	119
117	E	32.9	Very low	32.3	Very low	121 Å²	121	151.4 Å²	151.4	57%	0.565	74%	0.742	S	S	*	*			cis	-162.6	179.4	-16.3	-162	-131.8	134.6	0	0	109.9
118	M	30.7	Very low	32.4	Very low	118 Å²	118	154.4 Å²	154.4	58%	0.581	75%	0.749	S	S	*	*			trans	81.4	150.8	161.3	-49.4	-155	178.5	0	0	119
119	R	32.4	Very low	32.3	Very low	232 Å²	232	152.5 Å²	152.5	88%	0.875	76%	0.761	S	S	*	*			cis	-133.7	155.4	17.5	-78.5	-177.5	170.9	101.1	7.7	116.3
120	K	35.4	Very low	32.3	Very low	166 Å²	166	148.7 Å²	148.7	72%	0.722	77%	0.765	S	S	*	*			trans	-51.9	174.6	166	-72.5	153.1	179.3	145.1	0	114
121	P	48.5	Very low	32.3	Very low	108 Å²	108	151.3 Å²	151.3	70%	0.701	77%	0.77	S	S	*	*			cis	-152.7	164.1	29.3	42.2	-20	0	0	0	122.5
122	K	31.6	Very low	32.2	Very low	185 Å²	185	149.6 Å²	149.6	80%	0.804	78%	0.776	S	S	*	*			trans	47.2	128.7	140.7	-66.4	174.7	179	178.5	0	121.6
123	H	30.8	Very low	32.3	Very low	185 Å²	185	146.1 Å²	146.1	86%	0.856	78%	0.776	S	S	*	*				-157.9	171.5	86.5	-118.6	-93.7	0	0	0	113
124	R	26.9	Very low	32.3	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	78%	0.776	S	S	*	*			trans	-145.4	119.9	-169.2	172.5	-170.7	-179.9	178.6	2.4	111.9
125	A	30.1	Very low	32.4	Very low	100 Å²	100	147 Å²	147	83%	0.826	78%	0.775	S	S	*	*			trans	-177.6	164.7	159	0	0	0	0	0	110.2
126	D	31	Very low	32.5	Very low	130 Å²	130	148.9 Å²	148.9	70%	0.695	79%	0.785	S	S	*	*			cis	-169.9	168	-39.8	-171.2	16.8	0	0	0	108.3
127	K	35.5	Very low	32.4	Very low	164 Å²	164	145.2 Å²	145.2	71%	0.713	79%	0.788	S	S	*	*			trans	75.1	102.5	158.7	-49	-166.6	-176.3	172.7	0	121.6
128	K	32.1	Very low	32.5	Very low	209 Å²	209	145.2 Å²	145.2	91%	0.909	80%	0.796	S	S	*	*				50.5	128.7	114.1	-66	-178.1	175.3	-175.9	0	121.2
129	G	31.2	Very low	32.7	Very low	87 Å²	87	148.6 Å²	148.6	90%	0.897	81%	0.807	S	S	*	*			trans	134	138.8	146.3	0	0	0	0	0	113.6
130	G	31.7	Very low	32.7	Very low	78 Å²	78	146.4 Å²	146.4	80%	0.804	80%	0.804	S	S	*	*			cis	-178	150	-5.5	0	0	0	0	0	112.6
131	K	31.9	Very low	32.6	Very low	219 Å²	219	147.2 Å²	147.2	95%	0.952	81%	0.808	S	S	*	*			trans	-32.8	149.5	-179.1	-61.4	175.4	172.9	-177.8	0	118.4
132	G	30.9	Very low	31.6	Very low	83 Å²	83	149.6 Å²	149.6	86%	0.856	81%	0.809	S	S	*	*			trans	139.4	165.6	134.8	0	0	0	0	0	116.7
133	G	31.8	Very low	31.7	Very low	79 Å²	79	148.3 Å²	148.3	81%	0.814	80%	0.804	S	S	*	*			trans	129.3	11.9	160.8	0	0	0	0	0	119.5
134	H	32	Very low	31.7	Very low	166 Å²	166	146 Å²	146	77%	0.769	79%	0.793	S	S	*	*			trans	-54.2	155.9	178	-74.7	-70.9	0	0	0	117
135	H	35.1	Very low	32.1	Very low	151 Å²	151	140.8 Å²	140.8	70%	0.699	78%	0.779	S	S	*	*			trans	93	124.3	147.8	-50	-51.6	0	0	0	122.1
136	N	28.7	Very low	32	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	78%	0.782	S	S	*	*				50.9	133.2	127.9	-53.9	-7.2	0	0	0	123.1
137	G	29.6	Very low	32	Very low	73 Å²	73	142.9 Å²	142.9	75%	0.753	78%	0.782	S	S	*	*			trans	-168.7	143.8	159.9	0	0	0	0	0	112.5
138	T	35.3	Very low	31.9	Very low	121 Å²	121	144 Å²	144	74%	0.742	79%	0.789	S	S	*	*			trans	-146.8	160.7	-174.9	63.2	0	0	0	0	114.4
139	K	33.5	Very low	31.7	Very low	188 Å²	188	138.7 Å²	138.7	82%	0.817	78%	0.779	S	S	*	*			trans	96.8	133.1	154.3	-64.2	161.4	-177.1	171.8	0	121.4
140	K	34.2	Very low	31.6	Very low	187 Å²	187	139.5 Å²	139.5	81%	0.813	77%	0.766	S	S	*	*			trans	70.3	110	136.6	-79.5	-174.1	172.9	-176.5	0	123.2
141	K	32.6	Very low	31.6	Very low	183 Å²	183	144 Å²	144	80%	0.796	77%	0.766	S	S	*	*				58.2	113.2	102.5	-172.7	-152.8	176.7	-169.2	0	121.1
142	E	27.4	Very low	31.6	Very low	158 Å²	158	138 Å²	138	74%	0.738	75%	0.752	S	S	*	*				-163.8	131	127.9	-155	136.5	143.5	0	0	108.8
143	K	34.1	Very low	31.5	Very low	158 Å²	158	141.8 Å²	141.8	69%	0.687	75%	0.753	S	S	*	*				55.4	139.3	84.8	-134.1	-162.4	168.6	-151.5	0	113.5
144	Q	30.8	Very low	31.5	Very low	135 Å²	135	141.2 Å²	141.2	63%	0.631	75%	0.747	S	S	*	*			cis	-152.7	159.3	26	-27.3	-175.1	-11.9	0	0	115.6
145	Q	35.2	Very low	31.3	Very low	129 Å²	129	139.8 Å²	139.8	60%	0.603	75%	0.749	S	S	*	*			trans	43.1	142.6	138.8	-71	163.4	-90.2	0	0	121.6
146	T	27.3	Very low	31.3	Very low	144 Å²	144	139.9 Å²	139.9	88%	0.883	75%	0.753	S	S	*	*				-143.2	-177.7	68.5	42.8	0	0	0	0	115.6
147	N	31.9	Very low	31.4	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	76%	0.755	S	S	*	*			trans	-120	153.9	-164.7	-49.6	-61.8	0	0	0	115
148	Q	32.3	Very low	31.6	Very low	187 Å²	187	141.6 Å²	141.6	87%	0.874	75%	0.747	S	S	*	*				175.1	139.5	119.2	-93	179.1	99.4	0	0	109.4
149	S	27.5	Very low	32	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	75%	0.748	S	S	*	*				101.3	130.1	50.9	-152	0	0	0	0	110.1
150	V	30.2	Very low	31.8	Very low	104 Å²	104	139.8 Å²	139.8	63%	0.63	74%	0.741	S	S	*	*			cis	-163.1	148.6	1	102.7	0	0	0	0	113.6
151	H	32.2	Very low	31.6	Very low	171 Å²	171	136.8 Å²	136.8	79%	0.792	74%	0.743	S	S	*	*			trans	48.1	163.1	155	-56.6	-40.9	0	0	0	122.7
152	S	30.7	Very low	31.4	Very low	95 Å²	95	132.3 Å²	132.3	66%	0.664	74%	0.74	S	S	*	*			cis	-151.6	142.3	3.8	41.8	0	0	0	0	114.2
153	N	30	Very low	31.5	Very low	162 Å²	162	128.8 Å²	128.8	87%	0.866	74%	0.738	S	S	*	*			trans	46.6	144.2	136.8	-47.4	-15	0	0	0	122.2
154	G	30.4	Very low	31.3	Very low	67 Å²	67	130.7 Å²	130.7	69%	0.691	75%	0.747	S	S	*	*			cis	162.1	172.3	-4.5	0	0	0	0	0	113.8
155	V	28.8	Very low	31.1	Very low	136 Å²	136	132.4 Å²	132.4	82%	0.824	75%	0.752	S	S	*	*			trans	69.7	120.1	175.1	-169.9	0	0	0	0	115.1
156	I	34.5	Very low	30.9	Very low	152 Å²	152	132.6 Å²	132.6	78%	0.779	76%	0.757	S	S	*	*			cis	89.9	106.5	21.7	-52.3	172.4	0	0	0	116
157	T	30.9	Very low	31	Very low	144 Å²	144	133.1 Å²	133.1	88%	0.883	75%	0.749	S	S	*	*			trans	-154.6	135.8	130.8	23.9	0	0	0	0	110.7
158	E	33.6	Very low	30.9	Very low	124 Å²	124	134.6 Å²	134.6	58%	0.579	75%	0.75	S	S	*	*			trans	-125.4	165.2	161.5	-145.9	-152.8	-126.5	0	0	106.1	K160	E158-K160 IonicContact OE1-NZ 2.69Å; E158-K160 PolarHBondContact OE1-NZ 2.7Å; E158-K160 WeakPolarHBondContact OE2-CG 3.35Å; E158-K160 PolarHBondContact OE2-N 3.35Å; E158-K160 IonicContact OE2-NZ 3.54Å; E158-K160 PolarHBondContact OE2-NZ 3.36Å
159	P	43.5	Very low	30.7	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	75%	0.745	S	S	*	*				-149.4	157.2	78.3	37.7	-18.3	0	0	0	117.9
160	K	30.4	Very low	30.7	Very low	152 Å²	152	131.7 Å²	131.7	66%	0.661	75%	0.751	S	S	*	*			trans	-45.4	153.4	161.1	-63.6	146.7	-175.7	67.6	0	114.7	E158	E158-K160 IonicContact OE1-NZ 2.69Å; E158-K160 PolarHBondContact OE1-NZ 2.7Å; E158-K160 WeakPolarHBondContact OE2-CG 3.35Å; E158-K160 PolarHBondContact OE2-N 3.35Å; E158-K160 IonicContact OE2-NZ 3.54Å; E158-K160 PolarHBondContact OE2-NZ 3.36Å
161	S	28.9	Very low	30.8	Very low	124 Å²	124	137.1 Å²	137.1	87%	0.867	77%	0.766	S	S	*	*				174.7	-179.6	103	53.9	0	0	0	0	113.1
162	A	28.6	Very low	31	Very low	88 Å²	88	138.1 Å²	138.1	73%	0.727	77%	0.768	S	S	*	*				-166.9	142.8	-83.8	0	0	0	0	0	112.3
163	A	29.9	Very low	31.7	Very low	84 Å²	84	139.1 Å²	139.1	69%	0.694	77%	0.772	S	S	*	*			trans	76.7	131.5	149	0	0	0	0	0	122.4
164	K	29.4	Very low	31.8	Very low	199 Å²	199	135.1 Å²	135.1	87%	0.865	77%	0.769	S	S	*	*			trans	71.1	143.7	146.9	-67.3	162.4	-175.8	172.7	0	118
165	K	27.2	Very low	31.8	Very low	171 Å²	171	135.2 Å²	135.2	74%	0.743	77%	0.77	S	S	*	*			cis	135.3	140.8	-3.7	167.1	-179.7	173.4	-179.6	0	108
166	N	29.6	Very low	32.2	Very low	133 Å²	133	139.3 Å²	139.3	71%	0.711	77%	0.771	S	S	*	*			trans	94	156.1	176.3	-59.6	-32.8	0	0	0	115.3
167	Q	31.2	Very low	32	Very low	154 Å²	154	138 Å²	138	72%	0.72	78%	0.775	S	S	*	*			cis	-167.4	156.2	-41.8	-146.7	-170.2	40.8	0	0	109.8
168	K	29.6	Very low	32	Very low	161 Å²	161	134.3 Å²	134.3	70%	0.7	77%	0.766	S	S	*	*			trans	76.6	137.2	153.5	-84.7	-175.6	177.2	177.8	0	122.3
169	N	27.4	Very low	32.1	Very low	146 Å²	146	137.3 Å²	137.3	78%	0.781	78%	0.777	S	S	*	*			trans	70.3	102.3	139.6	-63.9	11.6	0	0	0	121.3
170	G	28.1	Very low	31.6	Very low	78 Å²	78	137.1 Å²	137.1	80%	0.804	77%	0.769	S	S	*	*			trans	-96	-161.9	159.5	0	0	0	0	0	114
171	K	31.5	Very low	31.7	Very low	219 Å²	219	136 Å²	136	95%	0.952	78%	0.775	S	S	*	*			trans	-156.1	173.8	174.2	-113.3	175.1	-178.2	-179.8	0	112.6
172	K	37	Very low	32	Very low	192 Å²	192	134.5 Å²	134.5	84%	0.835	76%	0.764	S	S	*	*			trans	-138.2	158.1	-173.5	-113.3	-166.3	-178.1	-169.2	0	112.4
173	P	44.5	Very low	32.2	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	77%	0.768	S	S	*	*			trans	-98	179.5	133.2	-18.3	35.1	0	0	0	112.6
174	G	32.2	Very low	32.4	Very low	78 Å²	78	144.4 Å²	144.4	80%	0.804	78%	0.775	S	S	*	*			cis	107.2	122.2	-1.6	0	0	0	0	0	113.7
175	G	31.1	Very low	32.4	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	76%	0.761	S	S	*	*			cis	164.3	-177.6	-11.7	0	0	0	0	0	114.3
176	R	36.8	Very low	32.9	Very low	222 Å²	222	138.5 Å²	138.5	84%	0.838	76%	0.762	S	S	*	*			trans	71.2	152	170.5	-53.9	-179.6	177	-165.1	-1.8	114.8	E352	R176-E352 IonicContact NH2-OE2 3.34Å
177	S	30.1	Very low	33.1	Very low	124 Å²	124	138.2 Å²	138.2	87%	0.867	76%	0.76	S	S	*	*			cis	-150.9	169.8	-2.7	46.4	0	0	0	0	109.2
178	G	32.3	Very low	33	Very low	66 Å²	66	138.3 Å²	138.3	68%	0.68	77%	0.766	S	S	*	*			cis	159.9	162.6	-8.4	0	0	0	0	0	112.5
179	K	35.8	Very low	33.1	Very low	188 Å²	188	142.5 Å²	142.5	82%	0.817	78%	0.777	S	S	*	*			trans	72.5	150.7	167.6	-65.8	-179.4	152.7	-95.1	0	118.1
180	D	32	Very low	33.4	Very low	116 Å²	116	141.6 Å²	141.6	62%	0.62	78%	0.777	S	S	*	*			cis	-159.9	179.6	-11.6	-112.6	-29.2	0	0	0	112.4
181	V	32.5	Very low	33.5	Very low	127 Å²	127	142.7 Å²	142.7	77%	0.77	77%	0.772	S	S	*	*			trans	77	103	167.5	-166.4	0	0	0	0	116
182	S	35	Very low	33.6	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	76%	0.762	S	S	*	*				66.4	142.4	83.8	-81.7	0	0	0	0	116
183	K	33.7	Very low	34.4	Very low	185 Å²	185	134 Å²	134	80%	0.804	76%	0.76	S	S	*	*			cis	-166.7	147.5	11.7	-123.8	160.9	-166.8	170.1	0	112.8
184	K	32.6	Very low	35	Very low	196 Å²	196	133.7 Å²	133.7	85%	0.852	76%	0.758	S	S	*	*			trans	66.6	151.4	143.1	-143.3	171.3	-174.4	-177.8	0	119.1
185	S	30.9	Very low	34.8	Very low	81 Å²	81	139.9 Å²	139.9	57%	0.566	76%	0.763	S	S	*	*			cis	-171.4	168.8	-37.3	-170.1	0	0	0	0	111.7
186	H	37.7	Very low	34.9	Very low	164 Å²	164	142.1 Å²	142.1	76%	0.759	76%	0.763	S	S	*	*			trans	84.3	164.2	160.9	-59.4	-59.4	0	0	0	120.8
187	N	32.1	Very low	34.5	Very low	127 Å²	127	138.9 Å²	138.9	68%	0.679	76%	0.759	S	S	*	*			trans	-124.2	155.5	-148.1	-68.7	-15.4	0	0	0	114.4
188	N	30.9	Very low	34.6	Very low	156 Å²	156	137.4 Å²	137.4	83%	0.834	75%	0.749	S	S	*	*			trans	2.5	128.1	149.8	-52.7	-4.3	0	0	0	119.4
189	R	31.1	Very low	36.2	Very low	250 Å²	250	139.9 Å²	139.9	94%	0.943	75%	0.753	S	S	*	*				-148.9	167.9	127.8	-130.4	-178.5	-176.5	-129	-1.1	113
190	V	33.3	Very low	36.8	Very low	127 Å²	127	136.4 Å²	136.4	77%	0.77	75%	0.749	S	S	*	*			trans	-98.9	165.4	-155.5	179.7	0	0	0	0	112.5
191	S	30.2	Very low	36.8	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	76%	0.759	S	S	*	*			trans	70.1	97.6	158.4	48.8	0	0	0	0	120.7
192	S	34.7	Very low	36.6	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	76%	0.76	S	S	*	*				1.3	164.3	119	61.7	0	0	0	0	121
193	P	53.8	Low	37.4	Very low	122 Å²	122	140.4 Å²	140.4	79%	0.792	76%	0.758	S	S	*	*			cis	-127.5	-114.5	10.7	25.9	1.8	0	0	0	115.2
194	P	57.2	Low	37.3	Very low	108 Å²	108	139.5 Å²	139.5	70%	0.701	76%	0.757	S	S	*	*				-128.3	160.7	-129.9	39.5	-20.2	0	0	0	117
195	K	27.7	Very low	37.3	Very low	209 Å²	209	140.2 Å²	140.2	91%	0.909	76%	0.755	S	S	*	*			trans	-168.7	156.5	140.2	-112.8	161.5	-173.1	176.8	0	116.5
196	T	33.5	Very low	37.7	Very low	117 Å²	117	143.2 Å²	143.2	72%	0.718	76%	0.764	S	S	*	*			trans	-74	167.3	178.1	-23.1	0	0	0	0	113.8
197	M	28.3	Very low	37.2	Very low	153 Å²	153	141.8 Å²	141.8	75%	0.754	76%	0.762	S	S	*	*			trans	116.2	100.3	153.1	-64.6	-75.2	95.7	0	0	118.6
198	S	31.1	Very low	37.4	Very low	94 Å²	94	141.1 Å²	141.1	66%	0.657	76%	0.763	S	S	*	*				74	155	111.8	-55.5	0	0	0	0	122.2
199	P	65.8	Low	38.3	Very low	118 Å²	118	139.2 Å²	139.2	77%	0.766	76%	0.759	S	S	*	*			trans	-95.6	-169.2	-171.5	41.2	-37.5	0	0	0	113.2
200	P	48.2	Very low	38.2	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	75%	0.753	S	S	*	*				-149.5	163.4	98.1	40.1	-24.9	0	0	0	116.5
201	L	33.2	Very low	38	Very low	156 Å²	156	137 Å²	137	82%	0.817	75%	0.752	S	S	*	*				178	110.6	119.8	-94.4	168	0	0	0	112.2
202	E	28.2	Very low	38	Very low	171 Å²	171	137.4 Å²	137.4	80%	0.799	75%	0.754	S	S	*	*			trans	15.7	167.6	136.7	-90.9	-163.4	108.3	0	0	124.8
203	P	51.3	Low	38.2	Very low	93 Å²	93	143.1 Å²	143.1	60%	0.604	76%	0.76	S	S	*	*			cis	-136.6	-177.3	-1.5	32.7	-10.9	0	0	0	117
204	Q	31.6	Very low	37.8	Very low	167 Å²	167	143.6 Å²	143.6	78%	0.78	76%	0.763	S	S	*	*			trans	76.9	139	164.9	-55.4	-172.3	0.2	0	0	117.6
205	Y	32.2	Very low	36.7	Very low	210 Å²	210	145.3 Å²	145.3	82%	0.824	77%	0.766	S	S	*	*			cis	-131.2	163.5	7.2	-131.3	-83	0	0	0	112.5
206	L	38.9	Very low	36.9	Very low	144 Å²	144	145.8 Å²	145.8	75%	0.754	76%	0.762	S	S	*	*			trans	-95.1	169.8	-178.2	-69.2	161.1	0	0	0	112.1
207	D	28.3	Very low	37.3	Very low	135 Å²	135	151.2 Å²	151.2	72%	0.722	77%	0.769	S	S	*	*			cis	-150	-177	10.2	-140.2	-36.8	0	0	0	113.9
208	V	36.8	Very low	37.4	Very low	113 Å²	113	151.1 Å²	151.1	69%	0.685	77%	0.771	S	S	*	*			trans	-132.8	151.1	-159	166	0	0	0	0	111.5
209	P	49.1	Very low	37.3	Very low	116 Å²	116	156.7 Å²	156.7	75%	0.753	78%	0.779	S	S	*	*				-156.3	129.1	108.2	36.4	-15	0	0	0	119.2
210	Y	28.9	Very low	35.8	Very low	208 Å²	208	159 Å²	159	82%	0.816	78%	0.784	S	S	*	*			trans	59	167.7	139.8	-78.9	-95.2	0	0	0	120.1
211	T	29.6	Very low	34.8	Very low	122 Å²	122	156.1 Å²	156.1	75%	0.748	78%	0.776	S	S	*	*			cis	-148.8	148.1	14.8	-23.9	0	0	0	0	113.8
212	S	29.7	Very low	35	Very low	108 Å²	108	158.6 Å²	158.6	76%	0.755	78%	0.78	S	S	*	*			trans	22.2	142.2	148.1	-146.3	0	0	0	0	124.2
213	R	39.3	Very low	35.2	Very low	228 Å²	228	155.5 Å²	155.5	86%	0.86	78%	0.777	S	S	*	*			trans	-72.2	161.4	148	-79.3	-169.9	173	-158.4	-1.1	111.5
214	P	44.8	Very low	34.3	Very low	131 Å²	131	156.3 Å²	156.3	85%	0.851	79%	0.785	S	S	*	*				-140.1	-157.3	116.3	40	-27.5	0	0	0	113.6
215	D	33.4	Very low	34.5	Very low	145 Å²	145	154.4 Å²	154.4	78%	0.775	79%	0.785	S	S	*	*			trans	-119.6	170.3	-173.4	177.2	35	0	0	0	112
216	R	32.9	Very low	34.6	Very low	219 Å²	219	151.8 Å²	151.8	83%	0.826	78%	0.784	S	S	*	*			trans	83.9	123	167.1	-74.5	-175.2	165.5	-152.9	-4	121.9
217	R	41.6	Very low	35.1	Very low	231 Å²	231	150.5 Å²	150.5	87%	0.872	79%	0.785	S	S	*	*			trans	-17.3	145.4	153.1	-51.5	170.8	178.6	172.4	-2.8	117.8
218	L	30.5	Very low	35.3	Very low	150 Å²	150	150 Å²	150	79%	0.785	79%	0.786	S	S	*	*				178.1	162	105.7	-99.4	171.9	0	0	0	116.3
219	Y	28.4	Very low	35.9	Very low	212 Å²	212	149.8 Å²	149.8	83%	0.831	79%	0.787	S	S	*	*			trans	78.9	172.1	157.3	-88.9	-68.2	0	0	0	122.9
220	L	35	Very low	34.8	Very low	165 Å²	165	151.1 Å²	151.1	86%	0.864	79%	0.788	S	S	*	*			trans	-156.9	141.3	-141.3	164.6	74.6	0	0	0	110.8
221	G	27	Very low	34.8	Very low	55 Å²	55	148.1 Å²	148.1	57%	0.567	79%	0.786	S	S	*	*			trans	166.3	119.6	156	0	0	0	0	0	119.6
222	K	36.4	Very low	34.8	Very low	207 Å²	207	147.3 Å²	147.3	90%	0.9	79%	0.786	S	S	*	*				64.1	142.9	127.7	-62.2	168.8	-173.2	178.6	0	118.8
223	S	32.7	Very low	35	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	79%	0.787	S	S	*	*			cis	-175	162.2	1.3	42	0	0	0	0	113.2
224	S	32.6	Very low	35.3	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	78%	0.784	S	S	*	*			trans	77.2	153.5	157.5	-140.5	0	0	0	0	117
225	T	35.7	Very low	34.5	Very low	127 Å²	127	141.1 Å²	141.1	78%	0.779	78%	0.776	S	S	*	*			cis	-143.8	162.6	12.2	-46.7	0	0	0	0	113
226	L	35.1	Very low	34.5	Very low	156 Å²	156	145.6 Å²	145.6	82%	0.817	78%	0.783	S	S	*	*			trans	-74.6	-179.1	169.5	-79.7	172.5	0	0	0	112.7
227	P	49.6	Very low	34.3	Very low	117 Å²	117	141 Å²	141	76%	0.76	78%	0.782	S	S	*	*			cis	-142	-174.4	19.6	44.6	-24.6	0	0	0	118.8
228	T	32.5	Very low	34	Very low	123 Å²	123	136.9 Å²	136.9	76%	0.755	78%	0.783	S	S	*	*			trans	-84.3	173.8	165.6	52.9	0	0	0	0	111.9
229	P	48.1	Very low	34	Very low	109 Å²	109	136.2 Å²	136.2	71%	0.708	78%	0.78	S	S	*	*				-152.8	170.6	92.4	41.1	-22.4	0	0	0	118.2
230	D	26.1	Very low	34.3	Very low	144 Å²	144	134 Å²	134	77%	0.77	78%	0.779	S	S	*	*			trans	51	102.2	146.7	-62.1	-36.7	0	0	0	125.1
231	N	29.1	Very low	34.2	Very low	145 Å²	145	132.2 Å²	132.2	78%	0.775	78%	0.775	S	S	*	*				54.8	145.7	92.2	-160.9	24.3	0	0	0	122
232	S	30.8	Very low	34.5	Very low	105 Å²	105	135 Å²	135	73%	0.734	79%	0.786	S	S	*	*			trans	108.8	120.4	155	-45.7	0	0	0	0	119
233	N	34.1	Very low	34.8	Very low	148 Å²	148	133.1 Å²	133.1	79%	0.791	78%	0.784	S	S	*	*			trans	-92.6	148.7	162.3	-170	-0.7	0	0	0	108.2	G235	N233-G235 PolarHBondContact OD1-N 2.78Å
234	P	45	Very low	35.3	Very low	122 Å²	122	134 Å²	134	79%	0.792	79%	0.788	S	S	*	*				-149.7	151	106.3	37.2	-20.4	0	0	0	115.5
235	G	28.8	Very low	35.2	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	79%	0.789	S	S	*	*			trans	-95	-166.2	179.3	0	0	0	0	0	116	N233	N233-G235 PolarHBondContact OD1-N 2.78Å
236	R	33	Very low	34.8	Very low	240 Å²	240	130 Å²	130	91%	0.906	79%	0.788	S	S	*	*			trans	-155.5	151.7	166.6	-116.7	-178.3	-173.4	-85.2	-0.7	111.8
237	C	28.7	Very low	34.5	Very low	122 Å²	122	127 Å²	127	82%	0.824	79%	0.787	S	S	*	*			trans	-111.7	143.3	176.6	-47.9	0	0	0	0	111.3
238	V	35.3	Very low	33.8	Very low	145 Å²	145	127.9 Å²	127.9	88%	0.879	79%	0.79	S	S	*	*			trans	-158.3	155	154.4	-170.5	0	0	0	0	106.7
239	D	30.3	Very low	34.5	Very low	135 Å²	135	127.9 Å²	127.9	72%	0.722	79%	0.792	S	S	*	*				-166.7	-178.9	-53.5	-160.7	-2.9	0	0	0	107.2
240	M	34.8	Very low	33.7	Very low	167 Å²	167	129 Å²	129	82%	0.823	80%	0.797	S	S	*	*			trans	75.6	117.7	175.7	-47.6	-155.3	-56.2	0	0	115.1
241	V	33.1	Very low	33.8	Very low	126 Å²	126	128.7 Å²	128.7	76%	0.764	79%	0.791	S	S	*	*			cis	79	101.8	44.6	-178.3	0	0	0	0	113.4
242	S	33.7	Very low	33.9	Very low	115 Å²	115	129 Å²	129	80%	0.804	79%	0.787	S	S	*	*				-171.2	109.5	124.6	-80.3	0	0	0	0	111.9
243	L	42.3	Very low	34	Very low	166 Å²	166	130.3 Å²	130.3	87%	0.869	78%	0.782	S	S	*	*			trans	-100.3	149.6	151.8	-72.5	174	0	0	0	107.4
244	P	43.7	Very low	33.7	Very low	126 Å²	126	133.3 Å²	133.3	82%	0.818	78%	0.782	S	S	*	*				-127.9	160.2	90.9	34.2	-24	0	0	0	111.3
245	G	29.1	Very low	32.9	Very low	77 Å²	77	139 Å²	139	79%	0.794	79%	0.788	S	S	*	*			cis	107.8	145.1	34.6	0	0	0	0	0	108.6
246	G	27.9	Very low	32.9	Very low	74 Å²	74	140.8 Å²	140.8	76%	0.763	79%	0.789	S	S	*	*			cis	176.2	-164.4	-0.1	0	0	0	0	0	110.4
247	A	29.8	Very low	33.1	Very low	94 Å²	94	136.7 Å²	136.7	78%	0.777	79%	0.786	S	S	*	*			trans	70.8	89.1	168.8	0	0	0	0	0	119.9
248	T	34.6	Very low	34	Very low	135 Å²	135	137.1 Å²	137.1	83%	0.828	79%	0.787	S	S	*	*				22.1	153.6	117.9	51.3	0	0	0	0	123.3
249	P	47.3	Very low	33.6	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	78%	0.78	S	S	*	*			trans	-97.9	168	-168.6	40.4	-38.5	0	0	0	116.6
250	T	30.5	Very low	33.5	Very low	132 Å²	132	134.1 Å²	134.1	81%	0.81	78%	0.783	S	S	*	*			trans	-135.3	124.2	156.8	37.2	0	0	0	0	107.3
251	H	28.3	Very low	33.2	Very low	138 Å²	138	132 Å²	132	64%	0.639	78%	0.784	S	S	*	*				60.7	107.5	63.4	-178.7	-85.1	0	0	0	113.9
252	H	32	Very low	33.3	Very low	152 Å²	152	131.1 Å²	131.1	70%	0.704	78%	0.784	S	S	*	*				-167.9	134.6	130	-100.9	-68.9	0	0	0	112.1
253	Q	31.7	Very low	34	Very low	133 Å²	133	131.3 Å²	131.3	62%	0.621	78%	0.783	S	S	*	*			trans	36.8	117.8	151.6	-49	-67.7	1.7	0	0	118.6
254	R	27.2	Very low	33.7	Very low	211 Å²	211	127.7 Å²	127.7	80%	0.796	78%	0.776	S	S	*	*				57.7	111.4	57.8	-165.1	-167.4	-148.2	-100.7	1.8	113.4
255	W	28.2	Very low	33.2	Very low	241 Å²	241	133.3 Å²	133.3	91%	0.913	78%	0.781	S	S	*	*			trans	-161.7	147.3	132.2	-103.1	21.3	0	0	0	109.6
256	S	30.1	Very low	33.3	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	77%	0.771	S	S	*	*			trans	-157.1	142	176.8	-50.8	0	0	0	0	108.3
257	N	35.8	Very low	33.5	Very low	155 Å²	155	135.3 Å²	135.3	83%	0.829	78%	0.775	S	S	*	*			trans	68.6	167.6	174.1	-49.5	-8	0	0	0	113.4
258	P	47.5	Very low	33.5	Very low	130 Å²	130	137.2 Å²	137.2	84%	0.844	78%	0.777	S	S	*	*			cis	-128.9	-167.6	5.7	43	-26.2	0	0	0	115
259	G	27.8	Very low	33.5	Very low	72 Å²	72	138 Å²	138	74%	0.742	77%	0.771	S	S	*	*			trans	117.6	73.2	178.1	0	0	0	0	0	112
260	D	28.8	Very low	33	Very low	145 Å²	145	139.7 Å²	139.7	78%	0.775	77%	0.768	S	S	*	*			cis	74.1	112.6	40.6	-164.3	16.4	0	0	0	114.4
261	S	28.1	Very low	33	Very low	122 Å²	122	139 Å²	139	85%	0.853	76%	0.764	S	S	*	*			trans	-177.9	101.2	164.1	-80.6	0	0	0	0	110.4
262	S	34.2	Very low	33.1	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	78%	0.777	S	S	*	*			trans	-86.6	161.8	158.6	-58.1	0	0	0	0	109.9
263	P	49	Very low	33.1	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	78%	0.779	S	S	*	*				-143.5	-171	97	38.3	-22.5	0	0	0	114
264	A	36.8	Very low	33.5	Very low	89 Å²	89	141.5 Å²	141.5	74%	0.736	79%	0.791	S	S	*	*			trans	-90.7	-133.1	-171.5	0	0	0	0	0	114
265	W	33.3	Very low	34.3	Very low	244 Å²	244	137.2 Å²	137.2	92%	0.924	79%	0.79	S	S	*	*			trans	71.4	128.1	-166.1	-44.6	96.9	0	0	0	113.2
266	G	29.8	Very low	34.8	Very low	56 Å²	56	133 Å²	133	58%	0.577	79%	0.785	S	S	*	*			cis	103.5	100.6	-5.1	0	0	0	0	0	113.9
267	T	33	Very low	35.1	Very low	137 Å²	137	134.1 Å²	134.1	84%	0.84	79%	0.787	S	S	*	*			trans	52.5	125.3	167.1	50.2	0	0	0	0	119
268	T	28.6	Very low	34.9	Very low	135 Å²	135	134.4 Å²	134.4	83%	0.828	78%	0.784	S	S	*	*				-178.4	147.5	113.8	-70.7	0	0	0	0	109.3
269	E	35.4	Very low	34	Very low	150 Å²	150	136.5 Å²	136.5	70%	0.701	78%	0.776	S	S	*	*			trans	-105.1	-173.3	-178.6	-59.3	-175.2	143.1	0	0	112.4
270	H	37.8	Very low	34.1	Very low	159 Å²	159	143.5 Å²	143.5	74%	0.736	78%	0.78	S	S	*	*			trans	75.2	161.3	164.8	-28.7	-58.2	0	0	0	115.7
271	T	29.8	Very low	34.1	Very low	119 Å²	119	140.9 Å²	140.9	73%	0.73	77%	0.769	S	S	*	*			cis	-146.8	143.1	6	-33.9	0	0	0	0	112
272	C	29.1	Very low	34.3	Very low	133 Å²	133	142.2 Å²	142.2	90%	0.899	77%	0.766	S	S	*	*			trans	-145.6	154.1	138.5	-159.5	0	0	0	0	109
273	C	33.1	Very low	35.2	Very low	110 Å²	110	141.7 Å²	141.7	74%	0.743	76%	0.76	S	S	*	*			trans	-104.8	155.8	-154.5	-70.6	0	0	0	0	116.2
274	R	39.3	Very low	34.4	Very low	231 Å²	231	143.5 Å²	143.5	87%	0.872	76%	0.758	S	S	*	*			trans	-45.1	162.9	153.5	-105.1	-174.9	-174.9	-158.1	2.8	112.9
275	P	44.3	Very low	34.1	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	75%	0.753	S	S	*	*				-143.4	176.3	51.2	40.8	-21.5	0	0	0	118.8
276	L	39.5	Very low	34	Very low	153 Å²	153	143.4 Å²	143.4	80%	0.801	75%	0.749	S	S	*	*			trans	-133.4	116.4	176.9	-169.6	120.1	0	0	0	108.3
277	T	35.9	Very low	34	Very low	127 Å²	127	144.6 Å²	144.6	78%	0.779	75%	0.754	S	S	*	*			trans	-174.3	156.2	169.7	33.5	0	0	0	0	108.5
278	E	31.4	Very low	33.9	Very low	160 Å²	160	143.3 Å²	143.3	75%	0.748	75%	0.751	S	S	*	*			cis	-112.4	165.5	-1.1	-82	-160.7	-86.6	0	0	111.2
279	Y	29.2	Very low	34	Very low	174 Å²	174	145 Å²	145	68%	0.682	75%	0.754	S	S	*	*			cis	97.4	96.3	14.1	-172.3	-94.7	0	0	0	117.5	V281	Y279-V281 HydrophobicContact CE1-CG2 4.24Å; Y279-V281 HydrophobicContact CE2-CG2 4.23Å
280	R	30.5	Very low	33.8	Very low	220 Å²	220	146.8 Å²	146.8	83%	0.83	76%	0.762	S	S	*	*			trans	-167.7	133.3	141.5	-96.7	171.8	-163	-107.6	1.4	106.9
281	V	28.6	Very low	33.3	Very low	89 Å²	89	142.1 Å²	142.1	54%	0.539	76%	0.757	S	S	.	*				76.7	121.6	51.5	170.2	0	0	0	0	110.4	Y279	Y279-V281 HydrophobicContact CE1-CG2 4.24Å; Y279-V281 HydrophobicContact CE2-CG2 4.23Å
282	L	31.5	Very low	33.4	Very low	151 Å²	151	145.8 Å²	145.8	79%	0.791	76%	0.762	S	S	*	*			cis	-167.3	-169.5	1.2	-135.9	63.5	0	0	0	107
283	P	52.3	Low	33.3	Very low	96 Å²	96	146.7 Å²	146.7	62%	0.623	75%	0.753	S	S	*	*			cis	-132.8	176.5	-23.1	40.9	-25	0	0	0	115.6
284	H	32.8	Very low	33	Very low	159 Å²	159	151.5 Å²	151.5	74%	0.736	76%	0.756	S	S	*	*			trans	60.8	127.7	157.3	-74.3	-7.1	0	0	0	119.8
285	E	31.2	Very low	32.4	Very low	138 Å²	138	147.3 Å²	147.3	65%	0.645	75%	0.751	S	S	*	*			cis	-165.8	-168.4	-25.1	-134.9	67.4	-72.2	0	0	105
286	F	31.2	Very low	31.5	Very low	192 Å²	192	148.4 Å²	148.4	84%	0.842	75%	0.745	S	S	*	*			cis	-160	-170	10.6	-138.1	-7	0	0	0	106.1
287	A	29	Very low	30.9	Very low	81 Å²	81	148 Å²	148	67%	0.669	74%	0.737	S	S	*	*			cis	-151.8	-173.8	2.5	0	0	0	0	0	109.6
288	S	30.9	Very low	30.6	Very low	111 Å²	111	149.6 Å²	149.6	78%	0.776	74%	0.736	S	S	*	*			trans	-73.6	138.3	-179.9	-60.9	0	0	0	0	114.1
289	L	31.3	Very low	30.4	Very low	171 Å²	171	149.6 Å²	149.6	90%	0.895	74%	0.736	S	S	*	*				90.8	132.3	57.8	-125.5	171.4	0	0	0	112.9
290	H	30.5	Very low	30.5	Very low	187 Å²	187	146.2 Å²	146.2	87%	0.866	74%	0.744	S	S	*	*			trans	-132.3	128.8	-170.7	168.3	-81.2	0	0	0	112.3
291	G	28.4	Very low	30.4	Very low	61 Å²	61	141.4 Å²	141.4	63%	0.629	74%	0.739	S	S	*	*			trans	166.9	141.7	166.3	0	0	0	0	0	116.3
292	K	31.4	Very low	30.3	Very low	196 Å²	196	145.6 Å²	145.6	85%	0.852	76%	0.755	S	S	*	*			trans	73.1	113	173.5	-59.5	-174.2	177.7	-173.2	0	116.1
293	E	27.4	Very low	30.2	Very low	152 Å²	152	145.7 Å²	145.7	71%	0.71	76%	0.756	S	S	*	*				83.4	150.8	74.9	-161.8	-175.2	114.2	0	0	112.7
294	W	25.8	Very low	29.2	Very low	210 Å²	210	148.5 Å²	148.5	80%	0.795	76%	0.761	S	S	*	*			trans	86.2	84.5	179.1	-61.8	82.2	0	0	0	119.1
295	D	26.8	Very low	29	Very low	144 Å²	144	148.2 Å²	148.2	77%	0.77	77%	0.765	S	S	*	*				56	153.9	118.6	-134.4	-12.9	0	0	0	123.9
296	E	26.2	Very low	28.7	Very low	144 Å²	144	145.6 Å²	145.6	67%	0.673	78%	0.775	S	S	*	*			trans	36.7	113.5	162	-140.4	-161.3	119.6	0	0	119.7
297	K	27.2	Very low	28.4	Very low	146 Å²	146	142.1 Å²	142.1	64%	0.635	77%	0.774	S	S	*	*				166.6	122.2	95.9	-164.8	178	-149.8	84.1	0	115.7
298	Q	28.9	Very low	28.3	Very low	159 Å²	159	145 Å²	145	74%	0.743	78%	0.777	S	S	*	*			trans	71.5	140	152.8	-77	176.6	7.7	0	0	123.3
299	Q	27.8	Very low	28.2	Very low	160 Å²	160	149.7 Å²	149.7	75%	0.748	78%	0.784	S	S	*	*			trans	73.7	64	146.3	-121.4	67.6	11.2	0	0	122.1
300	A	30.4	Very low	27.9	Very low	103 Å²	103	152.1 Å²	152.1	85%	0.851	78%	0.781	S	S	*	*			trans	-134.1	133.6	139.7	0	0	0	0	0	109.4
301	V	29	Very low	27.6	Very low	120 Å²	120	148.9 Å²	148.9	73%	0.727	78%	0.779	S	S	*	*			trans	-115.4	120.8	-168.6	177.5	0	0	0	0	111.1
302	M	26.7	Very low	27.5	Very low	177 Å²	177	150.8 Å²	150.8	87%	0.872	78%	0.782	S	S	*	*				-175.4	120.8	122.4	-97.6	-165.6	77.8	0	0	109.5
303	D	29.3	Very low	27.5	Very low	153 Å²	153	149.6 Å²	149.6	82%	0.818	78%	0.78	S	S	*	*			trans	-93.8	169.6	-179.5	-138.3	-36.6	0	0	0	112.3
304	Q	31.7	Very low	27.6	Very low	155 Å²	155	148.8 Å²	148.8	72%	0.724	78%	0.779	S	S	*	*			trans	-86	170.8	-164.3	-54.4	179.7	28.7	0	0	115.4
305	N	27.7	Very low	28.1	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	77%	0.767	S	S	*	*			trans	70.1	87.2	153.8	-58.1	-43.5	0	0	0	117.9
306	G	25.7	Very low	28.6	Very low	83 Å²	83	143.2 Å²	143.2	86%	0.856	77%	0.769	S	S	*	*			trans	-121.2	100.2	173.4	0	0	0	0	0	113.5
307	S	24.7	Very low	28.6	Very low	120 Å²	120	143.7 Å²	143.7	84%	0.839	77%	0.768	S	S	*	*			trans	-70	151	-179.3	-169.6	0	0	0	0	114.1
308	L	26	Very low	28.8	Very low	140 Å²	140	142.6 Å²	142.6	73%	0.733	77%	0.773	S	S	*	*			trans	63.8	101.8	150.5	-157.5	81.5	0	0	0	119.1
309	K	30.3	Very low	29.2	Very low	210 Å²	210	140.5 Å²	140.5	91%	0.913	77%	0.774	S	S	*	*			trans	-165.9	172.2	130.3	-105.3	146.8	-168.1	171.9	0	113.6
310	R	24.6	Very low	29.3	Very low	223 Å²	223	144.4 Å²	144.4	84%	0.842	78%	0.782	S	S	*	*			trans	-115.4	168.9	-169.6	-63.9	177.4	171.2	102.7	-2.7	111.5
311	S	24.3	Very low	29.1	Very low	118 Å²	118	144.2 Å²	144.2	83%	0.825	77%	0.774	S	S	*	*			trans	81.3	156.2	167.5	86.5	0	0	0	0	115.5
312	C	25.8	Very low	29.4	Very low	102 Å²	102	144.9 Å²	144.9	69%	0.689	78%	0.778	S	S	*	*			cis	-149.3	177.6	13.9	-152	0	0	0	0	114.6
313	Q	30.5	Very low	29.7	Very low	171 Å²	171	143.4 Å²	143.4	80%	0.799	78%	0.779	S	S	*	*			trans	76.9	91.9	171.3	-56.3	-168.5	-12.1	0	0	115.7
314	L	30	Very low	29.7	Very low	134 Å²	134	145 Å²	145	70%	0.702	78%	0.782	S	S	*	*				79.8	135	63.9	-64.4	174.3	0	0	0	111.2
315	Q	35.9	Very low	29.8	Very low	114 Å²	114	143.5 Å²	143.5	53%	0.533	78%	0.783	S	S	.	*			cis	-165.3	178.4	-2.8	-101.9	-48.3	-91.8	0	0	109
316	P	37.2	Very low	29.9	Very low	124 Å²	124	143 Å²	143	81%	0.805	78%	0.78	S	S	*	*			cis	-126.2	151.9	14.1	27.9	-5.2	0	0	0	119
317	K	27.4	Very low	30.4	Very low	153 Å²	153	146.1 Å²	146.1	67%	0.665	78%	0.776	S	S	*	*			trans	-74.4	176.8	163.7	-51.9	146.6	-177.7	165.3	0	111.4
318	V	30.7	Very low	30.8	Very low	123 Å²	123	145 Å²	145	75%	0.745	77%	0.769	S	S	*	*			cis	-147.1	153.9	-1.3	-155.2	0	0	0	0	108
319	P	37.8	Very low	31.4	Very low	116 Å²	116	146 Å²	146	75%	0.753	77%	0.77	S	S	*	*			trans	-110.3	122.6	156.1	34.3	-25.8	0	0	0	112.9
320	R	29.8	Very low	32	Very low	242 Å²	242	141.6 Å²	141.6	91%	0.913	76%	0.762	S	S	*	*			trans	173.8	142.4	163.1	-97.8	155.4	-172.2	177.2	3.4	107.3
321	S	27.1	Very low	32.4	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	76%	0.756	S	S	*	*			cis	-165.2	149.9	-2.3	48.1	0	0	0	0	111.1
322	V	34.4	Very low	33.1	Very low	135 Å²	135	143.9 Å²	143.9	82%	0.818	76%	0.763	S	S	*	*			trans	41.3	116.1	158.7	-60.4	0	0	0	0	120.3
323	T	32.2	Very low	33.2	Very low	145 Å²	145	144.5 Å²	144.5	89%	0.89	77%	0.769	S	S	*	*			trans	-139.3	116.7	135.8	48.9	0	0	0	0	109.8
324	E	29.1	Very low	33.3	Very low	186 Å²	186	143.3 Å²	143.3	87%	0.869	77%	0.773	S	S	*	*			trans	-65.4	136.9	164.6	155.2	-167	-110.7	0	0	111.1
325	V	33.9	Very low	33.5	Very low	125 Å²	125	142.4 Å²	142.4	76%	0.758	78%	0.778	S	S	*	*			trans	-150.6	122.7	147.4	175	0	0	0	0	107.8	L327	V325-L327 HydrophobicContact CG1-CD1 4.47Å; V325-L327 HydrophobicContact CG1-CG 4.07Å
326	D	31.7	Very low	33.4	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	79%	0.793	S	S	*	*			trans	-98.6	142	162.9	172	31.2	0	0	0	109.4
327	L	35.2	Very low	33.2	Very low	148 Å²	148	144 Å²	144	78%	0.775	79%	0.794	S	S	*	*			trans	-149	82.9	170.3	-80.4	-175.2	0	0	0	112.8	V325	V325-L327 HydrophobicContact CG1-CD1 4.47Å; V325-L327 HydrophobicContact CG1-CG 4.07Å
328	S	33.3	Very low	33.6	Very low	98 Å²	98	147.2 Å²	147.2	69%	0.685	80%	0.801	S	S	*	*			trans	67.9	132.7	137.3	63.5	0	0	0	0	121.1
329	E	38.3	Very low	33.6	Very low	161 Å²	161	149.4 Å²	149.4	75%	0.752	80%	0.801	S	S	*	*			trans	-64.6	171.9	163.6	-49.7	-171.6	154	0	0	113.1
330	P	43.9	Very low	33.3	Very low	116 Å²	116	151.9 Å²	151.9	75%	0.753	80%	0.803	S	S	*	*				-144.7	132.1	91.9	35	-18.8	0	0	0	116.6
331	N	32	Very low	33.3	Very low	134 Å²	134	143.3 Å²	143.3	72%	0.717	79%	0.79	S	S	*	*			trans	43.2	107.3	138.9	-75.4	-95.1	0	0	0	120.1
332	R	38.1	Very low	33.7	Very low	256 Å²	256	145.6 Å²	145.6	97%	0.966	79%	0.794	S	S	*	*				-167.6	134.1	116.1	-112.1	173.9	-179	-179.1	1	114.1
333	S	29.8	Very low	33.9	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	79%	0.789	S	S	*	*			trans	-97.9	151.2	174.1	33.7	0	0	0	0	112.7
334	T	30.9	Very low	34	Very low	146 Å²	146	149 Å²	149	90%	0.896	78%	0.782	S	S	*	*			trans	-137.9	130.9	145.7	53.2	0	0	0	0	108.8
335	S	35.7	Very low	34.1	Very low	114 Å²	114	147.7 Å²	147.7	80%	0.797	78%	0.776	S	S	*	*			trans	-103.2	174.9	-176.7	61.5	0	0	0	0	112.5
336	F	33.3	Very low	34.1	Very low	193 Å²	193	147 Å²	147	85%	0.846	78%	0.777	S	S	*	*			trans	-39.9	144	157	-91.5	-104.7	0	0	0	112.8
337	G	33.2	Very low	34.1	Very low	80 Å²	80	145 Å²	145	83%	0.825	77%	0.774	S	S	*	*			trans	-138.4	127	164	0	0	0	0	0	110.3
338	R	35.2	Very low	33.8	Very low	219 Å²	219	147 Å²	147	83%	0.826	78%	0.779	S	S	*	*			trans	-115.9	150.1	172	-72.3	-173.2	175.4	-131.5	4.9	110.2
339	F	30.3	Very low	33.6	Very low	170 Å²	170	146.9 Å²	146.9	75%	0.746	78%	0.784	S	S	*	*			trans	81.3	148.5	141	-114.8	-116.6	0	0	0	122.8
340	E	31.5	Very low	33.3	Very low	167 Å²	167	148.4 Å²	148.4	78%	0.78	79%	0.788	S	S	*	*			trans	67.5	153.9	151.9	-134.4	72.6	-80.9	0	0	121.9
341	G	30.1	Very low	32.6	Very low	63 Å²	63	149.1 Å²	149.1	65%	0.649	79%	0.785	S	S	*	*			trans	126.4	45.2	130.1	0	0	0	0	0	122.3
342	L	36.4	Very low	32.4	Very low	146 Å²	146	149.2 Å²	149.2	76%	0.764	78%	0.781	S	S	*	*			trans	17.4	106.6	145.6	-75.6	164.8	0	0	0	121.3
343	R	37.7	Very low	31.9	Very low	191 Å²	191	144.3 Å²	144.3	72%	0.721	77%	0.769	S	S	*	*			trans	66.4	158	146.5	-35.7	-178.2	-60.4	-129.5	-1.7	117
344	H	35.2	Very low	31.8	Very low	159 Å²	159	145.8 Å²	145.8	74%	0.736	77%	0.768	S	S	*	*			cis	-129.8	175.4	-2.5	-74.2	-88	0	0	0	108.3
345	H	30.5	Very low	31.8	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.736	76%	0.759	S	S	*	*				-172	178.7	70.5	-75.7	-77.9	0	0	0	112.4
346	S	33.9	Very low	31.5	Very low	112 Å²	112	143.2 Å²	143.2	78%	0.783	76%	0.761	S	S	*	*			trans	-80.9	-175.8	-173.4	60.6	0	0	0	0	114
347	S	31.6	Very low	31.3	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	76%	0.756	S	S	*	*			cis	-169.3	157.5	21.1	47	0	0	0	0	112.8
348	Q	28.9	Very low	31.1	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	76%	0.757	S	S	*	*			trans	-165.6	128	150.2	-160.3	76.1	-1.6	0	0	111.3
349	A	29	Very low	30.9	Very low	97 Å²	97	141.3 Å²	141.3	80%	0.802	76%	0.758	S	S	*	*			trans	173.1	119.4	153.2	0	0	0	0	0	115.2
350	K	31.2	Very low	30.8	Very low	193 Å²	193	141.9 Å²	141.9	84%	0.839	76%	0.755	S	S	*	*			trans	-168.1	131.4	144.6	-96	-172.4	179.9	-175.5	0	105.6
351	I	29.6	Very low	30.7	Very low	131 Å²	131	140 Å²	140	67%	0.672	75%	0.746	S	S	*	*				88.5	128.6	55.3	-75.5	-171.8	0	0	0	112.3
352	E	27.3	Very low	30.7	Very low	136 Å²	136	145 Å²	145	64%	0.636	75%	0.752	S	S	*	*			cis	-112.4	-105.7	-5.3	-155.3	76.6	-68.4	0	0	112.5	R176	R176-E352 IonicContact NH2-OE2 3.34Å
353	E	29.5	Very low	30.1	Very low	153 Å²	153	143.7 Å²	143.7	72%	0.715	75%	0.754	S	S	*	*			cis	-160.7	169.2	-7.1	68.5	169.8	75	0	0	113.6
354	N	26.9	Very low	29.6	Very low	146 Å²	146	142 Å²	142	78%	0.781	76%	0.759	S	S	*	*			trans	38.7	129.9	152.6	-59.7	-26	0	0	0	124.9
355	G	31.3	Very low	29.2	Very low	70 Å²	70	139 Å²	139	72%	0.722	76%	0.756	S	S	*	*			trans	101.3	104.8	164.8	0	0	0	0	0	114.9
356	T	29.5	Very low	29.7	Very low	135 Å²	135	137 Å²	137	83%	0.828	76%	0.758	S	S	*	*			cis	70	107.7	47.6	-38.1	0	0	0	0	111.9
357	T	27.4	Very low	29.4	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	76%	0.758	S	S	*	*				-168.3	154.3	80.8	31.2	0	0	0	0	114.7
358	M	30	Very low	30.1	Very low	173 Å²	173	139.5 Å²	139.5	85%	0.852	76%	0.76	S	S	*	*			trans	47.4	152.3	154.8	-54.5	-45.4	-159.7	0	0	120.9
359	L	31.3	Very low	30.2	Very low	159 Å²	159	135.6 Å²	135.6	83%	0.832	75%	0.749	S	S	*	*			cis	-131.6	143.3	2.4	-101	148.3	0	0	0	105.7
360	R	27.4	Very low	30.6	Very low	182 Å²	182	142 Å²	142	69%	0.687	75%	0.753	S	S	*	*			cis	70.9	115.8	37.5	179.5	154.4	-143.5	-111.1	-13.9	113.8
361	E	30.8	Very low	31.1	Very low	126 Å²	126	137.8 Å²	137.8	59%	0.589	75%	0.748	S	S	*	*			cis	-117.9	-128.6	-6.1	-147.3	90.3	-70	0	0	110.3
362	E	28.6	Very low	31.3	Very low	168 Å²	168	136.5 Å²	136.5	79%	0.785	76%	0.757	S	S	*	*			cis	-148.3	-118.6	-1	-152.3	136.1	80.9	0	0	112.4
363	C	25	Very low	31.6	Very low	120 Å²	120	133.8 Å²	133.8	81%	0.811	77%	0.765	S	S	*	*			trans	-133.6	161	-165.2	-64.8	0	0	0	0	112.2
364	D	26.3	Very low	32	Very low	155 Å²	155	137 Å²	137	83%	0.829	78%	0.777	S	S	*	*			cis	-146.9	-179.9	40.5	-156.1	1.3	0	0	0	115.1
365	S	26.7	Very low	32.5	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	77%	0.774	S	S	*	*			trans	-155.7	-174.8	-168.4	68.8	0	0	0	0	110.8
366	P	40.9	Very low	33.7	Very low	118 Å²	118	139.1 Å²	139.1	77%	0.766	78%	0.779	S	S	*	*			cis	-136.6	-177.7	3.8	43.2	-24.8	0	0	0	116.8
367	D	28.2	Very low	34.6	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	78%	0.781	S	S	*	*			trans	-62.9	167.3	169.4	-115.5	-35.4	0	0	0	114.4
368	P	45.6	Very low	35.2	Very low	114 Å²	114	145.2 Å²	145.2	74%	0.74	79%	0.788	S	S	*	*				-139.6	124	115.7	26.3	-7.6	0	0	0	117.9
369	V	31.1	Very low	36.3	Very low	107 Å²	107	146.2 Å²	146.2	65%	0.648	79%	0.788	S	S	*	*				92.1	99.6	123.6	175.4	0	0	0	0	120.8
370	R	38.5	Very low	36.9	Very low	230 Å²	230	145.6 Å²	145.6	87%	0.868	78%	0.781	S	S	*	*				65.9	150.1	126.8	-63.5	-176.9	-167.7	-168.4	1.7	120.4
371	S	40.6	Very low	37.8	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	79%	0.788	S	S	*	*			cis	-164.7	148.2	-6.3	40.1	0	0	0	0	114.2
372	A	33.8	Very low	38.4	Very low	105 Å²	105	142.1 Å²	142.1	87%	0.868	78%	0.784	S	S	*	*			trans	31.8	115.2	147.1	0	0	0	0	0	120.9
373	G	34.8	Very low	39.3	Very low	78 Å²	78	141.4 Å²	141.4	80%	0.804	79%	0.785	S	S	*	*			trans	-99.9	-170.3	169.8	0	0	0	0	0	115.2
374	F	38.2	Very low	40.9	Very low	222 Å²	222	140.1 Å²	140.1	97%	0.974	77%	0.773	S	S	*	*			trans	-157.6	173.5	172.9	-147.3	-101.2	0	0	0	111.5
375	G	35.9	Very low	41.6	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	77%	0.773	S	S	*	*			trans	87.1	124.3	159	0	0	0	0	0	116.8
376	K	56.8	Low	42.9	Very low	192 Å²	192	145.5 Å²	145.5	84%	0.835	78%	0.776	S	S	*	*			trans	-110.8	148.3	170.3	-66.3	176.4	175.3	172.6	0	110.1
377	K	48.8	Very low	43.8	Very low	202 Å²	202	151.8 Å²	151.8	88%	0.878	79%	0.785	S	S	*	*			trans	68.7	118.8	164.8	-32.5	177.1	-163	174.4	0	115.2
378	M	39.1	Very low	45	Very low	181 Å²	181	153.6 Å²	153.6	89%	0.892	79%	0.786	S	S	*	*			trans	-115.9	140.7	155.4	-175.1	167.9	167.1	0	0	107.5
379	K	54	Low	44.7	Very low	195 Å²	195	156 Å²	156	85%	0.848	79%	0.789	S	S	*	*			trans	-146.7	152.1	-178.2	-158.9	-169.3	-176	-161.9	0	107.1
380	E	43.3	Very low	44.9	Very low	145 Å²	145	154.8 Å²	154.8	68%	0.678	80%	0.798	S	S	*	*			trans	69.6	124.1	172.2	-161.1	-177.6	145.5	0	0	115.4	S382	E380-S382 WeakPolarHBondContact CG-OG 3.37Å; E380-S382 WeakPolarHBondContact OE1-CB 3.32Å; E380-S382 PolarHBondContact OE1-OG 2.89Å
381	I	45.9	Very low	45.7	Very low	164 Å²	164	152 Å²	152	84%	0.841	79%	0.792	S	S	*	*			trans	-111.3	86.7	170.9	-55.6	178.7	0	0	0	107.4
382	S	43.9	Very low	45.9	Very low	72 Å²	72	156.5 Å²	156.5	50%	0.503	80%	0.799	S	S	.	*			trans	-115.1	95.5	178.7	-73	0	0	0	0	110.4	E380	E380-S382 WeakPolarHBondContact CG-OG 3.37Å; E380-S382 WeakPolarHBondContact OE1-CB 3.32Å; E380-S382 PolarHBondContact OE1-OG 2.89Å
383	L	48.2	Very low	46	Very low	153 Å²	153	159 Å²	159	80%	0.801	79%	0.792	S	S	*	*			trans	-130.7	113.7	171.7	-68.7	173.8	0	0	0	108.2
384	T	59.3	Low	45.6	Very low	93 Å²	93	159.3 Å²	159.3	57%	0.571	79%	0.787	S	S	*	*			cis	75.3	72.2	45.8	81.8	0	0	0	0	115.9
385	M	39.9	Very low	45.5	Very low	166 Å²	166	154.8 Å²	154.8	82%	0.818	77%	0.767	S	S	*	*			trans	-111	89.1	158.7	-85.2	-92.7	48.5	0	0	112
386	R	54.2	Low	45.1	Very low	197 Å²	197	154.9 Å²	154.9	74%	0.743	76%	0.757	S	S	*	*			trans	-45	133.7	170.9	60.6	-148.2	96.8	-175.5	4	114.7
387	R	60.5	Low	43.7	Very low	251 Å²	251	150.9 Å²	150.9	95%	0.947	74%	0.744	S	S	*	*			trans	-73.7	158.3	174.1	-61.8	174.9	176.8	168.3	-3	112.1
388	K	53	Low	42.8	Very low	186 Å²	186	144.3 Å²	144.3	81%	0.809	72%	0.724	S	S	*	*			trans	-141.3	103.5	163.4	-170.6	169.4	178.7	-173.8	0	113.9
389	M	39.4	Very low	42.6	Very low	165 Å²	165	144 Å²	144	81%	0.813	72%	0.72	S	S	*	*			trans	22.2	132.3	155.9	72.5	-142.9	-81.9	0	0	123.1
390	G	35.8	Very low	41.5	Very low	81 Å²	81	142.8 Å²	142.8	84%	0.835	72%	0.717	S	S	*	*			trans	-148.6	130.4	146.6	0	0	0	0	0	108.6
391	K	54.9	Low	41	Very low	172 Å²	172	142.3 Å²	142.3	75%	0.748	72%	0.724	S	S	*	*			trans	-156.6	112.5	-168	176.7	-168.3	172.4	-174.6	0	113.2
392	K	43.9	Very low	40.4	Very low	199 Å²	199	138 Å²	138	87%	0.865	72%	0.721	S	S	*	*			trans	-149.7	120.7	160.4	-57.3	-173.3	-177.1	-178.8	0	107
393	H	35.3	Very low	39.7	Very low	158 Å²	158	142.5 Å²	142.5	73%	0.731	74%	0.739	S	S	*	*				69.8	133.4	74.7	-60.8	-64.1	0	0	0	113.9
394	A	27.8	Very low	38.9	Very low	84 Å²	84	141.7 Å²	141.7	69%	0.694	74%	0.735	S	S	*	*			cis	-173.8	147.4	-21.5	0	0	0	0	0	113.4
395	K	34.8	Very low	38.1	Very low	126 Å²	126	142.4 Å²	142.4	55%	0.548	74%	0.74	S	S	.	*			trans	52.2	170.3	149.8	-68.8	179.1	166.9	-172.8	0	122.7	F6 L8	F6-K395 WeakPolarHBondContact O-CD 3.33Å; F6-K395 PolarHBondContact O-NZ 3.23Å; L8-K395 WeakPolarHBondContact CG-O 3.33Å
396	S	28.8	Very low	37.8	Very low	70 Å²	70	140.9 Å²	140.9	49%	0.49	74%	0.735	S	S	.	*				-178	115.3	-84.7	54.8	0	0	0	0	115	S7 L8	S7-S396 VanDerWaalsContact C-N 3.35Å; S7-S396 WeakPolarHBondContact CA-O 3.26Å; S7-S396 VanDerWaalsContact CB-O 3.26Å; S7-S396 WeakPolarHBondContact CB-O 3.46Å; S7-S396 PolarHBondContact OG-O 3.08Å; L8-S396 VanDerWaalsContact N-N 3.11Å
397	L	26.6	Very low	37	Very low	108 Å²	108	139.9 Å²	139.9	57%	0.565	74%	0.736	S	S	*	*			trans	176.5	-146	171	-108.4	-172.3	0	0	0	108.9	F6 S7 L8	F6-L397 HydrophobicContact CD1-CD1 3.9Å; F6-L397 HydrophobicContact CE1-CD1 4.12Å; S7-L397 VanDerWaalsContact OG-CD1 3.31Å; S7-L397 WeakPolarHBondContact OG-CD1 3.24Å; S7-L397 WeakPolarHBondContact OG-CG 3.3Å; L8-L397 HydrophobicContact CB-CB 4.45Å; L8-L397 VanDerWaalsContact CD1-O 3.28Å; L8-L397 WeakPolarHBondContact CD1-O 3.42Å
398	S	31	Very low	35.4	Very low	65 Å²	65	134.8 Å²	134.8	46%	0.455	73%	0.728	S	S	.	*			cis	-149.3	-125.8	7.2	-42.2	0	0	0	0	114.9	E9	E9-S398 WeakPolarHBondContact OE2-CB 3.18Å; E9-S398 PolarHBondContact OE2-OG 3.29Å
399	E	33.9	Very low	35.2	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.813	72%	0.716	S	S	*	*			trans	-151.8	144.1	-140.7	-151.8	149.9	84.4	0	0	116.6
400	E	30.6	Very low	34.6	Very low	169 Å²	169	131 Å²	131	79%	0.79	72%	0.718	S	S	*	*			trans	53.3	127.7	145.2	-165.3	175.1	102	0	0	125.3
401	T	32.8	Very low	34.3	Very low	136 Å²	136	131.4 Å²	131.4	83%	0.834	71%	0.714	S	S	*	*				171.7	147.3	119.3	30.3	0	0	0	0	114
402	G	33.9	Very low	33	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	72%	0.717	S	S	*	*			trans	93.9	117.9	174.8	0	0	0	0	0	114.6
403	D	29	Very low	32.2	Very low	165 Å²	165	127.1 Å²	127.1	88%	0.882	71%	0.708	S	S	*	*			cis	74.5	122.4	28.2	-144.7	59.4	0	0	0	112.2
404	D	32.2	Very low	31.7	Very low	136 Å²	136	128.1 Å²	128.1	73%	0.727	71%	0.712	S	S	*	*			cis	-152.5	-178.5	4.8	176.5	44.6	0	0	0	111.4
405	T	41.5	Very low	31.7	Very low	109 Å²	109	129.9 Å²	129.9	67%	0.669	72%	0.72	S	S	*	*			trans	97.9	70.7	148.9	-34.9	0	0	0	0	119.7
406	D	34.6	Very low	31.4	Very low	134 Å²	134	129.3 Å²	129.3	72%	0.717	73%	0.732	S	S	*	*				69.4	151.6	116.3	-134.7	-15.9	0	0	0	123.9
407	K	36.3	Very low	32	Very low	175 Å²	175	132.1 Å²	132.1	76%	0.761	75%	0.748	S	S	*	*			trans	75.9	81.2	160.1	-59.1	-66.3	165.7	-176.2	0	124
408	D	27.6	Very low	32.1	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	76%	0.757	S	S	*	*			trans	-63.3	174.5	131.9	-159.4	41	0	0	0	111.1
409	P	48.9	Very low	32.1	Very low	87 Å²	87	134.1 Å²	134.1	57%	0.565	77%	0.771	S	S	*	*			cis	-130.7	-174.2	-6.3	13.2	15	0	0	0	116.1
410	E	25.6	Very low	31.9	Very low	183 Å²	183	132.8 Å²	132.8	86%	0.855	77%	0.765	S	S	*	*			trans	47.5	127.1	144.7	-71.1	173.1	136.2	0	0	121.7
411	A	29.8	Very low	32.2	Very low	91 Å²	91	132.8 Å²	132.8	75%	0.752	76%	0.762	S	S	*	*				170.8	133.1	101.4	0	0	0	0	0	114.2
412	E	28.1	Very low	31.9	Very low	171 Å²	171	131.4 Å²	131.4	80%	0.799	76%	0.758	S	S	*	*				38.8	142.6	127.4	-61.7	-58.1	139.7	0	0	124.2
413	T	27.3	Very low	31.6	Very low	110 Å²	110	133.8 Å²	133.8	68%	0.675	76%	0.763	S	S	*	*			trans	87.5	118.3	137.4	-70.6	0	0	0	0	122.3
414	E	25.6	Very low	31.6	Very low	178 Å²	178	129.7 Å²	129.7	83%	0.832	75%	0.752	S	S	*	*			trans	78.3	149.2	143.6	-85.9	175.2	-154.8	0	0	126.4
415	S	26.8	Very low	31.5	Very low	121 Å²	121	132.1 Å²	132.1	85%	0.846	76%	0.756	S	S	*	*			trans	83.9	150.1	158	78.9	0	0	0	0	119.1
416	S	28.8	Very low	30.8	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	75%	0.749	S	S	*	*			trans	-136.3	168	-168.8	76.8	0	0	0	0	110.1
417	P	40.7	Very low	30.6	Very low	130 Å²	130	128.8 Å²	128.8	84%	0.844	74%	0.744	S	S	*	*				-111.5	-179.4	-128.1	41.2	-39.6	0	0	0	115.9
418	A	28.6	Very low	30.2	Very low	89 Å²	89	128 Å²	128	74%	0.736	75%	0.749	S	S	*	*			trans	-118.7	128.7	168.8	0	0	0	0	0	112.5
419	V	31.9	Very low	30.2	Very low	125 Å²	125	126.1 Å²	126.1	76%	0.758	75%	0.747	S	S	*	*			trans	72.2	95.7	148.1	-177.6	0	0	0	0	119.6
420	E	29.8	Very low	29.2	Very low	147 Å²	147	129.2 Å²	129.2	69%	0.687	76%	0.758	S	S	*	*			trans	77.3	154.8	131.2	-68	-172.1	168.6	0	0	125.3
421	K	35.7	Very low	29.6	Very low	168 Å²	168	128.3 Å²	128.3	73%	0.73	75%	0.754	S	S	*	*			trans	84.4	71.8	153.7	-75.9	145.3	-179.3	149.2	0	121.3
422	S	27.8	Very low	29.7	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	75%	0.75	S	S	*	*				66.2	129.8	117.5	65	0	0	0	0	123.4
423	S	26.7	Very low	29.8	Very low	123 Å²	123	126.9 Å²	126.9	86%	0.86	75%	0.745	S	S	*	*			trans	77	136	147.8	-154.7	0	0	0	0	118.2
424	A	28.8	Very low	29.7	Very low	79 Å²	79	131 Å²	131	65%	0.653	75%	0.75	S	S	*	*			cis	-167.2	157.7	-18	0	0	0	0	0	111.1
425	K	30.7	Very low	29.9	Very low	187 Å²	187	128.2 Å²	128.2	81%	0.813	75%	0.75	S	S	*	*			trans	66.7	148.2	174.8	-113.5	76.6	173.1	-176	0	113.1
426	T	27.4	Very low	30.2	Very low	83 Å²	83	125.7 Å²	125.7	51%	0.509	74%	0.744	S	S	.	*			cis	-159.8	159.8	28.9	-43.4	0	0	0	0	111.4
427	S	29.8	Very low	30.4	Very low	90 Å²	90	129.5 Å²	129.5	63%	0.629	75%	0.749	S	S	*	*			trans	58	127.6	150.7	51	0	0	0	0	123.3
428	N	27	Very low	29.9	Very low	159 Å²	159	127.7 Å²	127.7	85%	0.85	74%	0.739	S	S	*	*			trans	53.7	120.1	139.6	-54	8.4	0	0	0	121
429	S	27.6	Very low	30.2	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	74%	0.741	S	S	*	*				159.5	151.8	101.8	-158.7	0	0	0	0	113.8
430	L	29.7	Very low	30.6	Very low	152 Å²	152	127.5 Å²	127.5	80%	0.796	74%	0.738	S	S	*	*			trans	44.9	112.7	156.9	-72.5	163.8	0	0	0	122.6
431	E	34	Very low	31.1	Very low	164 Å²	164	126.3 Å²	126.3	77%	0.766	75%	0.746	S	S	*	*				66.7	137.1	117.6	-148	64.4	-172.1	0	0	123.4
432	S	30.2	Very low	31.1	Very low	95 Å²	95	121.3 Å²	121.3	66%	0.664	74%	0.742	S	S	*	*			trans	72	146.6	163.2	-73.1	0	0	0	0	119.1
433	L	30.6	Very low	31.7	Very low	136 Å²	136	123.3 Å²	123.3	71%	0.712	75%	0.75	S	S	*	*			cis	-163.5	165.6	-16.5	-118.4	174.5	0	0	0	111.4
434	Y	25.3	Very low	32.2	Very low	197 Å²	197	123.4 Å²	123.4	77%	0.773	75%	0.745	S	S	*	*			trans	72.3	141.1	159.3	-82.9	-67.5	0	0	0	123.5
435	S	30.8	Very low	32.3	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	75%	0.751	S	S	*	*			trans	71.9	125.2	159	-62	0	0	0	0	119.1
436	G	31.6	Very low	32.4	Very low	68 Å²	68	125.5 Å²	125.5	70%	0.701	76%	0.756	S	S	*	*			cis	165.4	176.6	-7.5	0	0	0	0	0	113.9
437	Q	33.2	Very low	32.7	Very low	193 Å²	193	126.9 Å²	126.9	90%	0.902	77%	0.769	S	S	*	*			trans	69.8	139.8	172.1	-57.4	-178.1	14.2	0	0	115.9
438	S	30.8	Very low	33.3	Very low	93 Å²	93	130.2 Å²	130.2	65%	0.65	78%	0.78	S	S	*	*			cis	-163.9	154	-7.8	-102.2	0	0	0	0	111.7
439	S	34.9	Very low	33.9	Very low	111 Å²	111	126.7 Å²	126.7	78%	0.776	78%	0.781	S	S	*	*			trans	53.8	147.1	139.1	-61.6	0	0	0	0	122.1
440	S	39.3	Very low	34.7	Very low	99 Å²	99	127 Å²	127	69%	0.692	78%	0.784	S	S	*	*			cis	-170.7	151.9	-3.2	42.3	0	0	0	0	112.6
441	S	40.6	Very low	35.3	Very low	122 Å²	122	124.8 Å²	124.8	85%	0.853	78%	0.781	S	S	*	*			trans	53	139.2	147.3	60.6	0	0	0	0	121.9
442	G	36.4	Very low	35.6	Very low	63 Å²	63	124.5 Å²	124.5	65%	0.649	78%	0.779	S	S	*	*			cis	153.1	153.1	-7.1	0	0	0	0	0	114.4
443	V	40.5	Very low	36.8	Very low	150 Å²	150	129.8 Å²	129.8	91%	0.909	78%	0.784	S	S	*	*			trans	58	152	169.9	-54.4	0	0	0	0	117.3
444	T	36	Very low	37.3	Very low	124 Å²	124	130.3 Å²	130.3	76%	0.761	79%	0.788	S	S	*	*			cis	-121.1	-178.9	15.4	68.8	0	0	0	0	111.3
445	S	31.4	Very low	38	Very low	111 Å²	111	125.3 Å²	125.3	78%	0.776	78%	0.782	S	S	*	*			cis	-141.5	163.8	8.4	-57.5	0	0	0	0	111.2
446	E	34.4	Very low	38.7	Very low	200 Å²	200	128.2 Å²	128.2	94%	0.935	79%	0.787	S	S	*	*			trans	-87.3	142.7	-179.4	-60.2	168.8	100.2	0	0	113.5
447	S	31.9	Very low	39	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	79%	0.79	S	S	*	*			trans	-163.5	129.1	150.1	-171.6	0	0	0	0	110.8
448	N	43.4	Very low	39.4	Very low	161 Å²	161	130.9 Å²	130.9	86%	0.861	78%	0.782	S	S	*	*			trans	24.3	98.2	166.8	-70.7	47.1	0	0	0	118.7
449	G	40.2	Very low	39.9	Very low	84 Å²	84	134.5 Å²	134.5	87%	0.866	79%	0.789	S	S	*	*			trans	-88.4	163.2	166.7	0	0	0	0	0	114.2
450	S	44.2	Very low	40.6	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	78%	0.779	S	S	*	*			trans	-125.7	124.8	145.1	61.4	0	0	0	0	108.7	Q452	S450-Q452 VanDerWaalsContact C-N 3.35Å; S450-Q452 PolarHBondContact O-N 3.37Å
451	S	41.8	Very low	41.1	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	78%	0.778	S	S	*	*			trans	-88.5	73.4	178	173.3	0	0	0	0	110.2	R453	S451-R453 PolarHBondContact O-N 3.4Å
452	Q	40.5	Very low	41.7	Very low	157 Å²	157	133.5 Å²	133.5	73%	0.734	77%	0.77	S	S	*	*			trans	-94.8	86.9	168	-152.2	66.2	47.3	0	0	109.9	S450	S450-Q452 VanDerWaalsContact C-N 3.35Å; S450-Q452 PolarHBondContact O-N 3.37Å
453	R	54.5	Low	43.2	Very low	206 Å²	206	134.4 Å²	134.4	78%	0.777	77%	0.766	S	S	*	*			trans	-68.5	157.3	157.2	-66.4	178.5	177.3	-112.2	-4.2	108.2	S451	S451-R453 PolarHBondContact O-N 3.4Å
454	D	41.2	Very low	44.9	Very low	148 Å²	148	130.8 Å²	130.8	79%	0.791	74%	0.737	S	S	*	*			trans	61.5	79.5	-173.4	-59	-56.2	0	0	0	115
455	S	40	Very low	46.8	Very low	92 Å²	92	133.6 Å²	133.6	64%	0.643	74%	0.741	S	S	*	*			trans	-146.7	62.6	151.3	-77.7	0	0	0	0	110.5	K457	S455-K457 PolarHBondContact O-N 3.07Å
456	L	45.8	Very low	49.2	Very low	181 Å²	181	129.7 Å²	129.7	95%	0.948	72%	0.719	S	S	*	*			trans	-71.6	47.8	154.6	-65.9	-179.2	0	0	0	110.2	L458	L456-L458 PolarHBondContact O-N 2.82Å
457	K	37.4	Very low	51.7	Low	175 Å²	175	128.5 Å²	128.5	76%	0.761	71%	0.713	S	S	*	*			trans	-84.9	77.2	174.4	-173.1	179.1	-177.9	179	0	106.7	S455 E459	S455-K457 PolarHBondContact O-N 3.07Å; K457-E459 PolarHBondContact O-N 3.24Å; K457-E459 VanDerWaalsContact O-N 3.09Å
458	L	42.7	Very low	54.6	Low	141 Å²	141	126.3 Å²	126.3	74%	0.738	69%	0.69	S	S	*	*			trans	-22.8	110.6	174.3	179.5	75.4	0	0	0	110.7	L456 E460	L456-L458 PolarHBondContact O-N 2.82Å; L458-E460 HydrophobicContact CD2-CB 4.4Å; L458-E460 HydrophobicContact CD2-CG 4.45Å; L458-E460 HydrophobicContact CG-CB 4.49Å; L458-E460 PolarHBondContact O-N 3.08Å
459	E	40	Very low	56.8	Low	170 Å²	170	122 Å²	122	79%	0.794	67%	0.671	S	S	*	*			trans	-67.8	78.2	172.9	31	-99.4	100.2	0	0	110.7	K457 D461	K457-E459 PolarHBondContact O-N 3.24Å; K457-E459 VanDerWaalsContact O-N 3.09Å; E459-D461 PolarHBondContact O-N 3.35Å
460	E	51.5	Low	59.3	Low	118 Å²	118	118.5 Å²	118.5	55%	0.551	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	46.3	179.5	-155.9	-154.1	171.7	0	0	112.2	L458 K514	L458-E460 HydrophobicContact CD2-CB 4.4Å; L458-E460 HydrophobicContact CD2-CG 4.45Å; L458-E460 HydrophobicContact CG-CB 4.49Å; L458-E460 PolarHBondContact O-N 3.08Å; E460-K514 IonicContact OE1-NZ 2.62Å; E460-K514 PolarHBondContact OE1-NZ 3.44Å; E460-K514 IonicContact OE2-NZ 2.69Å; E460-K514 PolarHBondContact OE2-NZ 3.13Å
461	D	48.7	Very low	61.8	Low	126 Å²	126	116.1 Å²	116.1	67%	0.674	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.8	25.5	170.7	-149.8	10.2	0	0	0	111.1	E459 S463	E459-D461 PolarHBondContact O-N 3.35Å; D461-S463 VanDerWaalsContact C-N 3.29Å; D461-S463 PolarHBondContact O-N 2.82Å
462	G	53.8	Low	64.3	Low	67 Å²	67	111.1 Å²	111.1	69%	0.691	57%	0.574	S	S	*	*			trans	-70.6	84.5	165.2	0	0	0	0	0	110.2	Y464	G462-Y464 PolarHBondContact O-N 3.31Å
463	S	66.7	Low	67	Low	82 Å²	82	108.7 Å²	108.7	57%	0.573	56%	0.558	S	S	*	*			trans	-53.9	131.2	176.1	55.3	0	0	0	0	111	D461 Q465	D461-S463 VanDerWaalsContact C-N 3.29Å; D461-S463 PolarHBondContact O-N 2.82Å; S463-Q465 PolarHBondContact O-N 2.92Å
464	Y	77.4	Confident	69.1	Low	73 Å²	73	99 Å²	99	29%	0.286	52%	0.522	S	S	.	.			trans	-71.6	102.5	-172	178.6	-95	0	0	0	111.2	G462 G466 F468 I499 V515	G462-Y464 PolarHBondContact O-N 3.31Å; Y464-G466 VanDerWaalsContact C-N 3.25Å; Y464-G466 VanDerWaalsContact CE1-O 3.24Å; Y464-G466 WeakPolarHBondContact CE1-O 3.17Å; Y464-G466 PolarHBondContact O-N 3.47Å; Y464-F468 HydrophobicContact CD1-CD1 4.35Å; Y464-F468 AromaticContact CD1-CE1 3.51Å; Y464-F468 HydrophobicContact CD1-CE1 3.51Å; Y464-F468 HydrophobicContact CD1-CE2 4.44Å; Y464-F468 AromaticContact CD1-CZ 3.56Å; Y464-F468 HydrophobicContact CD1-CZ 3.56Å; Y464-F468 HydrophobicContact CE1-CD1 4.25Å; Y464-F468 AromaticContact CE1-CE1 3.85Å; Y464-F468 HydrophobicContact CE1-CE1 3.85Å; Y464-F468 HydrophobicContact CE1-CZ 4.19Å; Y464-I499 HydrophobicContact CD1-CD1 3.67Å; Y464-I499 HydrophobicContact CD1-CG1 3.96Å; Y464-I499 HydrophobicContact CD2-CD1 3.89Å; Y464-I499 HydrophobicContact CE1-CB 4.45Å; Y464-I499 HydrophobicContact CE1-CD1 3.69Å; Y464-I499 HydrophobicContact CE1-CG1 3.56Å; Y464-I499 HydrophobicContact CE1-CG2 4.19Å; Y464-I499 HydrophobicContact CE2-CD1 3.93Å; Y464-I499 HydrophobicContact CE2-CG1 4.42Å; Y464-I499 HydrophobicContact CE2-CG2 4.08Å; Y464-I499 HydrophobicContact CG-CD1 3.77Å; Y464-I499 VanDerWaalsContact OH-CG2 3.31Å; Y464-I499 WeakPolarHBondContact OH-CG2 3.09Å; Y464-V515 HydrophobicContact CD2-CG2 4.07Å; Y464-V515 HydrophobicContact CG-CG2 4.01Å
465	Q	76.2	Confident	71.7	Confident	183 Å²	183	95.5 Å²	95.5	86%	0.855	50%	0.5	S	S	*	.			trans	-84.1	8.9	-178.6	-169.7	55.2	22.7	0	0	113.5	S463	S463-Q465 PolarHBondContact O-N 2.92Å
466	G	81.4	Confident	74.5	Confident	30 Å²	30	93.8 Å²	93.8	31%	0.309	49%	0.486	S	S	.	.	S	Bend	trans	-85.3	168.1	176.8	0	0	0	0	0	113.1	Y464	Y464-G466 VanDerWaalsContact C-N 3.25Å; Y464-G466 VanDerWaalsContact CE1-O 3.24Å; Y464-G466 WeakPolarHBondContact CE1-O 3.17Å; Y464-G466 PolarHBondContact O-N 3.47Å
467	Q	87.4	Confident	76.9	Confident	174 Å²	174	89 Å²	89	81%	0.813	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-72.9	143.9	176.7	-174.3	174.5	3.4	0	0	111.6
468	F	91.5	Very high	79.7	Confident	65 Å²	65	83.2 Å²	83.2	29%	0.285	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-97.2	151.5	169.8	-57.4	-73.3	0	0	0	111.2	Y464 H497 I498 I499 M510	Y464-F468 HydrophobicContact CD1-CD1 4.35Å; Y464-F468 AromaticContact CD1-CE1 3.51Å; Y464-F468 HydrophobicContact CD1-CE1 3.51Å; Y464-F468 HydrophobicContact CD1-CE2 4.44Å; Y464-F468 AromaticContact CD1-CZ 3.56Å; Y464-F468 HydrophobicContact CD1-CZ 3.56Å; Y464-F468 HydrophobicContact CE1-CD1 4.25Å; Y464-F468 AromaticContact CE1-CE1 3.85Å; Y464-F468 HydrophobicContact CE1-CE1 3.85Å; Y464-F468 HydrophobicContact CE1-CZ 4.19Å; F468-H497 HydrophobicContact CD1-CB 3.47Å; F468-H497 VanDerWaalsContact CD1-CB 3.47Å; F468-H497 HydrophobicContact CD2-CB 4.31Å; F468-H497 HydrophobicContact CE1-CB 3.57Å; F468-H497 HydrophobicContact CE2-CB 4.41Å; F468-H497 HydrophobicContact CG-CB 3.86Å; F468-H497 HydrophobicContact CZ-CB 4.06Å; F468-I498 CarbonylContact C-O 3.47Å; F468-I498 VanDerWaalsContact CA-O 3.32Å; F468-I498 WeakPolarHBondContact CA-O 2.87Å; F468-I499 HydrophobicContact CD1-CG1 3.64Å; F468-I499 HydrophobicContact CE1-CD1 4.04Å; F468-I499 HydrophobicContact CE1-CG1 3.61Å; F468-M510 HydrophobicContact CE1-CB 3.98Å; F468-M510 HydrophobicContact CE1-CE 4.29Å; F468-M510 HydrophobicContact CE2-CE 4.41Å; F468-M510 HydrophobicContact CZ-CB 4.42Å; F468-M510 HydrophobicContact CZ-CE 3.6Å; F468-M510 HydrophobicContact CZ-SD 4.21Å
469	C	90.8	Very high	82.2	Confident	70 Å²	70	80.8 Å²	80.8	47%	0.473	43%	0.427	S	S	.	.			trans	-108.1	33.3	-179.9	60.1	0	0	0	0	112.7	I498	C469-I498 PolarHBondContact N-O 2.92Å; C469-I498 PolarHBondContact SG-O 3.44Å
470	G	92.8	Very high	84.7	Confident	11 Å²	11	73.9 Å²	73.9	11%	0.113	40%	0.397	C	S	.	.			trans	110.7	-177.7	-178.8	0	0	0	0	0	113.4	I498	G470-I498 WeakPolarHBondContact O-CB 3.45Å; G470-I498 WeakPolarHBondContact O-CG1 3.36Å; G470-I498 PolarHBondContact O-N 2.89Å
471	R	95.4	Very high	86.8	Confident	64 Å²	64	71.2 Å²	71.2	24%	0.242	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	154.2	-179.8	-63.4	-177	-49.6	-106	24.8	111.6	I495 I496 L526 E528 E531	R471-I495 HydrophobicContact CB-CG2 4.17Å; R471-I496 CarbonylContact C-O 3.38Å; R471-I496 WeakPolarHBondContact CA-O 3.49Å; R471-L526 HydrophobicContact CB-CB 4.44Å; R471-L526 PolarHBondContact O-N 3.06Å; R471-E528 WeakPolarHBondContact CG-OE1 3.31Å; R471-E528 IonicContact CZ-OE1 3.83Å; R471-E528 IonicContact NE-OE1 3.64Å; R471-E528 IonicContact NH1-OE1 2.63Å; R471-E528 PolarHBondContact NH1-OE1 2.91Å; R471-E531 IonicContact CZ-OE1 3.9Å; R471-E531 IonicContact CZ-OE2 3.61Å; R471-E531 IonicContact NH1-OE1 3.15Å; R471-E531 IonicContact NH1-OE2 3.67Å; R471-E531 PolarHBondContact NH1-OE2 2.99Å; R471-E531 IonicContact NH2-OE1 3.28Å; R471-E531 PolarHBondContact NH2-OE1 3.14Å; R471-E531 IonicContact NH2-OE2 2.68Å; R471-E531 PolarHBondContact NH2-OE2 3.43Å
472	A	95.7	Very high	88.9	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.2	172.9	0	0	0	0	0	110.9	I495 I496 I498 V523 D524	A472-I495 CarbonylContact O-C 3.58Å; A472-I495 WeakPolarHBondContact O-CA 3.49Å; A472-I496 PolarHBondContact N-O 3.37Å; A472-I496 PolarHBondContact O-N 3.34Å; A472-I498 HydrophobicContact CB-CD1 3.95Å; A472-I498 HydrophobicContact CB-CG1 4.01Å; A472-V523 HydrophobicContact CB-CB 3.96Å; A472-V523 HydrophobicContact CB-CG2 3.6Å; A472-D524 CarbonylContact C-O 3.52Å; A472-D524 WeakPolarHBondContact CA-O 3.34Å; A472-D524 WeakPolarHBondContact CB-O 3.49Å
473	R	96.9	Very high	90.8	Very high	107 Å²	107	78 Å²	78	40%	0.404	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.4	175	179.3	176.4	60.6	-127.9	-11.6	109.9	H475 D494 I495 V523 D524 L526	R473-H475 PolarHBondContact O-N 2.94Å; R473-D494 CarbonylContact C-O 3.53Å; R473-D494 WeakPolarHBondContact CA-O 3.22Å; R473-I495 HydrophobicContact CB-CD1 3.72Å; R473-I495 HydrophobicContact CG-CD1 3.81Å; R473-V523 CarbonylContact O-C 3.58Å; R473-V523 VanDerWaalsContact O-CA 3.28Å; R473-V523 WeakPolarHBondContact O-CA 3.36Å; R473-D524 PolarHBondContact N-O 3.15Å; R473-D524 IonicContact NH2-OD2 2.7Å; R473-D524 PolarHBondContact O-N 3.13Å; R473-L526 HydrophobicContact CB-CD1 4.11Å; R473-L526 HydrophobicContact CB-CD2 3.88Å; R473-L526 HydrophobicContact CB-CG 4Å
474	V	97.5	Very high	92	Very high	1 Å²	1	76.3 Å²	76.3	1%	0.006	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.6	175.7	177.9	0	0	0	0	110.2	T476 L490 K491 G493 D494 I496 Y522 V523	V474-T476 WeakPolarHBondContact CG1-O 3.4Å; V474-L490 HydrophobicContact CG1-CB 3.79Å; V474-L490 HydrophobicContact CG1-CD1 4.45Å; V474-L490 HydrophobicContact CG2-CB 3.94Å; V474-L490 HydrophobicContact CG2-CD1 4.27Å; V474-L490 HydrophobicContact CG2-CD2 4.18Å; V474-L490 HydrophobicContact CG2-CG 4.36Å; V474-K491 VanDerWaalsContact CB-O 3.24Å; V474-K491 WeakPolarHBondContact CB-O 3.43Å; V474-K491 VanDerWaalsContact CG1-O 3.25Å; V474-K491 WeakPolarHBondContact CG1-O 3.27Å; V474-G493 PolarHBondContact O-N 3.1Å; V474-D494 HydrophobicContact CB-CB 4.17Å; V474-D494 HydrophobicContact CG2-CB 3.78Å; V474-D494 PolarHBondContact N-O 3.1Å; V474-I496 HydrophobicContact CG2-CD1 3.95Å; V474-I496 HydrophobicContact CG2-CG1 4.05Å; V474-Y522 WeakPolarHBondContact CA-O 2.9Å; V474-V523 HydrophobicContact CG2-CG1 4.01Å
475	H	97	Very high	92.7	Very high	75 Å²	75	79.1 Å²	79.1	35%	0.347	41%	0.414	S	S	.	.			trans	-104.6	-5.2	171.8	69.5	60.6	0	0	0	112.6	R473 I521 Y522 V523 D524	R473-H475 PolarHBondContact O-N 2.94Å; H475-I521 PolarHBondContact CE1-O 3.37Å; H475-Y522 PolarHBondContact N-O 2.92Å; H475-V523 PolarHBondContact NE2-N 2.66Å; H475-D524 PolarHBondContact CD2-N 3.15Å; H475-D524 IonicContact CD2-OD1 3.46Å; H475-D524 PolarHBondContact CD2-OD1 3.28Å
476	T	97.3	Very high	93.5	Very high	56 Å²	56	74.4 Å²	74.4	34%	0.344	40%	0.395	S	S	.	.	S	Bend	trans	-143.9	125.8	178.5	-65.3	0	0	0	0	111.9	V474 F478 Y522	V474-T476 WeakPolarHBondContact CG1-O 3.4Å; T476-F478 PolarHBondContact O-N 3.26Å; T476-Y522 HydrophobicContact CG2-CD1 3.8Å; T476-Y522 HydrophobicContact CG2-CE1 4.29Å; T476-Y522 PolarHBondContact N-O 3.46Å
477	D	96.5	Very high	94.2	Very high	81 Å²	81	74.4 Å²	74.4	43%	0.433	39%	0.39	S	S	.	.			trans	-53.8	130	172.8	-97.4	23.7	0	0	0	111.2	K491 V492	D477-K491 VanDerWaalsContact OD1-CA 3.28Å; D477-K491 WeakPolarHBondContact OD1-CA 3.3Å; D477-K491 IonicContact OD1-NZ 3.59Å; D477-K491 WeakPolarHBondContact OD2-CE 3.32Å; D477-K491 IonicContact OD2-NZ 3.45Å; D477-K491 PolarHBondContact OD2-NZ 2.65Å; D477-V492 PolarHBondContact OD1-N 3.46Å
478	F	95.8	Very high	94.6	Very high	53 Å²	53	66.6 Å²	66.6	23%	0.232	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-136.1	129.2	171.7	178.3	-106.7	0	0	0	109.8	T476 P480 L490 Y522	T476-F478 PolarHBondContact O-N 3.26Å; F478-P480 HydrophobicContact CE1-CB 3.92Å; F478-P480 HydrophobicContact CZ-CB 4.33Å; F478-L490 HydrophobicContact CB-CB 4.04Å; F478-L490 HydrophobicContact CB-CD1 4Å; F478-L490 HydrophobicContact CB-CG 4.02Å; F478-L490 HydrophobicContact CD1-CG 4.44Å; F478-L490 PolarHBondContact N-O 3.38Å; F478-L490 PolarHBondContact O-N 3.38Å; F478-L490 VanDerWaalsContact O-O 3.09Å; F478-Y522 HydrophobicContact CB-CD2 4.07Å; F478-Y522 HydrophobicContact CB-CE2 4.2Å; F478-Y522 HydrophobicContact CD2-CD2 4.39Å; F478-Y522 AromaticContact CD2-CE2 3.69Å; F478-Y522 HydrophobicContact CD2-CE2 3.69Å; F478-Y522 HydrophobicContact CE2-CE2 4.25Å; F478-Y522 HydrophobicContact CG-CD2 4.2Å; F478-Y522 AromaticContact CG-CE2 3.93Å; F478-Y522 HydrophobicContact CG-CE2 3.93Å
479	V	95.2	Very high	94.8	Very high	90 Å²	90	69.8 Å²	69.8	55%	0.545	37%	0.367	S	S	.	.			trans	-118.9	115.2	172.8	-176.9	0	0	0	0	106.7
480	P	94.4	Very high	95	Very high	25 Å²	25	66.4 Å²	66.4	16%	0.162	35%	0.345	C	S	.	.			trans	-66.1	167.1	178.4	27.7	-35.4	0	0	0	111.7	F478 D484 K489	F478-P480 HydrophobicContact CE1-CB 3.92Å; F478-P480 HydrophobicContact CZ-CB 4.33Å; P480-D484 HydrophobicContact CB-CB 4.04Å; P480-D484 VanDerWaalsContact CB-OD2 3.3Å; P480-D484 WeakPolarHBondContact CB-OD2 3.44Å; P480-K489 HydrophobicContact CG-CB 4.38Å
481	S	93.8	Very high	95.2	Very high	63 Å²	63	69.8 Å²	69.8	44%	0.441	36%	0.356	S	S	.	.			trans	-61.9	149.2	172.3	-175.5	0	0	0	0	110.7	Y483 D484	S481-Y483 PolarHBondContact O-N 3.37Å; S481-D484 WeakPolarHBondContact O-CB 3.25Å; S481-D484 PolarHBondContact O-N 3.07Å
482	P	93.2	Very high	95.3	Very high	124 Å²	124	71 Å²	71	81%	0.805	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.5	173.3	-26.4	36.1	0	0	0	115.2
483	Y	94	Very high	95.3	Very high	212 Å²	212	73.2 Å²	73.2	83%	0.831	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-5.1	176.7	-54	-78.4	0	0	0	113.7	S481 T485	S481-Y483 PolarHBondContact O-N 3.37Å; Y483-T485 PolarHBondContact O-N 3.37Å
484	D	92.8	Very high	95.3	Very high	46 Å²	46	69.9 Å²	69.9	25%	0.246	38%	0.383	C	S	.	.			trans	-96.3	84.8	-177	172.2	5.7	0	0	0	107.6	P480 S481 S487	P480-D484 HydrophobicContact CB-CB 4.04Å; P480-D484 VanDerWaalsContact CB-OD2 3.3Å; P480-D484 WeakPolarHBondContact CB-OD2 3.44Å; S481-D484 WeakPolarHBondContact O-CB 3.25Å; S481-D484 PolarHBondContact O-N 3.07Å; D484-S487 VanDerWaalsContact CG-OG 3.27Å; D484-S487 WeakPolarHBondContact OD1-CB 3.44Å; D484-S487 PolarHBondContact OD1-N 2.76Å; D484-S487 VanDerWaalsContact OD1-N 3.12Å; D484-S487 PolarHBondContact OD1-OG 2.97Å; D484-S487 WeakPolarHBondContact OD2-CB 3.1Å; D484-S487 PolarHBondContact OD2-OG 3.5Å
485	T	91.7	Very high	95.2	Very high	131 Å²	131	72.9 Å²	72.9	80%	0.804	40%	0.399	S	S	*	.			trans	-82.9	-19.3	-173.3	52.8	0	0	0	0	113.4	Y483	Y483-T485 PolarHBondContact O-N 3.37Å
486	D	92.8	Very high	95.2	Very high	85 Å²	85	69.3 Å²	69.3	46%	0.455	38%	0.382	S	S	.	.	S	Bend	trans	-90.3	-20.7	179.6	66.7	-72.2	0	0	0	113.3	G516 N517	D486-G516 CarbonylContact O-C 3.42Å; D486-G516 WeakPolarHBondContact O-CA 3.2Å; D486-N517 PolarHBondContact O-N 3.2Å; D486-N517 PolarHBondContact OD2-ND2 3.46Å
487	S	95.6	Very high	95.1	Very high	30 Å²	30	69.8 Å²	69.8	21%	0.21	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-80.7	140.3	177.6	-60.6	0	0	0	0	114.2	D484 N517	D484-S487 VanDerWaalsContact CG-OG 3.27Å; D484-S487 WeakPolarHBondContact OD1-CB 3.44Å; D484-S487 PolarHBondContact OD1-N 2.76Å; D484-S487 VanDerWaalsContact OD1-N 3.12Å; D484-S487 PolarHBondContact OD1-OG 2.97Å; D484-S487 WeakPolarHBondContact OD2-CB 3.1Å; D484-S487 PolarHBondContact OD2-OG 3.5Å; S487-N517 CarbonylContact C-O 3.53Å; S487-N517 VanDerWaalsContact CA-O 3.26Å; S487-N517 WeakPolarHBondContact CA-O 3.22Å
488	L	95.3	Very high	95	Very high	9 Å²	9	66 Å²	66	5%	0.047	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-74.3	133.4	173.7	-64.3	176.5	0	0	0	111.3	L490 I496 L511 K514 N517 F518	L488-L490 HydrophobicContact CB-CD2 3.68Å; L488-L490 PolarHBondContact O-N 3.12Å; L488-I496 HydrophobicContact CD1-CD1 4.46Å; L488-I496 HydrophobicContact CD1-CG2 3.93Å; L488-L511 HydrophobicContact CD1-CB 3.98Å; L488-L511 HydrophobicContact CD2-CB 4.35Å; L488-K514 HydrophobicContact CD2-CB 4.29Å; L488-K514 WeakPolarHBondContact CD2-O 3.44Å; L488-N517 PolarHBondContact N-O 3.42Å; L488-F518 HydrophobicContact CD1-CD1 3.99Å
489	K	95.8	Very high	95	Very high	132 Å²	132	64.1 Å²	64.1	57%	0.574	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-76.2	118.6	164.8	-178.8	-179.2	178	-178.5	0	109.4	P480 L511	P480-K489 HydrophobicContact CG-CB 4.38Å; K489-L511 WeakPolarHBondContact O-CD2 3.48Å
490	L	96.3	Very high	94.9	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-108.6	138.1	-174.3	-46.2	-176.5	0	0	0	111.5	V474 F478 L488 I496 L511 F518 Y522 V523	V474-L490 HydrophobicContact CG1-CB 3.79Å; V474-L490 HydrophobicContact CG1-CD1 4.45Å; V474-L490 HydrophobicContact CG2-CB 3.94Å; V474-L490 HydrophobicContact CG2-CD1 4.27Å; V474-L490 HydrophobicContact CG2-CD2 4.18Å; V474-L490 HydrophobicContact CG2-CG 4.36Å; F478-L490 HydrophobicContact CB-CB 4.04Å; F478-L490 HydrophobicContact CB-CD1 4Å; F478-L490 HydrophobicContact CB-CG 4.02Å; F478-L490 HydrophobicContact CD1-CG 4.44Å; F478-L490 PolarHBondContact N-O 3.38Å; F478-L490 PolarHBondContact O-N 3.38Å; F478-L490 VanDerWaalsContact O-O 3.09Å; L488-L490 HydrophobicContact CB-CD2 3.68Å; L488-L490 PolarHBondContact O-N 3.12Å; L490-I496 HydrophobicContact CD2-CD1 3.63Å; L490-L511 HydrophobicContact CD2-CD2 3.86Å; L490-F518 HydrophobicContact CD1-CB 4.16Å; L490-F518 HydrophobicContact CD2-CB 4.29Å; L490-Y522 HydrophobicContact CD1-CD2 4.25Å; L490-V523 HydrophobicContact CD1-CG1 4.48Å
491	K	96.6	Very high	94.9	Very high	82 Å²	82	71.6 Å²	71.6	36%	0.357	37%	0.371	S	S	.	.			trans	-117.8	142.7	166.2	-68.5	-71.5	110	-178.3	0	110.7	V474 D477 G493 D494	V474-K491 VanDerWaalsContact CB-O 3.24Å; V474-K491 WeakPolarHBondContact CB-O 3.43Å; V474-K491 VanDerWaalsContact CG1-O 3.25Å; V474-K491 WeakPolarHBondContact CG1-O 3.27Å; D477-K491 VanDerWaalsContact OD1-CA 3.28Å; D477-K491 WeakPolarHBondContact OD1-CA 3.3Å; D477-K491 IonicContact OD1-NZ 3.59Å; D477-K491 WeakPolarHBondContact OD2-CE 3.32Å; D477-K491 IonicContact OD2-NZ 3.45Å; D477-K491 PolarHBondContact OD2-NZ 2.65Å; K491-G493 PolarHBondContact O-N 3.28Å; K491-D494 WeakPolarHBondContact CB-OD2 3.33Å; K491-D494 PolarHBondContact N-OD2 3.09Å; K491-D494 VanDerWaalsContact O-CB 3.24Å; K491-D494 WeakPolarHBondContact O-CB 3.13Å; K491-D494 VanDerWaalsContact O-CG 3.29Å; K491-D494 PolarHBondContact O-N 3.33Å
492	V	97.4	Very high	94.9	Very high	90 Å²	90	71 Å²	71	55%	0.545	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	122.9	174.7	179.9	0	0	0	0	110.4	D477	D477-V492 PolarHBondContact OD1-N 3.46Å
493	G	95.3	Very high	94.6	Very high	46 Å²	46	71.4 Å²	71.4	47%	0.474	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.3	-16.7	-175.1	0	0	0	0	0	115.1	V474 K491	V474-G493 PolarHBondContact O-N 3.1Å; K491-G493 PolarHBondContact O-N 3.28Å
494	D	96.6	Very high	94.4	Very high	36 Å²	36	68.3 Å²	68.3	19%	0.193	36%	0.363	C	S	.	.			trans	-59.2	144.1	175.3	-76.5	-13.5	0	0	0	111.6	R473 V474 K491 L511	R473-D494 CarbonylContact C-O 3.53Å; R473-D494 WeakPolarHBondContact CA-O 3.22Å; V474-D494 HydrophobicContact CB-CB 4.17Å; V474-D494 HydrophobicContact CG2-CB 3.78Å; V474-D494 PolarHBondContact N-O 3.1Å; K491-D494 WeakPolarHBondContact CB-OD2 3.33Å; K491-D494 PolarHBondContact N-OD2 3.09Å; K491-D494 VanDerWaalsContact O-CB 3.24Å; K491-D494 WeakPolarHBondContact O-CB 3.13Å; K491-D494 VanDerWaalsContact O-CG 3.29Å; K491-D494 PolarHBondContact O-N 3.33Å; D494-L511 HydrophobicContact CB-CD1 3.83Å; D494-L511 HydrophobicContact CB-CD2 4.15Å
495	I	96.7	Very high	94.4	Very high	64 Å²	64	67.9 Å²	67.9	33%	0.328	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.1	175.3	-52.1	-56.4	0	0	0	109.7	R471 A472 R473 L511 L526	R471-I495 HydrophobicContact CB-CG2 4.17Å; A472-I495 CarbonylContact O-C 3.58Å; A472-I495 WeakPolarHBondContact O-CA 3.49Å; R473-I495 HydrophobicContact CB-CD1 3.72Å; R473-I495 HydrophobicContact CG-CD1 3.81Å; I495-L511 WeakPolarHBondContact O-CD1 3.45Å; I495-L526 HydrophobicContact CD1-CD1 3.95Å
496	I	96.2	Very high	94.6	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.2	175.2	-42.3	-179.9	0	0	0	108.9	R471 A472 V474 L488 L490 L511 F518 V523	R471-I496 CarbonylContact C-O 3.38Å; R471-I496 WeakPolarHBondContact CA-O 3.49Å; A472-I496 PolarHBondContact N-O 3.37Å; A472-I496 PolarHBondContact O-N 3.34Å; V474-I496 HydrophobicContact CG2-CD1 3.95Å; V474-I496 HydrophobicContact CG2-CG1 4.05Å; L488-I496 HydrophobicContact CD1-CD1 4.46Å; L488-I496 HydrophobicContact CD1-CG2 3.93Å; L490-I496 HydrophobicContact CD2-CD1 3.63Å; I496-L511 HydrophobicContact CG1-CB 4.41Å; I496-L511 HydrophobicContact CG1-CD2 4.34Å; I496-L511 HydrophobicContact CG2-CB 4.41Å; I496-F518 HydrophobicContact CD1-CB 4.4Å; I496-F518 HydrophobicContact CD1-CD1 3.9Å; I496-F518 HydrophobicContact CD1-CD2 3.9Å; I496-F518 HydrophobicContact CD1-CE1 4.08Å; I496-F518 HydrophobicContact CD1-CE2 4.11Å; I496-F518 HydrophobicContact CD1-CG 3.79Å; I496-F518 HydrophobicContact CD1-CZ 4.17Å; I496-F518 HydrophobicContact CG2-CD1 4.19Å; I496-F518 HydrophobicContact CG2-CE1 3.76Å; I496-F518 HydrophobicContact CG2-CZ 4.28Å; I496-V523 HydrophobicContact CD1-CG1 3.94Å
497	H	95.2	Very high	94.8	Very high	66 Å²	66	63.2 Å²	63.2	31%	0.306	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	115.1	168.8	-59.1	78.6	0	0	0	108.1	F468 I499 G509 M510	F468-H497 HydrophobicContact CD1-CB 3.47Å; F468-H497 VanDerWaalsContact CD1-CB 3.47Å; F468-H497 HydrophobicContact CD2-CB 4.31Å; F468-H497 HydrophobicContact CE1-CB 3.57Å; F468-H497 HydrophobicContact CE2-CB 4.41Å; F468-H497 HydrophobicContact CG-CB 3.86Å; F468-H497 HydrophobicContact CZ-CB 4.06Å; H497-I499 PolarHBondContact O-N 3.01Å; H497-G509 CarbonylContact O-C 3.57Å; H497-G509 WeakPolarHBondContact O-CA 3.44Å; H497-M510 PolarHBondContact N-O 3.33Å; H497-M510 PolarHBondContact O-N 2.81Å
498	I	95.3	Very high	94.8	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.8	-170.6	-44.5	172	0	0	0	109.1	F468 C469 G470 A472 K501 W507 F518	F468-I498 CarbonylContact C-O 3.47Å; F468-I498 VanDerWaalsContact CA-O 3.32Å; F468-I498 WeakPolarHBondContact CA-O 2.87Å; C469-I498 PolarHBondContact N-O 2.92Å; C469-I498 PolarHBondContact SG-O 3.44Å; G470-I498 WeakPolarHBondContact O-CB 3.45Å; G470-I498 WeakPolarHBondContact O-CG1 3.36Å; G470-I498 PolarHBondContact O-N 2.89Å; A472-I498 HydrophobicContact CB-CD1 3.95Å; A472-I498 HydrophobicContact CB-CG1 4.01Å; I498-K501 HydrophobicContact CG2-CB 4.18Å; I498-W507 HydrophobicContact CD1-CE3 4.38Å; I498-W507 HydrophobicContact CD1-CZ3 4.27Å; I498-W507 HydrophobicContact CG2-CE3 4.42Å; I498-F518 HydrophobicContact CG2-CZ 4.46Å
499	I	95.3	Very high	94.8	Very high	14 Å²	14	62.4 Å²	62.4	7%	0.072	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-42.6	178.8	-69.9	169.3	0	0	0	110.7	Y464 F468 H497 T508 M510 V515	Y464-I499 HydrophobicContact CD1-CD1 3.67Å; Y464-I499 HydrophobicContact CD1-CG1 3.96Å; Y464-I499 HydrophobicContact CD2-CD1 3.89Å; Y464-I499 HydrophobicContact CE1-CB 4.45Å; Y464-I499 HydrophobicContact CE1-CD1 3.69Å; Y464-I499 HydrophobicContact CE1-CG1 3.56Å; Y464-I499 HydrophobicContact CE1-CG2 4.19Å; Y464-I499 HydrophobicContact CE2-CD1 3.93Å; Y464-I499 HydrophobicContact CE2-CG1 4.42Å; Y464-I499 HydrophobicContact CE2-CG2 4.08Å; Y464-I499 HydrophobicContact CG-CD1 3.77Å; Y464-I499 VanDerWaalsContact OH-CG2 3.31Å; Y464-I499 WeakPolarHBondContact OH-CG2 3.09Å; F468-I499 HydrophobicContact CD1-CG1 3.64Å; F468-I499 HydrophobicContact CE1-CD1 4.04Å; F468-I499 HydrophobicContact CE1-CG1 3.61Å; H497-I499 PolarHBondContact O-N 3.01Å; I499-T508 WeakPolarHBondContact CA-O 3.48Å; I499-T508 HydrophobicContact CB-CG2 4.49Å; I499-T508 WeakPolarHBondContact CB-O 3.3Å; I499-T508 PolarHBondContact N-O 3.18Å; I499-M510 HydrophobicContact CD1-CB 4.19Å; I499-V515 HydrophobicContact CD1-CB 4.45Å; I499-V515 HydrophobicContact CD1-CG1 3.8Å; I499-V515 HydrophobicContact CD1-CG2 3.88Å
500	R	93.9	Very high	94.8	Very high	157 Å²	157	57.5 Å²	57.5	59%	0.592	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	130.9	174.8	-69.9	176.1	-167.3	123.6	1.7	110.5	P502 W507 T508	R500-P502 VanDerWaalsContact O-CD 3.29Å; R500-P502 WeakPolarHBondContact O-CD 3.43Å; R500-W507 WeakPolarHBondContact O-CA 3.28Å; R500-W507 WeakPolarHBondContact O-CB 3.48Å; R500-T508 PolarHBondContact N-O 3.3Å; R500-T508 PolarHBondContact O-N 3.06Å
501	K	93.9	Very high	94.8	Very high	115 Å²	115	58 Å²	58	50%	0.5	31%	0.313	S	S	.	.			trans	-116.7	70.3	179.4	-167.7	-167.8	178.9	-179.8	0	112	I498 W507	I498-K501 HydrophobicContact CG2-CB 4.18Å; K501-W507 HydrophobicContact CB-CD2 4.48Å; K501-W507 HydrophobicContact CD-CH2 4.3Å; K501-W507 HydrophobicContact CD-CZ2 4.22Å; K501-W507 HydrophobicContact CG-CD2 3.86Å; K501-W507 VanDerWaalsContact CG-CE2 3.48Å; K501-W507 HydrophobicContact CG-CE3 4.18Å; K501-W507 HydrophobicContact CG-CH2 3.96Å; K501-W507 HydrophobicContact CG-CZ2 3.54Å; K501-W507 HydrophobicContact CG-CZ3 4.25Å
502	P	93.8	Very high	94.5	Very high	52 Å²	52	60 Å²	60	34%	0.338	33%	0.328	S	S	.	.			trans	-49.6	143.5	167.4	-29.6	36.3	0	0	0	112	R500 M504 I506 W507	R500-P502 VanDerWaalsContact O-CD 3.29Å; R500-P502 WeakPolarHBondContact O-CD 3.43Å; P502-M504 PolarHBondContact O-N 3.46Å; P502-I506 WeakPolarHBondContact CG-O 3.12Å; P502-W507 PolarHBondContact O-NE1 3.25Å
503	P	87.3	Confident	94.2	Very high	131 Å²	131	61 Å²	61	85%	0.851	33%	0.33	S	S	*	.	S	Bend	trans	-64.6	-14.2	-176.1	26	-35	0	0	0	113.7
504	M	89.3	Confident	94.1	Very high	148 Å²	148	63.7 Å²	63.7	73%	0.729	33%	0.329	S	S	*	.	S	Bend	trans	-154	155.9	176.7	55	-178	69.9	0	0	110.9	P502	P502-M504 PolarHBondContact O-N 3.46Å
505	G	92.1	Very high	94	Very high	36 Å²	36	65.1 Å²	65.1	37%	0.371	34%	0.339	S	S	.	.	S	Bend	trans	97.1	-112.8	172.5	0	0	0	0	0	114.5	F520	G505-F520 WeakPolarHBondContact O-CD1 3.36Å
506	I	95.6	Very high	94	Very high	100 Å²	100	62.3 Å²	62.3	51%	0.513	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.9	-172.8	-62.4	175.8	0	0	0	108.3	P502 N517	P502-I506 WeakPolarHBondContact CG-O 3.12Å; I506-N517 HydrophobicContact CG2-CB 3.7Å
507	W	96.8	Very high	94	Very high	18 Å²	18	64.2 Å²	64.2	7%	0.068	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	153.6	175	-66.7	-1.6	0	0	0	109.6	I498 R500 K501 P502 N517 F518 F520 V523 V525	I498-W507 HydrophobicContact CD1-CE3 4.38Å; I498-W507 HydrophobicContact CD1-CZ3 4.27Å; I498-W507 HydrophobicContact CG2-CE3 4.42Å; R500-W507 WeakPolarHBondContact O-CA 3.28Å; R500-W507 WeakPolarHBondContact O-CB 3.48Å; K501-W507 HydrophobicContact CB-CD2 4.48Å; K501-W507 HydrophobicContact CD-CH2 4.3Å; K501-W507 HydrophobicContact CD-CZ2 4.22Å; K501-W507 HydrophobicContact CG-CD2 3.86Å; K501-W507 VanDerWaalsContact CG-CE2 3.48Å; K501-W507 HydrophobicContact CG-CE3 4.18Å; K501-W507 HydrophobicContact CG-CH2 3.96Å; K501-W507 HydrophobicContact CG-CZ2 3.54Å; K501-W507 HydrophobicContact CG-CZ3 4.25Å; P502-W507 PolarHBondContact O-NE1 3.25Å; W507-N517 CarbonylContact O-C 3.48Å; W507-N517 WeakPolarHBondContact O-CA 3.47Å; W507-F518 HydrophobicContact CB-CD1 4.42Å; W507-F518 HydrophobicContact CB-CD2 4.35Å; W507-F518 HydrophobicContact CB-CE1 3.88Å; W507-F518 HydrophobicContact CB-CE2 3.77Å; W507-F518 HydrophobicContact CB-CZ 3.54Å; W507-F518 HydrophobicContact CD2-CE2 4.28Å; W507-F518 HydrophobicContact CD2-CZ 4.43Å; W507-F518 AromaticContact CE3-CE2 3.67Å; W507-F518 HydrophobicContact CE3-CE2 3.67Å; W507-F518 AromaticContact CE3-CZ 3.83Å; W507-F518 HydrophobicContact CE3-CZ 3.83Å; W507-F518 HydrophobicContact CG-CE2 4.38Å; W507-F518 HydrophobicContact CG-CZ 4.39Å; W507-F518 PolarHBondContact N-O 3.25Å; W507-F518 WeakPolarHBondContact O-CD1 3.37Å; W507-F518 PolarHBondContact O-N 3.2Å; W507-F520 HydrophobicContact CD2-CB 3.66Å; W507-F520 VanDerWaalsContact CE2-CB 3.41Å; W507-F520 HydrophobicContact CE3-CB 3.99Å; W507-F520 HydrophobicContact CG-CB 4.23Å; W507-F520 HydrophobicContact CH2-CB 3.82Å; W507-F520 HydrophobicContact CZ2-CB 3.52Å; W507-F520 HydrophobicContact CZ2-CG 4.13Å; W507-F520 HydrophobicContact CZ3-CB 4.05Å; W507-V523 HydrophobicContact CE3-CG2 4.4Å; W507-V523 HydrophobicContact CZ3-CG2 4.11Å; W507-V525 HydrophobicContact CH2-CG2 3.48Å; W507-V525 VanDerWaalsContact CH2-CG2 3.48Å; W507-V525 HydrophobicContact CZ3-CG2 3.55Å
508	T	96.4	Very high	94	Very high	22 Å²	22	61.2 Å²	61.2	14%	0.135	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	140.5	173.1	-48.7	0	0	0	0	108.4	I499 R500 V515 G516 N517	I499-T508 WeakPolarHBondContact CA-O 3.48Å; I499-T508 HydrophobicContact CB-CG2 4.49Å; I499-T508 WeakPolarHBondContact CB-O 3.3Å; I499-T508 PolarHBondContact N-O 3.18Å; R500-T508 PolarHBondContact N-O 3.3Å; R500-T508 PolarHBondContact O-N 3.06Å; T508-V515 HydrophobicContact CG2-CG1 4.11Å; T508-G516 CarbonylContact C-O 3.51Å; T508-G516 WeakPolarHBondContact CA-O 3.45Å; T508-N517 PolarHBondContact OG1-OD1 2.86Å
509	G	95.9	Very high	94	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	-176.6	178.3	0	0	0	0	0	112.9	H497 V515 G516	H497-G509 CarbonylContact O-C 3.57Å; H497-G509 WeakPolarHBondContact O-CA 3.44Å; G509-V515 WeakPolarHBondContact O-CA 3.24Å; G509-G516 PolarHBondContact N-O 2.99Å; G509-G516 PolarHBondContact O-N 3.06Å
510	M	95.7	Very high	94	Very high	30 Å²	30	68.7 Å²	68.7	15%	0.148	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.2	177.9	-171	179.8	72.6	0	0	111.2	F468 H497 I499 K514 V515	F468-M510 HydrophobicContact CE1-CB 3.98Å; F468-M510 HydrophobicContact CE1-CE 4.29Å; F468-M510 HydrophobicContact CE2-CE 4.41Å; F468-M510 HydrophobicContact CZ-CB 4.42Å; F468-M510 HydrophobicContact CZ-CE 3.6Å; F468-M510 HydrophobicContact CZ-SD 4.21Å; H497-M510 PolarHBondContact N-O 3.33Å; H497-M510 PolarHBondContact O-N 2.81Å; I499-M510 HydrophobicContact CD1-CB 4.19Å; M510-K514 VanDerWaalsContact CA-O 3.31Å; M510-K514 WeakPolarHBondContact CA-O 3.22Å; M510-V515 HydrophobicContact CB-CG2 4.29Å; M510-V515 HydrophobicContact CG-CG2 4.23Å
511	L	94.9	Very high	94.1	Very high	11 Å²	11	64.7 Å²	64.7	6%	0.058	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	130.6	177.6	174.3	61.9	0	0	0	108.9	L488 K489 L490 D494 I495 I496 N513 K514	L488-L511 HydrophobicContact CD1-CB 3.98Å; L488-L511 HydrophobicContact CD2-CB 4.35Å; K489-L511 WeakPolarHBondContact O-CD2 3.48Å; L490-L511 HydrophobicContact CD2-CD2 3.86Å; D494-L511 HydrophobicContact CB-CD1 3.83Å; D494-L511 HydrophobicContact CB-CD2 4.15Å; I495-L511 WeakPolarHBondContact O-CD1 3.45Å; I496-L511 HydrophobicContact CG1-CB 4.41Å; I496-L511 HydrophobicContact CG1-CD2 4.34Å; I496-L511 HydrophobicContact CG2-CB 4.41Å; L511-N513 VanDerWaalsContact C-N 3.29Å; L511-N513 PolarHBondContact O-N 3.05Å; L511-K514 PolarHBondContact N-O 2.93Å; L511-K514 PolarHBondContact O-N 3.12Å
512	N	91.7	Very high	94.2	Very high	123 Å²	123	61.9 Å²	61.9	66%	0.658	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	47.5	-178.1	-58.8	-45.2	0	0	0	112.5	K514	N512-K514 PolarHBondContact O-N 2.85Å
513	N	91.3	Very high	94.2	Very high	112 Å²	112	59.9 Å²	59.9	60%	0.599	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	-10.5	-172.9	-62.4	4.4	0	0	0	116.8	L511	L511-N513 VanDerWaalsContact C-N 3.29Å; L511-N513 PolarHBondContact O-N 3.05Å
514	K	92.9	Very high	94.6	Very high	101 Å²	101	57 Å²	57	44%	0.439	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130.1	175.1	-72.3	173	168.7	-79.9	0	110.4	E460 L488 M510 L511 N512	E460-K514 IonicContact OE1-NZ 2.62Å; E460-K514 PolarHBondContact OE1-NZ 3.44Å; E460-K514 IonicContact OE2-NZ 2.69Å; E460-K514 PolarHBondContact OE2-NZ 3.13Å; L488-K514 HydrophobicContact CD2-CB 4.29Å; L488-K514 WeakPolarHBondContact CD2-O 3.44Å; M510-K514 VanDerWaalsContact CA-O 3.31Å; M510-K514 WeakPolarHBondContact CA-O 3.22Å; L511-K514 PolarHBondContact N-O 2.93Å; L511-K514 PolarHBondContact O-N 3.12Å; N512-K514 PolarHBondContact O-N 2.85Å
515	V	94.9	Very high	94.8	Very high	66 Å²	66	53 Å²	53	40%	0.4	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.9	166.8	174.6	0	0	0	0	108.7	Y464 I499 T508 G509 M510	Y464-V515 HydrophobicContact CD2-CG2 4.07Å; Y464-V515 HydrophobicContact CG-CG2 4.01Å; I499-V515 HydrophobicContact CD1-CB 4.45Å; I499-V515 HydrophobicContact CD1-CG1 3.8Å; I499-V515 HydrophobicContact CD1-CG2 3.88Å; T508-V515 HydrophobicContact CG2-CG1 4.11Å; G509-V515 WeakPolarHBondContact O-CA 3.24Å; M510-V515 HydrophobicContact CB-CG2 4.29Å; M510-V515 HydrophobicContact CG-CG2 4.23Å
516	G	95.1	Very high	94.8	Very high	6 Å²	6	53.3 Å²	53.3	6%	0.062	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	-177.4	178	0	0	0	0	0	114	D486 T508 G509	D486-G516 CarbonylContact O-C 3.42Å; D486-G516 WeakPolarHBondContact O-CA 3.2Å; T508-G516 CarbonylContact C-O 3.51Å; T508-G516 WeakPolarHBondContact CA-O 3.45Å; G509-G516 PolarHBondContact N-O 2.99Å; G509-G516 PolarHBondContact O-N 3.06Å
517	N	96.1	Very high	93.8	Very high	40 Å²	40	51.3 Å²	51.3	21%	0.214	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	145.1	-175.4	-73	-33.3	0	0	0	111.4	D486 S487 L488 I506 W507 T508	D486-N517 PolarHBondContact O-N 3.2Å; D486-N517 PolarHBondContact OD2-ND2 3.46Å; S487-N517 CarbonylContact C-O 3.53Å; S487-N517 VanDerWaalsContact CA-O 3.26Å; S487-N517 WeakPolarHBondContact CA-O 3.22Å; L488-N517 PolarHBondContact N-O 3.42Å; I506-N517 HydrophobicContact CG2-CB 3.7Å; W507-N517 CarbonylContact O-C 3.48Å; W507-N517 WeakPolarHBondContact O-CA 3.47Å; T508-N517 PolarHBondContact OG1-OD1 2.86Å
518	F	96.3	Very high	92	Very high	3 Å²	3	54.2 Å²	54.2	1%	0.013	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	149.7	174.9	66.1	-85.9	0	0	0	110.3	L488 L490 I496 I498 W507 V523	L488-F518 HydrophobicContact CD1-CD1 3.99Å; L490-F518 HydrophobicContact CD1-CB 4.16Å; L490-F518 HydrophobicContact CD2-CB 4.29Å; I496-F518 HydrophobicContact CD1-CB 4.4Å; I496-F518 HydrophobicContact CD1-CD1 3.9Å; I496-F518 HydrophobicContact CD1-CD2 3.9Å; I496-F518 HydrophobicContact CD1-CE1 4.08Å; I496-F518 HydrophobicContact CD1-CE2 4.11Å; I496-F518 HydrophobicContact CD1-CG 3.79Å; I496-F518 HydrophobicContact CD1-CZ 4.17Å; I496-F518 HydrophobicContact CG2-CD1 4.19Å; I496-F518 HydrophobicContact CG2-CE1 3.76Å; I496-F518 HydrophobicContact CG2-CZ 4.28Å; I498-F518 HydrophobicContact CG2-CZ 4.46Å; W507-F518 HydrophobicContact CB-CD1 4.42Å; W507-F518 HydrophobicContact CB-CD2 4.35Å; W507-F518 HydrophobicContact CB-CE1 3.88Å; W507-F518 HydrophobicContact CB-CE2 3.77Å; W507-F518 HydrophobicContact CB-CZ 3.54Å; W507-F518 HydrophobicContact CD2-CE2 4.28Å; W507-F518 HydrophobicContact CD2-CZ 4.43Å; W507-F518 AromaticContact CE3-CE2 3.67Å; W507-F518 HydrophobicContact CE3-CE2 3.67Å; W507-F518 AromaticContact CE3-CZ 3.83Å; W507-F518 HydrophobicContact CE3-CZ 3.83Å; W507-F518 HydrophobicContact CG-CE2 4.38Å; W507-F518 HydrophobicContact CG-CZ 4.39Å; W507-F518 PolarHBondContact N-O 3.25Å; W507-F518 WeakPolarHBondContact O-CD1 3.37Å; W507-F518 PolarHBondContact O-N 3.2Å; F518-V523 HydrophobicContact CD2-CG1 3.91Å; F518-V523 HydrophobicContact CD2-CG2 4.26Å; F518-V523 HydrophobicContact CE2-CG1 4.03Å; F518-V523 HydrophobicContact CE2-CG2 3.67Å
519	K	95.4	Very high	90	Very high	93 Å²	93	60.6 Å²	60.6	40%	0.404	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.3	178.7	-157.8	177.6	172.2	-178.2	0	109.7	I521 Y522	K519-I521 HydrophobicContact CB-CG1 4.32Å; K519-I521 HydrophobicContact CD-CD1 3.74Å; K519-I521 HydrophobicContact CD-CG1 3.73Å; K519-I521 HydrophobicContact CG-CD1 4.45Å; K519-I521 HydrophobicContact CG-CG1 3.9Å; K519-I521 PolarHBondContact O-N 2.8Å; K519-Y522 HydrophobicContact CB-CD2 3.91Å; K519-Y522 HydrophobicContact CB-CE2 3.81Å; K519-Y522 PolarHBondContact O-N 3.21Å
520	F	94.3	Very high	87.5	Confident	79 Å²	79	68.8 Å²	68.8	35%	0.346	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-59.6	-24.5	-175.4	78.4	-92.5	0	0	0	113.6	G505 W507 Y522 V523	G505-F520 WeakPolarHBondContact O-CD1 3.36Å; W507-F520 HydrophobicContact CD2-CB 3.66Å; W507-F520 VanDerWaalsContact CE2-CB 3.41Å; W507-F520 HydrophobicContact CE3-CB 3.99Å; W507-F520 HydrophobicContact CG-CB 4.23Å; W507-F520 HydrophobicContact CH2-CB 3.82Å; W507-F520 HydrophobicContact CZ2-CB 3.52Å; W507-F520 HydrophobicContact CZ2-CG 4.13Å; W507-F520 HydrophobicContact CZ3-CB 4.05Å; F520-Y522 PolarHBondContact O-N 2.93Å; F520-V523 PolarHBondContact O-N 3.19Å
521	I	95.6	Very high	85.2	Confident	73 Å²	73	71.7 Å²	71.7	37%	0.374	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-68.2	2	179.2	73.4	167.8	0	0	0	114.9	H475 K519	H475-I521 PolarHBondContact CE1-O 3.37Å; K519-I521 HydrophobicContact CB-CG1 4.32Å; K519-I521 HydrophobicContact CD-CD1 3.74Å; K519-I521 HydrophobicContact CD-CG1 3.73Å; K519-I521 HydrophobicContact CG-CD1 4.45Å; K519-I521 HydrophobicContact CG-CG1 3.9Å; K519-I521 PolarHBondContact O-N 2.8Å
522	Y	95.9	Very high	82.8	Confident	56 Å²	56	80.1 Å²	80.1	22%	0.22	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-111.6	-0.9	177.1	-55.7	-42.4	0	0	0	112.9	V474 H475 T476 F478 L490 K519 F520	V474-Y522 WeakPolarHBondContact CA-O 2.9Å; H475-Y522 PolarHBondContact N-O 2.92Å; T476-Y522 HydrophobicContact CG2-CD1 3.8Å; T476-Y522 HydrophobicContact CG2-CE1 4.29Å; T476-Y522 PolarHBondContact N-O 3.46Å; F478-Y522 HydrophobicContact CB-CD2 4.07Å; F478-Y522 HydrophobicContact CB-CE2 4.2Å; F478-Y522 HydrophobicContact CD2-CD2 4.39Å; F478-Y522 AromaticContact CD2-CE2 3.69Å; F478-Y522 HydrophobicContact CD2-CE2 3.69Å; F478-Y522 HydrophobicContact CE2-CE2 4.25Å; F478-Y522 HydrophobicContact CG-CD2 4.2Å; F478-Y522 AromaticContact CG-CE2 3.93Å; F478-Y522 HydrophobicContact CG-CE2 3.93Å; L490-Y522 HydrophobicContact CD1-CD2 4.25Å; K519-Y522 HydrophobicContact CB-CD2 3.91Å; K519-Y522 HydrophobicContact CB-CE2 3.81Å; K519-Y522 PolarHBondContact O-N 3.21Å; F520-Y522 PolarHBondContact O-N 2.93Å
523	V	95.7	Very high	80.9	Confident	9 Å²	9	82 Å²	82	6%	0.055	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.8	-173.8	-44.2	0	0	0	0	112.9	A472 R473 V474 H475 L490 I496 W507 F518 F520	A472-V523 HydrophobicContact CB-CB 3.96Å; A472-V523 HydrophobicContact CB-CG2 3.6Å; R473-V523 CarbonylContact O-C 3.58Å; R473-V523 VanDerWaalsContact O-CA 3.28Å; R473-V523 WeakPolarHBondContact O-CA 3.36Å; V474-V523 HydrophobicContact CG2-CG1 4.01Å; H475-V523 PolarHBondContact NE2-N 2.66Å; L490-V523 HydrophobicContact CD1-CG1 4.48Å; I496-V523 HydrophobicContact CD1-CG1 3.94Å; W507-V523 HydrophobicContact CE3-CG2 4.4Å; W507-V523 HydrophobicContact CZ3-CG2 4.11Å; F518-V523 HydrophobicContact CD2-CG1 3.91Å; F518-V523 HydrophobicContact CD2-CG2 4.26Å; F518-V523 HydrophobicContact CE2-CG1 4.03Å; F518-V523 HydrophobicContact CE2-CG2 3.67Å; F520-V523 PolarHBondContact O-N 3.19Å
524	D	95.3	Very high	78.8	Confident	71 Å²	71	85.1 Å²	85.1	38%	0.38	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.1	163.4	-62.5	-42.5	0	0	0	108.3	A472 R473 H475 L526	A472-D524 CarbonylContact C-O 3.52Å; A472-D524 WeakPolarHBondContact CA-O 3.34Å; A472-D524 WeakPolarHBondContact CB-O 3.49Å; R473-D524 PolarHBondContact N-O 3.15Å; R473-D524 IonicContact NH2-OD2 2.7Å; R473-D524 PolarHBondContact O-N 3.13Å; H475-D524 PolarHBondContact CD2-N 3.15Å; H475-D524 IonicContact CD2-OD1 3.46Å; H475-D524 PolarHBondContact CD2-OD1 3.28Å; D524-L526 PolarHBondContact O-N 3.06Å
525	V	94	Very high	76.5	Confident	63 Å²	63	87.2 Å²	87.2	38%	0.382	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	122.6	165.8	177.5	0	0	0	0	108.1	W507 A527	W507-V525 HydrophobicContact CH2-CG2 3.48Å; W507-V525 VanDerWaalsContact CH2-CG2 3.48Å; W507-V525 HydrophobicContact CZ3-CG2 3.55Å; V525-A527 PolarHBondContact O-N 3.12Å
526	L	90.9	Very high	74.4	Confident	43 Å²	43	93.1 Å²	93.1	23%	0.225	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	103.9	166.7	-60.3	-173.2	0	0	0	107.3	R471 R473 I495 D524 E528	R471-L526 HydrophobicContact CB-CB 4.44Å; R471-L526 PolarHBondContact O-N 3.06Å; R473-L526 HydrophobicContact CB-CD1 4.11Å; R473-L526 HydrophobicContact CB-CD2 3.88Å; R473-L526 HydrophobicContact CB-CG 4Å; I495-L526 HydrophobicContact CD1-CD1 3.95Å; D524-L526 PolarHBondContact O-N 3.06Å; L526-E528 PolarHBondContact O-N 3.09Å
527	A	73.8	Confident	72.2	Confident	59 Å²	59	102 Å²	102	49%	0.488	49%	0.487	S	S	.	.			trans	-63.4	125	165.4	0	0	0	0	0	108.3	V525 E529	V525-A527 PolarHBondContact O-N 3.12Å; A527-E529 HydrophobicContact CB-CG 3.83Å; A527-E529 PolarHBondContact O-N 3.15Å
528	E	60.6	Low	69.3	Low	78 Å²	78	103.9 Å²	103.9	36%	0.364	50%	0.504	S	S	.	.			trans	-77.3	37.8	179.3	-69.1	162.4	156.4	0	0	111.3	R471 L526 K530 E531	R471-E528 WeakPolarHBondContact CG-OE1 3.31Å; R471-E528 IonicContact CZ-OE1 3.83Å; R471-E528 IonicContact NE-OE1 3.64Å; R471-E528 IonicContact NH1-OE1 2.63Å; R471-E528 PolarHBondContact NH1-OE1 2.91Å; L526-E528 PolarHBondContact O-N 3.09Å; E528-K530 PolarHBondContact O-N 2.96Å; E528-E531 PolarHBondContact O-N 3.39Å
529	E	53.4	Low	67	Low	156 Å²	156	109.5 Å²	109.5	73%	0.729	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	3.5	179.6	-72.9	173.5	173.4	0	0	113.6	A527	A527-E529 HydrophobicContact CB-CG 3.83Å; A527-E529 PolarHBondContact O-N 3.15Å
530	K	44.7	Very low	64.3	Low	173 Å²	173	114.1 Å²	114.1	75%	0.752	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-2.8	-178.6	-65.8	-155.2	169.5	-144.9	0	115.7	E528	E528-K530 PolarHBondContact O-N 2.96Å
531	E	45.9	Very low	62	Low	91 Å²	91	117.3 Å²	117.3	43%	0.425	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.3	-10.9	169.2	-80.3	158.5	-177.2	0	0	111.7	R471 E528 E533 E534 E535	R471-E531 IonicContact CZ-OE1 3.9Å; R471-E531 IonicContact CZ-OE2 3.61Å; R471-E531 IonicContact NH1-OE1 3.15Å; R471-E531 IonicContact NH1-OE2 3.67Å; R471-E531 PolarHBondContact NH1-OE2 2.99Å; R471-E531 IonicContact NH2-OE1 3.28Å; R471-E531 PolarHBondContact NH2-OE1 3.14Å; R471-E531 IonicContact NH2-OE2 2.68Å; R471-E531 PolarHBondContact NH2-OE2 3.43Å; E528-E531 PolarHBondContact O-N 3.39Å; E531-E533 PolarHBondContact O-N 2.93Å; E531-E534 PolarHBondContact O-N 2.97Å; E531-E535 PolarHBondContact O-N 3.25Å; E531-E535 VanDerWaalsContact O-N 3.13Å
532	K	45.7	Very low	59.7	Low	187 Å²	187	123.4 Å²	123.4	81%	0.813	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-2.3	170.2	-68.2	-168.9	175	-174.1	0	115.7
533	E	51.3	Low	57	Low	163 Å²	163	129.9 Å²	129.9	76%	0.762	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-11.6	176.9	-66.2	-172.5	146.8	0	0	113.6	E531	E531-E533 PolarHBondContact O-N 2.93Å
534	E	47.5	Very low	54.8	Low	178 Å²	178	136.5 Å²	136.5	83%	0.832	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	-13.2	179.7	-67.6	-170.7	160.3	0	0	114.3	E531 E536	E531-E534 PolarHBondContact O-N 2.97Å; E534-E536 VanDerWaalsContact C-N 3.28Å; E534-E536 PolarHBondContact O-N 3.02Å
535	E	44.4	Very low	52.6	Low	144 Å²	144	141.2 Å²	141.2	67%	0.673	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-85.7	16.7	172.8	-147.6	-175.1	-174.5	0	0	114	E531 E537	E531-E535 PolarHBondContact O-N 3.25Å; E531-E535 VanDerWaalsContact O-N 3.13Å; E535-E537 PolarHBondContact O-N 2.89Å
536	E	51.1	Low	50.4	Low	190 Å²	190	143.4 Å²	143.4	89%	0.888	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-72.2	-6.6	177.9	-149.3	178	-147.9	0	0	113.3	E534	E534-E536 VanDerWaalsContact C-N 3.28Å; E534-E536 PolarHBondContact O-N 3.02Å
537	E	48.9	Very low	48.4	Very low	192 Å²	192	144 Å²	144	90%	0.897	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-102	23.9	-179.3	-146.4	177.3	-142.9	0	0	115.4	E535	E535-E537 PolarHBondContact O-N 2.89Å
538	S	34.1	Very low	47.2	Very low	80 Å²	80	151.8 Å²	151.8	56%	0.559	72%	0.717	S	S	*	*	S	Bend	trans	-146.2	123.4	160.6	113.4	0	0	0	0	113.7
539	P	48.4	Very low	47	Very low	121 Å²	121	156.2 Å²	156.2	79%	0.786	73%	0.73	S	S	*	*			trans	-97.5	125	-170.1	34.2	-33.4	0	0	0	114.4
540	K	39	Very low	47.1	Very low	191 Å²	191	153.5 Å²	153.5	83%	0.83	73%	0.727	S	S	*	*			trans	-153.4	101.8	156.6	-112.2	147.4	-171.9	172.3	0	116
541	I	45.5	Very low	47.9	Very low	146 Å²	146	149.7 Å²	149.7	75%	0.749	71%	0.708	S	S	*	*			trans	71.6	100.2	143.2	-54	174.1	0	0	0	118.1
542	R	48.3	Very low	48.8	Very low	200 Å²	200	145.4 Å²	145.4	76%	0.755	69%	0.688	S	S	*	*			trans	52.7	94.1	142.8	-69.8	178.8	151.5	165.6	-10.1	118.6	D609	R542-D609 IonicContact NH2-OD2 2.75Å; R542-D609 PolarHBondContact NH2-OD2 2.69Å; R542-D609 VanDerWaalsContact NH2-OD2 3.15Å
543	E	39.6	Very low	49.7	Very low	193 Å²	193	145.7 Å²	145.7	90%	0.902	69%	0.689	S	S	*	*	S	Bend		-117	172.1	119.4	-71.6	-163.4	166.8	0	0	109.9	K545	E543-K545 PolarHBondContact O-N 2.94Å
544	Q	48.2	Very low	51.2	Low	147 Å²	147	141.4 Å²	141.4	69%	0.687	67%	0.674	S	S	*	*			trans	-67	125.7	-161	-70.4	168.6	-30.1	0	0	113	L546	Q544-L546 VanDerWaalsContact C-N 3.34Å; Q544-L546 PolarHBondContact O-N 3.28Å
545	K	50	Low	52.9	Low	170 Å²	170	133.4 Å²	133.4	74%	0.739	64%	0.637	S	S	*	*			trans	-72.4	86.4	173.5	-70.6	-171.1	175	-170.2	0	110.4	E543 C547 F610	E543-K545 PolarHBondContact O-N 2.94Å; K545-C547 PolarHBondContact O-N 3.23Å; K545-F610 HydrophobicContact CB-CD1 4.36Å; K545-F610 HydrophobicContact CB-CE1 3.57Å; K545-F610 HydrophobicContact CB-CZ 4.33Å; K545-F610 HydrophobicContact CD-CE1 4.46Å; K545-F610 HydrophobicContact CD-CZ 4.43Å; K545-F610 WeakPolarHBondContact O-CD1 3.31Å; K545-F610 VanDerWaalsContact O-CE1 3.22Å; K545-F610 WeakPolarHBondContact O-CE1 3.17Å
546	L	47.1	Very low	54.7	Low	109 Å²	109	131.4 Å²	131.4	57%	0.571	63%	0.63	S	S	*	*			trans	-65.7	94.4	173.3	-67.1	173	0	0	0	110.4	Q544 K548 V613	Q544-L546 VanDerWaalsContact C-N 3.34Å; Q544-L546 PolarHBondContact O-N 3.28Å; L546-K548 PolarHBondContact O-N 3.42Å; L546-K548 VanDerWaalsContact O-N 3.12Å; L546-V613 HydrophobicContact CD2-CG2 3.6Å
547	C	48.5	Very low	56.3	Low	57 Å²	57	125 Å²	125	39%	0.385	60%	0.6	S	S	.	*			trans	-66.6	109.8	176	-96.3	0	0	0	0	110.5	K545 R549 F610	K545-C547 PolarHBondContact O-N 3.23Å; C547-R549 PolarHBondContact O-N 2.9Å; C547-F610 HydrophobicContact CB-CD1 4.28Å; C547-F610 HydrophobicContact CB-CE1 4.3Å; C547-F610 WeakPolarHBondContact SG-CE1 3.46Å
548	K	50	Low	58.1	Low	221 Å²	221	116.3 Å²	116.3	96%	0.961	56%	0.56	S	S	*	*			trans	-68.8	37.1	169.3	-56.8	-176.1	-178.9	-178.5	0	113.2	L546	L546-K548 PolarHBondContact O-N 3.42Å; L546-K548 VanDerWaalsContact O-N 3.12Å
549	R	54.7	Low	60.6	Low	171 Å²	171	112.5 Å²	112.5	65%	0.645	53%	0.533	S	S	*	.	S	Bend	trans	-117.3	137.8	178	-70.7	-175.5	175.2	-176.9	-2.4	108.1	C547 R551	C547-R549 PolarHBondContact O-N 2.9Å; R549-R551 PolarHBondContact O-N 3Å
550	P	56.3	Low	62.4	Low	100 Å²	100	111.7 Å²	111.7	65%	0.649	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-56.9	134.7	178.6	24.3	-33.8	0	0	0	110.2	R561	P550-R561 PolarHBondContact O-NH1 3.12Å; P550-R561 PolarHBondContact O-NH2 3.15Å; P550-R561 VanDerWaalsContact O-NH2 3.07Å
551	R	61.1	Low	64.5	Low	93 Å²	93	106.4 Å²	106.4	35%	0.351	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-50.4	120.6	176.5	-176.4	178.3	-171.7	164.5	3.3	108.9	R549 K553 E580 Y612 E614	R549-R551 PolarHBondContact O-N 3Å; R551-K553 PolarHBondContact O-N 3.38Å; R551-E580 IonicContact CZ-OE1 2.64Å; R551-E580 IonicContact NE-OE1 3.6Å; R551-E580 IonicContact NH2-OE1 3.6Å; R551-E580 PolarHBondContact NH2-OE1 3.49Å; R551-Y612 HydrophobicContact CB-CD1 3.88Å; R551-Y612 HydrophobicContact CB-CD2 4.41Å; R551-Y612 HydrophobicContact CB-CE1 4.35Å; R551-Y612 HydrophobicContact CB-CG 3.92Å; R551-Y612 HydrophobicContact CG-CD1 4.22Å; R551-Y612 HydrophobicContact CG-CD2 3.84Å; R551-Y612 HydrophobicContact CG-CE2 4.31Å; R551-Y612 HydrophobicContact CG-CG 3.8Å; R551-E614 IonicContact NH1-OE1 2.66Å; R551-E614 IonicContact NH1-OE2 3.5Å
552	P	66.3	Low	66.3	Low	1 Å²	1	101.3 Å²	101.3	1%	0.006	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-63	132.2	172.4	26.2	-27.7	0	0	0	107.5	T554 E557 L558 Y612	P552-T554 VanDerWaalsContact C-N 3.31Å; P552-E557 WeakPolarHBondContact CA-OE2 3.16Å; P552-E557 HydrophobicContact CB-CB 3.95Å; P552-E557 HydrophobicContact CB-CG 3.83Å; P552-L558 HydrophobicContact CB-CB 4.12Å; P552-L558 HydrophobicContact CG-CB 3.73Å; P552-L558 HydrophobicContact CG-CD1 3.98Å; P552-L558 HydrophobicContact CG-CG 4.29Å; P552-Y612 VanDerWaalsContact CD-CZ 3.44Å; P552-Y612 VanDerWaalsContact CD-OH 3.27Å; P552-Y612 WeakPolarHBondContact CD-OH 3.04Å
553	K	64	Low	68	Low	193 Å²	193	97.9 Å²	97.9	84%	0.839	47%	0.465	S	S	*	.	S	Bend	trans	-88.9	-3.6	-173.7	-64.8	-170.6	178	-172.8	0	112.9	R551 E557	R551-K553 PolarHBondContact O-N 3.38Å; K553-E557 PolarHBondContact N-OE2 2.9Å
554	T	81.6	Confident	70.2	Confident	72 Å²	72	88.8 Å²	88.8	44%	0.442	42%	0.422	S	S	.	.	S	Bend	trans	-137.3	153.2	176.9	67.2	0	0	0	0	110.5	P552 L556 E557 L558	P552-T554 VanDerWaalsContact C-N 3.31Å; T554-L556 PolarHBondContact O-N 3.15Å; T554-E557 PolarHBondContact O-N 2.96Å; T554-E557 VanDerWaalsContact OG1-CB 3.32Å; T554-E557 WeakPolarHBondContact OG1-CB 3.44Å; T554-E557 PolarHBondContact OG1-N 2.85Å; T554-E557 VanDerWaalsContact OG1-N 3.13Å; T554-L558 PolarHBondContact O-N 3.5Å
555	L	83.9	Confident	72	Confident	11 Å²	11	86.7 Å²	86.7	6%	0.058	41%	0.412	C	S	.	.	H	α-helix	trans	-54.8	-41.6	170.5	172.3	60	0	0	0	112	L558 L559 L571 Y576 L582	L555-L558 PolarHBondContact O-N 2.83Å; L555-L559 HydrophobicContact CD1-CD1 3.86Å; L555-L559 HydrophobicContact CD1-CG 4.08Å; L555-L559 HydrophobicContact CG-CD1 3.84Å; L555-L559 HydrophobicContact CG-CG 4.46Å; L555-L559 WeakPolarHBondContact O-CG 3.45Å; L555-L559 PolarHBondContact O-N 3.36Å; L555-L571 HydrophobicContact CD1-CD1 4.46Å; L555-L571 HydrophobicContact CD2-CB 4.13Å; L555-Y576 WeakPolarHBondContact CD2-O 3.42Å; L555-L582 HydrophobicContact CD1-CD1 3.64Å; L555-L582 HydrophobicContact CD1-CD2 3.87Å; L555-L582 HydrophobicContact CD1-CG 4Å
556	L	83.3	Confident	73.6	Confident	101 Å²	101	86.8 Å²	86.8	53%	0.529	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-46.9	-178.2	-162.3	162.2	0	0	0	111.5	T554 L558 L559 E560	T554-L556 PolarHBondContact O-N 3.15Å; L556-L558 VanDerWaalsContact C-N 3.26Å; L556-L558 PolarHBondContact O-N 2.77Å; L556-L559 PolarHBondContact O-N 2.94Å; L556-E560 WeakPolarHBondContact O-CB 3.25Å; L556-E560 PolarHBondContact O-N 3.37Å
557	E	84.7	Confident	75.5	Confident	56 Å²	56	82.9 Å²	82.9	26%	0.262	39%	0.393	S	S	.	.	H	α-helix	trans	-60.4	-34.5	176.8	-172.4	-167.9	171.5	0	0	112.2	P552 K553 T554 R561	P552-E557 WeakPolarHBondContact CA-OE2 3.16Å; P552-E557 HydrophobicContact CB-CB 3.95Å; P552-E557 HydrophobicContact CB-CG 3.83Å; K553-E557 PolarHBondContact N-OE2 2.9Å; T554-E557 PolarHBondContact O-N 2.96Å; T554-E557 VanDerWaalsContact OG1-CB 3.32Å; T554-E557 WeakPolarHBondContact OG1-CB 3.44Å; T554-E557 PolarHBondContact OG1-N 2.85Å; T554-E557 VanDerWaalsContact OG1-N 3.13Å; E557-R561 WeakPolarHBondContact O-CB 3.22Å; E557-R561 WeakPolarHBondContact O-CD 3.34Å; E557-R561 WeakPolarHBondContact O-CG 3.35Å; E557-R561 PolarHBondContact O-N 3.24Å; E557-R561 IonicContact OE1-CZ 3.8Å; E557-R561 IonicContact OE1-NE 3.35Å; E557-R561 PolarHBondContact OE1-NE 2.91Å; E557-R561 IonicContact OE1-NH2 3.8Å; E557-R561 PolarHBondContact OE1-NH2 3.39Å
558	L	85.1	Confident	77.4	Confident	9 Å²	9	81 Å²	81	5%	0.047	38%	0.382	C	S	.	.	H	α-helix	trans	-69.3	-41.1	173.4	178.8	56.9	0	0	0	111.9	P552 T554 L555 L556 R561 L562 V579 L582 A607	P552-L558 HydrophobicContact CB-CB 4.12Å; P552-L558 HydrophobicContact CG-CB 3.73Å; P552-L558 HydrophobicContact CG-CD1 3.98Å; P552-L558 HydrophobicContact CG-CG 4.29Å; T554-L558 PolarHBondContact O-N 3.5Å; L555-L558 PolarHBondContact O-N 2.83Å; L556-L558 VanDerWaalsContact C-N 3.26Å; L556-L558 PolarHBondContact O-N 2.77Å; L558-R561 PolarHBondContact O-N 3.09Å; L558-L562 HydrophobicContact CD1-CD1 3.97Å; L558-L562 HydrophobicContact CD1-CG 4.4Å; L558-L562 HydrophobicContact CG-CD1 4.05Å; L558-L562 WeakPolarHBondContact O-CD1 3.39Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.01Å; L558-L562 PolarHBondContact O-N 3.39Å; L558-V579 HydrophobicContact CD2-CG1 4.05Å; L558-V579 HydrophobicContact CD2-CG2 4.3Å; L558-L582 HydrophobicContact CD2-CD1 3.41Å; L558-L582 VanDerWaalsContact CD2-CD1 3.41Å; L558-A607 HydrophobicContact CD1-CB 4.39Å; L558-A607 HydrophobicContact CD2-CB 4.33Å
559	L	86.6	Confident	79.2	Confident	0 Å²	0	75 Å²	75	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-68.3	-41.3	178.8	-68.5	169.9	0	0	0	112.3	L555 L556 L562 N563 L564 A568 L571 L604	L555-L559 HydrophobicContact CD1-CD1 3.86Å; L555-L559 HydrophobicContact CD1-CG 4.08Å; L555-L559 HydrophobicContact CG-CD1 3.84Å; L555-L559 HydrophobicContact CG-CG 4.46Å; L555-L559 WeakPolarHBondContact O-CG 3.45Å; L555-L559 PolarHBondContact O-N 3.36Å; L556-L559 PolarHBondContact O-N 2.94Å; L559-L562 CarbonylContact O-C 3.59Å; L559-L562 PolarHBondContact O-N 2.63Å; L559-L562 VanDerWaalsContact O-N 3.09Å; L559-N563 PolarHBondContact O-N 3.12Å; L559-L564 HydrophobicContact CB-CB 4.45Å; L559-L564 HydrophobicContact CD2-CB 3.84Å; L559-L564 PolarHBondContact O-N 3.04Å; L559-A568 VanDerWaalsContact CD1-CA 3.49Å; L559-A568 HydrophobicContact CD1-CB 3.54Å; L559-L571 HydrophobicContact CD1-CD1 3.98Å; L559-L571 HydrophobicContact CD2-CD1 3.95Å; L559-L604 HydrophobicContact CD2-CD2 3.54Å
560	E	86.4	Confident	80.8	Confident	104 Å²	104	68.3 Å²	68.3	49%	0.486	35%	0.349	S	S	.	.	H	α-helix	trans	-54.5	-52.9	170.9	178.6	-174	-168.5	0	0	110.6	L556 L562 N563 E565	L556-E560 WeakPolarHBondContact O-CB 3.25Å; L556-E560 PolarHBondContact O-N 3.37Å; E560-L562 PolarHBondContact O-N 3.21Å; E560-N563 PolarHBondContact O-N 3.02Å; E560-N563 PolarHBondContact O-ND2 2.75Å; E560-E565 WeakPolarHBondContact CA-OE1 3.29Å; E560-E565 HydrophobicContact CB-CG 4.17Å
561	R	83.3	Confident	82.3	Confident	80 Å²	80	63.6 Å²	63.6	30%	0.302	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-21	176.8	-70	165.4	177.2	-151.7	5.9	114.1	P550 E557 L558	P550-R561 PolarHBondContact O-NH1 3.12Å; P550-R561 PolarHBondContact O-NH2 3.15Å; P550-R561 VanDerWaalsContact O-NH2 3.07Å; E557-R561 WeakPolarHBondContact O-CB 3.22Å; E557-R561 WeakPolarHBondContact O-CD 3.34Å; E557-R561 WeakPolarHBondContact O-CG 3.35Å; E557-R561 PolarHBondContact O-N 3.24Å; E557-R561 IonicContact OE1-CZ 3.8Å; E557-R561 IonicContact OE1-NE 3.35Å; E557-R561 PolarHBondContact OE1-NE 2.91Å; E557-R561 IonicContact OE1-NH2 3.8Å; E557-R561 PolarHBondContact OE1-NH2 3.39Å; L558-R561 PolarHBondContact O-N 3.09Å
562	L	84.5	Confident	83.6	Confident	40 Å²	40	63.9 Å²	63.9	21%	0.209	33%	0.326	C	S	.	.	H	α-helix	trans	-98.8	-8.4	176.5	-66.3	167.6	0	0	0	113.5	L558 L559 E560 L564 L604 A607	L558-L562 HydrophobicContact CD1-CD1 3.97Å; L558-L562 HydrophobicContact CD1-CG 4.4Å; L558-L562 HydrophobicContact CG-CD1 4.05Å; L558-L562 WeakPolarHBondContact O-CD1 3.39Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.01Å; L558-L562 PolarHBondContact O-N 3.39Å; L559-L562 CarbonylContact O-C 3.59Å; L559-L562 PolarHBondContact O-N 2.63Å; L559-L562 VanDerWaalsContact O-N 3.09Å; E560-L562 PolarHBondContact O-N 3.21Å; L562-L564 HydrophobicContact CB-CB 4.28Å; L562-L564 HydrophobicContact CB-CD1 3.74Å; L562-L564 HydrophobicContact CB-CG 3.89Å; L562-L564 HydrophobicContact CD1-CD1 4.26Å; L562-L604 HydrophobicContact CD1-CD2 4.35Å; L562-A607 HydrophobicContact CD1-CB 3.7Å
563	N	82.1	Confident	84.6	Confident	128 Å²	128	71 Å²	71	68%	0.684	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	55.3	-170.5	-62.4	-130.3	0	0	0	110.7	L559 E560	L559-N563 PolarHBondContact O-N 3.12Å; E560-N563 PolarHBondContact O-N 3.02Å; E560-N563 PolarHBondContact O-ND2 2.75Å
564	L	86.5	Confident	85.6	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	35%	0.348	C	S	.	.			trans	-137.8	19.8	-172.9	-66.6	-178.4	0	0	0	113.7	L559 L562 E566 Y567 H600 K603 L604	L559-L564 HydrophobicContact CB-CB 4.45Å; L559-L564 HydrophobicContact CD2-CB 3.84Å; L559-L564 PolarHBondContact O-N 3.04Å; L562-L564 HydrophobicContact CB-CB 4.28Å; L562-L564 HydrophobicContact CB-CD1 3.74Å; L562-L564 HydrophobicContact CB-CG 3.89Å; L562-L564 HydrophobicContact CD1-CD1 4.26Å; L564-E566 PolarHBondContact O-N 3.24Å; L564-E566 VanDerWaalsContact O-N 3.12Å; L564-Y567 HydrophobicContact CB-CD2 4.18Å; L564-Y567 HydrophobicContact CD2-CD2 4.04Å; L564-Y567 HydrophobicContact CD2-CE2 3.87Å; L564-Y567 PolarHBondContact O-N 3.31Å; L564-H600 HydrophobicContact CD2-CB 3.78Å; L564-H600 VanDerWaalsContact CD2-CD2 3.44Å; L564-H600 WeakPolarHBondContact CD2-CD2 3.44Å; L564-H600 VanDerWaalsContact CD2-CG 3.49Å; L564-K603 HydrophobicContact CD1-CB 3.79Å; L564-K603 HydrophobicContact CD1-CD 4.08Å; L564-K603 HydrophobicContact CD2-CD 4.13Å; L564-K603 HydrophobicContact CG-CD 4.26Å; L564-L604 HydrophobicContact CD1-CD1 4.15Å; L564-L604 HydrophobicContact CD1-CD2 3.67Å; L564-L604 HydrophobicContact CD1-CG 3.6Å
565	E	85.5	Confident	85.7	Confident	103 Å²	103	65.6 Å²	65.6	48%	0.481	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-54.3	-31.1	-178.1	-68.7	157.5	-120	0	0	113.4	E560 Y567 A568	E560-E565 WeakPolarHBondContact CA-OE1 3.29Å; E560-E565 HydrophobicContact CB-CG 4.17Å; E565-Y567 PolarHBondContact O-N 2.8Å; E565-Y567 VanDerWaalsContact O-N 3.1Å; E565-A568 WeakPolarHBondContact O-CB 3.34Å; E565-A568 PolarHBondContact O-N 2.87Å
566	E	85.3	Confident	85.7	Confident	171 Å²	171	66.5 Å²	66.5	80%	0.799	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-53.8	-29.8	176.2	-61.9	179.1	-157.2	0	0	113.3	L564	L564-E566 PolarHBondContact O-N 3.24Å; L564-E566 VanDerWaalsContact O-N 3.12Å
567	Y	86.6	Confident	85.8	Confident	28 Å²	28	68.5 Å²	68.5	11%	0.11	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-90.7	-5.3	179.3	-55.2	-69.4	0	0	0	113.8	L564 E565 S569 A570 L571 V595 D597 H600	L564-Y567 HydrophobicContact CB-CD2 4.18Å; L564-Y567 HydrophobicContact CD2-CD2 4.04Å; L564-Y567 HydrophobicContact CD2-CE2 3.87Å; L564-Y567 PolarHBondContact O-N 3.31Å; E565-Y567 PolarHBondContact O-N 2.8Å; E565-Y567 VanDerWaalsContact O-N 3.1Å; Y567-S569 VanDerWaalsContact C-N 3.34Å; Y567-S569 PolarHBondContact O-N 3.41Å; Y567-A570 PolarHBondContact O-N 3Å; Y567-A570 VanDerWaalsContact O-N 3.14Å; Y567-L571 WeakPolarHBondContact O-CB 3.39Å; Y567-L571 WeakPolarHBondContact O-CG 3.28Å; Y567-L571 PolarHBondContact O-N 3.13Å; Y567-V595 HydrophobicContact CD1-CB 4.47Å; Y567-V595 HydrophobicContact CD1-CG1 4.47Å; Y567-V595 HydrophobicContact CD1-CG2 3.74Å; Y567-V595 HydrophobicContact CE1-CB 4.2Å; Y567-V595 HydrophobicContact CE1-CG1 4.02Å; Y567-V595 HydrophobicContact CE1-CG2 3.97Å; Y567-V595 HydrophobicContact CE2-CG1 4.31Å; Y567-V595 HydrophobicContact CG-CG2 4.23Å; Y567-D597 PolarHBondContact OH-OD2 3.42Å; Y567-H600 HydrophobicContact CE2-CB 3.94Å; Y567-H600 AromaticContact CE2-CG 3.92Å; Y567-H600 AromaticContact CE2-ND1 3.53Å; Y567-H600 AromaticContact CZ-ND1 3.69Å; Y567-H600 PolarHBondContact OH-ND1 3.33Å
568	A	88	Confident	85.8	Confident	18 Å²	18	68.2 Å²	68.2	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-57.7	-45.6	-178.7	0	0	0	0	0	111.9	L559 E565 A570 L571 L572	L559-A568 VanDerWaalsContact CD1-CA 3.49Å; L559-A568 HydrophobicContact CD1-CB 3.54Å; E565-A568 WeakPolarHBondContact O-CB 3.34Å; E565-A568 PolarHBondContact O-N 2.87Å; A568-A570 VanDerWaalsContact C-N 3.33Å; A568-A570 PolarHBondContact O-N 3.46Å; A568-L571 PolarHBondContact O-N 3.22Å; A568-L572 VanDerWaalsContact O-CB 3.24Å; A568-L572 WeakPolarHBondContact O-CB 3.48Å; A568-L572 PolarHBondContact O-N 3.05Å
569	S	87.9	Confident	85.7	Confident	94 Å²	94	68.2 Å²	68.2	66%	0.657	37%	0.365	S	S	*	.	H	α-helix	trans	-64.7	-35.3	178	-54.9	0	0	0	0	112.9	Y567 L573	Y567-S569 VanDerWaalsContact C-N 3.34Å; Y567-S569 PolarHBondContact O-N 3.41Å; S569-L573 VanDerWaalsContact O-CB 3.3Å; S569-L573 WeakPolarHBondContact O-CB 3.44Å; S569-L573 PolarHBondContact O-N 3.1Å; S569-L573 VanDerWaalsContact O-N 3.12Å
570	A	88.1	Confident	85.5	Confident	30 Å²	30	72.2 Å²	72.2	25%	0.248	38%	0.384	C	S	.	.	H	α-helix	trans	-72.1	-46.1	178.2	0	0	0	0	0	111.4	Y567 A568 L573 N574 L593	Y567-A570 PolarHBondContact O-N 3Å; Y567-A570 VanDerWaalsContact O-N 3.14Å; A568-A570 VanDerWaalsContact C-N 3.33Å; A568-A570 PolarHBondContact O-N 3.46Å; A570-L573 PolarHBondContact O-N 3.18Å; A570-N574 PolarHBondContact O-N 3.37Å; A570-N574 PolarHBondContact O-ND2 3.45Å; A570-L593 HydrophobicContact CB-CD2 4.15Å; A570-L593 VanDerWaalsContact O-CD2 3.26Å; A570-L593 WeakPolarHBondContact O-CD2 3.48Å
571	L	87.6	Confident	85.4	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-59.2	-48.9	175.3	-77.9	161.1	0	0	0	111.1	L555 L559 Y567 A568 L573 N574 G575 Y576 L582 L585 L593	L555-L571 HydrophobicContact CD1-CD1 4.46Å; L555-L571 HydrophobicContact CD2-CB 4.13Å; L559-L571 HydrophobicContact CD1-CD1 3.98Å; L559-L571 HydrophobicContact CD2-CD1 3.95Å; Y567-L571 WeakPolarHBondContact O-CB 3.39Å; Y567-L571 WeakPolarHBondContact O-CG 3.28Å; Y567-L571 PolarHBondContact O-N 3.13Å; A568-L571 PolarHBondContact O-N 3.22Å; L571-L573 PolarHBondContact O-N 3.38Å; L571-N574 CarbonylContact O-C 3.57Å; L571-N574 PolarHBondContact O-N 3.28Å; L571-N574 VanDerWaalsContact O-N 3.08Å; L571-G575 PolarHBondContact O-N 3.49Å; L571-Y576 CarbonylContact C-O 3.48Å; L571-Y576 HydrophobicContact CD2-CD2 3.91Å; L571-Y576 HydrophobicContact CD2-CG 3.95Å; L571-Y576 WeakPolarHBondContact O-CB 3.41Å; L571-Y576 PolarHBondContact O-N 2.82Å; L571-L582 HydrophobicContact CD2-CD2 4.19Å; L571-L585 HydrophobicContact CD2-CD1 4.24Å; L571-L585 HydrophobicContact CD2-CD2 4.33Å; L571-L593 HydrophobicContact CD2-CD1 3.57Å; L571-L593 HydrophobicContact CG-CD1 4.3Å
572	L	87.9	Confident	85.5	Confident	99 Å²	99	66 Å²	66	52%	0.518	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-41.1	179.9	-175.5	63.5	0	0	0	112.9	A568 N574 G575 Y576 Q577	A568-L572 VanDerWaalsContact O-CB 3.24Å; A568-L572 WeakPolarHBondContact O-CB 3.48Å; A568-L572 PolarHBondContact O-N 3.05Å; L572-N574 PolarHBondContact O-N 3.18Å; L572-G575 PolarHBondContact O-N 3.02Å; L572-G575 VanDerWaalsContact O-N 3.12Å; L572-Y576 WeakPolarHBondContact CA-O 3.48Å; L572-Q577 HydrophobicContact CD1-CB 4.13Å; L572-Q577 HydrophobicContact CD1-CG 4.02Å
573	L	87.4	Confident	85.4	Confident	152 Å²	152	68.2 Å²	68.2	80%	0.796	37%	0.371	S	S	*	.	H	α-helix	trans	-64.4	-21.7	176.5	-175.5	60.7	0	0	0	113	S569 A570 L571	S569-L573 VanDerWaalsContact O-CB 3.3Å; S569-L573 WeakPolarHBondContact O-CB 3.44Å; S569-L573 PolarHBondContact O-N 3.1Å; S569-L573 VanDerWaalsContact O-N 3.12Å; A570-L573 PolarHBondContact O-N 3.18Å; L571-L573 PolarHBondContact O-N 3.38Å
574	N	85.9	Confident	85.4	Confident	98 Å²	98	68.6 Å²	68.6	52%	0.524	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	16.6	177.3	-72	-97.2	0	0	0	112.8	A570 L571 L572 Y576 L593	A570-N574 PolarHBondContact O-N 3.37Å; A570-N574 PolarHBondContact O-ND2 3.45Å; L571-N574 CarbonylContact O-C 3.57Å; L571-N574 PolarHBondContact O-N 3.28Å; L571-N574 VanDerWaalsContact O-N 3.08Å; L572-N574 PolarHBondContact O-N 3.18Å; N574-Y576 HydrophobicContact CB-CD2 4.18Å; N574-Y576 HydrophobicContact CB-CE2 4.26Å; N574-L593 HydrophobicContact CB-CD2 3.87Å; N574-L593 WeakPolarHBondContact ND2-CD2 3.37Å
575	G	82.6	Confident	85.4	Confident	53 Å²	53	68.9 Å²	68.9	55%	0.546	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	2.1	172.9	0	0	0	0	0	115.8	L571 L572 Q577	L571-G575 PolarHBondContact O-N 3.49Å; L572-G575 PolarHBondContact O-N 3.02Å; L572-G575 VanDerWaalsContact O-N 3.12Å; G575-Q577 PolarHBondContact O-N 2.91Å
576	Y	85.3	Confident	85.4	Confident	30 Å²	30	68.7 Å²	68.7	12%	0.118	37%	0.37	C	S	.	.			trans	-79.4	102.3	169.3	-58.9	-90.8	0	0	0	108.2	L555 L571 L572 N574 D581 L582 L585 H589 L593	L555-Y576 WeakPolarHBondContact CD2-O 3.42Å; L571-Y576 CarbonylContact C-O 3.48Å; L571-Y576 HydrophobicContact CD2-CD2 3.91Å; L571-Y576 HydrophobicContact CD2-CG 3.95Å; L571-Y576 WeakPolarHBondContact O-CB 3.41Å; L571-Y576 PolarHBondContact O-N 2.82Å; L572-Y576 WeakPolarHBondContact CA-O 3.48Å; N574-Y576 HydrophobicContact CB-CD2 4.18Å; N574-Y576 HydrophobicContact CB-CE2 4.26Å; Y576-D581 HydrophobicContact CD1-CB 3.8Å; Y576-D581 HydrophobicContact CG-CB 4.44Å; Y576-L582 HydrophobicContact CD1-CD2 4.18Å; Y576-L585 HydrophobicContact CD1-CD1 4.33Å; Y576-L585 HydrophobicContact CE1-CB 4.07Å; Y576-L585 HydrophobicContact CE1-CD1 3.64Å; Y576-L585 HydrophobicContact CE1-CG 4.43Å; Y576-L585 HydrophobicContact CE2-CD1 4.06Å; Y576-L585 VanDerWaalsContact CZ-CD1 3.49Å; Y576-H589 PolarHBondContact OH-ND1 2.86Å; Y576-L593 HydrophobicContact CE2-CD1 4.36Å
577	Q	84.6	Confident	85.6	Confident	143 Å²	143	63.9 Å²	63.9	67%	0.668	35%	0.349	S	S	*	.			trans	-111.4	-29	-178.7	-172.7	173.5	13.2	0	0	112.2	L572 G575 D581	L572-Q577 HydrophobicContact CD1-CB 4.13Å; L572-Q577 HydrophobicContact CD1-CG 4.02Å; G575-Q577 PolarHBondContact O-N 2.91Å; Q577-D581 PolarHBondContact N-OD2 3.28Å
578	T	85.4	Confident	85.6	Confident	50 Å²	50	67.5 Å²	67.5	31%	0.307	37%	0.366	S	S	.	.	S	Bend	trans	-113	175.7	-172.6	70.9	0	0	0	0	111.5	E580 D581	T578-E580 VanDerWaalsContact C-N 3.3Å; T578-E580 WeakPolarHBondContact CB-OE2 3.43Å; T578-E580 PolarHBondContact OG1-N 3.05Å; T578-D581 WeakPolarHBondContact CB-OD2 3.21Å; T578-D581 PolarHBondContact N-OD2 2.86Å; T578-D581 PolarHBondContact OG1-N 2.95Å; T578-D581 VanDerWaalsContact OG1-N 3.08Å; T578-D581 PolarHBondContact OG1-OD1 3.46Å; T578-D581 PolarHBondContact OG1-OD2 2.82Å
579	V	81.5	Confident	85.6	Confident	8 Å²	8	68.7 Å²	68.7	5%	0.048	37%	0.368	C	S	.	.	H	α-helix	trans	-79.9	-23.9	172.6	177.1	0	0	0	0	110.2	L558 L582 L583 Y612	L558-V579 HydrophobicContact CD2-CG1 4.05Å; L558-V579 HydrophobicContact CD2-CG2 4.3Å; V579-L582 WeakPolarHBondContact O-CB 3.31Å; V579-L582 PolarHBondContact O-N 2.86Å; V579-L583 VanDerWaalsContact O-CD1 3.31Å; V579-L583 WeakPolarHBondContact O-CD1 3.32Å; V579-Y612 HydrophobicContact CG1-CE2 4.4Å
580	E	82.6	Confident	85.7	Confident	84 Å²	84	64.2 Å²	64.2	39%	0.393	34%	0.337	S	S	.	.	H	α-helix	trans	-70.5	-36.4	179.8	-64.5	58.4	-137.9	0	0	111.4	R551 T578 L582 L583 H584	R551-E580 IonicContact CZ-OE1 2.64Å; R551-E580 IonicContact NE-OE1 3.6Å; R551-E580 IonicContact NH2-OE1 3.6Å; R551-E580 PolarHBondContact NH2-OE1 3.49Å; T578-E580 VanDerWaalsContact C-N 3.3Å; T578-E580 WeakPolarHBondContact CB-OE2 3.43Å; T578-E580 PolarHBondContact OG1-N 3.05Å; E580-L582 VanDerWaalsContact C-N 3.26Å; E580-L582 PolarHBondContact O-N 2.82Å; E580-L583 PolarHBondContact O-N 2.83Å; E580-H584 PolarHBondContact O-ND1 2.68Å
581	D	85.1	Confident	85.6	Confident	52 Å²	52	67.1 Å²	67.1	28%	0.278	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-36.1	173.6	-56.1	-41.7	0	0	0	111.5	Y576 Q577 T578 L583 H584	Y576-D581 HydrophobicContact CD1-CB 3.8Å; Y576-D581 HydrophobicContact CG-CB 4.44Å; Q577-D581 PolarHBondContact N-OD2 3.28Å; T578-D581 WeakPolarHBondContact CB-OD2 3.21Å; T578-D581 PolarHBondContact N-OD2 2.86Å; T578-D581 PolarHBondContact OG1-N 2.95Å; T578-D581 VanDerWaalsContact OG1-N 3.08Å; T578-D581 PolarHBondContact OG1-OD1 3.46Å; T578-D581 PolarHBondContact OG1-OD2 2.82Å; D581-L583 PolarHBondContact O-N 2.79Å; D581-H584 PolarHBondContact O-N 2.85Å; D581-H584 VanDerWaalsContact O-N 3.12Å
582	L	84.4	Confident	85.6	Confident	2 Å²	2	73.7 Å²	73.7	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-24.1	-179.6	-61.1	176.5	0	0	0	113.2	L555 L558 L571 Y576 V579 E580 H584 L585 A608	L555-L582 HydrophobicContact CD1-CD1 3.64Å; L555-L582 HydrophobicContact CD1-CD2 3.87Å; L555-L582 HydrophobicContact CD1-CG 4Å; L558-L582 HydrophobicContact CD2-CD1 3.41Å; L558-L582 VanDerWaalsContact CD2-CD1 3.41Å; L571-L582 HydrophobicContact CD2-CD2 4.19Å; Y576-L582 HydrophobicContact CD1-CD2 4.18Å; V579-L582 WeakPolarHBondContact O-CB 3.31Å; V579-L582 PolarHBondContact O-N 2.86Å; E580-L582 VanDerWaalsContact C-N 3.26Å; E580-L582 PolarHBondContact O-N 2.82Å; L582-H584 PolarHBondContact O-N 3.38Å; L582-H584 VanDerWaalsContact O-N 3.09Å; L582-L585 HydrophobicContact CD2-CD2 3.89Å; L582-L585 WeakPolarHBondContact O-CB 3.24Å; L582-L585 PolarHBondContact O-N 3.38Å; L582-A608 WeakPolarHBondContact O-CB 3.46Å
583	L	83.4	Confident	85.5	Confident	86 Å²	86	69.6 Å²	69.6	45%	0.45	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.4	175.5	-85.5	62.9	0	0	0	112.3	V579 E580 D581	V579-L583 VanDerWaalsContact O-CD1 3.31Å; V579-L583 WeakPolarHBondContact O-CD1 3.32Å; E580-L583 PolarHBondContact O-N 2.83Å; D581-L583 PolarHBondContact O-N 2.79Å
584	H	81.1	Confident	85.3	Confident	136 Å²	136	67.2 Å²	67.2	63%	0.63	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	1	177.4	-54.1	95.8	0	0	0	113.1	E580 D581 L582 Q586 H589	E580-H584 PolarHBondContact O-ND1 2.68Å; D581-H584 PolarHBondContact O-N 2.85Å; D581-H584 VanDerWaalsContact O-N 3.12Å; L582-H584 PolarHBondContact O-N 3.38Å; L582-H584 VanDerWaalsContact O-N 3.09Å; H584-Q586 PolarHBondContact O-N 3.01Å; H584-H589 PolarHBondContact O-CE1 2.7Å; H584-H589 PolarHBondContact O-ND1 2.75Å
585	L	86.4	Confident	85.3	Confident	8 Å²	8	62.7 Å²	62.7	4%	0.042	32%	0.32	C	S	.	.			trans	-73.4	116.9	-178.6	-172.3	68.6	0	0	0	110.9	L571 Y576 L582 H589 L590 L593 L604 L605	L571-L585 HydrophobicContact CD2-CD1 4.24Å; L571-L585 HydrophobicContact CD2-CD2 4.33Å; Y576-L585 HydrophobicContact CD1-CD1 4.33Å; Y576-L585 HydrophobicContact CE1-CB 4.07Å; Y576-L585 HydrophobicContact CE1-CD1 3.64Å; Y576-L585 HydrophobicContact CE1-CG 4.43Å; Y576-L585 HydrophobicContact CE2-CD1 4.06Å; Y576-L585 VanDerWaalsContact CZ-CD1 3.49Å; L582-L585 HydrophobicContact CD2-CD2 3.89Å; L582-L585 WeakPolarHBondContact O-CB 3.24Å; L582-L585 PolarHBondContact O-N 3.38Å; L585-H589 HydrophobicContact CD1-CB 3.85Å; L585-L590 HydrophobicContact CD1-CD2 4.38Å; L585-L590 HydrophobicContact CD1-CG 4.13Å; L585-L590 HydrophobicContact CD2-CD1 4.14Å; L585-L590 HydrophobicContact CD2-CD2 3.89Å; L585-L590 HydrophobicContact CD2-CG 4.05Å; L585-L590 HydrophobicContact CG-CD1 4.14Å; L585-L590 HydrophobicContact CG-CD2 4.32Å; L585-L590 HydrophobicContact CG-CG 3.98Å; L585-L593 HydrophobicContact CD1-CD1 4.02Å; L585-L604 HydrophobicContact CD2-CB 4.17Å; L585-L605 WeakPolarHBondContact O-CD2 3.34Å
586	Q	86.7	Confident	85.1	Confident	100 Å²	100	66.9 Å²	66.9	47%	0.467	32%	0.324	S	S	.	.			trans	-105.4	158.8	177.9	-65	-176.7	-2.5	0	0	110.8	H584 K588 H589 L590	H584-Q586 PolarHBondContact O-N 3.01Å; Q586-K588 HydrophobicContact CB-CD 4.46Å; Q586-K588 HydrophobicContact CB-CG 4.13Å; Q586-K588 PolarHBondContact O-N 3.2Å; Q586-K588 VanDerWaalsContact O-N 3.13Å; Q586-K588 VanDerWaalsContact OE1-CE 3.22Å; Q586-H589 PolarHBondContact N-ND1 3.34Å; Q586-H589 WeakPolarHBondContact O-CB 3.25Å; Q586-H589 PolarHBondContact O-N 2.75Å; Q586-L590 PolarHBondContact O-N 3.43Å; Q586-L590 VanDerWaalsContact O-N 3.15Å
587	D	89.7	Confident	85.3	Confident	69 Å²	69	68.9 Å²	68.9	37%	0.369	34%	0.336	S	S	.	.	H	α-helix	trans	-57.1	-32.2	-179.5	-164.6	52.1	0	0	0	112.4	L590 I591 R601 L605	D587-L590 WeakPolarHBondContact O-CB 3.28Å; D587-L590 PolarHBondContact O-N 2.75Å; D587-I591 WeakPolarHBondContact O-CD1 3.26Å; D587-I591 VanDerWaalsContact O-CG1 3.3Å; D587-I591 WeakPolarHBondContact O-CG1 3.46Å; D587-I591 PolarHBondContact O-N 2.87Å; D587-R601 WeakPolarHBondContact OD1-CB 3.02Å; D587-R601 WeakPolarHBondContact OD1-CD 3.41Å; D587-L605 HydrophobicContact CB-CD1 3.87Å
588	K	86	Confident	85.4	Confident	105 Å²	105	66.7 Å²	66.7	46%	0.457	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-43.8	172.6	78.6	-166.9	-171.1	-160.4	0	112.6	Q586 L590 I591 E592	Q586-K588 HydrophobicContact CB-CD 4.46Å; Q586-K588 HydrophobicContact CB-CG 4.13Å; Q586-K588 PolarHBondContact O-N 3.2Å; Q586-K588 VanDerWaalsContact O-N 3.13Å; Q586-K588 VanDerWaalsContact OE1-CE 3.22Å; K588-L590 VanDerWaalsContact C-N 3.28Å; K588-L590 PolarHBondContact O-N 2.81Å; K588-I591 WeakPolarHBondContact O-CB 3.07Å; K588-I591 PolarHBondContact O-N 2.89Å; K588-I591 VanDerWaalsContact O-N 3.15Å; K588-E592 VanDerWaalsContact O-CG 3.3Å; K588-E592 WeakPolarHBondContact O-CG 3.41Å; K588-E592 PolarHBondContact O-N 2.82Å
589	H	89.2	Confident	85.4	Confident	43 Å²	43	70.7 Å²	70.7	20%	0.199	35%	0.35	C	S	.	.	H	α-helix	trans	-64.7	-37.2	177.1	-54.4	163	0	0	0	110.1	Y576 H584 L585 Q586 I591 E592 L593	Y576-H589 PolarHBondContact OH-ND1 2.86Å; H584-H589 PolarHBondContact O-CE1 2.7Å; H584-H589 PolarHBondContact O-ND1 2.75Å; L585-H589 HydrophobicContact CD1-CB 3.85Å; Q586-H589 PolarHBondContact N-ND1 3.34Å; Q586-H589 WeakPolarHBondContact O-CB 3.25Å; Q586-H589 PolarHBondContact O-N 2.75Å; H589-I591 VanDerWaalsContact C-N 3.34Å; H589-E592 WeakPolarHBondContact CA-OE2 3.49Å; H589-E592 IonicContact CD2-OE2 2.65Å; H589-E592 PolarHBondContact O-N 2.86Å; H589-L593 WeakPolarHBondContact O-CB 3.39Å; H589-L593 WeakPolarHBondContact O-CD1 3.06Å; H589-L593 WeakPolarHBondContact O-CG 3.36Å; H589-L593 PolarHBondContact O-N 2.95Å
590	L	88.9	Confident	85.8	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.3	-33.1	175.7	-74.2	161	0	0	0	113	L585 Q586 D587 K588 L593 V595 R601 L604 L605	L585-L590 HydrophobicContact CD1-CD2 4.38Å; L585-L590 HydrophobicContact CD1-CG 4.13Å; L585-L590 HydrophobicContact CD2-CD1 4.14Å; L585-L590 HydrophobicContact CD2-CD2 3.89Å; L585-L590 HydrophobicContact CD2-CG 4.05Å; L585-L590 HydrophobicContact CG-CD1 4.14Å; L585-L590 HydrophobicContact CG-CD2 4.32Å; L585-L590 HydrophobicContact CG-CG 3.98Å; Q586-L590 PolarHBondContact O-N 3.43Å; Q586-L590 VanDerWaalsContact O-N 3.15Å; D587-L590 WeakPolarHBondContact O-CB 3.28Å; D587-L590 PolarHBondContact O-N 2.75Å; K588-L590 VanDerWaalsContact C-N 3.28Å; K588-L590 PolarHBondContact O-N 2.81Å; L590-L593 HydrophobicContact CD2-CD1 4.48Å; L590-V595 HydrophobicContact CD2-CB 4.41Å; L590-V595 HydrophobicContact CD2-CG2 3.87Å; L590-V595 VanDerWaalsContact O-CB 3.24Å; L590-V595 WeakPolarHBondContact O-CB 3.24Å; L590-V595 WeakPolarHBondContact O-CG2 3.36Å; L590-V595 PolarHBondContact O-N 2.9Å; L590-R601 HydrophobicContact CB-CB 4.4Å; L590-R601 HydrophobicContact CB-CG 3.93Å; L590-R601 HydrophobicContact CD1-CB 4.1Å; L590-L604 HydrophobicContact CD1-CB 4.17Å; L590-L604 HydrophobicContact CD2-CB 4Å; L590-L604 HydrophobicContact CD2-CD1 3.41Å; L590-L604 VanDerWaalsContact CD2-CD1 3.41Å; L590-L604 HydrophobicContact CD2-CG 4.31Å; L590-L605 HydrophobicContact CD1-CD1 4.21Å; L590-L605 HydrophobicContact CD1-CD2 3.76Å; L590-L605 HydrophobicContact CD1-CG 3.62Å
591	I	85.9	Confident	86.2	Confident	90 Å²	90	70.6 Å²	70.6	46%	0.462	35%	0.346	S	S	.	.	H	α-helix	trans	-69.3	-44.4	171.6	-68.4	159.8	0	0	0	110.6	D587 K588 H589 N594 R601	D587-I591 WeakPolarHBondContact O-CD1 3.26Å; D587-I591 VanDerWaalsContact O-CG1 3.3Å; D587-I591 WeakPolarHBondContact O-CG1 3.46Å; D587-I591 PolarHBondContact O-N 2.87Å; K588-I591 WeakPolarHBondContact O-CB 3.07Å; K588-I591 PolarHBondContact O-N 2.89Å; K588-I591 VanDerWaalsContact O-N 3.15Å; H589-I591 VanDerWaalsContact C-N 3.34Å; I591-N594 WeakPolarHBondContact O-CA 3.45Å; I591-N594 PolarHBondContact O-N 2.99Å; I591-R601 VanDerWaalsContact CG1-CZ 3.45Å
592	E	88.2	Confident	86.3	Confident	139 Å²	139	77.6 Å²	77.6	65%	0.65	37%	0.369	S	S	*	.	H	α-helix	trans	-62.6	-39.6	176.1	-70.2	154.2	-170.5	0	0	111.9	K588 H589 N594	K588-E592 VanDerWaalsContact O-CG 3.3Å; K588-E592 WeakPolarHBondContact O-CG 3.41Å; K588-E592 PolarHBondContact O-N 2.82Å; H589-E592 WeakPolarHBondContact CA-OE2 3.49Å; H589-E592 IonicContact CD2-OE2 2.65Å; H589-E592 PolarHBondContact O-N 2.86Å; E592-N594 PolarHBondContact O-N 2.82Å
593	L	85.6	Confident	86.5	Confident	14 Å²	14	80.7 Å²	80.7	7%	0.073	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	1.9	169.9	-75.6	163.8	0	0	0	114	A570 L571 N574 Y576 L585 H589 L590 V595	A570-L593 HydrophobicContact CB-CD2 4.15Å; A570-L593 VanDerWaalsContact O-CD2 3.26Å; A570-L593 WeakPolarHBondContact O-CD2 3.48Å; L571-L593 HydrophobicContact CD2-CD1 3.57Å; L571-L593 HydrophobicContact CG-CD1 4.3Å; N574-L593 HydrophobicContact CB-CD2 3.87Å; N574-L593 WeakPolarHBondContact ND2-CD2 3.37Å; Y576-L593 HydrophobicContact CE2-CD1 4.36Å; L585-L593 HydrophobicContact CD1-CD1 4.02Å; H589-L593 WeakPolarHBondContact O-CB 3.39Å; H589-L593 WeakPolarHBondContact O-CD1 3.06Å; H589-L593 WeakPolarHBondContact O-CG 3.36Å; H589-L593 PolarHBondContact O-N 2.95Å; L590-L593 HydrophobicContact CD2-CD1 4.48Å; L593-V595 HydrophobicContact CB-CG2 4.08Å; L593-V595 PolarHBondContact O-N 2.97Å
594	N	82.1	Confident	86.8	Confident	102 Å²	102	76.7 Å²	76.7	55%	0.545	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	27.4	179.9	-176.6	74.6	0	0	0	113.2	I591 E592 K596	I591-N594 WeakPolarHBondContact O-CA 3.45Å; I591-N594 PolarHBondContact O-N 2.99Å; E592-N594 PolarHBondContact O-N 2.82Å; N594-K596 PolarHBondContact O-N 3Å; N594-K596 WeakPolarHBondContact OD1-CE 3.26Å
595	V	85.9	Confident	87.1	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.012	34%	0.344	C	S	.	.			trans	-71.5	92.3	168.1	-173.7	0	0	0	0	107.5	Y567 L590 L593 H600 R601	Y567-V595 HydrophobicContact CD1-CB 4.47Å; Y567-V595 HydrophobicContact CD1-CG1 4.47Å; Y567-V595 HydrophobicContact CD1-CG2 3.74Å; Y567-V595 HydrophobicContact CE1-CB 4.2Å; Y567-V595 HydrophobicContact CE1-CG1 4.02Å; Y567-V595 HydrophobicContact CE1-CG2 3.97Å; Y567-V595 HydrophobicContact CE2-CG1 4.31Å; Y567-V595 HydrophobicContact CG-CG2 4.23Å; L590-V595 HydrophobicContact CD2-CB 4.41Å; L590-V595 HydrophobicContact CD2-CG2 3.87Å; L590-V595 VanDerWaalsContact O-CB 3.24Å; L590-V595 WeakPolarHBondContact O-CB 3.24Å; L590-V595 WeakPolarHBondContact O-CG2 3.36Å; L590-V595 PolarHBondContact O-N 2.9Å; L593-V595 HydrophobicContact CB-CG2 4.08Å; L593-V595 PolarHBondContact O-N 2.97Å; V595-H600 HydrophobicContact CG1-CB 3.66Å; V595-R601 HydrophobicContact CB-CG 4.21Å; V595-R601 HydrophobicContact CG1-CG 3.89Å; V595-R601 VanDerWaalsContact O-CZ 3.27Å; V595-R601 PolarHBondContact O-NE 2.67Å; V595-R601 PolarHBondContact O-NH2 3.26Å
596	K	80.1	Confident	87.1	Confident	142 Å²	142	74.3 Å²	74.3	62%	0.617	36%	0.359	S	S	*	.			trans	-72.8	-31.8	-172.2	-65.9	-168.7	-177.1	-178.9	0	113	N594 R601	N594-K596 PolarHBondContact O-N 3Å; N594-K596 WeakPolarHBondContact OD1-CE 3.26Å; K596-R601 PolarHBondContact O-NH2 3.17Å; K596-R601 VanDerWaalsContact O-NH2 3.09Å
597	D	87.8	Confident	87	Confident	72 Å²	72	69.8 Å²	69.8	39%	0.385	34%	0.339	S	S	.	.			trans	-81.6	123.7	-171.6	-46.7	-73.4	0	0	0	112	Y567 E599 H600 R601	Y567-D597 PolarHBondContact OH-OD2 3.42Å; D597-E599 PolarHBondContact O-N 2.79Å; D597-H600 HydrophobicContact CB-CB 4.07Å; D597-H600 PolarHBondContact O-N 2.71Å; D597-H600 IonicContact OD2-CE1 3.33Å; D597-H600 IonicContact OD2-ND1 3.01Å; D597-H600 PolarHBondContact OD2-ND1 2.51Å; D597-R601 PolarHBondContact O-N 3.12Å; D597-R601 VanDerWaalsContact O-N 3.12Å
598	P	86.6	Confident	86.7	Confident	96 Å²	96	67.1 Å²	67.1	62%	0.623	33%	0.326	S	S	*	.	H	α-helix	trans	-65	-26.6	-178.7	27.1	-34.8	0	0	0	112.2	R602	P598-R602 WeakPolarHBondContact O-CB 3.39Å; P598-R602 PolarHBondContact O-N 2.81Å
599	E	86.7	Confident	86.5	Confident	135 Å²	135	67.5 Å²	67.5	63%	0.631	33%	0.333	S	S	*	.	H	α-helix	trans	-68.1	-37.8	172.9	-62	-158.8	169.4	0	0	112.3	D597 R602 K603	D597-E599 PolarHBondContact O-N 2.79Å; E599-R602 PolarHBondContact O-N 3.43Å; E599-K603 WeakPolarHBondContact O-CB 3.31Å; E599-K603 VanDerWaalsContact O-CG 3.25Å; E599-K603 WeakPolarHBondContact O-CG 3.34Å; E599-K603 PolarHBondContact O-N 3Å
600	H	89.6	Confident	85.8	Confident	41 Å²	41	68 Å²	68	19%	0.19	34%	0.335	C	S	.	.	H	α-helix	trans	-71	-40.6	179.1	-63.4	168.7	0	0	0	110.9	L564 Y567 V595 D597 K603 L604	L564-H600 HydrophobicContact CD2-CB 3.78Å; L564-H600 VanDerWaalsContact CD2-CD2 3.44Å; L564-H600 WeakPolarHBondContact CD2-CD2 3.44Å; L564-H600 VanDerWaalsContact CD2-CG 3.49Å; Y567-H600 HydrophobicContact CE2-CB 3.94Å; Y567-H600 AromaticContact CE2-CG 3.92Å; Y567-H600 AromaticContact CE2-ND1 3.53Å; Y567-H600 AromaticContact CZ-ND1 3.69Å; Y567-H600 PolarHBondContact OH-ND1 3.33Å; V595-H600 HydrophobicContact CG1-CB 3.66Å; D597-H600 HydrophobicContact CB-CB 4.07Å; D597-H600 PolarHBondContact O-N 2.71Å; D597-H600 IonicContact OD2-CE1 3.33Å; D597-H600 IonicContact OD2-ND1 3.01Å; D597-H600 PolarHBondContact OD2-ND1 2.51Å; H600-K603 PolarHBondContact O-N 3.5Å; H600-L604 WeakPolarHBondContact O-CG 3.3Å; H600-L604 PolarHBondContact O-N 3.18Å
601	R	90.6	Very high	84.4	Confident	49 Å²	49	76.8 Å²	76.8	19%	0.185	37%	0.368	C	S	.	.	H	α-helix	trans	-59.3	-49.2	168.9	-54.6	-165	-160.6	127.7	16.7	111.9	D587 L590 I591 V595 K596 D597 K603 L604 L605	D587-R601 WeakPolarHBondContact OD1-CB 3.02Å; D587-R601 WeakPolarHBondContact OD1-CD 3.41Å; L590-R601 HydrophobicContact CB-CB 4.4Å; L590-R601 HydrophobicContact CB-CG 3.93Å; L590-R601 HydrophobicContact CD1-CB 4.1Å; I591-R601 VanDerWaalsContact CG1-CZ 3.45Å; V595-R601 HydrophobicContact CB-CG 4.21Å; V595-R601 HydrophobicContact CG1-CG 3.89Å; V595-R601 VanDerWaalsContact O-CZ 3.27Å; V595-R601 PolarHBondContact O-NE 2.67Å; V595-R601 PolarHBondContact O-NH2 3.26Å; K596-R601 PolarHBondContact O-NH2 3.17Å; K596-R601 VanDerWaalsContact O-NH2 3.09Å; D597-R601 PolarHBondContact O-N 3.12Å; D597-R601 VanDerWaalsContact O-N 3.12Å; R601-K603 VanDerWaalsContact C-N 3.32Å; R601-K603 PolarHBondContact O-N 2.96Å; R601-L604 PolarHBondContact O-N 2.78Å; R601-L604 VanDerWaalsContact O-N 3.12Å; R601-L605 WeakPolarHBondContact O-CB 3.15Å; R601-L605 WeakPolarHBondContact O-CG 3.02Å; R601-L605 PolarHBondContact O-N 2.86Å
602	R	87.7	Confident	83.1	Confident	198 Å²	198	75.1 Å²	75.1	75%	0.747	36%	0.356	S	S	*	.	H	α-helix	trans	-59.4	-39.3	178.6	176	179	164.5	83.5	-2.4	112.6	P598 E599 A606	P598-R602 WeakPolarHBondContact O-CB 3.39Å; P598-R602 PolarHBondContact O-N 2.81Å; E599-R602 PolarHBondContact O-N 3.43Å; R602-A606 WeakPolarHBondContact O-CB 3.43Å; R602-A606 PolarHBondContact O-N 3.06Å
603	K	89.3	Confident	81	Confident	68 Å²	68	73.8 Å²	73.8	30%	0.296	36%	0.358	S	S	.	.	H	α-helix	trans	-62.8	-44.1	174	-75.9	170.6	-173	178.2	0	111.3	L564 E599 H600 R601 A606 A607	L564-K603 HydrophobicContact CD1-CB 3.79Å; L564-K603 HydrophobicContact CD1-CD 4.08Å; L564-K603 HydrophobicContact CD2-CD 4.13Å; L564-K603 HydrophobicContact CG-CD 4.26Å; E599-K603 WeakPolarHBondContact O-CB 3.31Å; E599-K603 VanDerWaalsContact O-CG 3.25Å; E599-K603 WeakPolarHBondContact O-CG 3.34Å; E599-K603 PolarHBondContact O-N 3Å; H600-K603 PolarHBondContact O-N 3.5Å; R601-K603 VanDerWaalsContact C-N 3.32Å; R601-K603 PolarHBondContact O-N 2.96Å; K603-A606 PolarHBondContact O-N 3.33Å; K603-A607 WeakPolarHBondContact O-CB 3.24Å; K603-A607 PolarHBondContact O-N 2.93Å
604	L	88.2	Confident	79	Confident	2 Å²	2	80.5 Å²	80.5	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-72.6	-39.9	-179	-68.3	166.5	0	0	0	113	L559 L562 L564 L585 L590 H600 R601 A607 A608	L559-L604 HydrophobicContact CD2-CD2 3.54Å; L562-L604 HydrophobicContact CD1-CD2 4.35Å; L564-L604 HydrophobicContact CD1-CD1 4.15Å; L564-L604 HydrophobicContact CD1-CD2 3.67Å; L564-L604 HydrophobicContact CD1-CG 3.6Å; L585-L604 HydrophobicContact CD2-CB 4.17Å; L590-L604 HydrophobicContact CD1-CB 4.17Å; L590-L604 HydrophobicContact CD2-CB 4Å; L590-L604 HydrophobicContact CD2-CD1 3.41Å; L590-L604 VanDerWaalsContact CD2-CD1 3.41Å; L590-L604 HydrophobicContact CD2-CG 4.31Å; H600-L604 WeakPolarHBondContact O-CG 3.3Å; H600-L604 PolarHBondContact O-N 3.18Å; R601-L604 PolarHBondContact O-N 2.78Å; R601-L604 VanDerWaalsContact O-N 3.12Å; L604-A607 WeakPolarHBondContact O-CA 3.41Å; L604-A607 VanDerWaalsContact O-CB 3.28Å; L604-A607 WeakPolarHBondContact O-CB 3.28Å; L604-A607 PolarHBondContact O-N 3.38Å; L604-A607 VanDerWaalsContact O-N 3.15Å; L604-A608 PolarHBondContact O-N 2.98Å
605	L	88.1	Confident	77	Confident	50 Å²	50	78.6 Å²	78.6	26%	0.262	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-38.3	172.7	-66.2	169.6	0	0	0	111.6	L585 D587 L590 R601 A607 A608 D609	L585-L605 WeakPolarHBondContact O-CD2 3.34Å; D587-L605 HydrophobicContact CB-CD1 3.87Å; L590-L605 HydrophobicContact CD1-CD1 4.21Å; L590-L605 HydrophobicContact CD1-CD2 3.76Å; L590-L605 HydrophobicContact CD1-CG 3.62Å; R601-L605 WeakPolarHBondContact O-CB 3.15Å; R601-L605 WeakPolarHBondContact O-CG 3.02Å; R601-L605 PolarHBondContact O-N 2.86Å; L605-A607 VanDerWaalsContact C-N 3.3Å; L605-A607 PolarHBondContact O-N 2.94Å; L605-A608 PolarHBondContact O-N 3.4Å; L605-D609 PolarHBondContact O-N 2.98Å
606	A	87.3	Confident	74.8	Confident	43 Å²	43	85.2 Å²	85.2	36%	0.355	43%	0.429	S	S	.	.	H	α-helix	trans	-63.7	-37	170.6	0	0	0	0	0	111.6	R602 K603 D609 F610	R602-A606 WeakPolarHBondContact O-CB 3.43Å; R602-A606 PolarHBondContact O-N 3.06Å; K603-A606 PolarHBondContact O-N 3.33Å; A606-D609 PolarHBondContact O-N 2.63Å; A606-F610 WeakPolarHBondContact O-CD2 3.48Å; A606-F610 WeakPolarHBondContact O-CE2 3.41Å; A606-F610 PolarHBondContact O-N 2.62Å
607	A	84.2	Confident	72.9	Confident	6 Å²	6	85.8 Å²	85.8	5%	0.05	44%	0.438	C	S	.	.	H	α-helix	trans	-61.2	-45	174.2	0	0	0	0	0	112.2	L558 L562 K603 L604 L605 F610	L558-A607 HydrophobicContact CD1-CB 4.39Å; L558-A607 HydrophobicContact CD2-CB 4.33Å; L562-A607 HydrophobicContact CD1-CB 3.7Å; K603-A607 WeakPolarHBondContact O-CB 3.24Å; K603-A607 PolarHBondContact O-N 2.93Å; L604-A607 WeakPolarHBondContact O-CA 3.41Å; L604-A607 VanDerWaalsContact O-CB 3.28Å; L604-A607 WeakPolarHBondContact O-CB 3.28Å; L604-A607 PolarHBondContact O-N 3.38Å; L604-A607 VanDerWaalsContact O-N 3.15Å; L605-A607 VanDerWaalsContact C-N 3.3Å; L605-A607 PolarHBondContact O-N 2.94Å; A607-F610 PolarHBondContact O-N 2.74Å
608	A	83.8	Confident	70.5	Confident	12 Å²	12	88 Å²	88	10%	0.099	46%	0.455	C	S	.	.	H	α-helix	trans	-63.1	-38.6	174.9	0	0	0	0	0	113.3	L582 L604 L605 F610	L582-A608 WeakPolarHBondContact O-CB 3.46Å; L604-A608 PolarHBondContact O-N 2.98Å; L605-A608 PolarHBondContact O-N 3.4Å; A608-F610 PolarHBondContact O-N 2.94Å
609	D	80	Confident	67.9	Low	113 Å²	113	89.1 Å²	89.1	60%	0.604	46%	0.464	S	S	*	.	H	α-helix	trans	-65.4	-15.8	175.7	-94.3	8.1	0	0	0	112.9	R542 L605 A606 R611	R542-D609 IonicContact NH2-OD2 2.75Å; R542-D609 PolarHBondContact NH2-OD2 2.69Å; R542-D609 VanDerWaalsContact NH2-OD2 3.15Å; L605-D609 PolarHBondContact O-N 2.98Å; A606-D609 PolarHBondContact O-N 2.63Å; D609-R611 PolarHBondContact O-N 2.88Å
610	F	75.2	Confident	65.3	Low	54 Å²	54	90.6 Å²	90.6	24%	0.237	48%	0.477	C	S	.	.			trans	-81.1	95.3	179.5	-77.1	-73.1	0	0	0	113	K545 C547 A606 A607 A608 Y612	K545-F610 HydrophobicContact CB-CD1 4.36Å; K545-F610 HydrophobicContact CB-CE1 3.57Å; K545-F610 HydrophobicContact CB-CZ 4.33Å; K545-F610 HydrophobicContact CD-CE1 4.46Å; K545-F610 HydrophobicContact CD-CZ 4.43Å; K545-F610 WeakPolarHBondContact O-CD1 3.31Å; K545-F610 VanDerWaalsContact O-CE1 3.22Å; K545-F610 WeakPolarHBondContact O-CE1 3.17Å; C547-F610 HydrophobicContact CB-CD1 4.28Å; C547-F610 HydrophobicContact CB-CE1 4.3Å; C547-F610 WeakPolarHBondContact SG-CE1 3.46Å; A606-F610 WeakPolarHBondContact O-CD2 3.48Å; A606-F610 WeakPolarHBondContact O-CE2 3.41Å; A606-F610 PolarHBondContact O-N 2.62Å; A607-F610 PolarHBondContact O-N 2.74Å; A608-F610 PolarHBondContact O-N 2.94Å; F610-Y612 PolarHBondContact O-N 2.89Å
611	R	60.2	Low	62.8	Low	185 Å²	185	92.7 Å²	92.7	70%	0.698	50%	0.501	S	S	*	.			trans	-68.5	110.9	159.6	-75.3	-176.3	168.5	-112.7	-5.9	110.6	D609 V613	D609-R611 PolarHBondContact O-N 2.88Å; R611-V613 PolarHBondContact O-N 3.09Å
612	Y	57.4	Low	60	Low	54 Å²	54	99.9 Å²	99.9	21%	0.212	54%	0.537	C	S	.	.	P	Polyproline II helix	trans	-69.7	119.9	164	-65.7	-81.5	0	0	0	109.3	R551 P552 V579 F610	R551-Y612 HydrophobicContact CB-CD1 3.88Å; R551-Y612 HydrophobicContact CB-CD2 4.41Å; R551-Y612 HydrophobicContact CB-CE1 4.35Å; R551-Y612 HydrophobicContact CB-CG 3.92Å; R551-Y612 HydrophobicContact CG-CD1 4.22Å; R551-Y612 HydrophobicContact CG-CD2 3.84Å; R551-Y612 HydrophobicContact CG-CE2 4.31Å; R551-Y612 HydrophobicContact CG-CG 3.8Å; P552-Y612 VanDerWaalsContact CD-CZ 3.44Å; P552-Y612 VanDerWaalsContact CD-OH 3.27Å; P552-Y612 WeakPolarHBondContact CD-OH 3.04Å; V579-Y612 HydrophobicContact CG1-CE2 4.4Å; F610-Y612 PolarHBondContact O-N 2.89Å
613	V	44.1	Very low	57.6	Low	112 Å²	112	98.7 Å²	98.7	68%	0.679	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-77.5	122.1	161.8	174	0	0	0	0	106.8	L546 R611 G615	L546-V613 HydrophobicContact CD2-CG2 3.6Å; R611-V613 PolarHBondContact O-N 3.09Å; V613-G615 PolarHBondContact O-N 3.05Å
614	E	44.3	Very low	54.8	Low	154 Å²	154	104.6 Å²	104.6	72%	0.72	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-64.3	117.9	170.4	-155.2	111.1	-115.9	0	0	107.7	R551	R551-E614 IonicContact NH1-OE1 2.66Å; R551-E614 IonicContact NH1-OE2 3.5Å
615	G	40.8	Very low	51.8	Low	62 Å²	62	108.2 Å²	108.2	64%	0.639	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-75.4	125.4	-179.8	0	0	0	0	0	110.3	V613 D617	V613-G615 PolarHBondContact O-N 3.05Å; G615-D617 PolarHBondContact O-N 3.45Å; G615-D617 VanDerWaalsContact O-N 3.15Å
616	D	38.3	Very low	48.9	Very low	142 Å²	142	111.4 Å²	111.4	76%	0.759	63%	0.633	S	S	*	*			trans	-63.2	110.9	164	172.1	17.4	0	0	0	109.1	T618	D616-T618 PolarHBondContact OD1-N 3.31Å; D616-T618 VanDerWaalsContact OD1-N 3.1Å
617	D	41.4	Very low	46	Very low	153 Å²	153	114.1 Å²	114.1	82%	0.818	65%	0.649	S	S	*	*			trans	-133.8	48.4	168.7	-102.3	-47.5	0	0	0	108.9	G615	G615-D617 PolarHBondContact O-N 3.45Å; G615-D617 VanDerWaalsContact O-N 3.15Å
618	T	35.7	Very low	43.2	Very low	120 Å²	120	123.2 Å²	123.2	74%	0.736	69%	0.69	S	S	*	*			trans	-161.9	135.8	151.1	0.2	0	0	0	0	117.8	D616	D616-T618 PolarHBondContact OD1-N 3.31Å; D616-T618 VanDerWaalsContact OD1-N 3.1Å
619	S	34	Very low	40.5	Very low	118 Å²	118	125 Å²	125	83%	0.825	71%	0.71	S	S	*	*			trans	90.1	134.4	155.2	80.7	0	0	0	0	118.8
620	N	30.8	Very low	38	Very low	166 Å²	166	128.7 Å²	128.7	89%	0.888	72%	0.724	S	S	*	*			trans	-148.1	92.2	175.2	173.6	0.2	0	0	0	106.5
621	A	38.1	Very low	35.9	Very low	86 Å²	86	133 Å²	133	71%	0.711	75%	0.745	S	S	*	*			trans	-162.7	113.3	175.7	0	0	0	0	0	112.6
622	E	32.1	Very low	34.5	Very low	199 Å²	199	132.9 Å²	132.9	93%	0.93	75%	0.752	S	S	*	*			trans	66.7	168.1	149.9	-52.5	-166.7	144.1	0	0	119.7
623	E	35.8	Very low	33.7	Very low	174 Å²	174	138.3 Å²	138.3	81%	0.813	78%	0.779	S	S	*	*			trans	-108.7	174.4	-160.1	-58.7	179.4	118.1	0	0	113.7
624	H	30.2	Very low	33.1	Very low	191 Å²	191	139 Å²	139	88%	0.884	78%	0.779	S	S	*	*			trans	63.3	94.6	162.3	-78.9	-80.5	0	0	0	118.1
625	G	26.4	Very low	32.6	Very low	79 Å²	79	136 Å²	136	81%	0.814	78%	0.775	S	S	*	*			trans	-150.2	135.2	166.4	0	0	0	0	0	112.6
626	S	26.4	Very low	32.3	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	78%	0.783	S	S	*	*			trans	-63.5	152.6	-175.7	-175.2	0	0	0	0	114
627	S	25.8	Very low	32.2	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	78%	0.779	S	S	*	*			trans	-61.6	157.9	159.2	54.5	0	0	0	0	113.1
628	H	25.8	Very low	32.8	Very low	197 Å²	197	137 Å²	137	91%	0.912	78%	0.78	S	S	*	*			trans	73.6	138	165.1	-136.5	74.9	0	0	0	115.2
629	G	28.1	Very low	33.2	Very low	50 Å²	50	142.9 Å²	142.9	52%	0.515	79%	0.788	S	S	.	*			cis	145.6	133.2	-4.3	0	0	0	0	0	111.5
630	Q	27.8	Very low	33	Very low	191 Å²	191	144 Å²	144	89%	0.893	79%	0.785	S	S	*	*			trans	-150.2	154.5	169.8	-66.8	-168.1	-88.3	0	0	110.4
631	Q	30.3	Very low	33.6	Very low	145 Å²	145	141.6 Å²	141.6	68%	0.678	78%	0.781	S	S	*	*			cis	176	139	-42.1	163.1	173.3	4.6	0	0	106.4
632	E	31.9	Very low	33.7	Very low	181 Å²	181	140.5 Å²	140.5	85%	0.846	78%	0.778	S	S	*	*			trans	177.4	123.5	153.8	-102.3	160.3	-140.5	0	0	107.4
633	E	38.8	Very low	33.9	Very low	168 Å²	168	136.6 Å²	136.6	79%	0.785	77%	0.772	S	S	*	*			cis	-141.3	173.5	-22	-58.1	-174.4	118.5	0	0	105.7
634	D	32	Very low	33.8	Very low	127 Å²	127	137.4 Å²	137.4	68%	0.679	77%	0.773	S	S	*	*			cis	-159.3	170.9	16.7	-174.1	31.3	0	0	0	111.8
635	S	34.7	Very low	34.1	Very low	92 Å²	92	135.8 Å²	135.8	64%	0.643	77%	0.769	S	S	*	*			trans	62.2	80.1	152.7	-76.5	0	0	0	0	121.1
636	D	34.8	Very low	34.7	Very low	151 Å²	151	137 Å²	137	81%	0.807	76%	0.762	S	S	*	*				60	159.6	116.2	-153	18.3	0	0	0	123.9
637	C	35.4	Very low	35.5	Very low	98 Å²	98	136 Å²	136	66%	0.662	76%	0.755	S	S	*	*			trans	69.7	85.5	163	-79.4	0	0	0	0	120.2	R639	C637-R639 PolarHBondContact O-N 3.18Å
638	P	54	Low	35.9	Very low	129 Å²	129	139.5 Å²	139.5	84%	0.838	76%	0.761	S	S	*	*			trans	-86.4	78.7	166.2	35.4	-33.7	0	0	0	112.4
639	R	43.2	Very low	36.2	Very low	242 Å²	242	136.2 Å²	136.2	91%	0.913	76%	0.759	S	S	*	*			trans	-167.1	105.4	169.8	-107.7	163.1	-174	156.7	0.7	112.9	C637	C637-R639 PolarHBondContact O-N 3.18Å
640	D	30.1	Very low	36.5	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	77%	0.772	S	S	*	*				-160.2	132.8	113.5	-170.4	20.5	0	0	0	110.6	G642	D640-G642 PolarHBondContact OD1-N 3.47Å
641	S	44.4	Very low	36.9	Very low	116 Å²	116	136.6 Å²	136.6	81%	0.811	76%	0.764	S	S	*	*			trans	-116.7	83.6	163.9	-74.6	0	0	0	0	106	C643	S641-C643 PolarHBondContact O-N 3.07Å
642	G	38.8	Very low	37.1	Very low	63 Å²	63	135.4 Å²	135.4	65%	0.649	77%	0.767	S	S	*	*			trans	-55.9	92.1	-165.6	0	0	0	0	0	114.6	D640	D640-G642 PolarHBondContact OD1-N 3.47Å
643	C	37	Very low	37.4	Very low	117 Å²	117	133.4 Å²	133.4	79%	0.791	76%	0.755	S	S	*	*			trans	-140.2	71	175.8	-96.6	0	0	0	0	110.5	S641	S641-C643 PolarHBondContact O-N 3.07Å
644	F	34.7	Very low	37.5	Very low	191 Å²	191	132.1 Å²	132.1	84%	0.838	75%	0.749	S	S	*	*			trans	33.3	101.2	145.6	-127.3	-86.8	0	0	0	118.7	P646	F644-P646 HydrophobicContact CE1-CB 4.39Å; F644-P646 HydrophobicContact CE1-CG 4.34Å
645	I	35.2	Very low	37.8	Very low	157 Å²	157	132.5 Å²	132.5	81%	0.805	75%	0.751	S	S	*	*			trans	-130.5	121.5	144.9	-59	-178.4	0	0	0	107.2
646	P	40.2	Very low	37.9	Very low	104 Å²	104	133.8 Å²	133.8	68%	0.675	76%	0.755	S	S	*	*			trans	-87.3	125.1	177.8	33	-30.2	0	0	0	110.9	F644	F644-P646 HydrophobicContact CE1-CB 4.39Å; F644-P646 HydrophobicContact CE1-CG 4.34Å
647	S	42.2	Very low	38.1	Very low	95 Å²	95	134.4 Å²	134.4	66%	0.664	75%	0.753	S	S	*	*			trans	-139.1	144.8	174.6	-109.4	0	0	0	0	111.4
648	E	34.8	Very low	38	Very low	173 Å²	173	136.8 Å²	136.8	81%	0.808	75%	0.754	S	S	*	*			trans	-17.5	156	-176.4	44	-101.2	97	0	0	124
649	C	31.5	Very low	37.3	Very low	129 Å²	129	135.8 Å²	135.8	87%	0.872	75%	0.746	S	S	*	*			trans	-85.9	146.8	-169.2	-39.4	0	0	0	0	116.6
650	S	35.5	Very low	37	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	74%	0.743	S	S	*	*			trans	177.6	123	136.6	49.5	0	0	0	0	108.4
651	D	36.3	Very low	37.4	Very low	135 Å²	135	130.2 Å²	130.2	72%	0.722	74%	0.739	S	S	*	*				90.1	147.9	50.7	-160.1	11	0	0	0	113.2
652	T	33.9	Very low	37.1	Very low	121 Å²	121	130.6 Å²	130.6	74%	0.742	74%	0.737	S	S	*	*			trans	74.3	124.7	-161.8	66.6	0	0	0	0	115.6
653	K	38.4	Very low	37.2	Very low	139 Å²	139	131.4 Å²	131.4	60%	0.604	74%	0.738	S	S	*	*			cis	79.3	152.2	28.5	-59.4	167	150.4	-77	0	114
654	E	39.8	Very low	37.4	Very low	141 Å²	141	135.3 Å²	135.3	66%	0.659	74%	0.744	S	S	*	*			cis	-165.6	147.1	-16.4	-105.4	156.6	-20.5	0	0	106.3
655	D	38.1	Very low	37.8	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	77%	0.771	S	S	*	*			cis	-164.4	-177.2	-19.3	-127.9	42.1	0	0	0	110.5
656	T	37.6	Very low	38	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	77%	0.769	S	S	*	*			trans	9.2	122.2	156.2	-55	0	0	0	0	121.1
657	E	38.6	Very low	37.8	Very low	165 Å²	165	134.6 Å²	134.6	77%	0.771	77%	0.774	S	S	*	*			trans	-138.2	163.3	157.4	-108.5	-65.6	17.7	0	0	110.7
658	H	34.6	Very low	37.6	Very low	147 Å²	147	136.8 Å²	136.8	68%	0.681	78%	0.78	S	S	*	*			trans	-152.5	158.9	-147	75.9	-45.9	0	0	0	119.3
659	V	38	Very low	37.8	Very low	108 Å²	108	134.7 Å²	134.7	66%	0.655	78%	0.778	S	S	*	*			trans	63.6	122.7	152.5	174.7	0	0	0	0	121	D661	V659-D661 HydrophobicContact CG1-CB 3.9Å
660	T	38.1	Very low	38.2	Very low	140 Å²	140	135.1 Å²	135.1	86%	0.859	77%	0.772	S	S	*	*				-156.9	117.4	127.6	51.8	0	0	0	0	106.7
661	D	37.9	Very low	38.3	Very low	128 Å²	128	136.5 Å²	136.5	68%	0.684	77%	0.771	S	S	*	*			cis	93.3	142.3	31.1	-161.6	28.1	0	0	0	115.1	V659	V659-D661 HydrophobicContact CG1-CB 3.9Å
662	T	38.3	Very low	38.5	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	78%	0.775	S	S	*	*			trans	65.6	150.1	178.8	65.5	0	0	0	0	118.7
663	A	41.5	Very low	38.8	Very low	80 Å²	80	137.8 Å²	137.8	66%	0.661	78%	0.777	S	S	*	*			cis	-169.7	153.2	-25.4	0	0	0	0	0	110.4
664	E	39.4	Very low	38.9	Very low	198 Å²	198	137.8 Å²	137.8	93%	0.925	79%	0.792	S	S	*	*			trans	59.6	151	162.8	-65.5	-177.7	121.5	0	0	118.3
665	A	44.7	Very low	38.8	Very low	169 Å²	169	137.5 Å²	137.5	100%	1.397	80%	0.804	S	S	*	*			cis	-135.1	0	6.4	0	0	0	0	0	112.1

Retrieved 665 of 665 residues in 215.5 ms (Link to these results)

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