A0A5K4FAK6_SCHMA Loading...

PKD_channel domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FAK6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 796 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	33.2	Very low	29.6	Very low	249 Å²	249	177.4 Å²	177.4	100%	1.227	88%	0.883	S	S	*	*				0	125.1	0	-83.3	176.7	175.4	0	0	108.8
2	T	27.8	Very low	30	Very low	145 Å²	145	172.1 Å²	172.1	89%	0.89	86%	0.859	S	S	*	*			trans	-66.4	134.8	170.9	43.1	0	0	0	0	112.3
3	S	34.8	Very low	30.8	Very low	113 Å²	113	163.8 Å²	163.8	79%	0.79	83%	0.828	S	S	*	*			trans	-161.7	98.6	146.9	-168.4	0	0	0	0	107.1
4	K	24.6	Very low	31.5	Very low	187 Å²	187	163.1 Å²	163.1	81%	0.813	82%	0.82	S	S	*	*				39.4	115.7	87.7	-87.6	-172	178.8	177.4	0	114.8
5	K	26.3	Very low	32.5	Very low	199 Å²	199	160.2 Å²	160.2	87%	0.865	81%	0.808	S	S	*	*			trans	104.1	136.2	144.5	-76.6	-177.5	170.5	-178	0	119.4
6	S	28.7	Very low	33.6	Very low	111 Å²	111	156.5 Å²	156.5	78%	0.776	79%	0.787	S	S	*	*			trans	67.6	129	175.8	76.7	0	0	0	0	115.4
7	E	31.4	Very low	34.6	Very low	186 Å²	186	156.1 Å²	156.1	87%	0.869	78%	0.779	S	S	*	*			cis	-143.2	137.9	33.7	-72.4	165.7	148.7	0	0	111.8
8	K	27.5	Very low	35.3	Very low	194 Å²	194	151.9 Å²	151.9	84%	0.843	76%	0.76	S	S	*	*			trans	-75.2	144.3	162	-74.5	175.9	170.5	-177.7	0	108.4
9	Q	26.4	Very low	35.7	Very low	185 Å²	185	150.7 Å²	150.7	86%	0.864	75%	0.752	S	S	*	*			trans	135.5	97.7	142.4	-82.5	169	-64.5	0	0	111.7
10	F	33.3	Very low	36.2	Very low	198 Å²	198	149.2 Å²	149.2	87%	0.868	74%	0.744	S	S	*	*				-176.8	60.5	129.5	-111.3	-78.6	0	0	0	108.7
11	M	32.1	Very low	36.8	Very low	184 Å²	184	144.1 Å²	144.1	91%	0.906	73%	0.725	S	S	*	*			trans	-126.6	97.3	163.3	-72.9	-79.4	-91.2	0	0	104.4	S13	M11-S13 PolarHBondContact O-N 3.05Å
12	L	34.4	Very low	37.3	Very low	114 Å²	114	140.7 Å²	140.7	60%	0.597	70%	0.7	S	S	*	*			trans	-52	124.8	174.3	-75.2	158.9	0	0	0	107.4	E16	L12-E16 HydrophobicContact CD2-CB 4.15Å; L12-E16 VanDerWaalsContact CD2-OE2 3.32Å; L12-E16 WeakPolarHBondContact CD2-OE2 3.4Å
13	S	40.4	Very low	37.9	Very low	65 Å²	65	138.7 Å²	138.7	46%	0.455	68%	0.684	S	S	.	*			trans	-68.3	148.4	178.4	68.2	0	0	0	0	109.1	M11 N15 E16 F17	M11-S13 PolarHBondContact O-N 3.05Å; S13-N15 PolarHBondContact O-N 3.49Å; S13-E16 PolarHBondContact N-OE2 2.91Å; S13-E16 WeakPolarHBondContact O-CB 3.42Å; S13-E16 PolarHBondContact O-N 3.2Å; S13-F17 PolarHBondContact O-N 3.07Å
14	E	40.5	Very low	38.2	Very low	154 Å²	154	138.4 Å²	138.4	72%	0.72	67%	0.673	S	S	*	*	H	α-helix	trans	-51.6	-27.9	-177.8	-162	170.2	-171.8	0	0	112.9	F17 N18	E14-F17 PolarHBondContact O-N 3.34Å; E14-N18 WeakPolarHBondContact O-CB 3.32Å; E14-N18 PolarHBondContact O-N 3.36Å; E14-N18 PolarHBondContact O-ND2 3.43Å
15	N	45.7	Very low	38.9	Very low	119 Å²	119	133.2 Å²	133.2	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-66.4	-37.3	173.5	-70.7	-10.7	0	0	0	113.4	S13 N18 Q19	S13-N15 PolarHBondContact O-N 3.49Å; N15-N18 PolarHBondContact O-N 3.4Å; N15-Q19 WeakPolarHBondContact O-CB 3.5Å; N15-Q19 PolarHBondContact O-N 3.45Å
16	E	49.8	Very low	39.4	Very low	101 Å²	101	126.9 Å²	126.9	47%	0.472	64%	0.642	S	S	.	*	H	α-helix	trans	-72.3	-34.6	176.8	-68.9	171.8	140.9	0	0	111.4	L12 S13 Q19 M20	L12-E16 HydrophobicContact CD2-CB 4.15Å; L12-E16 VanDerWaalsContact CD2-OE2 3.32Å; L12-E16 WeakPolarHBondContact CD2-OE2 3.4Å; S13-E16 PolarHBondContact N-OE2 2.91Å; S13-E16 WeakPolarHBondContact O-CB 3.42Å; S13-E16 PolarHBondContact O-N 3.2Å; E16-Q19 PolarHBondContact O-N 3.09Å; E16-M20 WeakPolarHBondContact O-CB 3.47Å; E16-M20 PolarHBondContact O-N 3.43Å
17	F	51	Low	39.6	Very low	149 Å²	149	128.9 Å²	128.9	65%	0.654	64%	0.644	S	S	*	*	H	α-helix	trans	-66.4	-41.9	172.1	-167.1	-94.5	0	0	0	111.3	S13 E14 M20 A21	S13-F17 PolarHBondContact O-N 3.07Å; E14-F17 PolarHBondContact O-N 3.34Å; F17-M20 PolarHBondContact O-N 3.14Å; F17-A21 WeakPolarHBondContact O-CB 3.39Å; F17-A21 PolarHBondContact O-N 3.03Å
18	N	47.2	Very low	39.8	Very low	82 Å²	82	127.7 Å²	127.7	44%	0.439	64%	0.64	S	S	.	*	H	α-helix	trans	-68.3	-35.6	176.4	-71.7	-24.2	0	0	0	112.4	E14 N15 A21 Y22	E14-N18 WeakPolarHBondContact O-CB 3.32Å; E14-N18 PolarHBondContact O-N 3.36Å; E14-N18 PolarHBondContact O-ND2 3.43Å; N15-N18 PolarHBondContact O-N 3.4Å; N18-A21 PolarHBondContact O-N 3.42Å; N18-Y22 WeakPolarHBondContact O-CB 3.48Å; N18-Y22 PolarHBondContact O-N 2.9Å
19	Q	43.9	Very low	39.9	Very low	129 Å²	129	123.8 Å²	123.8	60%	0.603	63%	0.628	S	S	*	*	H	α-helix	trans	-65.1	-42.2	173.9	-151.2	101.1	22.8	0	0	110.9	N15 E16 A21 Y22 D23	N15-Q19 WeakPolarHBondContact O-CB 3.5Å; N15-Q19 PolarHBondContact O-N 3.45Å; E16-Q19 PolarHBondContact O-N 3.09Å; Q19-A21 VanDerWaalsContact C-N 3.34Å; Q19-A21 PolarHBondContact O-N 2.83Å; Q19-Y22 WeakPolarHBondContact O-CB 3.45Å; Q19-Y22 PolarHBondContact O-N 3.02Å; Q19-Y22 VanDerWaalsContact O-N 3.14Å; Q19-D23 PolarHBondContact O-N 3.49Å
20	M	45.6	Very low	40.5	Very low	119 Å²	119	120 Å²	120	59%	0.586	62%	0.618	S	S	*	*	H	α-helix	trans	-70.2	-30.7	177.9	-151.2	179.7	-77.3	0	0	112.2	E16 F17 N24	E16-M20 WeakPolarHBondContact O-CB 3.47Å; E16-M20 PolarHBondContact O-N 3.43Å; F17-M20 PolarHBondContact O-N 3.14Å; M20-N24 WeakPolarHBondContact O-CB 3.42Å; M20-N24 PolarHBondContact O-N 3.18Å; M20-N24 PolarHBondContact O-ND2 3.27Å; M20-N24 VanDerWaalsContact O-ND2 3.14Å
21	A	47.7	Very low	40.5	Very low	43 Å²	43	118.4 Å²	118.4	36%	0.355	61%	0.613	S	S	.	*	H	α-helix	trans	-71	-34.7	169	0	0	0	0	0	112.1	F17 N18 Q19 T25	F17-A21 WeakPolarHBondContact O-CB 3.39Å; F17-A21 PolarHBondContact O-N 3.03Å; N18-A21 PolarHBondContact O-N 3.42Å; Q19-A21 VanDerWaalsContact C-N 3.34Å; Q19-A21 PolarHBondContact O-N 2.83Å; A21-T25 WeakPolarHBondContact O-CB 3.39Å; A21-T25 WeakPolarHBondContact O-CG2 3.38Å; A21-T25 PolarHBondContact O-N 3.4Å; A21-T25 PolarHBondContact O-OG1 3.13Å
22	Y	43.4	Very low	40.5	Very low	178 Å²	178	118.1 Å²	118.1	70%	0.698	60%	0.603	S	S	*	*	H	α-helix	trans	-69.2	-42.2	174.6	-126.9	-88.3	0	0	0	111.9	N18 Q19 N24 T25 A26	N18-Y22 WeakPolarHBondContact O-CB 3.48Å; N18-Y22 PolarHBondContact O-N 2.9Å; Q19-Y22 WeakPolarHBondContact O-CB 3.45Å; Q19-Y22 PolarHBondContact O-N 3.02Å; Q19-Y22 VanDerWaalsContact O-N 3.14Å; Y22-N24 VanDerWaalsContact C-N 3.31Å; Y22-N24 PolarHBondContact O-N 2.91Å; Y22-T25 WeakPolarHBondContact CA-OG1 3.46Å; Y22-T25 PolarHBondContact O-N 3.36Å; Y22-T25 PolarHBondContact O-OG1 3.33Å; Y22-T25 VanDerWaalsContact O-OG1 3.13Å; Y22-A26 WeakPolarHBondContact O-CB 3.35Å; Y22-A26 PolarHBondContact O-N 3.39Å
23	D	41.2	Very low	40.5	Very low	103 Å²	103	118 Å²	118	55%	0.551	60%	0.602	S	S	*	*	H	α-helix	trans	-66.1	-34.6	177.4	-73.5	-17	0	0	0	111.6	Q19	Q19-D23 PolarHBondContact O-N 3.49Å
24	N	41.5	Very low	40.1	Very low	106 Å²	106	120.7 Å²	120.7	57%	0.567	61%	0.611	S	S	*	*	H	α-helix	trans	-77.3	-25.8	175.7	-78.3	-34.2	0	0	0	113.9	M20 Y22	M20-N24 WeakPolarHBondContact O-CB 3.42Å; M20-N24 PolarHBondContact O-N 3.18Å; M20-N24 PolarHBondContact O-ND2 3.27Å; M20-N24 VanDerWaalsContact O-ND2 3.14Å; Y22-N24 VanDerWaalsContact C-N 3.31Å; Y22-N24 PolarHBondContact O-N 2.91Å
25	T	39.2	Very low	39.6	Very low	79 Å²	79	120.4 Å²	120.4	49%	0.485	61%	0.61	S	S	.	*	H	α-helix	trans	-84.9	-29.3	175.4	43.3	0	0	0	0	112.4	A21 Y22 L27 M28 N29	A21-T25 WeakPolarHBondContact O-CB 3.39Å; A21-T25 WeakPolarHBondContact O-CG2 3.38Å; A21-T25 PolarHBondContact O-N 3.4Å; A21-T25 PolarHBondContact O-OG1 3.13Å; Y22-T25 WeakPolarHBondContact CA-OG1 3.46Å; Y22-T25 PolarHBondContact O-N 3.36Å; Y22-T25 PolarHBondContact O-OG1 3.33Å; Y22-T25 VanDerWaalsContact O-OG1 3.13Å; T25-L27 PolarHBondContact O-N 3.14Å; T25-M28 PolarHBondContact O-N 3.48Å; T25-M28 VanDerWaalsContact O-N 3.09Å; T25-N29 PolarHBondContact O-N 3.04Å
26	A	36.7	Very low	38.9	Very low	66 Å²	66	120.7 Å²	120.7	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-61.7	-30.6	171	0	0	0	0	0	112.5	Y22 M28	Y22-A26 WeakPolarHBondContact O-CB 3.35Å; Y22-A26 PolarHBondContact O-N 3.39Å; A26-M28 VanDerWaalsContact C-N 3.29Å; A26-M28 PolarHBondContact O-N 2.85Å
27	L	33.5	Very low	38	Very low	153 Å²	153	122.3 Å²	122.3	80%	0.801	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-11.9	176	-115.5	141.2	0	0	0	114.2	T25	T25-L27 PolarHBondContact O-N 3.14Å
28	M	34.5	Very low	36.9	Very low	160 Å²	160	122.2 Å²	122.2	79%	0.788	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-2.4	-176.5	-79.1	-88	-165.3	0	0	113.7	T25 A26 T30	T25-M28 PolarHBondContact O-N 3.48Å; T25-M28 VanDerWaalsContact O-N 3.09Å; A26-M28 VanDerWaalsContact C-N 3.29Å; A26-M28 PolarHBondContact O-N 2.85Å; M28-T30 PolarHBondContact O-N 2.84Å
29	N	29.3	Very low	36	Very low	112 Å²	112	127.1 Å²	127.1	60%	0.599	65%	0.646	S	S	*	*			trans	-87.8	108.7	177.1	-97.3	-13.1	0	0	0	111.6	T25 Q31 Y32	T25-N29 PolarHBondContact O-N 3.04Å; N29-Q31 PolarHBondContact O-N 2.73Å; N29-Y32 PolarHBondContact O-N 3.24Å
30	T	39.7	Very low	35.2	Very low	106 Å²	106	127.5 Å²	127.5	65%	0.65	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-61.1	-5.8	179.6	36.2	0	0	0	0	115.3	M28	M28-T30 PolarHBondContact O-N 2.84Å
31	Q	34.1	Very low	34.2	Very low	165 Å²	165	130.3 Å²	130.3	77%	0.771	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-81.1	-9.1	177.1	-75.8	-175.8	-29.6	0	0	114.9	N29	N29-Q31 PolarHBondContact O-N 2.73Å
32	Y	31.6	Very low	33.3	Very low	177 Å²	177	135.1 Å²	135.1	69%	0.694	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-91.5	-6	172.1	-103.6	-84.8	0	0	0	114.2	N29	N29-Y32 PolarHBondContact O-N 3.24Å
33	I	35	Very low	32.3	Very low	113 Å²	113	134.4 Å²	134.4	58%	0.579	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-29.7	177.3	-62.5	177.6	0	0	0	110.8	E35	I33-E35 VanDerWaalsContact C-N 3.33Å; I33-E35 PolarHBondContact O-N 3.25Å
34	D	30.7	Very low	31.4	Very low	121 Å²	121	139 Å²	139	65%	0.647	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-15	-178.3	-72	-18.1	0	0	0	114.4
35	E	30	Very low	30.6	Very low	147 Å²	147	140 Å²	140	69%	0.687	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-12.6	178.3	-86.8	-167.1	159.3	0	0	114.7	I33	I33-E35 VanDerWaalsContact C-N 3.33Å; I33-E35 PolarHBondContact O-N 3.25Å
36	I	31.7	Very low	29.8	Very low	126 Å²	126	145.9 Å²	145.9	65%	0.646	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-27.1	177.8	-61.3	178.9	0	0	0	111.6	N38	I36-N38 VanDerWaalsContact C-N 3.28Å; I36-N38 PolarHBondContact O-N 3.37Å
37	D	30.5	Very low	29.1	Very low	134 Å²	134	148 Å²	148	72%	0.717	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-9.2	-179.3	-90.5	-13.4	0	0	0	114.6
38	N	29	Very low	28.6	Very low	148 Å²	148	149.8 Å²	149.8	79%	0.791	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	12	178.9	-105.5	-18.4	0	0	0	115.3	I36	I36-N38 VanDerWaalsContact C-N 3.28Å; I36-N38 PolarHBondContact O-N 3.37Å
39	K	26.6	Very low	28.3	Very low	184 Å²	184	147.4 Å²	147.4	80%	0.8	74%	0.741	S	S	*	*	S	Bend	trans	-117.7	4.9	179.7	-93	-174.6	179.2	174.6	0	117.4
40	N	27.5	Very low	28	Very low	137 Å²	137	150 Å²	150	73%	0.733	75%	0.754	S	S	*	*			trans	-112.7	65	173.1	-67.8	-28.4	0	0	0	111	I42	N40-I42 PolarHBondContact O-N 3.44Å; N40-I42 VanDerWaalsContact O-N 3.07Å
41	E	25.8	Very low	27.3	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	77%	0.765	S	S	*	*			trans	-58.4	109.7	155.7	-84.5	-173.1	154	0	0	108.4	Q43	E41-Q43 VanDerWaalsContact C-N 3.33Å; E41-Q43 PolarHBondContact O-N 2.8Å
42	I	27.1	Very low	26.6	Very low	145 Å²	145	151.4 Å²	151.4	74%	0.744	76%	0.76	S	S	*	*			trans	-66.9	91.8	174.3	-62	168.6	0	0	0	107.6	N40 F44	N40-I42 PolarHBondContact O-N 3.44Å; N40-I42 VanDerWaalsContact O-N 3.07Å; I42-F44 PolarHBondContact O-N 2.96Å
43	Q	23.4	Very low	26.3	Very low	162 Å²	162	150 Å²	150	76%	0.757	76%	0.764	S	S	*	*			trans	-71.1	106.5	164.4	-80.4	-170.6	-6.8	0	0	109.4	E41 T45	E41-Q43 VanDerWaalsContact C-N 3.33Å; E41-Q43 PolarHBondContact O-N 2.8Å; Q43-T45 PolarHBondContact O-N 3.19Å
44	F	21.5	Very low	26	Very low	199 Å²	199	154.1 Å²	154.1	87%	0.873	78%	0.781	S	S	*	*			trans	-54.3	104.8	163.6	-80.7	-96.1	0	0	0	110.2	I42	I42-F44 PolarHBondContact O-N 2.96Å
45	T	24.7	Very low	25.7	Very low	128 Å²	128	154.5 Å²	154.5	79%	0.785	79%	0.788	S	S	*	*			trans	-116.9	138.6	163.9	51.2	0	0	0	0	110.9	Q43	Q43-T45 PolarHBondContact O-N 3.19Å
46	K	23.9	Very low	25.5	Very low	203 Å²	203	153.9 Å²	153.9	88%	0.883	79%	0.788	S	S	*	*			trans	-70.1	149.6	-159.8	-71.5	166.1	172.3	171.3	0	113.1
47	S	20.9	Very low	25.3	Very low	111 Å²	111	155.4 Å²	155.4	78%	0.776	79%	0.793	S	S	*	*			trans	-44.9	129.3	162.5	42.9	0	0	0	0	114.2
48	Q	23.1	Very low	25.3	Very low	189 Å²	189	156.8 Å²	156.8	88%	0.883	80%	0.8	S	S	*	*			trans	-177.9	158.3	146.8	-108	-175.6	20.3	0	0	111.5
49	P	29.5	Very low	25.3	Very low	111 Å²	111	154.8 Å²	154.8	72%	0.721	80%	0.804	S	S	*	*				-119.1	173.1	-95.7	40.6	-30.9	0	0	0	115.6	K51	P49-K51 PolarHBondContact O-N 3.43Å
50	I	22.3	Very low	25.7	Very low	167 Å²	167	153.2 Å²	153.2	86%	0.856	80%	0.804	S	S	*	*			trans	-39	121.6	174.4	-59.9	158	0	0	0	113
51	K	23.7	Very low	25.9	Very low	206 Å²	206	152.5 Å²	152.5	90%	0.896	81%	0.807	S	S	*	*			trans	-117.8	115	157.2	-78.5	-173.7	178.6	179.3	0	109.5	P49	P49-K51 PolarHBondContact O-N 3.43Å
52	S	20.6	Very low	26.4	Very low	93 Å²	93	151.4 Å²	151.4	65%	0.65	81%	0.807	S	S	*	*			trans	-70.3	157.1	165.6	42.2	0	0	0	0	111.6
53	N	24.1	Very low	27.1	Very low	149 Å²	149	152 Å²	152	80%	0.797	81%	0.806	S	S	*	*			trans	82.9	98.9	165.6	-58.5	-12.5	0	0	0	117.5
54	Q	29.8	Very low	28	Very low	199 Å²	199	154.7 Å²	154.7	93%	0.93	81%	0.811	S	S	*	*				-154.9	115.5	121.3	-107.8	169	6	0	0	111.1
55	V	24.1	Very low	29	Very low	129 Å²	129	148.4 Å²	148.4	78%	0.782	79%	0.792	S	S	*	*			trans	-76.5	132.4	164.7	174	0	0	0	0	107.7
56	L	26.4	Very low	29.9	Very low	134 Å²	134	147.5 Å²	147.5	70%	0.702	79%	0.79	S	S	*	*				-179.2	119.9	126.6	-120.8	90.6	0	0	0	112.3
57	Q	26.2	Very low	30.7	Very low	158 Å²	158	146.1 Å²	146.1	74%	0.738	78%	0.779	S	S	*	*			trans	54.9	102.3	134	-67.6	171.8	3.7	0	0	119.5
58	N	31.4	Very low	31.6	Very low	162 Å²	162	145.2 Å²	145.2	87%	0.866	77%	0.765	S	S	*	*				-136.1	111.4	129.5	-83.9	-31	0	0	0	107.1	D60	N58-D60 PolarHBondContact O-N 2.92Å
59	A	29.1	Very low	32.6	Very low	106 Å²	106	146.2 Å²	146.2	88%	0.876	76%	0.761	S	S	*	*			trans	-81.5	105.6	177.2	0	0	0	0	0	108.9
60	D	33.6	Very low	33.2	Very low	151 Å²	151	146.7 Å²	146.7	81%	0.807	75%	0.752	S	S	*	*			trans	-84	143.5	169.7	-78.5	-34.1	0	0	0	110.8	N58	N58-D60 PolarHBondContact O-N 2.92Å
61	P	33.7	Very low	34.2	Very low	122 Å²	122	141.2 Å²	141.2	79%	0.792	73%	0.726	S	S	*	*			trans	-79.4	159.5	-163	31.5	-34.8	0	0	0	115
62	D	35.4	Very low	35.1	Very low	156 Å²	156	139.4 Å²	139.4	83%	0.834	71%	0.714	S	S	*	*			trans	-42.4	130.8	-165.4	-70.1	-44.6	0	0	0	118.6	Y64	D62-Y64 PolarHBondContact O-N 2.82Å
63	H	41.1	Very low	36.3	Very low	156 Å²	156	139.1 Å²	139.1	72%	0.722	71%	0.711	S	S	*	*	S	Bend	trans	-86.2	10.9	-174	-160.9	-77.7	0	0	0	114.7
64	Y	42.5	Very low	37.3	Very low	220 Å²	220	135.2 Å²	135.2	86%	0.863	69%	0.689	S	S	*	*			trans	-117.4	27.6	-167.6	-82.1	-79.2	0	0	0	117.1	D62	D62-Y64 PolarHBondContact O-N 2.82Å
65	S	42.7	Very low	38.1	Very low	67 Å²	67	135.1 Å²	135.1	47%	0.469	68%	0.68	S	S	.	*			trans	-89.3	114.9	167.4	-171.4	0	0	0	0	111.7	W67 N68	S65-W67 PolarHBondContact O-N 3.37Å; S65-W67 WeakPolarHBondContact OG-CB 3.29Å; S65-N68 PolarHBondContact O-N 2.99Å
66	C	44.7	Very low	39.4	Very low	109 Å²	109	132.3 Å²	132.3	74%	0.736	67%	0.667	S	S	*	*	H	α-helix	trans	-45.8	-33	169.4	173.6	0	0	0	0	112.5	N68 R69 F70	C66-N68 VanDerWaalsContact C-N 3.31Å; C66-N68 PolarHBondContact O-N 3.48Å; C66-R69 PolarHBondContact O-N 3.37Å; C66-F70 PolarHBondContact O-N 2.76Å; C66-F70 VanDerWaalsContact O-N 3.09Å
67	W	39.7	Very low	40.4	Very low	173 Å²	173	128.9 Å²	128.9	66%	0.655	66%	0.657	S	S	*	*	H	α-helix	trans	-58.7	-38.6	176.1	-167.4	-107.7	0	0	0	112.9	S65 R69 F70 T71	S65-W67 PolarHBondContact O-N 3.37Å; S65-W67 WeakPolarHBondContact OG-CB 3.29Å; W67-R69 PolarHBondContact O-N 3.44Å; W67-F70 PolarHBondContact O-N 3.36Å; W67-T71 VanDerWaalsContact O-CG2 3.3Å; W67-T71 WeakPolarHBondContact O-CG2 3.09Å; W67-T71 PolarHBondContact O-N 2.98Å; W67-T71 PolarHBondContact O-OG1 2.64Å; W67-T71 VanDerWaalsContact O-OG1 3.1Å
68	N	39.4	Very low	41.4	Very low	93 Å²	93	124.3 Å²	124.3	50%	0.497	63%	0.634	S	S	.	*	H	α-helix	trans	-73.5	-26.2	179.4	-78.4	-9.6	0	0	0	113.2	S65 C66 T71 R72	S65-N68 PolarHBondContact O-N 2.99Å; C66-N68 VanDerWaalsContact C-N 3.31Å; C66-N68 PolarHBondContact O-N 3.48Å; N68-T71 WeakPolarHBondContact CA-OG1 3.36Å; N68-T71 PolarHBondContact O-OG1 2.92Å; N68-R72 VanDerWaalsContact O-CB 3.27Å; N68-R72 WeakPolarHBondContact O-CB 3.22Å; N68-R72 WeakPolarHBondContact O-CG 3.22Å; N68-R72 PolarHBondContact O-N 2.62Å
69	R	45.1	Very low	42	Very low	210 Å²	210	117.9 Å²	117.9	79%	0.792	60%	0.603	S	S	*	*	H	α-helix	trans	-73.6	-41	170.7	-104.4	-174.1	179.7	-176	0.9	111.3	C66 W67 R72 C73	C66-R69 PolarHBondContact O-N 3.37Å; W67-R69 PolarHBondContact O-N 3.44Å; R69-R72 PolarHBondContact O-N 3.04Å; R69-C73 WeakPolarHBondContact O-CB 3.3Å; R69-C73 PolarHBondContact O-N 2.96Å
70	F	42.4	Very low	43	Very low	121 Å²	121	114 Å²	114	53%	0.531	57%	0.569	S	S	.	*	H	α-helix	trans	-65.2	-45.3	176.1	-173.1	-111.2	0	0	0	111.3	C66 W67 R72 C73 I74	C66-F70 PolarHBondContact O-N 2.76Å; C66-F70 VanDerWaalsContact O-N 3.09Å; W67-F70 PolarHBondContact O-N 3.36Å; F70-R72 PolarHBondContact O-N 2.84Å; F70-C73 PolarHBondContact O-N 3.09Å; F70-I74 HydrophobicContact CD1-CD1 3.58Å; F70-I74 HydrophobicContact CD2-CD1 4.44Å; F70-I74 HydrophobicContact CE1-CD1 3.19Å; F70-I74 HydrophobicContact CE1-CG1 4.36Å; F70-I74 HydrophobicContact CE2-CD1 4.12Å; F70-I74 HydrophobicContact CG-CD1 4.21Å; F70-I74 HydrophobicContact CZ-CD1 3.51Å; F70-I74 HydrophobicContact CZ-CG1 4.39Å; F70-I74 WeakPolarHBondContact O-CB 3.36Å; F70-I74 VanDerWaalsContact O-CG1 3.32Å; F70-I74 WeakPolarHBondContact O-CG1 3.23Å; F70-I74 PolarHBondContact O-N 2.95Å
71	T	43.3	Very low	43.4	Very low	51 Å²	51	116.3 Å²	116.3	31%	0.313	57%	0.566	S	S	.	*	H	α-helix	trans	-67.3	-32.1	174.9	60.2	0	0	0	0	112.5	W67 N68 R75	W67-T71 VanDerWaalsContact O-CG2 3.3Å; W67-T71 WeakPolarHBondContact O-CG2 3.09Å; W67-T71 PolarHBondContact O-N 2.98Å; W67-T71 PolarHBondContact O-OG1 2.64Å; W67-T71 VanDerWaalsContact O-OG1 3.1Å; N68-T71 WeakPolarHBondContact CA-OG1 3.36Å; N68-T71 PolarHBondContact O-OG1 2.92Å; T71-R75 WeakPolarHBondContact O-CB 3Å; T71-R75 PolarHBondContact O-N 2.93Å
72	R	40.7	Very low	43.8	Very low	168 Å²	168	114.7 Å²	114.7	63%	0.634	55%	0.55	S	S	*	*	H	α-helix	trans	-68.5	-41.9	170.1	-84.8	-176.3	-174.2	163.3	4.4	112.8	N68 R69 F70 R75 S76	N68-R72 VanDerWaalsContact O-CB 3.27Å; N68-R72 WeakPolarHBondContact O-CB 3.22Å; N68-R72 WeakPolarHBondContact O-CG 3.22Å; N68-R72 PolarHBondContact O-N 2.62Å; R69-R72 PolarHBondContact O-N 3.04Å; F70-R72 PolarHBondContact O-N 2.84Å; R72-R75 PolarHBondContact O-N 3.33Å; R72-S76 VanDerWaalsContact O-CB 3.24Å; R72-S76 WeakPolarHBondContact O-CB 2.76Å; R72-S76 PolarHBondContact O-N 3.44Å; R72-S76 PolarHBondContact O-OG 2.82Å
73	C	46	Very low	44.3	Very low	87 Å²	87	110.9 Å²	110.9	59%	0.588	53%	0.533	S	S	*	.	H	α-helix	trans	-62.6	-46.4	175.8	-101.9	0	0	0	0	111.1	R69 F70 S76 A77	R69-C73 WeakPolarHBondContact O-CB 3.3Å; R69-C73 PolarHBondContact O-N 2.96Å; F70-C73 PolarHBondContact O-N 3.09Å; C73-S76 PolarHBondContact O-N 3.02Å; C73-S76 PolarHBondContact O-OG 3.47Å; C73-A77 WeakPolarHBondContact O-CB 3.32Å; C73-A77 PolarHBondContact O-N 3.25Å
74	I	45.7	Very low	44.5	Very low	68 Å²	68	108.9 Å²	108.9	35%	0.349	52%	0.523	S	S	.	.	H	α-helix	trans	-57.8	-59.8	171.4	-71.9	177.2	0	0	0	108.7	F70 S76 A77 W78	F70-I74 HydrophobicContact CD1-CD1 3.58Å; F70-I74 HydrophobicContact CD2-CD1 4.44Å; F70-I74 HydrophobicContact CE1-CD1 3.19Å; F70-I74 HydrophobicContact CE1-CG1 4.36Å; F70-I74 HydrophobicContact CE2-CD1 4.12Å; F70-I74 HydrophobicContact CG-CD1 4.21Å; F70-I74 HydrophobicContact CZ-CD1 3.51Å; F70-I74 HydrophobicContact CZ-CG1 4.39Å; F70-I74 WeakPolarHBondContact O-CB 3.36Å; F70-I74 VanDerWaalsContact O-CG1 3.32Å; F70-I74 WeakPolarHBondContact O-CG1 3.23Å; F70-I74 PolarHBondContact O-N 2.95Å; I74-S76 PolarHBondContact O-N 3.24Å; I74-A77 CarbonylContact O-C 3.53Å; I74-A77 WeakPolarHBondContact O-CA 3.33Å; I74-A77 WeakPolarHBondContact O-CB 3.46Å; I74-A77 PolarHBondContact O-N 3.08Å; I74-W78 HydrophobicContact CG2-CG 4.24Å; I74-W78 WeakPolarHBondContact O-CB 3.12Å; I74-W78 PolarHBondContact O-N 3.24Å
75	R	47.3	Very low	44.4	Very low	196 Å²	196	106.6 Å²	106.6	74%	0.74	53%	0.526	S	S	*	.	H	α-helix	trans	-54	-35.6	-178.9	-169.1	174.1	178.4	169.4	-0.1	113.4	T71 R72 W78 A79	T71-R75 WeakPolarHBondContact O-CB 3Å; T71-R75 PolarHBondContact O-N 2.93Å; R72-R75 PolarHBondContact O-N 3.33Å; R75-W78 PolarHBondContact O-N 2.99Å; R75-A79 PolarHBondContact O-N 3.1Å
76	S	50.1	Low	44.6	Very low	71 Å²	71	105.8 Å²	105.8	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-73.2	-29.8	174.7	75.3	0	0	0	0	114.3	R72 C73 I74	R72-S76 VanDerWaalsContact O-CB 3.24Å; R72-S76 WeakPolarHBondContact O-CB 2.76Å; R72-S76 PolarHBondContact O-N 3.44Å; R72-S76 PolarHBondContact O-OG 2.82Å; C73-S76 PolarHBondContact O-N 3.02Å; C73-S76 PolarHBondContact O-OG 3.47Å; I74-S76 PolarHBondContact O-N 3.24Å
77	A	49	Very low	44.7	Very low	61 Å²	61	109 Å²	109	50%	0.504	53%	0.525	S	S	.	.	H	α-helix	trans	-78.4	-27	172.1	0	0	0	0	0	112	C73 I74	C73-A77 WeakPolarHBondContact O-CB 3.32Å; C73-A77 PolarHBondContact O-N 3.25Å; I74-A77 CarbonylContact O-C 3.53Å; I74-A77 WeakPolarHBondContact O-CA 3.33Å; I74-A77 WeakPolarHBondContact O-CB 3.46Å; I74-A77 PolarHBondContact O-N 3.08Å
78	W	47.2	Very low	45.3	Very low	63 Å²	63	105.7 Å²	105.7	24%	0.239	53%	0.528	C	S	.	.	H	α-helix	trans	-87.8	-18.3	-178.2	-80.6	85	0	0	0	114.2	I74 R75 T80 Y368 V371 M375	I74-W78 HydrophobicContact CG2-CG 4.24Å; I74-W78 WeakPolarHBondContact O-CB 3.12Å; I74-W78 PolarHBondContact O-N 3.24Å; R75-W78 PolarHBondContact O-N 2.99Å; W78-T80 PolarHBondContact O-N 3.36Å; W78-T80 VanDerWaalsContact O-N 3.15Å; W78-Y368 HydrophobicContact CH2-CD2 4.37Å; W78-Y368 HydrophobicContact CZ2-CD2 4.14Å; W78-V371 HydrophobicContact CE3-CG1 4.42Å; W78-V371 HydrophobicContact CH2-CB 3.28Å; W78-V371 HydrophobicContact CH2-CG1 3.12Å; W78-V371 HydrophobicContact CZ2-CB 3.98Å; W78-V371 HydrophobicContact CZ2-CG1 3.75Å; W78-V371 HydrophobicContact CZ3-CB 3.99Å; W78-V371 HydrophobicContact CZ3-CG1 3.45Å; W78-V371 VanDerWaalsContact CZ3-CG1 3.45Å; W78-M375 HydrophobicContact CE3-SD 3.61Å; W78-M375 HydrophobicContact CZ3-SD 3.63Å
79	A	43.8	Very low	45.9	Very low	27 Å²	27	108 Å²	108	22%	0.223	54%	0.541	C	S	.	.			trans	-64.6	115.9	-179.7	0	0	0	0	0	110.5	R75 L101	R75-A79 PolarHBondContact O-N 3.1Å; A79-L101 WeakPolarHBondContact O-CD2 3.04Å
80	T	48.6	Very low	46.2	Very low	25 Å²	25	106.2 Å²	106.2	15%	0.153	53%	0.534	C	S	.	.			trans	-119.1	161.8	175.7	58.6	0	0	0	0	110.3	W78 L82 T83 K105	W78-T80 PolarHBondContact O-N 3.36Å; W78-T80 VanDerWaalsContact O-N 3.15Å; T80-L82 PolarHBondContact O-N 3.06Å; T80-T83 PolarHBondContact N-OG1 2.91Å; T80-T83 VanDerWaalsContact N-OG1 3.15Å; T80-T83 PolarHBondContact O-N 3.49Å; T80-T83 PolarHBondContact O-OG1 3.09Å; T80-K105 VanDerWaalsContact CG2-NZ 3.35Å
81	R	42.1	Very low	46.9	Very low	198 Å²	198	108 Å²	108	75%	0.747	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-16.6	179	-166.2	-179.1	176.1	-179.6	-1	114.1	L98	R81-L98 HydrophobicContact CG-CD2 4.12Å
82	L	43.3	Very low	47.1	Very low	89 Å²	89	112 Å²	112	47%	0.466	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.4	1.3	-179.2	-68.3	167.1	0	0	0	113.8	T80 K379	T80-L82 PolarHBondContact O-N 3.06Å; L82-K379 PolarHBondContact O-NZ 3.18Å
83	T	45.2	Very low	47.6	Very low	76 Å²	76	108.1 Å²	108.1	47%	0.466	55%	0.549	S	S	.	.	S	Bend	trans	-116	-2.7	-170.4	51.4	0	0	0	0	116.2	T80	T80-T83 PolarHBondContact N-OG1 2.91Å; T80-T83 VanDerWaalsContact N-OG1 3.15Å; T80-T83 PolarHBondContact O-N 3.49Å; T80-T83 PolarHBondContact O-OG1 3.09Å
84	E	46.1	Very low	47.9	Very low	113 Å²	113	107.2 Å²	107.2	53%	0.528	54%	0.537	S	S	.	.			trans	-132.6	122.7	-171.3	-138.6	166.5	-146.1	0	0	112.8	T86 Y93	E84-T86 HydrophobicContact CB-CG2 4.32Å; E84-T86 HydrophobicContact CG-CG2 3.83Å; E84-Y93 PolarHBondContact OE2-OH 2.8Å
85	D	40.3	Very low	48.3	Very low	172 Å²	172	108.1 Å²	108.1	92%	0.92	54%	0.54	S	S	*	.			trans	-92.2	104.2	168.4	-80.3	-36	0	0	0	108.5
86	T	47	Very low	48.7	Very low	50 Å²	50	102.3 Å²	102.3	31%	0.307	53%	0.526	S	S	.	.			trans	-119.7	100.1	-179.1	57.6	0	0	0	0	111.2	E84 Y93	E84-T86 HydrophobicContact CB-CG2 4.32Å; E84-T86 HydrophobicContact CG-CG2 3.83Å; T86-Y93 HydrophobicContact CG2-CD1 4.14Å; T86-Y93 HydrophobicContact CG2-CE1 3.33Å; T86-Y93 WeakPolarHBondContact OG1-CD1 3.4Å; T86-Y93 VanDerWaalsContact OG1-CE1 3.29Å; T86-Y93 WeakPolarHBondContact OG1-CE1 3.34Å
87	M	46.3	Very low	48.9	Very low	176 Å²	176	100.7 Å²	100.7	87%	0.867	51%	0.513	S	S	*	.			trans	-100.3	13.9	-172.5	-116.1	-174	-171.7	0	0	115.5
88	S	53	Low	49.1	Very low	105 Å²	105	99.6 Å²	99.6	73%	0.734	50%	0.499	S	S	*	.	S	Bend	trans	-131.2	110.2	175.7	61	0	0	0	0	111.2
89	N	51.5	Low	49.5	Very low	142 Å²	142	101.8 Å²	101.8	76%	0.759	51%	0.507	S	S	*	.			trans	71.8	71.3	-171.7	-81.6	-19.6	0	0	0	116.4	Y93	N89-Y93 WeakPolarHBondContact O-CB 3.3Å
90	R	52.1	Low	50.4	Low	171 Å²	171	105.7 Å²	105.7	65%	0.645	52%	0.521	S	S	*	.	H	α-helix	trans	-53.1	-57.5	-178.1	-93.2	-178.8	170	167.1	-3.2	114.3	I94	R90-I94 HydrophobicContact CB-CD1 4.02Å; R90-I94 HydrophobicContact CG-CD1 4.04Å; R90-I94 WeakPolarHBondContact O-CB 3.06Å; R90-I94 VanDerWaalsContact O-CD1 3.23Å; R90-I94 WeakPolarHBondContact O-CD1 3.27Å; R90-I94 WeakPolarHBondContact O-CG1 3.33Å; R90-I94 PolarHBondContact O-N 3.39Å
91	E	55.4	Low	51.1	Low	158 Å²	158	106.4 Å²	106.4	74%	0.738	52%	0.523	S	S	*	.	H	α-helix	trans	-68.5	-55.7	-165.4	-68.1	-177.4	168	0	0	113.1	Y93 I94 H95	E91-Y93 VanDerWaalsContact C-N 3.34Å; E91-Y93 PolarHBondContact O-N 3.46Å; E91-I94 PolarHBondContact O-N 3.4Å; E91-H95 WeakPolarHBondContact O-CB 3.24Å; E91-H95 PolarHBondContact O-CD2 2.86Å; E91-H95 PolarHBondContact O-N 3.1Å
92	L	49	Very low	52.2	Low	137 Å²	137	98.7 Å²	98.7	72%	0.717	50%	0.497	S	S	*	.	H	α-helix	trans	-67.1	-34.9	-174.9	-163.3	72.1	0	0	0	112.7	T96	L92-T96 WeakPolarHBondContact O-CB 3.14Å; L92-T96 PolarHBondContact O-N 2.99Å; L92-T96 VanDerWaalsContact O-N 3.09Å; L92-T96 PolarHBondContact O-OG1 3.4Å
93	Y	51.3	Low	53.5	Low	85 Å²	85	97.5 Å²	97.5	33%	0.333	49%	0.493	S	S	.	.	H	α-helix	trans	-72.1	-47.7	177.3	-173.7	-96.3	0	0	0	111.4	E84 T86 N89 E91 H95 T96 T97	E84-Y93 PolarHBondContact OE2-OH 2.8Å; T86-Y93 HydrophobicContact CG2-CD1 4.14Å; T86-Y93 HydrophobicContact CG2-CE1 3.33Å; T86-Y93 WeakPolarHBondContact OG1-CD1 3.4Å; T86-Y93 VanDerWaalsContact OG1-CE1 3.29Å; T86-Y93 WeakPolarHBondContact OG1-CE1 3.34Å; N89-Y93 WeakPolarHBondContact O-CB 3.3Å; E91-Y93 VanDerWaalsContact C-N 3.34Å; E91-Y93 PolarHBondContact O-N 3.46Å; Y93-H95 VanDerWaalsContact C-N 3.3Å; Y93-H95 PolarHBondContact O-N 3.37Å; Y93-T96 PolarHBondContact O-N 3.24Å; Y93-T96 PolarHBondContact O-OG1 3.15Å; Y93-T97 HydrophobicContact CD1-CG2 4.06Å; Y93-T97 HydrophobicContact CD2-CG2 4.12Å; Y93-T97 HydrophobicContact CE1-CG2 3.76Å; Y93-T97 HydrophobicContact CE2-CG2 3.85Å; Y93-T97 HydrophobicContact CG-CG2 4.22Å; Y93-T97 VanDerWaalsContact O-CB 3.3Å; Y93-T97 WeakPolarHBondContact O-CB 3.5Å; Y93-T97 VanDerWaalsContact O-CG2 3.22Å; Y93-T97 WeakPolarHBondContact O-CG2 3.19Å; Y93-T97 PolarHBondContact O-N 2.75Å; Y93-T97 PolarHBondContact O-OG1 3.22Å
94	I	51.5	Low	54.8	Low	69 Å²	69	99.3 Å²	99.3	35%	0.354	50%	0.495	S	S	.	.	H	α-helix	trans	-58.2	-43.3	175.6	-69.4	168.4	0	0	0	110.3	R90 E91 T97 L98	R90-I94 HydrophobicContact CB-CD1 4.02Å; R90-I94 HydrophobicContact CG-CD1 4.04Å; R90-I94 WeakPolarHBondContact O-CB 3.06Å; R90-I94 VanDerWaalsContact O-CD1 3.23Å; R90-I94 WeakPolarHBondContact O-CD1 3.27Å; R90-I94 WeakPolarHBondContact O-CG1 3.33Å; R90-I94 PolarHBondContact O-N 3.39Å; E91-I94 PolarHBondContact O-N 3.4Å; I94-T97 PolarHBondContact O-OG1 2.85Å; I94-L98 HydrophobicContact CG2-CD1 3.46Å; I94-L98 VanDerWaalsContact CG2-CD1 3.46Å; I94-L98 HydrophobicContact CG2-CG 4.21Å; I94-L98 WeakPolarHBondContact O-CB 3.05Å; I94-L98 WeakPolarHBondContact O-CD1 3.43Å; I94-L98 WeakPolarHBondContact O-CG 3.29Å; I94-L98 PolarHBondContact O-N 3.32Å
95	H	53.7	Low	56.3	Low	86 Å²	86	96.9 Å²	96.9	40%	0.398	48%	0.482	S	S	.	.	H	α-helix	trans	-71.6	-39.9	-177.5	-74.9	-61	0	0	0	114.4	E91 Y93 R99 E582	E91-H95 WeakPolarHBondContact O-CB 3.24Å; E91-H95 PolarHBondContact O-CD2 2.86Å; E91-H95 PolarHBondContact O-N 3.1Å; Y93-H95 VanDerWaalsContact C-N 3.3Å; Y93-H95 PolarHBondContact O-N 3.37Å; H95-R99 WeakPolarHBondContact O-CB 3.41Å; H95-R99 PolarHBondContact O-N 3.04Å; H95-E582 IonicContact CE1-OE2 3.68Å; H95-E582 PolarHBondContact CE1-OE2 3.43Å
96	T	56	Low	58.3	Low	74 Å²	74	90.6 Å²	90.6	45%	0.454	45%	0.448	S	S	.	.	H	α-helix	trans	-73.2	-43	178	43.7	0	0	0	0	111.7	L92 Y93 R99 E100	L92-T96 WeakPolarHBondContact O-CB 3.14Å; L92-T96 PolarHBondContact O-N 2.99Å; L92-T96 VanDerWaalsContact O-N 3.09Å; L92-T96 PolarHBondContact O-OG1 3.4Å; Y93-T96 PolarHBondContact O-N 3.24Å; Y93-T96 PolarHBondContact O-OG1 3.15Å; T96-R99 PolarHBondContact O-N 3.06Å; T96-E100 PolarHBondContact O-N 2.67Å
97	T	54.8	Low	60	Low	37 Å²	37	92.4 Å²	92.4	23%	0.227	46%	0.456	C	S	.	.	H	α-helix	trans	-66.6	-43.9	177.8	57.9	0	0	0	0	112.6	Y93 I94 R99 E100 L101	Y93-T97 HydrophobicContact CD1-CG2 4.06Å; Y93-T97 HydrophobicContact CD2-CG2 4.12Å; Y93-T97 HydrophobicContact CE1-CG2 3.76Å; Y93-T97 HydrophobicContact CE2-CG2 3.85Å; Y93-T97 HydrophobicContact CG-CG2 4.22Å; Y93-T97 VanDerWaalsContact O-CB 3.3Å; Y93-T97 WeakPolarHBondContact O-CB 3.5Å; Y93-T97 VanDerWaalsContact O-CG2 3.22Å; Y93-T97 WeakPolarHBondContact O-CG2 3.19Å; Y93-T97 PolarHBondContact O-N 2.75Å; Y93-T97 PolarHBondContact O-OG1 3.22Å; I94-T97 PolarHBondContact O-OG1 2.85Å; T97-R99 VanDerWaalsContact C-N 3.32Å; T97-R99 PolarHBondContact O-N 3.15Å; T97-E100 PolarHBondContact O-N 2.96Å; T97-L101 VanDerWaalsContact O-CB 3.29Å; T97-L101 WeakPolarHBondContact O-CB 3.15Å; T97-L101 WeakPolarHBondContact O-CG 3.36Å; T97-L101 PolarHBondContact O-N 3.25Å
98	L	53	Low	61.8	Low	39 Å²	39	86.7 Å²	86.7	20%	0.204	43%	0.429	C	S	.	.	H	α-helix	trans	-59.6	-43.3	176.5	-80.3	170.9	0	0	0	111.7	R81 I94 I102	R81-L98 HydrophobicContact CG-CD2 4.12Å; I94-L98 HydrophobicContact CG2-CD1 3.46Å; I94-L98 VanDerWaalsContact CG2-CD1 3.46Å; I94-L98 HydrophobicContact CG2-CG 4.21Å; I94-L98 WeakPolarHBondContact O-CB 3.05Å; I94-L98 WeakPolarHBondContact O-CD1 3.43Å; I94-L98 WeakPolarHBondContact O-CG 3.29Å; I94-L98 PolarHBondContact O-N 3.32Å; L98-I102 HydrophobicContact CB-CD1 4.33Å; L98-I102 HydrophobicContact CD2-CD1 4.25Å; L98-I102 WeakPolarHBondContact O-CB 3.42Å; L98-I102 WeakPolarHBondContact O-CD1 3.35Å; L98-I102 WeakPolarHBondContact O-CG1 3.44Å; L98-I102 PolarHBondContact O-N 2.84Å
99	R	56.2	Low	63.5	Low	108 Å²	108	81.7 Å²	81.7	41%	0.408	39%	0.394	S	S	.	.	H	α-helix	trans	-65.3	-45.7	178.9	-178.8	172.3	169	-127.1	-21.5	111.8	H95 T96 T97 T103 R590	H95-R99 WeakPolarHBondContact O-CB 3.41Å; H95-R99 PolarHBondContact O-N 3.04Å; T96-R99 PolarHBondContact O-N 3.06Å; T97-R99 VanDerWaalsContact C-N 3.32Å; T97-R99 PolarHBondContact O-N 3.15Å; R99-T103 WeakPolarHBondContact O-CB 3.31Å; R99-T103 PolarHBondContact O-N 3.37Å; R99-T103 PolarHBondContact O-OG1 3.03Å; R99-R590 VanDerWaalsContact NH1-NH1 3.19Å
100	E	62.5	Low	65.2	Low	110 Å²	110	78.6 Å²	78.6	51%	0.514	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-45.9	177	-76.2	-163.2	-165	0	0	111.8	T96 T97 K104	T96-E100 PolarHBondContact O-N 2.67Å; T97-E100 PolarHBondContact O-N 2.96Å; E100-K104 WeakPolarHBondContact O-CB 3.48Å; E100-K104 VanDerWaalsContact O-CD 3.32Å; E100-K104 WeakPolarHBondContact O-CD 3.46Å; E100-K104 WeakPolarHBondContact O-CG 3.46Å; E100-K104 PolarHBondContact O-N 3.45Å; E100-K104 IonicContact OE2-NZ 2.88Å; E100-K104 PolarHBondContact OE2-NZ 3.16Å
101	L	62	Low	67	Low	39 Å²	39	74 Å²	74	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-67.9	-44.2	-178.7	-68	179.3	0	0	0	112.1	A79 T97 K105	A79-L101 WeakPolarHBondContact O-CD2 3.04Å; T97-L101 VanDerWaalsContact O-CB 3.29Å; T97-L101 WeakPolarHBondContact O-CB 3.15Å; T97-L101 WeakPolarHBondContact O-CG 3.36Å; T97-L101 PolarHBondContact O-N 3.25Å; L101-K105 WeakPolarHBondContact O-CB 3.3Å; L101-K105 WeakPolarHBondContact O-CG 3.42Å; L101-K105 PolarHBondContact O-N 3.34Å
102	I	65.8	Low	68.7	Low	37 Å²	37	67 Å²	67	19%	0.19	34%	0.335	C	S	.	.	H	α-helix	trans	-69.2	-46.3	-179.9	-68.5	167.8	0	0	0	110.6	L98 K104 K105 I106 F462 M583	L98-I102 HydrophobicContact CB-CD1 4.33Å; L98-I102 HydrophobicContact CD2-CD1 4.25Å; L98-I102 WeakPolarHBondContact O-CB 3.42Å; L98-I102 WeakPolarHBondContact O-CD1 3.35Å; L98-I102 WeakPolarHBondContact O-CG1 3.44Å; L98-I102 PolarHBondContact O-N 2.84Å; I102-K104 PolarHBondContact O-N 3.07Å; I102-K105 PolarHBondContact O-N 3.19Å; I102-I106 HydrophobicContact CG2-CD1 3.68Å; I102-I106 HydrophobicContact CG2-CG1 4.38Å; I102-I106 VanDerWaalsContact O-CG1 3.25Å; I102-I106 WeakPolarHBondContact O-CG1 3.26Å; I102-I106 PolarHBondContact O-N 3.36Å; I102-F462 HydrophobicContact CD1-CE1 4.2Å; I102-F462 HydrophobicContact CD1-CZ 4.27Å; I102-F462 HydrophobicContact CG2-CE1 4.2Å; I102-F462 HydrophobicContact CG2-CE2 3.9Å; I102-F462 HydrophobicContact CG2-CZ 3.38Å; I102-M583 HydrophobicContact CD1-CE 3.78Å; I102-M583 HydrophobicContact CG2-CE 4.34Å
103	T	70.8	Confident	70.7	Confident	64 Å²	64	61 Å²	61	39%	0.393	30%	0.303	S	S	.	.	H	α-helix	trans	-66.3	-40.3	179.7	-56.4	0	0	0	0	110.7	R99 N107	R99-T103 WeakPolarHBondContact O-CB 3.31Å; R99-T103 PolarHBondContact O-N 3.37Å; R99-T103 PolarHBondContact O-OG1 3.03Å; T103-N107 WeakPolarHBondContact O-CB 3.37Å; T103-N107 VanDerWaalsContact O-CG 3.23Å; T103-N107 PolarHBondContact O-N 2.84Å; T103-N107 PolarHBondContact O-ND2 3.49Å
104	K	72.8	Confident	72.6	Confident	114 Å²	114	63.8 Å²	63.8	50%	0.496	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-45.2	173.5	-74.1	168	-179.6	164.1	0	111.5	E100 I102 N107 L108	E100-K104 WeakPolarHBondContact O-CB 3.48Å; E100-K104 VanDerWaalsContact O-CD 3.32Å; E100-K104 WeakPolarHBondContact O-CD 3.46Å; E100-K104 WeakPolarHBondContact O-CG 3.46Å; E100-K104 PolarHBondContact O-N 3.45Å; E100-K104 IonicContact OE2-NZ 2.88Å; E100-K104 PolarHBondContact OE2-NZ 3.16Å; I102-K104 PolarHBondContact O-N 3.07Å; K104-N107 PolarHBondContact O-N 3.45Å; K104-L108 VanDerWaalsContact O-CB 3.26Å; K104-L108 WeakPolarHBondContact O-CB 3.38Å; K104-L108 PolarHBondContact O-N 3.47Å
105	K	77.8	Confident	74.5	Confident	61 Å²	61	60.9 Å²	60.9	27%	0.265	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-44.1	177.3	-79.3	-164.6	179.3	-149.1	0	112.5	T80 L101 I102 L108 Y109 E372	T80-K105 VanDerWaalsContact CG2-NZ 3.35Å; L101-K105 WeakPolarHBondContact O-CB 3.3Å; L101-K105 WeakPolarHBondContact O-CG 3.42Å; L101-K105 PolarHBondContact O-N 3.34Å; I102-K105 PolarHBondContact O-N 3.19Å; K105-L108 PolarHBondContact O-N 2.88Å; K105-Y109 VanDerWaalsContact O-CB 3.27Å; K105-Y109 WeakPolarHBondContact O-CB 3.11Å; K105-Y109 PolarHBondContact O-N 3.16Å; K105-E372 IonicContact NZ-OE1 2.84Å; K105-E372 PolarHBondContact NZ-OE1 2.98Å
106	I	81.1	Confident	76.3	Confident	40 Å²	40	57 Å²	57	21%	0.205	28%	0.282	C	S	.	.	H	α-helix	trans	-64.1	-47.2	177.8	-66.1	167.4	0	0	0	110.3	I102 L108 Y109 L110 Y459 F462	I102-I106 HydrophobicContact CG2-CD1 3.68Å; I102-I106 HydrophobicContact CG2-CG1 4.38Å; I102-I106 VanDerWaalsContact O-CG1 3.25Å; I102-I106 WeakPolarHBondContact O-CG1 3.26Å; I102-I106 PolarHBondContact O-N 3.36Å; I106-L108 VanDerWaalsContact C-N 3.35Å; I106-L108 PolarHBondContact O-N 2.9Å; I106-Y109 WeakPolarHBondContact O-CB 3.33Å; I106-Y109 PolarHBondContact O-N 3.42Å; I106-Y109 VanDerWaalsContact O-N 3.15Å; I106-L110 HydrophobicContact CG2-CD1 4Å; I106-L110 HydrophobicContact CG2-CG 4.29Å; I106-L110 WeakPolarHBondContact O-CG 3.45Å; I106-L110 PolarHBondContact O-N 3.19Å; I106-Y459 HydrophobicContact CG1-CD1 3.99Å; I106-Y459 HydrophobicContact CG1-CG 4.36Å; I106-F462 HydrophobicContact CD1-CE2 3.87Å
107	N	82.9	Confident	78.1	Confident	88 Å²	88	55.5 Å²	55.5	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-63.7	-40.5	179.1	-72.8	-15.7	0	0	0	112.1	T103 K104 Y109 L110 T111	T103-N107 WeakPolarHBondContact O-CB 3.37Å; T103-N107 VanDerWaalsContact O-CG 3.23Å; T103-N107 PolarHBondContact O-N 2.84Å; T103-N107 PolarHBondContact O-ND2 3.49Å; K104-N107 PolarHBondContact O-N 3.45Å; N107-Y109 VanDerWaalsContact C-N 3.31Å; N107-Y109 PolarHBondContact O-N 3.26Å; N107-L110 PolarHBondContact O-N 2.86Å; N107-T111 WeakPolarHBondContact O-CB 3.48Å; N107-T111 PolarHBondContact O-N 3.2Å; N107-T111 PolarHBondContact O-OG1 3.08Å
108	L	84.8	Confident	79.8	Confident	57 Å²	57	54.7 Å²	54.7	30%	0.298	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-42.9	173.5	-170.4	74.8	0	0	0	110.9	K104 K105 I106 T111 K112 F365 Y368	K104-L108 VanDerWaalsContact O-CB 3.26Å; K104-L108 WeakPolarHBondContact O-CB 3.38Å; K104-L108 PolarHBondContact O-N 3.47Å; K105-L108 PolarHBondContact O-N 2.88Å; I106-L108 VanDerWaalsContact C-N 3.35Å; I106-L108 PolarHBondContact O-N 2.9Å; L108-T111 WeakPolarHBondContact O-CB 3.4Å; L108-T111 PolarHBondContact O-N 2.67Å; L108-K112 PolarHBondContact O-N 3.12Å; L108-F365 HydrophobicContact CD1-CE1 3.69Å; L108-F365 HydrophobicContact CG-CE1 4.1Å; L108-Y368 HydrophobicContact CD2-CD1 4.33Å; L108-Y368 HydrophobicContact CD2-CE1 3.77Å
109	Y	87.4	Confident	81.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-41.8	178.5	-171.4	-106.5	0	0	0	112.9	K105 I106 N107 T111 K112 I113 A452 K455 L456 Y459	K105-Y109 VanDerWaalsContact O-CB 3.27Å; K105-Y109 WeakPolarHBondContact O-CB 3.11Å; K105-Y109 PolarHBondContact O-N 3.16Å; I106-Y109 WeakPolarHBondContact O-CB 3.33Å; I106-Y109 PolarHBondContact O-N 3.42Å; I106-Y109 VanDerWaalsContact O-N 3.15Å; N107-Y109 VanDerWaalsContact C-N 3.31Å; N107-Y109 PolarHBondContact O-N 3.26Å; Y109-T111 VanDerWaalsContact C-N 3.3Å; Y109-T111 PolarHBondContact O-N 3.42Å; Y109-K112 HydrophobicContact CD2-CD 4.24Å; Y109-K112 HydrophobicContact CE2-CD 4.15Å; Y109-K112 WeakPolarHBondContact O-CB 3.43Å; Y109-K112 PolarHBondContact O-N 3.15Å; Y109-I113 HydrophobicContact CD1-CD1 3.84Å; Y109-I113 HydrophobicContact CD1-CG1 4.39Å; Y109-I113 HydrophobicContact CE1-CD1 3.3Å; Y109-I113 HydrophobicContact CE1-CG1 3.96Å; Y109-I113 PolarHBondContact O-N 2.9Å; Y109-A452 WeakPolarHBondContact OH-CA 3.42Å; Y109-A452 PolarHBondContact OH-O 3.36Å; Y109-K455 HydrophobicContact CE1-CG 4.44Å; Y109-K455 HydrophobicContact CE2-CD 3.69Å; Y109-K455 HydrophobicContact CE2-CG 4.17Å; Y109-K455 VanDerWaalsContact OH-CB 3.29Å; Y109-K455 WeakPolarHBondContact OH-CB 3.37Å; Y109-K455 WeakPolarHBondContact OH-CD 3.46Å; Y109-K455 WeakPolarHBondContact OH-CG 3.48Å; Y109-L456 HydrophobicContact CD1-CD1 4.26Å; Y109-L456 HydrophobicContact CE1-CD1 4.22Å; Y109-Y459 AromaticContact CD1-CD2 3.6Å; Y109-Y459 HydrophobicContact CD1-CD2 3.6Å; Y109-Y459 AromaticContact CD1-CE2 3.33Å; Y109-Y459 HydrophobicContact CD1-CE2 3.33Å; Y109-Y459 AromaticContact CD2-CE2 3.77Å; Y109-Y459 HydrophobicContact CD2-CE2 3.77Å; Y109-Y459 AromaticContact CE1-CD2 3.83Å; Y109-Y459 HydrophobicContact CE1-CD2 3.83Å; Y109-Y459 AromaticContact CE1-CE2 3.56Å; Y109-Y459 HydrophobicContact CE1-CE2 3.56Å; Y109-Y459 HydrophobicContact CE2-CE2 4.01Å; Y109-Y459 HydrophobicContact CG-CD2 4.13Å; Y109-Y459 AromaticContact CG-CE2 3.44Å; Y109-Y459 HydrophobicContact CG-CE2 3.44Å; Y109-Y459 VanDerWaalsContact CG-CE2 3.44Å; Y109-Y459 AromaticContact CG-CZ 3.91Å; Y109-Y459 AromaticContact CZ-CE2 3.93Å
110	L	88.5	Confident	83	Confident	77 Å²	77	48.4 Å²	48.4	40%	0.403	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-39.1	173.1	-71	174.9	0	0	0	111.2	I106 N107 K112 I113 Y114 L456	I106-L110 HydrophobicContact CG2-CD1 4Å; I106-L110 HydrophobicContact CG2-CG 4.29Å; I106-L110 WeakPolarHBondContact O-CG 3.45Å; I106-L110 PolarHBondContact O-N 3.19Å; N107-L110 PolarHBondContact O-N 2.86Å; L110-K112 VanDerWaalsContact C-N 3.33Å; L110-K112 PolarHBondContact O-N 2.99Å; L110-I113 PolarHBondContact O-N 3.33Å; L110-Y114 WeakPolarHBondContact O-CB 3.32Å; L110-Y114 PolarHBondContact O-N 3.14Å; L110-L456 HydrophobicContact CD2-CD1 4.12Å
111	T	89.5	Confident	84.3	Confident	74 Å²	74	50.8 Å²	50.8	45%	0.454	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-40.4	173.7	-53.6	0	0	0	0	111.1	N107 L108 Y109 Y114 N115 F365	N107-T111 WeakPolarHBondContact O-CB 3.48Å; N107-T111 PolarHBondContact O-N 3.2Å; N107-T111 PolarHBondContact O-OG1 3.08Å; L108-T111 WeakPolarHBondContact O-CB 3.4Å; L108-T111 PolarHBondContact O-N 2.67Å; Y109-T111 VanDerWaalsContact C-N 3.3Å; Y109-T111 PolarHBondContact O-N 3.42Å; T111-Y114 PolarHBondContact O-N 3.15Å; T111-N115 WeakPolarHBondContact O-CB 3.23Å; T111-N115 PolarHBondContact O-N 2.88Å; T111-F365 HydrophobicContact CG2-CZ 4.11Å
112	K	90.3	Very high	85.3	Confident	12 Å²	12	49.8 Å²	49.8	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-47.1	173.1	-175.4	-151	-171.6	164	0	111.5	L108 Y109 L110 Y114 N115 L116 F365 Y369	L108-K112 PolarHBondContact O-N 3.12Å; Y109-K112 HydrophobicContact CD2-CD 4.24Å; Y109-K112 HydrophobicContact CE2-CD 4.15Å; Y109-K112 WeakPolarHBondContact O-CB 3.43Å; Y109-K112 PolarHBondContact O-N 3.15Å; L110-K112 VanDerWaalsContact C-N 3.33Å; L110-K112 PolarHBondContact O-N 2.99Å; K112-Y114 VanDerWaalsContact C-N 3.34Å; K112-N115 PolarHBondContact O-N 3.4Å; K112-L116 WeakPolarHBondContact O-CB 3.32Å; K112-L116 PolarHBondContact O-N 3.39Å; K112-F365 HydrophobicContact CG-CG 4.46Å; K112-Y369 HydrophobicContact CD-CD2 4.36Å; K112-Y369 HydrophobicContact CD-CE2 3.41Å; K112-Y369 VanDerWaalsContact CD-CE2 3.41Å; K112-Y369 VanDerWaalsContact CE-CE2 3.4Å; K112-Y369 HydrophobicContact CG-CE2 4.1Å
113	I	91.2	Very high	85.9	Confident	9 Å²	9	49.8 Å²	49.8	5%	0.046	25%	0.249	C	C	.	.	H	α-helix	trans	-59.1	-48.2	176.7	-74.6	177.2	0	0	0	109.8	Y109 L110 N115 L116 L117 A452 W453 L456	Y109-I113 HydrophobicContact CD1-CD1 3.84Å; Y109-I113 HydrophobicContact CD1-CG1 4.39Å; Y109-I113 HydrophobicContact CE1-CD1 3.3Å; Y109-I113 HydrophobicContact CE1-CG1 3.96Å; Y109-I113 PolarHBondContact O-N 2.9Å; L110-I113 PolarHBondContact O-N 3.33Å; I113-N115 VanDerWaalsContact C-N 3.33Å; I113-N115 PolarHBondContact O-N 2.97Å; I113-L116 PolarHBondContact O-N 2.8Å; I113-L117 HydrophobicContact CG2-CD1 3.73Å; I113-L117 HydrophobicContact CG2-CG 4.19Å; I113-L117 VanDerWaalsContact O-CG 3.23Å; I113-L117 WeakPolarHBondContact O-CG 3.42Å; I113-L117 PolarHBondContact O-N 3.36Å; I113-A452 HydrophobicContact CG1-CB 4.38Å; I113-W453 HydrophobicContact CG2-CZ2 4.27Å; I113-L456 HydrophobicContact CD1-CD1 4.4Å
114	Y	91.9	Very high	86.4	Confident	144 Å²	144	51.9 Å²	51.9	57%	0.565	25%	0.252	S	S	*	.	H	α-helix	trans	-56.9	-47.2	177.5	177.5	-99.8	0	0	0	111.7	L110 T111 K112 L116 L117 V118	L110-Y114 WeakPolarHBondContact O-CB 3.32Å; L110-Y114 PolarHBondContact O-N 3.14Å; T111-Y114 PolarHBondContact O-N 3.15Å; K112-Y114 VanDerWaalsContact C-N 3.34Å; Y114-L116 PolarHBondContact O-N 2.85Å; Y114-L117 WeakPolarHBondContact O-CB 3.37Å; Y114-L117 PolarHBondContact O-N 3.21Å; Y114-V118 HydrophobicContact CD1-CG2 4.45Å; Y114-V118 HydrophobicContact CE1-CG2 4.01Å; Y114-V118 HydrophobicContact CE2-CG2 4.38Å; Y114-V118 WeakPolarHBondContact O-CG2 3.49Å; Y114-V118 PolarHBondContact O-N 3.46Å
115	N	92.1	Very high	86.8	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-45.5	176.9	-170.3	7.1	0	0	0	112	T111 K112 I113 L117 V118 I119 C358 A361 F362	T111-N115 WeakPolarHBondContact O-CB 3.23Å; T111-N115 PolarHBondContact O-N 2.88Å; K112-N115 PolarHBondContact O-N 3.4Å; I113-N115 VanDerWaalsContact C-N 3.33Å; I113-N115 PolarHBondContact O-N 2.97Å; N115-L117 VanDerWaalsContact C-N 3.29Å; N115-L117 PolarHBondContact O-N 3.4Å; N115-V118 PolarHBondContact O-N 3.22Å; N115-V118 VanDerWaalsContact O-N 3.15Å; N115-I119 WeakPolarHBondContact O-CG1 3.41Å; N115-I119 PolarHBondContact O-N 2.96Å; N115-C358 PolarHBondContact ND2-O 3.39Å; N115-C358 WeakPolarHBondContact OD1-CA 3.44Å; N115-C358 WeakPolarHBondContact OD1-CB 3.07Å; N115-C358 PolarHBondContact OD1-O 3.02Å; N115-C358 VanDerWaalsContact OD1-O 3.12Å; N115-C358 PolarHBondContact OD1-SG 3.49Å; N115-A361 WeakPolarHBondContact ND2-CB 3.43Å; N115-F362 PolarHBondContact ND2-N 2.92Å
116	L	91.7	Very high	87.2	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-38	176.9	-176.4	66.3	0	0	0	111.9	K112 I113 Y114 I119 A120 F362 T448 V449 A452	K112-L116 WeakPolarHBondContact O-CB 3.32Å; K112-L116 PolarHBondContact O-N 3.39Å; I113-L116 PolarHBondContact O-N 2.8Å; Y114-L116 PolarHBondContact O-N 2.85Å; L116-I119 PolarHBondContact O-N 2.82Å; L116-A120 VanDerWaalsContact O-CB 3.24Å; L116-A120 WeakPolarHBondContact O-CB 3.46Å; L116-A120 PolarHBondContact O-N 3.09Å; L116-F362 HydrophobicContact CD1-CE2 3.85Å; L116-F362 HydrophobicContact CD1-CZ 4Å; L116-T448 HydrophobicContact CD1-CG2 4.29Å; L116-T448 HydrophobicContact CD2-CG2 4Å; L116-V449 HydrophobicContact CD1-CG2 4.39Å; L116-V449 HydrophobicContact CD2-CB 4.38Å; L116-V449 HydrophobicContact CD2-CG2 3.79Å; L116-V449 HydrophobicContact CG-CG2 3.73Å; L116-A452 HydrophobicContact CD2-CB 3.95Å
117	L	92	Very high	87.4	Confident	42 Å²	42	52.3 Å²	52.3	22%	0.22	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-41.4	175	-69.1	167.7	0	0	0	111.4	I113 Y114 N115 A120 Y121 V449 W453	I113-L117 HydrophobicContact CG2-CD1 3.73Å; I113-L117 HydrophobicContact CG2-CG 4.19Å; I113-L117 VanDerWaalsContact O-CG 3.23Å; I113-L117 WeakPolarHBondContact O-CG 3.42Å; I113-L117 PolarHBondContact O-N 3.36Å; Y114-L117 WeakPolarHBondContact O-CB 3.37Å; Y114-L117 PolarHBondContact O-N 3.21Å; N115-L117 VanDerWaalsContact C-N 3.29Å; N115-L117 PolarHBondContact O-N 3.4Å; L117-A120 PolarHBondContact O-N 3.46Å; L117-Y121 HydrophobicContact CB-CD2 4.34Å; L117-Y121 HydrophobicContact CD2-CD2 4.2Å; L117-Y121 HydrophobicContact CD2-CE2 3.73Å; L117-Y121 WeakPolarHBondContact O-CB 3.16Å; L117-Y121 VanDerWaalsContact O-CD2 3.31Å; L117-Y121 WeakPolarHBondContact O-CD2 3.32Å; L117-Y121 PolarHBondContact O-N 2.88Å; L117-V449 HydrophobicContact CD2-CG1 4.07Å; L117-W453 HydrophobicContact CD1-CZ2 4.35Å
118	V	91.2	Very high	87.8	Confident	19 Å²	19	49.4 Å²	49.4	12%	0.115	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-42.4	175.4	174.3	0	0	0	0	111.1	Y114 N115 G122 F354 V355 C358	Y114-V118 HydrophobicContact CD1-CG2 4.45Å; Y114-V118 HydrophobicContact CE1-CG2 4.01Å; Y114-V118 HydrophobicContact CE2-CG2 4.38Å; Y114-V118 WeakPolarHBondContact O-CG2 3.49Å; Y114-V118 PolarHBondContact O-N 3.46Å; N115-V118 PolarHBondContact O-N 3.22Å; N115-V118 VanDerWaalsContact O-N 3.15Å; V118-G122 WeakPolarHBondContact O-CA 3.44Å; V118-G122 PolarHBondContact O-N 3.48Å; V118-F354 HydrophobicContact CG1-CD1 4.31Å; V118-F354 HydrophobicContact CG1-CE1 3.83Å; V118-V355 HydrophobicContact CG1-CG2 4.47Å; V118-C358 HydrophobicContact CG1-CB 4.24Å
119	I	89	Confident	88.2	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-67	-41	177.2	-66	168.9	0	0	0	111.2	N115 L116 P123 C358 E359 F362 I445	N115-I119 WeakPolarHBondContact O-CG1 3.41Å; N115-I119 PolarHBondContact O-N 2.96Å; L116-I119 PolarHBondContact O-N 2.82Å; I119-P123 WeakPolarHBondContact O-CD 3.4Å; I119-C358 HydrophobicContact CG1-CB 4.08Å; I119-E359 HydrophobicContact CD1-CG 4.24Å; I119-E359 HydrophobicContact CG1-CG 4.15Å; I119-F362 HydrophobicContact CD1-CB 3.46Å; I119-F362 VanDerWaalsContact CD1-CB 3.46Å; I119-F362 HydrophobicContact CD1-CD1 4.23Å; I119-F362 HydrophobicContact CD1-CD2 4.34Å; I119-F362 HydrophobicContact CD1-CG 3.78Å; I119-I445 HydrophobicContact CG2-CD1 4.26Å
120	A	88.7	Confident	88.4	Confident	10 Å²	10	59.2 Å²	59.2	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-56	179.3	0	0	0	0	0	110.7	L116 L117 F124 I445 V449	L116-A120 VanDerWaalsContact O-CB 3.24Å; L116-A120 WeakPolarHBondContact O-CB 3.46Å; L116-A120 PolarHBondContact O-N 3.09Å; L117-A120 PolarHBondContact O-N 3.46Å; A120-F124 WeakPolarHBondContact O-CD2 3.32Å; A120-F124 WeakPolarHBondContact O-CE2 3.23Å; A120-I445 HydrophobicContact CB-CG2 3.6Å; A120-V449 HydrophobicContact CB-CG2 3.85Å
121	Y	88.3	Confident	88.5	Confident	160 Å²	160	55.9 Å²	55.9	63%	0.627	28%	0.28	S	S	*	.	H	α-helix	trans	-80.6	-25.7	-174.9	-71.6	-71.4	0	0	0	114.4	L117 F124	L117-Y121 HydrophobicContact CB-CD2 4.34Å; L117-Y121 HydrophobicContact CD2-CD2 4.2Å; L117-Y121 HydrophobicContact CD2-CE2 3.73Å; L117-Y121 WeakPolarHBondContact O-CB 3.16Å; L117-Y121 VanDerWaalsContact O-CD2 3.31Å; L117-Y121 WeakPolarHBondContact O-CD2 3.32Å; L117-Y121 PolarHBondContact O-N 2.88Å; Y121-F124 PolarHBondContact O-N 3.37Å
122	G	83.6	Confident	88.7	Confident	17 Å²	17	53.9 Å²	53.9	18%	0.175	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-45.2	-173.7	0	0	0	0	0	114.6	V118	V118-G122 WeakPolarHBondContact O-CA 3.44Å; V118-G122 PolarHBondContact O-N 3.48Å
123	P	79.1	Confident	88.8	Confident	38 Å²	38	55.4 Å²	55.4	25%	0.247	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.9	177.2	-20.4	34.3	0	0	0	115	I119	I119-P123 WeakPolarHBondContact O-CD 3.4Å
124	F	80	Confident	88.9	Confident	107 Å²	107	58 Å²	58	47%	0.469	30%	0.298	S	S	.	.			trans	-83.8	130.8	-175	-68.8	-70.2	0	0	0	111.3	A120 Y121 N442	A120-F124 WeakPolarHBondContact O-CD2 3.32Å; A120-F124 WeakPolarHBondContact O-CE2 3.23Å; Y121-F124 PolarHBondContact O-N 3.37Å; F124-N442 HydrophobicContact CZ-CB 4.28Å
125	N	80.7	Confident	88.9	Confident	78 Å²	78	51.1 Å²	51.1	42%	0.417	27%	0.271	S	S	.	.			trans	-128	139.8	173.4	-173.6	-18	0	0	0	108.9	N127 T128	N125-N127 PolarHBondContact ND2-ND2 2.89Å; N125-N127 PolarHBondContact O-N 3.39Å; N125-N127 PolarHBondContact OD1-N 2.75Å; N125-T128 WeakPolarHBondContact O-CB 3.08Å; N125-T128 PolarHBondContact O-N 3.13Å; N125-T128 PolarHBondContact O-OG1 2.83Å
126	S	86.7	Confident	89	Confident	90 Å²	90	53.3 Å²	53.3	63%	0.629	28%	0.283	S	S	*	.	H	α-helix	trans	-55.2	-30.7	173.3	53.2	0	0	0	0	112.5	T128 Y129 L130	S126-T128 PolarHBondContact O-N 3.28Å; S126-T128 VanDerWaalsContact O-N 3.16Å; S126-Y129 WeakPolarHBondContact O-CB 3.33Å; S126-Y129 PolarHBondContact O-N 2.76Å; S126-Y129 VanDerWaalsContact O-N 3.09Å; S126-L130 PolarHBondContact O-N 2.77Å
127	N	86.9	Confident	89	Confident	57 Å²	57	56.1 Å²	56.1	31%	0.305	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-25.9	174.2	-70.2	-14.4	0	0	0	113.7	N125 Y129 L130 L131 M315	N125-N127 PolarHBondContact ND2-ND2 2.89Å; N125-N127 PolarHBondContact O-N 3.39Å; N125-N127 PolarHBondContact OD1-N 2.75Å; N127-Y129 VanDerWaalsContact C-N 3.3Å; N127-Y129 PolarHBondContact O-N 3.08Å; N127-L130 PolarHBondContact O-N 3.28Å; N127-L131 PolarHBondContact O-N 3.35Å; N127-M315 HydrophobicContact CB-SD 3.7Å
128	T	90.5	Very high	88.9	Confident	26 Å²	26	55.3 Å²	55.3	16%	0.16	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-41.3	176.4	-45.4	0	0	0	0	110.9	N125 S126 T132 S341	N125-T128 WeakPolarHBondContact O-CB 3.08Å; N125-T128 PolarHBondContact O-N 3.13Å; N125-T128 PolarHBondContact O-OG1 2.83Å; S126-T128 PolarHBondContact O-N 3.28Å; S126-T128 VanDerWaalsContact O-N 3.16Å; T128-T132 WeakPolarHBondContact O-CB 3.15Å; T128-T132 PolarHBondContact O-N 2.87Å; T128-T132 VanDerWaalsContact O-N 3.11Å; T128-T132 PolarHBondContact O-OG1 2.89Å; T128-S341 VanDerWaalsContact CG2-O 3.27Å; T128-S341 WeakPolarHBondContact CG2-O 3.41Å
129	Y	92.6	Very high	89	Confident	165 Å²	165	54.5 Å²	54.5	65%	0.647	29%	0.291	S	S	*	.	H	α-helix	trans	-67.1	-44.1	176	169.5	-100.6	0	0	0	111.4	S126 N127 L131 T132 S133	S126-Y129 WeakPolarHBondContact O-CB 3.33Å; S126-Y129 PolarHBondContact O-N 2.76Å; S126-Y129 VanDerWaalsContact O-N 3.09Å; N127-Y129 VanDerWaalsContact C-N 3.3Å; N127-Y129 PolarHBondContact O-N 3.08Å; Y129-L131 VanDerWaalsContact C-N 3.34Å; Y129-L131 PolarHBondContact O-N 2.83Å; Y129-T132 PolarHBondContact O-N 2.95Å; Y129-S133 VanDerWaalsContact O-CB 3.3Å; Y129-S133 WeakPolarHBondContact O-CB 3.12Å; Y129-S133 PolarHBondContact O-N 2.78Å
130	L	91.8	Very high	89.2	Confident	98 Å²	98	55 Å²	55	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-59.1	-45.7	178.8	-64.2	177.5	0	0	0	111.2	S126 N127 S133 S134	S126-L130 PolarHBondContact O-N 2.77Å; N127-L130 PolarHBondContact O-N 3.28Å; L130-S133 PolarHBondContact O-N 2.86Å; L130-S134 WeakPolarHBondContact O-CB 3.14Å; L130-S134 PolarHBondContact O-N 2.76Å; L130-S134 PolarHBondContact O-OG 2.85Å
131	L	91.8	Very high	89.3	Confident	8 Å²	8	60.1 Å²	60.1	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-48.2	176.7	-177.7	59.8	0	0	0	112.1	N127 Y129 S133 S134 M135 N195 M315 L317	N127-L131 PolarHBondContact O-N 3.35Å; Y129-L131 VanDerWaalsContact C-N 3.34Å; Y129-L131 PolarHBondContact O-N 2.83Å; L131-S133 VanDerWaalsContact C-N 3.35Å; L131-S133 PolarHBondContact O-N 2.9Å; L131-S134 PolarHBondContact O-N 3.28Å; L131-M135 HydrophobicContact CD1-CE 4.15Å; L131-M135 HydrophobicContact CD1-CG 4.27Å; L131-M135 WeakPolarHBondContact O-CB 3.49Å; L131-M135 WeakPolarHBondContact O-CG 3.46Å; L131-M135 PolarHBondContact O-N 2.89Å; L131-N195 WeakPolarHBondContact CD1-OD1 3.39Å; L131-M315 HydrophobicContact CB-CE 4Å; L131-M315 HydrophobicContact CD1-CE 4.06Å; L131-M315 HydrophobicContact CD2-CE 3.98Å; L131-M315 HydrophobicContact CG-CE 4.23Å; L131-L317 HydrophobicContact CD2-CB 3.83Å; L131-L317 HydrophobicContact CD2-CD1 4.15Å
132	T	93.3	Very high	89.4	Confident	32 Å²	32	53.6 Å²	53.6	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-44.7	178.7	-63.4	0	0	0	0	111.7	T128 Y129 M135 N136 F339 S341	T128-T132 WeakPolarHBondContact O-CB 3.15Å; T128-T132 PolarHBondContact O-N 2.87Å; T128-T132 VanDerWaalsContact O-N 3.11Å; T128-T132 PolarHBondContact O-OG1 2.89Å; Y129-T132 PolarHBondContact O-N 2.95Å; T132-M135 PolarHBondContact O-N 3.42Å; T132-N136 VanDerWaalsContact O-CB 3.32Å; T132-N136 WeakPolarHBondContact O-CB 3.46Å; T132-N136 PolarHBondContact O-N 3.41Å; T132-F339 HydrophobicContact CG2-CB 3.75Å; T132-F339 WeakPolarHBondContact CG2-O 3.33Å; T132-S341 VanDerWaalsContact OG1-CB 3.24Å; T132-S341 WeakPolarHBondContact OG1-CB 3.45Å; T132-S341 PolarHBondContact OG1-OG 3.22Å
133	S	92.9	Very high	89.6	Confident	44 Å²	44	58.5 Å²	58.5	31%	0.308	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-45.8	179.2	-174.4	0	0	0	0	111.5	Y129 L130 L131 M135 N136 T137	Y129-S133 VanDerWaalsContact O-CB 3.3Å; Y129-S133 WeakPolarHBondContact O-CB 3.12Å; Y129-S133 PolarHBondContact O-N 2.78Å; L130-S133 PolarHBondContact O-N 2.86Å; L131-S133 VanDerWaalsContact C-N 3.35Å; L131-S133 PolarHBondContact O-N 2.9Å; S133-M135 PolarHBondContact O-N 3Å; S133-N136 PolarHBondContact O-N 3.11Å; S133-T137 PolarHBondContact O-N 2.94Å; S133-T137 PolarHBondContact O-OG1 2.81Å
134	S	91.5	Very high	90	Very high	62 Å²	62	57.9 Å²	57.9	43%	0.434	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-42.4	175.8	-64.6	0	0	0	0	112.5	L130 L131 M138	L130-S134 WeakPolarHBondContact O-CB 3.14Å; L130-S134 PolarHBondContact O-N 2.76Å; L130-S134 PolarHBondContact O-OG 2.85Å; L131-S134 PolarHBondContact O-N 3.28Å; S134-M138 WeakPolarHBondContact O-CB 3.4Å; S134-M138 PolarHBondContact O-N 3.45Å
135	M	92.4	Very high	90	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-42.2	175.8	-73.9	-65.1	-175.7	0	0	111.9	L131 T132 S133 M138 F139 N195 T310 F339	L131-M135 HydrophobicContact CD1-CE 4.15Å; L131-M135 HydrophobicContact CD1-CG 4.27Å; L131-M135 WeakPolarHBondContact O-CB 3.49Å; L131-M135 WeakPolarHBondContact O-CG 3.46Å; L131-M135 PolarHBondContact O-N 2.89Å; T132-M135 PolarHBondContact O-N 3.42Å; S133-M135 PolarHBondContact O-N 3Å; M135-M138 PolarHBondContact O-N 2.71Å; M135-F139 WeakPolarHBondContact O-CD2 3.16Å; M135-F139 PolarHBondContact O-N 2.71Å; M135-F139 VanDerWaalsContact O-N 3.12Å; M135-F139 HydrophobicContact SD-CE2 4.21Å; M135-N195 HydrophobicContact CE-CB 3.66Å; M135-N195 VanDerWaalsContact CE-CG 3.41Å; M135-T310 HydrophobicContact CE-CG2 4.34Å; M135-F339 HydrophobicContact CB-CD1 3.8Å; M135-F339 HydrophobicContact CB-CE1 4.16Å; M135-F339 WeakPolarHBondContact O-CE1 3.29Å
136	N	94.2	Very high	89.9	Confident	55 Å²	55	62.7 Å²	62.7	29%	0.294	34%	0.343	S	S	.	.	H	α-helix	trans	-59.7	-55.1	177.2	-177.3	-31.4	0	0	0	111.1	T132 S133 M138 F139 L140 F339	T132-N136 VanDerWaalsContact O-CB 3.32Å; T132-N136 WeakPolarHBondContact O-CB 3.46Å; T132-N136 PolarHBondContact O-N 3.41Å; S133-N136 PolarHBondContact O-N 3.11Å; N136-M138 VanDerWaalsContact C-N 3.29Å; N136-M138 PolarHBondContact O-N 3.27Å; N136-F139 PolarHBondContact O-N 2.77Å; N136-L140 WeakPolarHBondContact O-CB 3.17Å; N136-L140 WeakPolarHBondContact O-CG 3.41Å; N136-L140 PolarHBondContact O-N 2.93Å; N136-L140 WeakPolarHBondContact OD1-CD1 3.42Å; N136-L140 WeakPolarHBondContact OD1-CG 3.44Å; N136-F339 HydrophobicContact CB-CD2 3.85Å; N136-F339 HydrophobicContact CB-CE2 3.91Å; N136-F339 HydrophobicContact CB-CG 4.2Å; N136-F339 HydrophobicContact CB-CZ 4.31Å
137	T	92.4	Very high	89.6	Confident	65 Å²	65	59.9 Å²	59.9	40%	0.399	33%	0.329	S	S	.	.	H	α-helix	trans	-57.4	-42.6	177.6	-70.3	0	0	0	0	111.9	S133 F139 Q141	S133-T137 PolarHBondContact O-N 2.94Å; S133-T137 PolarHBondContact O-OG1 2.81Å; T137-F139 PolarHBondContact O-N 2.71Å; T137-Q141 WeakPolarHBondContact O-CB 3.47Å; T137-Q141 PolarHBondContact O-N 3.46Å; T137-Q141 VanDerWaalsContact O-N 3.12Å
138	M	90.3	Very high	89.5	Confident	25 Å²	25	62.4 Å²	62.4	12%	0.123	35%	0.346	C	S	.	.	H	α-helix	trans	-63.4	-37.5	-177.8	-175.6	-107.7	-149.8	0	0	113.1	S134 M135 N136 A142 N171 L191 L192	S134-M138 WeakPolarHBondContact O-CB 3.4Å; S134-M138 PolarHBondContact O-N 3.45Å; M135-M138 PolarHBondContact O-N 2.71Å; N136-M138 VanDerWaalsContact C-N 3.29Å; N136-M138 PolarHBondContact O-N 3.27Å; M138-A142 WeakPolarHBondContact O-CB 3.13Å; M138-N171 HydrophobicContact CE-CB 3.41Å; M138-N171 VanDerWaalsContact CE-CB 3.41Å; M138-N171 PolarHBondContact O-ND2 2.98Å; M138-N171 HydrophobicContact SD-CB 3.71Å; M138-L191 HydrophobicContact CE-CB 4.2Å; M138-L191 HydrophobicContact CE-CD2 4.14Å; M138-L191 HydrophobicContact CE-CG 4.37Å; M138-L192 HydrophobicContact CE-CG 4.29Å; M138-L192 HydrophobicContact CG-CD2 4.35Å
139	F	92.6	Very high	89.4	Confident	2 Å²	2	64 Å²	64	1%	0.009	35%	0.354	C	S	.	.	H	α-helix	trans	-94	-36.7	-179.9	-77.1	-77.3	0	0	0	114.2	M135 N136 T137 I168 N171 W172 L191 F308 I323 F339	M135-F139 WeakPolarHBondContact O-CD2 3.16Å; M135-F139 PolarHBondContact O-N 2.71Å; M135-F139 VanDerWaalsContact O-N 3.12Å; M135-F139 HydrophobicContact SD-CE2 4.21Å; N136-F139 PolarHBondContact O-N 2.77Å; T137-F139 PolarHBondContact O-N 2.71Å; F139-I168 HydrophobicContact CD1-CG1 4.42Å; F139-I168 HydrophobicContact CD1-CG2 4.22Å; F139-I168 HydrophobicContact CE1-CG2 4.18Å; F139-N171 HydrophobicContact CE1-CB 3.96Å; F139-N171 HydrophobicContact CZ-CB 4.23Å; F139-W172 AromaticContact CE1-CD1 3.73Å; F139-W172 HydrophobicContact CE1-CG 4.49Å; F139-W172 AromaticContact CE1-NE1 3.39Å; F139-W172 AromaticContact CZ-CD1 3.59Å; F139-W172 AromaticContact CZ-NE1 3.48Å; F139-L191 HydrophobicContact CE2-CD2 3.72Å; F139-L191 HydrophobicContact CZ-CD2 3.51Å; F139-F308 HydrophobicContact CD1-CZ 4.28Å; F139-F308 AromaticContact CD2-CZ 3.77Å; F139-F308 HydrophobicContact CD2-CZ 3.77Å; F139-F308 HydrophobicContact CE1-CE1 4.25Å; F139-F308 AromaticContact CE1-CZ 3.86Å; F139-F308 HydrophobicContact CE1-CZ 3.86Å; F139-F308 HydrophobicContact CE2-CE1 4.37Å; F139-F308 AromaticContact CE2-CE2 3.7Å; F139-F308 HydrophobicContact CE2-CE2 3.7Å; F139-F308 AromaticContact CE2-CZ 3.28Å; F139-F308 HydrophobicContact CE2-CZ 3.28Å; F139-F308 HydrophobicContact CG-CZ 4.24Å; F139-F308 HydrophobicContact CZ-CE1 4.14Å; F139-F308 AromaticContact CZ-CE2 3.75Å; F139-F308 HydrophobicContact CZ-CE2 3.75Å; F139-F308 AromaticContact CZ-CZ 3.34Å; F139-F308 HydrophobicContact CZ-CZ 3.34Å; F139-I323 HydrophobicContact CB-CD1 4.12Å; F139-F339 HydrophobicContact CB-CE1 4.36Å; F139-F339 HydrophobicContact CB-CZ 4.19Å; F139-F339 HydrophobicContact CD2-CE1 4.3Å
140	L	93	Very high	89.3	Confident	16 Å²	16	56.5 Å²	56.5	8%	0.084	33%	0.325	C	S	.	.	H	α-helix	trans	-84.4	-33.9	-174.3	-59.2	-162.5	0	0	0	113.5	N136 S150 L151 S152 L335 S337 F339	N136-L140 WeakPolarHBondContact O-CB 3.17Å; N136-L140 WeakPolarHBondContact O-CG 3.41Å; N136-L140 PolarHBondContact O-N 2.93Å; N136-L140 WeakPolarHBondContact OD1-CD1 3.42Å; N136-L140 WeakPolarHBondContact OD1-CG 3.44Å; L140-S150 WeakPolarHBondContact O-CB 2.94Å; L140-L151 HydrophobicContact CD2-CD2 3.66Å; L140-L151 HydrophobicContact CD2-CG 4.38Å; L140-L151 PolarHBondContact O-N 3.48Å; L140-S152 PolarHBondContact O-N 3.34Å; L140-S152 VanDerWaalsContact O-N 3.11Å; L140-L335 HydrophobicContact CD2-CD2 4.23Å; L140-S337 WeakPolarHBondContact CD1-OG 3.42Å; L140-F339 HydrophobicContact CD1-CE2 4.12Å; L140-F339 HydrophobicContact CD2-CE2 4.17Å; L140-F339 HydrophobicContact CD2-CZ 4.11Å; L140-F339 HydrophobicContact CG-CE2 4Å; L140-F339 HydrophobicContact CG-CZ 4.1Å
141	Q	91.5	Very high	89.2	Confident	117 Å²	117	51.9 Å²	51.9	55%	0.547	30%	0.301	S	S	.	.	S	Bend	trans	-104.5	-5.1	-173.6	-58.7	-179.8	-17.5	0	0	113.2	T137 Q143	T137-Q141 WeakPolarHBondContact O-CB 3.47Å; T137-Q141 PolarHBondContact O-N 3.46Å; T137-Q141 VanDerWaalsContact O-N 3.12Å; Q141-Q143 PolarHBondContact O-N 3.22Å
142	A	88.9	Confident	89.1	Confident	23 Å²	23	54.7 Å²	54.7	19%	0.19	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-63.6	131.7	175.6	0	0	0	0	0	111	M138 S150 P167	M138-A142 WeakPolarHBondContact O-CB 3.13Å; A142-S150 WeakPolarHBondContact O-CA 3.23Å; A142-P167 HydrophobicContact CB-CB 3.64Å
143	Q	89.3	Confident	88.8	Confident	120 Å²	120	56.9 Å²	56.9	56%	0.561	34%	0.335	S	S	*	.	B	Isolated β-bridge	trans	-95.9	148.7	-174.8	-66.7	179.4	-30.7	0	0	111.5	Q141 D149	Q141-Q143 PolarHBondContact O-N 3.22Å; Q143-D149 VanDerWaalsContact CA-O 3.31Å; Q143-D149 WeakPolarHBondContact CA-O 3.46Å
144	V	87.8	Confident	88.6	Confident	26 Å²	26	55.5 Å²	55.5	16%	0.158	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-66.5	143.8	171.6	-178.4	0	0	0	0	110.4	N146 G147 D149 V163 P167	V144-N146 PolarHBondContact O-N 2.47Å; V144-G147 PolarHBondContact O-N 2.92Å; V144-D149 HydrophobicContact CG2-CB 4.35Å; V144-D149 PolarHBondContact N-O 3.49Å; V144-V163 HydrophobicContact CG2-CB 4.46Å; V144-V163 HydrophobicContact CG2-CG2 3.74Å; V144-P167 HydrophobicContact CG2-CG 4.14Å
145	T	79.2	Confident	88.4	Confident	103 Å²	103	56.6 Å²	56.6	63%	0.632	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	120.5	175.1	49.6	0	0	0	0	110.4
146	N	79.4	Confident	88.4	Confident	182 Å²	182	58.7 Å²	58.7	97%	0.973	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	15.6	-175.9	-50.9	-29.9	0	0	0	116.4	V144	V144-N146 PolarHBondContact O-N 2.47Å
147	G	79.4	Confident	88.3	Confident	32 Å²	32	58.3 Å²	58.3	33%	0.33	35%	0.346	S	S	.	.	S	Bend	trans	-136.9	171.3	175.9	0	0	0	0	0	113	V144	V144-G147 PolarHBondContact O-N 2.92Å
148	T	85.1	Confident	88.3	Confident	109 Å²	109	61 Å²	61	67%	0.669	36%	0.358	S	S	*	.			trans	-97.9	-1.2	172.1	52.6	0	0	0	0	112.8
149	D	87.9	Confident	88.3	Confident	60 Å²	60	61.2 Å²	61.2	32%	0.321	36%	0.36	S	S	.	.			trans	-71.2	131.3	-175.2	-63.8	-29.1	0	0	0	110.8	Q143 V144 V159	Q143-D149 VanDerWaalsContact CA-O 3.31Å; Q143-D149 WeakPolarHBondContact CA-O 3.46Å; V144-D149 HydrophobicContact CG2-CB 4.35Å; V144-D149 PolarHBondContact N-O 3.49Å; D149-V159 HydrophobicContact CB-CG1 3.79Å
150	S	90.2	Very high	88.4	Confident	7 Å²	7	61.1 Å²	61.1	5%	0.049	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-128.3	168.6	174.1	68.5	0	0	0	0	109.1	L140 A142 S152 T153 A154	L140-S150 WeakPolarHBondContact O-CB 2.94Å; A142-S150 WeakPolarHBondContact O-CA 3.23Å; S150-S152 PolarHBondContact O-N 2.93Å; S150-S152 PolarHBondContact OG-OG 3.12Å; S150-T153 PolarHBondContact N-OG1 3.28Å; S150-T153 PolarHBondContact O-N 3.35Å; S150-T153 VanDerWaalsContact O-N 3.14Å; S150-T153 PolarHBondContact O-OG1 3.49Å; S150-T153 VanDerWaalsContact O-OG1 3.08Å; S150-T153 PolarHBondContact OG-N 3.35Å; S150-T153 PolarHBondContact OG-OG1 3.47Å; S150-A154 PolarHBondContact O-N 3.3Å; S150-A154 VanDerWaalsContact O-N 3.16Å
151	L	90.3	Very high	88.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-59.5	-37.8	176.2	-172.2	58.3	0	0	0	111.6	L140 T153 A154 L160 V163 I168 I323 L335	L140-L151 HydrophobicContact CD2-CD2 3.66Å; L140-L151 HydrophobicContact CD2-CG 4.38Å; L140-L151 PolarHBondContact O-N 3.48Å; L151-T153 PolarHBondContact O-N 3.32Å; L151-A154 WeakPolarHBondContact O-CB 3.19Å; L151-A154 PolarHBondContact O-N 3.05Å; L151-L160 HydrophobicContact CD1-CD1 3.74Å; L151-V163 HydrophobicContact CB-CG1 3.83Å; L151-V163 HydrophobicContact CD1-CG1 4.16Å; L151-I168 HydrophobicContact CD1-CD1 4.42Å; L151-I168 HydrophobicContact CD2-CD1 4Å; L151-I323 HydrophobicContact CD2-CD1 3.99Å; L151-I323 HydrophobicContact CD2-CG2 3.64Å; L151-L335 HydrophobicContact CD1-CD1 4.3Å; L151-L335 HydrophobicContact CD2-CD1 4.16Å; L151-L335 HydrophobicContact CG-CD1 3.93Å; L151-L335 HydrophobicContact CG-CD2 4.05Å
152	S	88.8	Confident	88.5	Confident	67 Å²	67	57.2 Å²	57.2	47%	0.469	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-65	-23.7	178.7	70	0	0	0	0	114.8	L140 S150	L140-S152 PolarHBondContact O-N 3.34Å; L140-S152 VanDerWaalsContact O-N 3.11Å; S150-S152 PolarHBondContact O-N 2.93Å; S150-S152 PolarHBondContact OG-OG 3.12Å
153	T	87.8	Confident	88.7	Confident	78 Å²	78	56.1 Å²	56.1	48%	0.479	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-103.9	-1.8	-179.3	58.5	0	0	0	0	112.7	S150 L151 S155	S150-T153 PolarHBondContact N-OG1 3.28Å; S150-T153 PolarHBondContact O-N 3.35Å; S150-T153 VanDerWaalsContact O-N 3.14Å; S150-T153 PolarHBondContact O-OG1 3.49Å; S150-T153 VanDerWaalsContact O-OG1 3.08Å; S150-T153 PolarHBondContact OG-N 3.35Å; S150-T153 PolarHBondContact OG-OG1 3.47Å; L151-T153 PolarHBondContact O-N 3.32Å; T153-S155 PolarHBondContact O-N 3.38Å
154	A	89	Confident	89	Confident	14 Å²	14	50.4 Å²	50.4	12%	0.116	31%	0.31	C	S	.	.			trans	-67.9	114.8	-176.7	0	0	0	0	0	110.8	S150 L151 V159	S150-A154 PolarHBondContact O-N 3.3Å; S150-A154 VanDerWaalsContact O-N 3.16Å; L151-A154 WeakPolarHBondContact O-CB 3.19Å; L151-A154 PolarHBondContact O-N 3.05Å; A154-V159 HydrophobicContact CB-CG1 4.12Å
155	S	87.9	Confident	89.2	Confident	86 Å²	86	52.5 Å²	52.5	60%	0.601	32%	0.318	S	S	*	.			trans	-112.3	-15.6	179.2	57.4	0	0	0	0	113.9	T153	T153-S155 PolarHBondContact O-N 3.38Å
156	S	91.5	Very high	89.8	Confident	43 Å²	43	48.1 Å²	48.1	30%	0.301	29%	0.293	S	S	.	.	S	Bend	trans	-125.7	156.5	179.7	69.7	0	0	0	0	111.7	D158 V159 L160 L333	S156-D158 VanDerWaalsContact C-N 3.29Å; S156-D158 PolarHBondContact O-N 3Å; S156-V159 PolarHBondContact O-N 3.4Å; S156-V159 WeakPolarHBondContact OG-CG2 3.2Å; S156-V159 PolarHBondContact OG-N 3.38Å; S156-L160 PolarHBondContact O-N 3.09Å; S156-L333 VanDerWaalsContact C-CD1 3.46Å; S156-L333 VanDerWaalsContact O-CD1 3.29Å; S156-L333 WeakPolarHBondContact O-CD1 3.36Å
157	L	92.4	Very high	90.4	Very high	48 Å²	48	39.9 Å²	39.9	25%	0.251	25%	0.25	S	C	.	.	H	α-helix	trans	-64.7	-31.9	179.7	-69.6	174	0	0	0	112.8	L160 W161 L297 L333	L157-L160 HydrophobicContact CD2-CD2 4.08Å; L157-L160 WeakPolarHBondContact O-CB 3.33Å; L157-L160 PolarHBondContact O-N 3.13Å; L157-W161 VanDerWaalsContact O-CD1 3.26Å; L157-W161 PolarHBondContact O-N 3.46Å; L157-L297 HydrophobicContact CD2-CB 4.41Å; L157-L297 HydrophobicContact CD2-CD1 4.41Å; L157-L333 HydrophobicContact CD2-CD2 3.93Å
158	D	91	Very high	91	Very high	122 Å²	122	38.4 Å²	38.4	65%	0.652	23%	0.234	S	C	*	.	H	α-helix	trans	-66.6	-44.2	178.6	-59.1	-41.7	0	0	0	111.4	S156 L160 W161 S162	S156-D158 VanDerWaalsContact C-N 3.29Å; S156-D158 PolarHBondContact O-N 3Å; D158-L160 VanDerWaalsContact C-N 3.32Å; D158-W161 PolarHBondContact O-N 2.7Å; D158-S162 PolarHBondContact O-N 2.77Å; D158-S162 VanDerWaalsContact O-N 3.13Å
159	V	91.6	Very high	91.3	Very high	28 Å²	28	33.5 Å²	33.5	17%	0.17	20%	0.204	C	C	.	.	H	α-helix	trans	-66.6	-37.4	174.7	176	0	0	0	0	110.5	D149 A154 S156 W161 S162 V163	D149-V159 HydrophobicContact CB-CG1 3.79Å; A154-V159 HydrophobicContact CB-CG1 4.12Å; S156-V159 PolarHBondContact O-N 3.4Å; S156-V159 WeakPolarHBondContact OG-CG2 3.2Å; S156-V159 PolarHBondContact OG-N 3.38Å; V159-W161 PolarHBondContact O-N 3.09Å; V159-S162 PolarHBondContact O-N 3.44Å; V159-S162 PolarHBondContact O-OG 3.25Å; V159-V163 HydrophobicContact CG1-CG2 4.4Å; V159-V163 VanDerWaalsContact O-CG2 3.25Å; V159-V163 WeakPolarHBondContact O-CG2 3.39Å; V159-V163 PolarHBondContact O-N 3.38Å
160	L	93.8	Very high	91.4	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-45.3	175.1	178.6	64.3	0	0	0	111.7	L151 S156 L157 D158 V163 I164 L297 L304 I325 L333	L151-L160 HydrophobicContact CD1-CD1 3.74Å; S156-L160 PolarHBondContact O-N 3.09Å; L157-L160 HydrophobicContact CD2-CD2 4.08Å; L157-L160 WeakPolarHBondContact O-CB 3.33Å; L157-L160 PolarHBondContact O-N 3.13Å; D158-L160 VanDerWaalsContact C-N 3.32Å; L160-V163 PolarHBondContact O-N 2.88Å; L160-I164 HydrophobicContact CD1-CD1 3.97Å; L160-I164 HydrophobicContact CD1-CG1 4.29Å; L160-I164 HydrophobicContact CG-CD1 3.82Å; L160-I164 HydrophobicContact CG-CG1 4.49Å; L160-I164 VanDerWaalsContact O-CG1 3.25Å; L160-I164 WeakPolarHBondContact O-CG1 3.43Å; L160-I164 PolarHBondContact O-N 3.44Å; L160-L297 HydrophobicContact CD2-CD1 4.16Å; L160-L304 HydrophobicContact CD2-CD2 4Å; L160-I325 HydrophobicContact CD1-CD1 4.36Å; L160-I325 HydrophobicContact CD1-CG1 4.09Å; L160-I325 HydrophobicContact CD2-CG2 4.11Å; L160-L333 HydrophobicContact CB-CD1 3.99Å; L160-L333 HydrophobicContact CD2-CD1 4.13Å
161	W	94.7	Very high	91.3	Very high	9 Å²	9	35.5 Å²	35.5	3%	0.034	21%	0.214	C	C	.	.	H	α-helix	trans	-64.6	-40.5	177.7	-84.5	115.9	0	0	0	113	L157 D158 V159 V163 I164 Q165 L288 L291 F292 W296 L297	L157-W161 VanDerWaalsContact O-CD1 3.26Å; L157-W161 PolarHBondContact O-N 3.46Å; D158-W161 PolarHBondContact O-N 2.7Å; V159-W161 PolarHBondContact O-N 3.09Å; W161-V163 VanDerWaalsContact C-N 3.29Å; W161-V163 PolarHBondContact O-N 3.13Å; W161-I164 PolarHBondContact O-N 2.77Å; W161-Q165 HydrophobicContact CE3-CG 4.39Å; W161-Q165 WeakPolarHBondContact O-CB 3.46Å; W161-Q165 WeakPolarHBondContact O-CG 3.48Å; W161-Q165 PolarHBondContact O-N 3.39Å; W161-L288 HydrophobicContact CZ3-CD2 4.3Å; W161-L291 HydrophobicContact CH2-CB 3.69Å; W161-L291 HydrophobicContact CZ2-CB 4.44Å; W161-L291 HydrophobicContact CZ3-CB 4.47Å; W161-F292 HydrophobicContact CB-CD2 3.83Å; W161-F292 HydrophobicContact CB-CE2 3.9Å; W161-F292 AromaticContact CD1-CD2 3.6Å; W161-F292 AromaticContact CD1-CE2 3.86Å; W161-F292 HydrophobicContact CD2-CB 4.32Å; W161-F292 AromaticContact CD2-CD2 3.68Å; W161-F292 HydrophobicContact CD2-CD2 3.68Å; W161-F292 HydrophobicContact CD2-CG 4.46Å; W161-F292 AromaticContact CE2-CD2 3.97Å; W161-F292 HydrophobicContact CE3-CB 4.26Å; W161-F292 HydrophobicContact CE3-CD2 4.31Å; W161-F292 AromaticContact CG-CD2 3.44Å; W161-F292 HydrophobicContact CG-CD2 3.44Å; W161-F292 VanDerWaalsContact CG-CD2 3.44Å; W161-F292 AromaticContact CG-CE2 3.85Å; W161-F292 HydrophobicContact CG-CE2 3.85Å; W161-F292 HydrophobicContact CZ3-CB 4.39Å; W161-F292 AromaticContact NE1-CD2 3.88Å; W161-W296 HydrophobicContact CH2-CE3 4.34Å; W161-W296 HydrophobicContact CZ2-CB 4.5Å; W161-W296 HydrophobicContact CZ2-CE3 4.42Å; W161-L297 HydrophobicContact CD2-CD1 4.48Å; W161-L297 HydrophobicContact CZ2-CB 4.34Å; W161-L297 HydrophobicContact CZ2-CD1 3.76Å; W161-L297 HydrophobicContact CZ2-CG 3.7Å
162	S	92.8	Very high	91.3	Very high	41 Å²	41	35.4 Å²	35.4	29%	0.287	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-36	176.7	72	0	0	0	0	112.1	D158 V159 G166	D158-S162 PolarHBondContact O-N 2.77Å; D158-S162 VanDerWaalsContact O-N 3.13Å; V159-S162 PolarHBondContact O-N 3.44Å; V159-S162 PolarHBondContact O-OG 3.25Å; S162-G166 WeakPolarHBondContact O-CA 3.31Å; S162-G166 PolarHBondContact O-N 3.24Å
163	V	93.6	Very high	91.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.9	-42.7	173.7	171.9	0	0	0	0	111.6	V144 L151 V159 L160 W161 P167 I168	V144-V163 HydrophobicContact CG2-CB 4.46Å; V144-V163 HydrophobicContact CG2-CG2 3.74Å; L151-V163 HydrophobicContact CB-CG1 3.83Å; L151-V163 HydrophobicContact CD1-CG1 4.16Å; V159-V163 HydrophobicContact CG1-CG2 4.4Å; V159-V163 VanDerWaalsContact O-CG2 3.25Å; V159-V163 WeakPolarHBondContact O-CG2 3.39Å; V159-V163 PolarHBondContact O-N 3.38Å; L160-V163 PolarHBondContact O-N 2.88Å; W161-V163 VanDerWaalsContact C-N 3.29Å; W161-V163 PolarHBondContact O-N 3.13Å; V163-P167 HydrophobicContact CB-CG 4.41Å; V163-P167 HydrophobicContact CG1-CG 4.02Å; V163-P167 WeakPolarHBondContact O-CD 3.34Å; V163-P167 VanDerWaalsContact O-CG 3.28Å; V163-P167 WeakPolarHBondContact O-CG 3.29Å; V163-I168 HydrophobicContact CG1-CD1 3.98Å; V163-I168 HydrophobicContact CG1-CG1 4.16Å; V163-I168 PolarHBondContact O-N 3.46Å; V163-I168 VanDerWaalsContact O-N 3.16Å
164	I	94.5	Very high	90.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-65.5	-48.1	178.8	-67.9	168	0	0	0	110.9	L160 W161 I168 M169 L203 L288 L304 I306	L160-I164 HydrophobicContact CD1-CD1 3.97Å; L160-I164 HydrophobicContact CD1-CG1 4.29Å; L160-I164 HydrophobicContact CG-CD1 3.82Å; L160-I164 HydrophobicContact CG-CG1 4.49Å; L160-I164 VanDerWaalsContact O-CG1 3.25Å; L160-I164 WeakPolarHBondContact O-CG1 3.43Å; L160-I164 PolarHBondContact O-N 3.44Å; W161-I164 PolarHBondContact O-N 2.77Å; I164-I168 HydrophobicContact CG1-CD1 4.17Å; I164-M169 WeakPolarHBondContact O-CB 3.48Å; I164-M169 PolarHBondContact O-N 2.94Å; I164-M169 VanDerWaalsContact O-N 3.14Å; I164-L203 HydrophobicContact CG2-CD2 4.41Å; I164-L288 HydrophobicContact CG2-CD1 3.74Å; I164-L288 HydrophobicContact CG2-CD2 4.37Å; I164-L304 HydrophobicContact CD1-CD2 3.76Å; I164-I306 HydrophobicContact CD1-CD1 4.16Å; I164-I306 HydrophobicContact CG1-CD1 4.08Å
165	Q	93.3	Very high	90.4	Very high	70 Å²	70	33.4 Å²	33.4	33%	0.327	20%	0.201	S	C	.	.	I	π-helix	trans	-74.7	-24.2	-178.3	-69	177.3	-7.5	0	0	113.3	W161 L288	W161-Q165 HydrophobicContact CE3-CG 4.39Å; W161-Q165 WeakPolarHBondContact O-CB 3.46Å; W161-Q165 WeakPolarHBondContact O-CG 3.48Å; W161-Q165 PolarHBondContact O-N 3.39Å; Q165-L288 HydrophobicContact CG-CB 4.3Å; Q165-L288 HydrophobicContact CG-CD1 4.04Å
166	G	91.3	Very high	90	Very high	11 Å²	11	32.1 Å²	32.1	11%	0.113	19%	0.19	C	C	.	.	I	π-helix	trans	-94.5	-101.6	177.8	0	0	0	0	0	112.3	S162 I168 M169 N170	S162-G166 WeakPolarHBondContact O-CA 3.31Å; S162-G166 PolarHBondContact O-N 3.24Å; G166-I168 PolarHBondContact O-N 3.36Å; G166-M169 PolarHBondContact O-N 3.08Å; G166-N170 WeakPolarHBondContact O-CB 3.2Å; G166-N170 PolarHBondContact O-N 3.04Å; G166-N170 PolarHBondContact O-ND2 2.96Å
167	P	91.6	Very high	89.5	Confident	10 Å²	10	34.8 Å²	34.8	7%	0.065	19%	0.193	C	C	.	.	I	π-helix	trans	-57.5	-42.2	-170	19.3	-31.3	0	0	0	114	A142 V144 V163 N171	A142-P167 HydrophobicContact CB-CB 3.64Å; V144-P167 HydrophobicContact CG2-CG 4.14Å; V163-P167 HydrophobicContact CB-CG 4.41Å; V163-P167 HydrophobicContact CG1-CG 4.02Å; V163-P167 WeakPolarHBondContact O-CD 3.34Å; V163-P167 VanDerWaalsContact O-CG 3.28Å; V163-P167 WeakPolarHBondContact O-CG 3.29Å; P167-N171 WeakPolarHBondContact O-CB 3.32Å; P167-N171 PolarHBondContact O-N 3.06Å; P167-N171 PolarHBondContact O-ND2 2.87Å
168	I	92.4	Very high	88.9	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.216	C	C	.	.	I	π-helix	trans	-66.5	-49	-178	-62.5	-178.9	0	0	0	111	F139 L151 V163 I164 G166 N171 W172 I306	F139-I168 HydrophobicContact CD1-CG1 4.42Å; F139-I168 HydrophobicContact CD1-CG2 4.22Å; F139-I168 HydrophobicContact CE1-CG2 4.18Å; L151-I168 HydrophobicContact CD1-CD1 4.42Å; L151-I168 HydrophobicContact CD2-CD1 4Å; V163-I168 HydrophobicContact CG1-CD1 3.98Å; V163-I168 HydrophobicContact CG1-CG1 4.16Å; V163-I168 PolarHBondContact O-N 3.46Å; V163-I168 VanDerWaalsContact O-N 3.16Å; I164-I168 HydrophobicContact CG1-CD1 4.17Å; G166-I168 PolarHBondContact O-N 3.36Å; I168-N171 PolarHBondContact O-N 3.42Å; I168-W172 HydrophobicContact CG2-CD2 4.03Å; I168-W172 HydrophobicContact CG2-CE3 3.96Å; I168-W172 HydrophobicContact CG2-CH2 3.38Å; I168-W172 HydrophobicContact CG2-CZ2 3.43Å; I168-W172 VanDerWaalsContact CG2-CZ2 3.43Å; I168-W172 HydrophobicContact CG2-CZ3 3.66Å; I168-W172 PolarHBondContact O-N 3.03Å; I168-W172 VanDerWaalsContact O-N 3.15Å; I168-I306 HydrophobicContact CD1-CD1 4.3Å
169	M	91	Very high	88.6	Confident	5 Å²	5	39 Å²	39	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-48.2	176.6	-178.8	62.7	70.4	0	0	111.6	I164 G166 N171 W172 Y173 L277 A284 L288	I164-M169 WeakPolarHBondContact O-CB 3.48Å; I164-M169 PolarHBondContact O-N 2.94Å; I164-M169 VanDerWaalsContact O-N 3.14Å; G166-M169 PolarHBondContact O-N 3.08Å; M169-N171 PolarHBondContact O-N 3.22Å; M169-W172 PolarHBondContact O-N 2.89Å; M169-W172 VanDerWaalsContact O-N 3.15Å; M169-Y173 HydrophobicContact CE-CE2 4.32Å; M169-Y173 HydrophobicContact CG-CD2 4.29Å; M169-Y173 WeakPolarHBondContact O-CD2 3.42Å; M169-Y173 PolarHBondContact O-N 3.26Å; M169-Y173 VanDerWaalsContact O-N 3.15Å; M169-Y173 HydrophobicContact SD-CD2 3.25Å; M169-Y173 WeakPolarHBondContact SD-CD2 3.41Å; M169-Y173 HydrophobicContact SD-CE2 3.2Å; M169-Y173 WeakPolarHBondContact SD-CE2 3.3Å; M169-Y173 HydrophobicContact SD-CG 4.42Å; M169-L277 HydrophobicContact CE-CD1 3.95Å; M169-A284 HydrophobicContact CE-CB 4.07Å; M169-A284 HydrophobicContact SD-CB 4.14Å; M169-L288 HydrophobicContact CE-CD1 3.13Å; M169-L288 HydrophobicContact CE-CG 3.6Å
170	N	89	Confident	88.1	Confident	73 Å²	73	42.4 Å²	42.4	39%	0.39	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-35.7	178.9	-69.4	-19.2	0	0	0	112.3	G166 S174	G166-N170 WeakPolarHBondContact O-CB 3.2Å; G166-N170 PolarHBondContact O-N 3.04Å; G166-N170 PolarHBondContact O-ND2 2.96Å; N170-S174 PolarHBondContact O-N 3.07Å
171	N	89.7	Confident	87.6	Confident	36 Å²	36	47.9 Å²	47.9	19%	0.193	25%	0.254	C	S	.	.	H	α-helix	trans	-69.4	-35.7	177.5	-81.3	-16.8	0	0	0	113.2	M138 F139 P167 I168 M169	M138-N171 HydrophobicContact CE-CB 3.41Å; M138-N171 VanDerWaalsContact CE-CB 3.41Å; M138-N171 PolarHBondContact O-ND2 2.98Å; M138-N171 HydrophobicContact SD-CB 3.71Å; F139-N171 HydrophobicContact CE1-CB 3.96Å; F139-N171 HydrophobicContact CZ-CB 4.23Å; P167-N171 WeakPolarHBondContact O-CB 3.32Å; P167-N171 PolarHBondContact O-N 3.06Å; P167-N171 PolarHBondContact O-ND2 2.87Å; I168-N171 PolarHBondContact O-N 3.42Å; M169-N171 PolarHBondContact O-N 3.22Å
172	W	90	Very high	86.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-72.1	-38.5	176.9	-71.8	-34.1	0	0	0	113.4	F139 I168 M169 P201 L277 I306 F308	F139-W172 AromaticContact CE1-CD1 3.73Å; F139-W172 HydrophobicContact CE1-CG 4.49Å; F139-W172 AromaticContact CE1-NE1 3.39Å; F139-W172 AromaticContact CZ-CD1 3.59Å; F139-W172 AromaticContact CZ-NE1 3.48Å; I168-W172 HydrophobicContact CG2-CD2 4.03Å; I168-W172 HydrophobicContact CG2-CE3 3.96Å; I168-W172 HydrophobicContact CG2-CH2 3.38Å; I168-W172 HydrophobicContact CG2-CZ2 3.43Å; I168-W172 VanDerWaalsContact CG2-CZ2 3.43Å; I168-W172 HydrophobicContact CG2-CZ3 3.66Å; I168-W172 PolarHBondContact O-N 3.03Å; I168-W172 VanDerWaalsContact O-N 3.15Å; M169-W172 PolarHBondContact O-N 2.89Å; M169-W172 VanDerWaalsContact O-N 3.15Å; W172-P201 HydrophobicContact CD2-CB 4.21Å; W172-P201 HydrophobicContact CD2-CG 3.89Å; W172-P201 HydrophobicContact CE3-CB 4.24Å; W172-P201 HydrophobicContact CE3-CG 4.08Å; W172-P201 HydrophobicContact CG-CG 4.2Å; W172-P201 HydrophobicContact CH2-CB 4.05Å; W172-P201 HydrophobicContact CZ2-CB 4.01Å; W172-P201 HydrophobicContact CZ3-CB 4.16Å; W172-P201 HydrophobicContact CZ3-CG 4.49Å; W172-L277 HydrophobicContact CE3-CD1 4.02Å; W172-L277 HydrophobicContact CH2-CD1 4.47Å; W172-L277 HydrophobicContact CZ3-CD1 3.57Å; W172-I306 HydrophobicContact CH2-CG2 3.46Å; W172-I306 VanDerWaalsContact CH2-CG2 3.46Å; W172-I306 HydrophobicContact CZ2-CG2 3.38Å; W172-F308 AromaticContact CE2-CD1 3.88Å; W172-F308 AromaticContact CZ2-CD1 3.76Å; W172-F308 HydrophobicContact CZ2-CD1 3.76Å; W172-F308 AromaticContact CZ2-CE1 3.97Å; W172-F308 HydrophobicContact CZ2-CE1 3.97Å; W172-F308 AromaticContact NE1-CD1 3.44Å; W172-F308 AromaticContact NE1-CD2 3.84Å; W172-F308 AromaticContact NE1-CE1 3.42Å; W172-F308 AromaticContact NE1-CE2 3.82Å; W172-F308 AromaticContact NE1-CG 3.66Å; W172-F308 AromaticContact NE1-CZ 3.62Å
173	Y	87.2	Confident	86	Confident	8 Å²	8	51.8 Å²	51.8	3%	0.031	28%	0.276	C	S	.	.	S	Bend	trans	-112.9	30.1	-171.5	-57.6	-87.7	0	0	0	113.2	M169 S175 L189 S278 R279 Q281 A284	M169-Y173 HydrophobicContact CE-CE2 4.32Å; M169-Y173 HydrophobicContact CG-CD2 4.29Å; M169-Y173 WeakPolarHBondContact O-CD2 3.42Å; M169-Y173 PolarHBondContact O-N 3.26Å; M169-Y173 VanDerWaalsContact O-N 3.15Å; M169-Y173 HydrophobicContact SD-CD2 3.25Å; M169-Y173 WeakPolarHBondContact SD-CD2 3.41Å; M169-Y173 HydrophobicContact SD-CE2 3.2Å; M169-Y173 WeakPolarHBondContact SD-CE2 3.3Å; M169-Y173 HydrophobicContact SD-CG 4.42Å; Y173-S175 PolarHBondContact O-N 3.47Å; Y173-S175 VanDerWaalsContact O-N 3.15Å; Y173-L189 HydrophobicContact CD1-CD2 3.37Å; Y173-L189 HydrophobicContact CE1-CD1 4.42Å; Y173-L189 HydrophobicContact CE1-CD2 3.78Å; Y173-L189 HydrophobicContact CG-CD2 4.32Å; Y173-S278 WeakPolarHBondContact CE1-O 3.41Å; Y173-S278 PolarHBondContact OH-O 3.12Å; Y173-R279 WeakPolarHBondContact CD1-O 3.49Å; Y173-R279 WeakPolarHBondContact CE1-O 3.32Å; Y173-Q281 HydrophobicContact CD1-CB 4.13Å; Y173-Q281 HydrophobicContact CD2-CG 4.46Å; Y173-Q281 HydrophobicContact CG-CB 3.97Å; Y173-Q281 HydrophobicContact CG-CG 4.05Å; Y173-A284 HydrophobicContact CE1-CB 4.46Å; Y173-A284 HydrophobicContact CE2-CB 4.12Å
174	S	80.9	Confident	84.8	Confident	43 Å²	43	58.9 Å²	58.9	30%	0.301	32%	0.319	S	S	.	.			trans	-57.9	123.3	175.1	-174.6	0	0	0	0	109.9	N170 F183	N170-S174 PolarHBondContact O-N 3.07Å; S174-F183 WeakPolarHBondContact O-CE2 3.49Å
175	S	77.2	Confident	83.3	Confident	66 Å²	66	62.7 Å²	62.7	46%	0.462	34%	0.342	S	S	.	.			trans	-114.1	-1.7	-176.1	56	0	0	0	0	113.3	Y173 P182 F183	Y173-S175 PolarHBondContact O-N 3.47Å; Y173-S175 VanDerWaalsContact O-N 3.15Å; S175-P182 WeakPolarHBondContact O-CA 3.37Å; S175-F183 VanDerWaalsContact C-CE2 3.45Å; S175-F183 WeakPolarHBondContact O-CD2 3.38Å; S175-F183 PolarHBondContact O-N 2.94Å
176	T	79.8	Confident	81.7	Confident	60 Å²	60	64 Å²	64	37%	0.368	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-117.2	144.8	-176.3	55.1	0	0	0	0	112	Q181 Y193	T176-Q181 CarbonylContact C-O 3.46Å; T176-Q181 WeakPolarHBondContact CA-O 3.25Å; T176-Y193 WeakPolarHBondContact O-CE1 3.4Å
177	W	80.8	Confident	80.1	Confident	98 Å²	98	69.8 Å²	69.8	37%	0.371	39%	0.393	S	S	.	.			trans	-68.6	167.3	165.8	-75.1	108.5	0	0	0	111.2	N179 S180 Q181 F183 Y193	W177-N179 WeakPolarHBondContact CB-OD1 3.3Å; W177-N179 PolarHBondContact O-N 3.19Å; W177-S180 WeakPolarHBondContact O-CA 3.39Å; W177-S180 PolarHBondContact O-N 3.1Å; W177-Q181 PolarHBondContact N-O 3.48Å; W177-F183 AromaticContact CD1-CD1 3.94Å; W177-F183 AromaticContact CD2-CD1 3.94Å; W177-F183 HydrophobicContact CD2-CD1 3.94Å; W177-F183 AromaticContact CD2-CE1 3.55Å; W177-F183 HydrophobicContact CD2-CE1 3.55Å; W177-F183 AromaticContact CE2-CD1 3.37Å; W177-F183 AromaticContact CE2-CE1 3.43Å; W177-F183 VanDerWaalsContact CE2-CE1 3.43Å; W177-F183 AromaticContact CE3-CE1 3.88Å; W177-F183 HydrophobicContact CE3-CE1 3.88Å; W177-F183 HydrophobicContact CG-CD1 4.27Å; W177-F183 HydrophobicContact CG-CE1 4.07Å; W177-F183 HydrophobicContact CH2-CD1 4.38Å; W177-F183 AromaticContact CH2-CE1 3.97Å; W177-F183 HydrophobicContact CH2-CE1 3.97Å; W177-F183 AromaticContact CZ2-CD1 3.64Å; W177-F183 HydrophobicContact CZ2-CD1 3.64Å; W177-F183 AromaticContact CZ2-CE1 3.66Å; W177-F183 HydrophobicContact CZ2-CE1 3.66Å; W177-F183 HydrophobicContact CZ3-CE1 4.08Å; W177-F183 AromaticContact NE1-CD1 3.4Å; W177-F183 AromaticContact NE1-CE1 3.86Å; W177-Y193 AromaticContact CE3-CD1 3.63Å; W177-Y193 HydrophobicContact CE3-CD1 3.63Å; W177-Y193 HydrophobicContact CE3-CE1 4.21Å; W177-Y193 HydrophobicContact CE3-CG 4.24Å; W177-Y193 AromaticContact CZ3-CD1 3.91Å; W177-Y193 HydrophobicContact CZ3-CD1 3.91Å; W177-Y193 HydrophobicContact CZ3-CG 4.12Å
178	Y	79.8	Confident	78.7	Confident	188 Å²	188	72.1 Å²	72.1	74%	0.737	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-17.9	175.9	67	-92.1	0	0	0	114.1	Y193	Y178-Y193 WeakPolarHBondContact CA-OH 3.1Å; Y178-Y193 PolarHBondContact N-OH 3.12Å
179	N	86.1	Confident	77.7	Confident	71 Å²	71	73.1 Å²	73.1	38%	0.38	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	15	175.2	69.8	-12.6	0	0	0	113	W177 Q181	W177-N179 WeakPolarHBondContact CB-OD1 3.3Å; W177-N179 PolarHBondContact O-N 3.19Å; N179-Q181 VanDerWaalsContact ND2-CD 3.29Å; N179-Q181 PolarHBondContact ND2-OE1 2.81Å; N179-Q181 PolarHBondContact O-N 3.46Å; N179-Q181 WeakPolarHBondContact OD1-CB 3.49Å; N179-Q181 PolarHBondContact OD1-N 2.91Å; N179-Q181 VanDerWaalsContact OD1-N 3.17Å
180	S	80.2	Confident	76.8	Confident	99 Å²	99	73.9 Å²	73.9	69%	0.692	42%	0.415	S	S	*	.	S	Bend	trans	64.4	10.5	-178.2	-52.1	0	0	0	0	115.7	W177	W177-S180 WeakPolarHBondContact O-CA 3.39Å; W177-S180 PolarHBondContact O-N 3.1Å
181	Q	82.6	Confident	76.2	Confident	117 Å²	117	70.4 Å²	70.4	55%	0.547	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-80.2	143.1	172.3	-68.6	-176.4	-23.1	0	0	110.8	T176 W177 N179	T176-Q181 CarbonylContact C-O 3.46Å; T176-Q181 WeakPolarHBondContact CA-O 3.25Å; W177-Q181 PolarHBondContact N-O 3.48Å; N179-Q181 VanDerWaalsContact ND2-CD 3.29Å; N179-Q181 PolarHBondContact ND2-OE1 2.81Å; N179-Q181 PolarHBondContact O-N 3.46Å; N179-Q181 WeakPolarHBondContact OD1-CB 3.49Å; N179-Q181 PolarHBondContact OD1-N 2.91Å; N179-Q181 VanDerWaalsContact OD1-N 3.17Å
182	P	80.2	Confident	75.5	Confident	98 Å²	98	72.1 Å²	72.1	64%	0.636	41%	0.405	S	S	*	.	B	Isolated β-bridge	trans	-68.4	152.5	177.4	29.1	-34.6	0	0	0	111.8	S175	S175-P182 WeakPolarHBondContact O-CA 3.37Å
183	F	74	Confident	74.9	Confident	34 Å²	34	76.7 Å²	76.7	15%	0.149	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-62.8	143.3	168.7	-65.4	-66.2	0	0	0	111.3	S174 S175 W177 T185 Y193	S174-F183 WeakPolarHBondContact O-CE2 3.49Å; S175-F183 VanDerWaalsContact C-CE2 3.45Å; S175-F183 WeakPolarHBondContact O-CD2 3.38Å; S175-F183 PolarHBondContact O-N 2.94Å; W177-F183 AromaticContact CD1-CD1 3.94Å; W177-F183 AromaticContact CD2-CD1 3.94Å; W177-F183 HydrophobicContact CD2-CD1 3.94Å; W177-F183 AromaticContact CD2-CE1 3.55Å; W177-F183 HydrophobicContact CD2-CE1 3.55Å; W177-F183 AromaticContact CE2-CD1 3.37Å; W177-F183 AromaticContact CE2-CE1 3.43Å; W177-F183 VanDerWaalsContact CE2-CE1 3.43Å; W177-F183 AromaticContact CE3-CE1 3.88Å; W177-F183 HydrophobicContact CE3-CE1 3.88Å; W177-F183 HydrophobicContact CG-CD1 4.27Å; W177-F183 HydrophobicContact CG-CE1 4.07Å; W177-F183 HydrophobicContact CH2-CD1 4.38Å; W177-F183 AromaticContact CH2-CE1 3.97Å; W177-F183 HydrophobicContact CH2-CE1 3.97Å; W177-F183 AromaticContact CZ2-CD1 3.64Å; W177-F183 HydrophobicContact CZ2-CD1 3.64Å; W177-F183 AromaticContact CZ2-CE1 3.66Å; W177-F183 HydrophobicContact CZ2-CE1 3.66Å; W177-F183 HydrophobicContact CZ3-CE1 4.08Å; W177-F183 AromaticContact NE1-CD1 3.4Å; W177-F183 AromaticContact NE1-CE1 3.86Å; F183-T185 VanDerWaalsContact C-N 3.26Å; F183-T185 PolarHBondContact O-N 3.21Å; F183-Y193 HydrophobicContact CE1-CD1 4.09Å; F183-Y193 AromaticContact CZ-CD1 3.8Å; F183-Y193 HydrophobicContact CZ-CD1 3.8Å; F183-Y193 HydrophobicContact CZ-CE1 4.36Å
184	V	68.4	Low	74.8	Confident	148 Å²	148	81.7 Å²	81.7	90%	0.897	45%	0.447	S	S	*	.	S	Bend	trans	-67.4	-28.5	179.9	-178.9	0	0	0	0	111.9
185	T	63.6	Low	75.2	Confident	80 Å²	80	80 Å²	80	49%	0.491	43%	0.434	S	S	.	.			trans	-117	114.6	177.5	48.6	0	0	0	0	110	F183 D187 N188	F183-T185 VanDerWaalsContact C-N 3.26Å; F183-T185 PolarHBondContact O-N 3.21Å; T185-D187 VanDerWaalsContact C-N 3.27Å; T185-D187 PolarHBondContact O-N 3.47Å; T185-N188 PolarHBondContact OG1-ND2 3.04Å
186	A	58.8	Low	75.7	Confident	97 Å²	97	82.3 Å²	82.3	80%	0.802	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-26.3	179.1	0	0	0	0	0	113.4	N188	A186-N188 VanDerWaalsContact C-N 3.27Å; A186-N188 PolarHBondContact O-N 3.29Å
187	D	58.2	Low	76.2	Confident	134 Å²	134	79.6 Å²	79.6	72%	0.717	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	0.3	-167.9	-65	-16.3	0	0	0	115.6	T185	T185-D187 VanDerWaalsContact C-N 3.27Å; T185-D187 PolarHBondContact O-N 3.47Å
188	N	62.8	Low	76.7	Confident	59 Å²	59	75.9 Å²	75.9	32%	0.316	40%	0.404	S	S	.	.			trans	-108.6	93.1	-177.8	-69.2	-35	0	0	0	109.9	T185 A186 T190 R196	T185-N188 PolarHBondContact OG1-ND2 3.04Å; A186-N188 VanDerWaalsContact C-N 3.27Å; A186-N188 PolarHBondContact O-N 3.29Å; N188-T190 VanDerWaalsContact C-N 3.32Å; N188-T190 HydrophobicContact CB-CG2 4.08Å; N188-T190 PolarHBondContact O-N 2.86Å; N188-R196 PolarHBondContact OD1-NH2 3.28Å
189	L	70.7	Confident	77.2	Confident	22 Å²	22	67 Å²	67	12%	0.115	37%	0.369	C	S	.	.			trans	-60.2	93.2	166.2	-67.9	167.1	0	0	0	109.1	Y173 L197 R279	Y173-L189 HydrophobicContact CD1-CD2 3.37Å; Y173-L189 HydrophobicContact CE1-CD1 4.42Å; Y173-L189 HydrophobicContact CE1-CD2 3.78Å; Y173-L189 HydrophobicContact CG-CD2 4.32Å; L189-L197 HydrophobicContact CB-CB 3.85Å; L189-L197 HydrophobicContact CB-CD2 4.33Å; L189-L197 HydrophobicContact CD1-CD2 3.98Å; L189-L197 PolarHBondContact O-N 3.05Å; L189-R279 HydrophobicContact CD1-CB 3.96Å; L189-R279 HydrophobicContact CD1-CG 3.8Å
190	T	71.9	Confident	77.5	Confident	20 Å²	20	63.7 Å²	63.7	12%	0.123	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	120.1	-178.5	56	0	0	0	0	111.6	N188 N195	N188-T190 VanDerWaalsContact C-N 3.32Å; N188-T190 HydrophobicContact CB-CG2 4.08Å; N188-T190 PolarHBondContact O-N 2.86Å; T190-N195 CarbonylContact C-O 3.56Å; T190-N195 VanDerWaalsContact CA-O 3.28Å; T190-N195 WeakPolarHBondContact CA-O 3.23Å
191	L	76.9	Confident	78.2	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.7	167.6	-68.3	80.8	0	0	0	109.8	M138 F139 Y193 Q194 N195 L197 F308 T310	M138-L191 HydrophobicContact CE-CB 4.2Å; M138-L191 HydrophobicContact CE-CD2 4.14Å; M138-L191 HydrophobicContact CE-CG 4.37Å; F139-L191 HydrophobicContact CE2-CD2 3.72Å; F139-L191 HydrophobicContact CZ-CD2 3.51Å; L191-Y193 PolarHBondContact O-N 3.25Å; L191-Q194 PolarHBondContact O-N 3.48Å; L191-N195 HydrophobicContact CB-CB 4.17Å; L191-N195 PolarHBondContact N-O 2.85Å; L191-N195 VanDerWaalsContact O-CB 3.3Å; L191-N195 WeakPolarHBondContact O-CB 3.38Å; L191-N195 PolarHBondContact O-N 3.21Å; L191-N195 PolarHBondContact O-ND2 2.94Å; L191-L197 HydrophobicContact CD1-CB 3.93Å; L191-L197 HydrophobicContact CD1-CD1 4.1Å; L191-F308 HydrophobicContact CD2-CE2 4.13Å; L191-T310 HydrophobicContact CD1-CG2 3.87Å; L191-T310 HydrophobicContact CD2-CG2 3.92Å; L191-T310 HydrophobicContact CG-CG2 4.42Å
192	L	74.9	Confident	78.8	Confident	72 Å²	72	54 Å²	54	38%	0.377	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	36.1	-177.9	-60.4	169.9	0	0	0	113	M138 Q194	M138-L192 HydrophobicContact CE-CG 4.29Å; M138-L192 HydrophobicContact CG-CD2 4.35Å; L192-Q194 PolarHBondContact O-N 3.47Å
193	Y	78.6	Confident	79.6	Confident	96 Å²	96	49.4 Å²	49.4	38%	0.376	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-23.2	179.9	-41.9	-74.1	0	0	0	116.4	T176 W177 Y178 F183 L191	T176-Y193 WeakPolarHBondContact O-CE1 3.4Å; W177-Y193 AromaticContact CE3-CD1 3.63Å; W177-Y193 HydrophobicContact CE3-CD1 3.63Å; W177-Y193 HydrophobicContact CE3-CE1 4.21Å; W177-Y193 HydrophobicContact CE3-CG 4.24Å; W177-Y193 AromaticContact CZ3-CD1 3.91Å; W177-Y193 HydrophobicContact CZ3-CD1 3.91Å; W177-Y193 HydrophobicContact CZ3-CG 4.12Å; Y178-Y193 WeakPolarHBondContact CA-OH 3.1Å; Y178-Y193 PolarHBondContact N-OH 3.12Å; F183-Y193 HydrophobicContact CE1-CD1 4.09Å; F183-Y193 AromaticContact CZ-CD1 3.8Å; F183-Y193 HydrophobicContact CZ-CD1 3.8Å; F183-Y193 HydrophobicContact CZ-CE1 4.36Å; L191-Y193 PolarHBondContact O-N 3.25Å
194	Q	84.1	Confident	80.7	Confident	114 Å²	114	47.8 Å²	47.8	53%	0.533	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-17.4	-170	-60.8	-172.9	8.9	0	0	114.7	L191 L192 N314	L191-Q194 PolarHBondContact O-N 3.48Å; L192-Q194 PolarHBondContact O-N 3.47Å; Q194-N314 VanDerWaalsContact CD-ND2 3.33Å; Q194-N314 PolarHBondContact OE1-ND2 3.41Å
195	N	89.3	Confident	82	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.032	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	117.3	179.3	-55.2	-79.9	0	0	0	109.2	L131 M135 T190 L191 N312	L131-N195 WeakPolarHBondContact CD1-OD1 3.39Å; M135-N195 HydrophobicContact CE-CB 3.66Å; M135-N195 VanDerWaalsContact CE-CG 3.41Å; T190-N195 CarbonylContact C-O 3.56Å; T190-N195 VanDerWaalsContact CA-O 3.28Å; T190-N195 WeakPolarHBondContact CA-O 3.23Å; L191-N195 HydrophobicContact CB-CB 4.17Å; L191-N195 PolarHBondContact N-O 2.85Å; L191-N195 VanDerWaalsContact O-CB 3.3Å; L191-N195 WeakPolarHBondContact O-CB 3.38Å; L191-N195 PolarHBondContact O-N 3.21Å; L191-N195 PolarHBondContact O-ND2 2.94Å; N195-N312 WeakPolarHBondContact OD1-CB 3.44Å; N195-N312 PolarHBondContact OD1-ND2 2.7Å
196	R	89	Confident	83.6	Confident	116 Å²	116	36.9 Å²	36.9	44%	0.438	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	130.3	178.6	-171.7	177.5	-171.7	-174.3	4.4	110.4	N188 I198 T310 Y311	N188-R196 PolarHBondContact OD1-NH2 3.28Å; R196-I198 PolarHBondContact O-N 3.34Å; R196-T310 CarbonylContact O-C 3.54Å; R196-T310 WeakPolarHBondContact O-CA 3.27Å; R196-Y311 PolarHBondContact N-O 3.1Å; R196-Y311 PolarHBondContact O-N 3.06Å
197	L	90.4	Very high	85.3	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	127.9	170.1	-166.9	68.9	0	0	0	109.8	L189 L191 P201 F308 T310	L189-L197 HydrophobicContact CB-CB 3.85Å; L189-L197 HydrophobicContact CB-CD2 4.33Å; L189-L197 HydrophobicContact CD1-CD2 3.98Å; L189-L197 PolarHBondContact O-N 3.05Å; L191-L197 HydrophobicContact CD1-CB 3.93Å; L191-L197 HydrophobicContact CD1-CD1 4.1Å; L197-P201 HydrophobicContact CD2-CG 3.93Å; L197-F308 HydrophobicContact CD1-CB 4Å; L197-F308 HydrophobicContact CD1-CD2 3.91Å; L197-F308 HydrophobicContact CD1-CG 4.36Å; L197-T310 HydrophobicContact CD1-CG2 4Å
198	I	89.8	Confident	87	Confident	21 Å²	21	26.6 Å²	26.6	11%	0.108	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.2	175.5	-63.8	-171.9	0	0	0	108.3	R196 T309 Y311 F318 I421 A429 F431	R196-I198 PolarHBondContact O-N 3.34Å; I198-T309 PolarHBondContact N-O 3.39Å; I198-Y311 HydrophobicContact CD1-CG 4.16Å; I198-F318 HydrophobicContact CD1-CD1 3.79Å; I198-F318 HydrophobicContact CD1-CE1 3.38Å; I198-F318 HydrophobicContact CD1-CZ 4.39Å; I198-I421 HydrophobicContact CG2-CD1 4.42Å; I198-I421 HydrophobicContact CG2-CG2 3.67Å; I198-A429 HydrophobicContact CG2-CB 3.86Å; I198-A429 WeakPolarHBondContact O-CB 3.48Å; I198-F431 HydrophobicContact CG2-CE2 4.15Å
199	G	90.4	Very high	88.5	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.01	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	67.4	-149.5	-169.8	0	0	0	0	0	111.8	E427	G199-E427 WeakPolarHBondContact CA-O 3.26Å
200	V	92.7	Very high	89.5	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.012	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156.3	177	-65.5	0	0	0	0	112.1	D276 L277 R279 E427 F428	V200-D276 HydrophobicContact CG2-CB 3.89Å; V200-L277 WeakPolarHBondContact CB-O 3.34Å; V200-L277 VanDerWaalsContact CG1-O 3.26Å; V200-L277 WeakPolarHBondContact CG1-O 3.49Å; V200-R279 HydrophobicContact CG1-CG 3.78Å; V200-E427 PolarHBondContact N-O 2.99Å; V200-F428 HydrophobicContact CG2-CB 4.39Å; V200-F428 VanDerWaalsContact O-CD2 3.3Å; V200-F428 WeakPolarHBondContact O-CD2 3.37Å
201	P	95.1	Very high	90.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	141	172.5	-14	29.6	0	0	0	111.3	W172 L197 L277 H307 F308	W172-P201 HydrophobicContact CD2-CB 4.21Å; W172-P201 HydrophobicContact CD2-CG 3.89Å; W172-P201 HydrophobicContact CE3-CB 4.24Å; W172-P201 HydrophobicContact CE3-CG 4.08Å; W172-P201 HydrophobicContact CG-CG 4.2Å; W172-P201 HydrophobicContact CH2-CB 4.05Å; W172-P201 HydrophobicContact CZ2-CB 4.01Å; W172-P201 HydrophobicContact CZ3-CB 4.16Å; W172-P201 HydrophobicContact CZ3-CG 4.49Å; L197-P201 HydrophobicContact CD2-CG 3.93Å; P201-L277 HydrophobicContact CB-CD1 4.26Å; P201-L277 PolarHBondContact O-N 3.17Å; P201-H307 WeakPolarHBondContact CA-O 3.49Å; P201-F308 HydrophobicContact CB-CB 4.17Å
202	R	95.6	Very high	91	Very high	13 Å²	13	31.5 Å²	31.5	5%	0.049	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.6	177.4	174.6	172.7	-73.5	-179	-2.8	110.4	Y274 D276 H307 F428	R202-Y274 HydrophobicContact CG-CD2 4.27Å; R202-D276 WeakPolarHBondContact CB-OD1 3.38Å; R202-D276 VanDerWaalsContact CG-OD1 3.31Å; R202-D276 WeakPolarHBondContact CG-OD1 3.27Å; R202-D276 IonicContact CZ-OD1 3.99Å; R202-D276 IonicContact CZ-OD2 3.43Å; R202-D276 IonicContact NE-OD1 3.21Å; R202-D276 PolarHBondContact NE-OD1 3.38Å; R202-D276 IonicContact NE-OD2 2.68Å; R202-D276 IonicContact NH2-OD1 3.1Å; R202-D276 PolarHBondContact NH2-OD1 3.18Å; R202-D276 IonicContact NH2-OD2 3.32Å; R202-D276 PolarHBondContact NH2-OD2 3.43Å; R202-H307 HydrophobicContact CB-CB 4.49Å; R202-H307 PolarHBondContact N-O 2.85Å; R202-H307 PolarHBondContact O-N 2.74Å; R202-F428 HydrophobicContact CB-CB 4.44Å; R202-F428 HydrophobicContact CB-CD2 3.35Å; R202-F428 HydrophobicContact CB-CE2 3.66Å; R202-F428 HydrophobicContact CB-CG 3.87Å; R202-F428 HydrophobicContact CB-CZ 4.36Å; R202-F428 HydrophobicContact CG-CD2 4.44Å; R202-F428 VanDerWaalsContact CZ-CD1 3.41Å
203	L	97	Very high	91.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.4	164.1	-71.7	83.1	0	0	0	108	I164 Y274 Q275 L277 L288 W296 L304 F305 I306	I164-L203 HydrophobicContact CG2-CD2 4.41Å; L203-Y274 CarbonylContact O-C 3.44Å; L203-Y274 WeakPolarHBondContact O-CA 3.29Å; L203-Y274 WeakPolarHBondContact O-CB 3.43Å; L203-Q275 PolarHBondContact N-O 2.94Å; L203-Q275 PolarHBondContact O-N 3.27Å; L203-L277 HydrophobicContact CD1-CD1 3.69Å; L203-L277 HydrophobicContact CD1-CD2 4.04Å; L203-L277 HydrophobicContact CD1-CG 3.74Å; L203-L288 HydrophobicContact CD1-CD2 4.26Å; L203-L288 HydrophobicContact CD2-CD2 3.91Å; L203-W296 HydrophobicContact CB-CH2 3.94Å; L203-W296 HydrophobicContact CB-CZ3 4.17Å; L203-W296 HydrophobicContact CD2-CZ3 4.39Å; L203-L304 HydrophobicContact CB-CD1 4.5Å; L203-F305 CarbonylContact C-O 3.6Å; L203-F305 WeakPolarHBondContact CA-O 3.4Å; L203-I306 HydrophobicContact CG-CG1 4.44Å
204	R	96.2	Very high	92.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139	177.4	176.4	-179.1	70.5	113.7	-3.6	109.8	G269 G270 G271 Y273 L304 F305	R204-G269 PolarHBondContact NH1-O 3.42Å; R204-G270 PolarHBondContact NH1-O 3.01Å; R204-G270 VanDerWaalsContact NH1-O 3.15Å; R204-G271 PolarHBondContact NH1-O 3.48Å; R204-Y273 CarbonylContact C-O 3.4Å; R204-Y273 VanDerWaalsContact CA-O 3.29Å; R204-Y273 WeakPolarHBondContact CA-O 3.38Å; R204-L304 CarbonylContact O-C 3.6Å; R204-F305 HydrophobicContact CB-CB 4.06Å; R204-F305 PolarHBondContact N-O 2.9Å; R204-F305 VanDerWaalsContact NH2-CD2 3.33Å; R204-F305 VanDerWaalsContact NH2-CE2 3.3Å; R204-F305 WeakPolarHBondContact O-CB 3.46Å; R204-F305 PolarHBondContact O-N 3.21Å
205	Q	96	Very high	92.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154.9	174.4	70.8	169	-39	0	0	112.6	R207 F240 G272 Y273 W296 T301 V303	Q205-R207 HydrophobicContact CG-CG 4.37Å; Q205-F240 VanDerWaalsContact NE2-CZ 3.33Å; Q205-G272 WeakPolarHBondContact O-CA 3.24Å; Q205-Y273 HydrophobicContact CG-CD2 4.44Å; Q205-Y273 PolarHBondContact N-O 3.42Å; Q205-Y273 PolarHBondContact O-N 3.05Å; Q205-W296 HydrophobicContact CB-CH2 3.9Å; Q205-W296 HydrophobicContact CB-CZ2 4.13Å; Q205-W296 HydrophobicContact CB-CZ3 4.39Å; Q205-W296 HydrophobicContact CG-CD2 4.5Å; Q205-W296 HydrophobicContact CG-CH2 3.83Å; Q205-W296 HydrophobicContact CG-CZ2 3.54Å; Q205-W296 HydrophobicContact CG-CZ3 4.43Å; Q205-W296 VanDerWaalsContact NE2-CD1 3.27Å; Q205-W296 PolarHBondContact NE2-O 3.45Å; Q205-W296 PolarHBondContact OE1-O 2.91Å; Q205-T301 HydrophobicContact CB-CG2 4.21Å; Q205-T301 VanDerWaalsContact OE1-CG2 3.28Å; Q205-T301 PolarHBondContact OE1-OG1 3.45Å; Q205-V303 VanDerWaalsContact CA-O 3.22Å; Q205-V303 WeakPolarHBondContact CA-O 3.11Å; Q205-V303 WeakPolarHBondContact CB-O 3.16Å
206	L	96.2	Very high	92.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.3	167.9	-65.2	172	0	0	0	110	Y230 E235 Y268 G271 R302 V303 F305	L206-Y230 HydrophobicContact CB-CE2 4.13Å; L206-Y230 HydrophobicContact CD1-CE2 3.92Å; L206-E235 VanDerWaalsContact CD2-OE1 3.31Å; L206-E235 WeakPolarHBondContact CD2-OE1 3.21Å; L206-Y268 HydrophobicContact CD1-CD1 4.13Å; L206-Y268 HydrophobicContact CD1-CG 4.3Å; L206-G271 VanDerWaalsContact CD2-O 3.22Å; L206-G271 WeakPolarHBondContact CD2-O 3.24Å; L206-R302 PolarHBondContact O-N 2.98Å; L206-V303 HydrophobicContact CB-CG1 3.74Å; L206-V303 HydrophobicContact CD1-CG1 3.78Å; L206-V303 HydrophobicContact CG-CG1 4.01Å; L206-V303 PolarHBondContact N-O 3.15Å; L206-V303 VanDerWaalsContact N-O 3.1Å; L206-F305 HydrophobicContact CD1-CE2 4.33Å
207	R	94.9	Very high	92.9	Very high	13 Å²	13	34.9 Å²	34.9	5%	0.049	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	147.1	-175.3	-64.2	177.1	69.9	-114.8	2.5	110	Q205 D236 F240 Y273 D298 G300	Q205-R207 HydrophobicContact CG-CG 4.37Å; R207-D236 HydrophobicContact CB-CB 4.21Å; R207-D236 IonicContact CZ-OD2 3.93Å; R207-D236 IonicContact NH1-OD2 2.99Å; R207-D236 PolarHBondContact NH1-OD2 3.46Å; R207-D236 PolarHBondContact O-N 3.34Å; R207-F240 VanDerWaalsContact CZ-CG 3.48Å; R207-F240 VanDerWaalsContact NH1-CB 3.34Å; R207-Y273 HydrophobicContact CB-CE2 4.27Å; R207-Y273 HydrophobicContact CG-CD2 4.33Å; R207-Y273 HydrophobicContact CG-CE2 4.39Å; R207-D298 IonicContact CZ-OD2 3.59Å; R207-D298 IonicContact NE-OD1 3.47Å; R207-D298 PolarHBondContact NE-OD1 3.43Å; R207-D298 IonicContact NE-OD2 3.69Å; R207-D298 IonicContact NH2-OD1 3.66Å; R207-D298 IonicContact NH2-OD2 2.69Å; R207-D298 PolarHBondContact NH2-OD2 3.33Å; R207-G300 CarbonylContact C-O 3.6Å; R207-G300 WeakPolarHBondContact CA-O 3.39Å
208	M	95.1	Very high	93.1	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-95.9	145.2	172.3	-73.6	-63.9	-64.7	0	0	110.4	Y227 Q229 Y230 N234 G300 R302	M208-Y227 HydrophobicContact CB-CD1 4.41Å; M208-Y227 WeakPolarHBondContact O-CD1 3.48Å; M208-Q229 WeakPolarHBondContact CE-O 3.26Å; M208-Y230 HydrophobicContact SD-CD2 3.97Å; M208-N234 HydrophobicContact CE-CB 3.61Å; M208-G300 PolarHBondContact N-O 2.93Å; M208-R302 HydrophobicContact CB-CG 4.34Å; M208-R302 HydrophobicContact CG-CG 3.44Å; M208-R302 VanDerWaalsContact CG-CG 3.44Å
209	S	93.7	Very high	93.3	Very high	37 Å²	37	49.2 Å²	49.2	26%	0.259	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-61.8	145.9	174.3	-63.1	0	0	0	0	110.7	S212 N234 D236	S209-S212 WeakPolarHBondContact O-CB 3.35Å; S209-S212 PolarHBondContact O-N 2.85Å; S209-S212 PolarHBondContact O-OG 3.36Å; S209-N234 WeakPolarHBondContact CB-O 3.37Å; S209-N234 PolarHBondContact N-O 2.76Å; S209-N234 VanDerWaalsContact N-O 3.09Å; S209-N234 PolarHBondContact OG-O 3.4Å; S209-N234 VanDerWaalsContact OG-O 3.07Å; S209-D236 WeakPolarHBondContact OG-CA 3.12Å
210	S	90.6	Very high	93.2	Very high	51 Å²	51	52.2 Å²	52.2	36%	0.357	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	140.8	170.1	-177.6	0	0	0	0	110	S212	S210-S212 VanDerWaalsContact C-N 3.29Å; S210-S212 PolarHBondContact O-N 2.94Å
211	N	89.4	Confident	93.2	Very high	92 Å²	92	58.2 Å²	58.2	49%	0.492	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	33.9	-173.9	-60	-34.7	0	0	0	114.2	C213 E225 C226	N211-C213 PolarHBondContact O-N 2.91Å; N211-E225 WeakPolarHBondContact OD1-CA 3.49Å; N211-C226 VanDerWaalsContact CA-O 3.29Å; N211-C226 WeakPolarHBondContact CA-O 3.29Å; N211-C226 PolarHBondContact N-O 3.39Å; N211-C226 PolarHBondContact OD1-N 2.95Å
212	S	91.1	Very high	93.1	Very high	25 Å²	25	64.7 Å²	64.7	18%	0.175	34%	0.343	C	S	.	.			trans	-73.7	-3.2	171.5	44.7	0	0	0	0	113.7	S209 S210 C226 G228	S209-S212 WeakPolarHBondContact O-CB 3.35Å; S209-S212 PolarHBondContact O-N 2.85Å; S209-S212 PolarHBondContact O-OG 3.36Å; S210-S212 VanDerWaalsContact C-N 3.29Å; S210-S212 PolarHBondContact O-N 2.94Å; S212-C226 PolarHBondContact N-O 3.29Å; S212-G228 PolarHBondContact OG-N 3.17Å
213	C	90.3	Very high	92.9	Very high	44 Å²	44	67.7 Å²	67.7	30%	0.297	36%	0.359	S	S	.	.	S	Bend	trans	-122.3	163.7	171.5	39	0	0	0	0	111.3	N211 C226 Y227 G228	N211-C213 PolarHBondContact O-N 2.91Å; C213-C226 WeakPolarHBondContact CA-SG 3.4Å; C213-C226 HydrophobicContact CB-CB 4.45Å; C213-C226 WeakPolarHBondContact CB-SG 3.21Å; C213-C226 PolarHBondContact O-SG 3.31Å; C213-C226 WeakPolarHBondContact SG-CB 3.05Å; C213-C226 CovalentContact SG-SG 2.03Å; C213-C226 PolarHBondContact SG-SG 3.18Å; C213-Y227 PolarHBondContact SG-N 3.3Å; C213-Y227 VanDerWaalsContact SG-N 3.37Å; C213-G228 PolarHBondContact SG-N 3.44Å
214	M	90.1	Very high	92.5	Very high	184 Å²	184	74.2 Å²	74.2	91%	0.906	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-92.4	119	173.5	-60.2	-138.5	-61.8	0	0	109.7
215	I	91.4	Very high	92.2	Very high	43 Å²	43	79.5 Å²	79.5	22%	0.221	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-81.4	124.5	173.8	-55	176.1	0	0	0	107.4	F219 I223 C226	I215-F219 HydrophobicContact CG2-CB 4.11Å; I215-I223 HydrophobicContact CD1-CB 4.46Å; I215-I223 HydrophobicContact CD1-CG2 3.98Å; I215-I223 VanDerWaalsContact CD1-O 3.3Å; I215-I223 WeakPolarHBondContact CD1-O 3.3Å; I215-I223 HydrophobicContact CG2-CB 4.27Å; I215-C226 HydrophobicContact CD1-CB 3.88Å; I215-C226 HydrophobicContact CG1-CB 3.72Å
216	P	92.8	Very high	92	Very high	76 Å²	76	80.4 Å²	80.4	49%	0.494	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-58.1	141.6	173.9	-23.1	33.4	0	0	0	111	Y218 F219 T220	P216-Y218 PolarHBondContact O-N 2.75Å; P216-F219 HydrophobicContact CB-CD2 4.19Å; P216-F219 HydrophobicContact CG-CD2 4.34Å; P216-F219 PolarHBondContact O-N 3.4Å; P216-T220 PolarHBondContact O-N 3.23Å; P216-T220 PolarHBondContact O-OG1 3.29Å
217	V	92.6	Very high	91.9	Very high	127 Å²	127	82.5 Å²	82.5	77%	0.77	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-51.3	-38.5	-174.2	-178.4	0	0	0	0	112.2	F219 T220	V217-F219 PolarHBondContact O-N 2.75Å; V217-T220 WeakPolarHBondContact CA-OG1 3.28Å; V217-T220 WeakPolarHBondContact O-CB 3.47Å; V217-T220 PolarHBondContact O-N 3.41Å; V217-T220 PolarHBondContact O-OG1 2.77Å
218	Y	93.6	Very high	91.7	Very high	216 Å²	216	82.3 Å²	82.3	85%	0.847	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-60.1	-23.8	178.6	-59.3	-70.3	0	0	0	115	P216	P216-Y218 PolarHBondContact O-N 2.75Å
219	F	93.5	Very high	91.5	Very high	108 Å²	108	89 Å²	89	47%	0.474	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-109.3	4.6	-178.6	-63.6	-68.5	0	0	0	113.3	I215 P216 V217 D221 D222 I223	I215-F219 HydrophobicContact CG2-CB 4.11Å; P216-F219 HydrophobicContact CB-CD2 4.19Å; P216-F219 HydrophobicContact CG-CD2 4.34Å; P216-F219 PolarHBondContact O-N 3.4Å; V217-F219 PolarHBondContact O-N 2.75Å; F219-D221 PolarHBondContact O-N 3.4Å; F219-D222 PolarHBondContact O-N 3.4Å; F219-I223 HydrophobicContact CB-CD1 4.06Å; F219-I223 HydrophobicContact CB-CG1 4.34Å; F219-I223 PolarHBondContact O-N 2.82Å
220	T	89.1	Confident	91.5	Very high	65 Å²	65	87.9 Å²	87.9	40%	0.399	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.1	-177.3	-57.8	0	0	0	0	112.1	P216 V217 K224	P216-T220 PolarHBondContact O-N 3.23Å; P216-T220 PolarHBondContact O-OG1 3.29Å; V217-T220 WeakPolarHBondContact CA-OG1 3.28Å; V217-T220 WeakPolarHBondContact O-CB 3.47Å; V217-T220 PolarHBondContact O-N 3.41Å; V217-T220 PolarHBondContact O-OG1 2.77Å; T220-K224 PolarHBondContact O-NZ 2.7Å
221	D	92.6	Very high	91.6	Very high	128 Å²	128	90.4 Å²	90.4	68%	0.684	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-38.1	177.2	-70.6	-25.2	0	0	0	112.5	F219 K224	F219-D221 PolarHBondContact O-N 3.4Å; D221-K224 WeakPolarHBondContact O-CE 3.28Å; D221-K224 PolarHBondContact O-NZ 3.27Å
222	D	93.7	Very high	91.6	Very high	135 Å²	135	92.4 Å²	92.4	72%	0.722	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-36.2	-177.3	-62.2	-40.1	0	0	0	113.4	F219	F219-D222 PolarHBondContact O-N 3.4Å
223	I	91	Very high	91.6	Very high	77 Å²	77	95.8 Å²	95.8	40%	0.395	49%	0.492	S	S	.	.			trans	-110.6	106.1	-175.2	-52.2	179	0	0	0	108.3	I215 F219 E225	I215-I223 HydrophobicContact CD1-CB 4.46Å; I215-I223 HydrophobicContact CD1-CG2 3.98Å; I215-I223 VanDerWaalsContact CD1-O 3.3Å; I215-I223 WeakPolarHBondContact CD1-O 3.3Å; I215-I223 HydrophobicContact CG2-CB 4.27Å; F219-I223 HydrophobicContact CB-CD1 4.06Å; F219-I223 HydrophobicContact CB-CG1 4.34Å; F219-I223 PolarHBondContact O-N 2.82Å; I223-E225 WeakPolarHBondContact CG2-O 3.28Å
224	K	89	Confident	91.6	Very high	136 Å²	136	96.8 Å²	96.8	59%	0.591	49%	0.494	S	S	*	.			trans	-88.7	-26.4	-178.2	-59.2	-56.7	176.6	-162.3	0	114.3	T220 D221	T220-K224 PolarHBondContact O-NZ 2.7Å; D221-K224 WeakPolarHBondContact O-CE 3.28Å; D221-K224 PolarHBondContact O-NZ 3.27Å
225	E	89.7	Confident	91.8	Very high	112 Å²	112	88.5 Å²	88.5	52%	0.523	45%	0.453	S	S	.	.			trans	-136.2	141.7	-179.1	-63.6	-172.7	179.1	0	0	110	N211 I223 Y227	N211-E225 WeakPolarHBondContact OD1-CA 3.49Å; I223-E225 WeakPolarHBondContact CG2-O 3.28Å; E225-Y227 PolarHBondContact OE2-OH 2.89Å
226	C	91.7	Very high	91.9	Very high	19 Å²	19	87.4 Å²	87.4	13%	0.128	45%	0.448	C	S	.	.			trans	-138.9	146.4	174.6	88.4	0	0	0	0	111.1	N211 S212 C213 I215	N211-C226 VanDerWaalsContact CA-O 3.29Å; N211-C226 WeakPolarHBondContact CA-O 3.29Å; N211-C226 PolarHBondContact N-O 3.39Å; N211-C226 PolarHBondContact OD1-N 2.95Å; S212-C226 PolarHBondContact N-O 3.29Å; C213-C226 WeakPolarHBondContact CA-SG 3.4Å; C213-C226 HydrophobicContact CB-CB 4.45Å; C213-C226 WeakPolarHBondContact CB-SG 3.21Å; C213-C226 PolarHBondContact O-SG 3.31Å; C213-C226 WeakPolarHBondContact SG-CB 3.05Å; C213-C226 CovalentContact SG-SG 2.03Å; C213-C226 PolarHBondContact SG-SG 3.18Å; I215-C226 HydrophobicContact CD1-CB 3.88Å; I215-C226 HydrophobicContact CG1-CB 3.72Å
227	Y	93.2	Very high	92	Very high	44 Å²	44	89.2 Å²	89.2	17%	0.173	45%	0.448	C	S	.	.			trans	-117.6	117.8	178.6	-62.5	-86.1	0	0	0	108.4	M208 C213 E225 R299 R302	M208-Y227 HydrophobicContact CB-CD1 4.41Å; M208-Y227 WeakPolarHBondContact O-CD1 3.48Å; C213-Y227 PolarHBondContact SG-N 3.3Å; C213-Y227 VanDerWaalsContact SG-N 3.37Å; E225-Y227 PolarHBondContact OE2-OH 2.89Å; Y227-R299 HydrophobicContact CD2-CB 3.97Å; Y227-R299 HydrophobicContact CE2-CB 3.96Å; Y227-R302 PolarHBondContact O-NH2 3.32Å
228	G	91.8	Very high	92	Very high	9 Å²	9	90.6 Å²	90.6	9%	0.093	44%	0.444	C	S	.	.			trans	-73.9	-174.3	-178.1	0	0	0	0	0	113.2	S212 C213 R302	S212-G228 PolarHBondContact OG-N 3.17Å; C213-G228 PolarHBondContact SG-N 3.44Å; G228-R302 PolarHBondContact O-NE 3.2Å; G228-R302 PolarHBondContact O-NH2 3.48Å; G228-R302 VanDerWaalsContact O-NH2 3.1Å
229	Q	91.6	Very high	92	Very high	141 Å²	141	83.7 Å²	83.7	66%	0.659	43%	0.426	S	S	*	.	S	Bend	trans	-66.4	156.4	167.1	-66.4	177.8	-9	0	0	110.4	M208 Q231	M208-Q229 WeakPolarHBondContact CE-O 3.26Å; Q229-Q231 PolarHBondContact O-N 3.49Å
230	Y	93.5	Very high	92	Very high	14 Å²	14	79.4 Å²	79.4	6%	0.055	41%	0.407	C	S	.	.			trans	-62.4	123.5	179.2	-179.9	-96.1	0	0	0	111.1	L206 M208 E235 S266 S267 Y268 G269 R302	L206-Y230 HydrophobicContact CB-CE2 4.13Å; L206-Y230 HydrophobicContact CD1-CE2 3.92Å; M208-Y230 HydrophobicContact SD-CD2 3.97Å; Y230-E235 HydrophobicContact CE2-CG 4.23Å; Y230-E235 PolarHBondContact OH-OE2 3.39Å; Y230-S266 PolarHBondContact O-OG 2.94Å; Y230-S267 WeakPolarHBondContact CD1-O 3.26Å; Y230-S267 WeakPolarHBondContact CE1-O 3.42Å; Y230-Y268 AromaticContact CD1-CD1 3.73Å; Y230-Y268 HydrophobicContact CD1-CD1 3.73Å; Y230-Y268 HydrophobicContact CD1-CE1 4.18Å; Y230-Y268 HydrophobicContact CD2-CD1 4.04Å; Y230-Y268 HydrophobicContact CD2-CE1 4.4Å; Y230-Y268 HydrophobicContact CE1-CD1 4.12Å; Y230-Y268 HydrophobicContact CE2-CD1 4.4Å; Y230-Y268 AromaticContact CG-CD1 3.68Å; Y230-Y268 HydrophobicContact CG-CD1 3.68Å; Y230-Y268 AromaticContact CG-CE1 3.85Å; Y230-Y268 HydrophobicContact CG-CE1 3.85Å; Y230-G269 PolarHBondContact OH-N 3.32Å; Y230-R302 HydrophobicContact CD2-CB 4.44Å
231	Q	91.6	Very high	92.1	Very high	104 Å²	104	78.7 Å²	78.7	49%	0.486	41%	0.412	S	S	.	.			trans	-139.8	124.9	172.3	-68.9	179.1	-11.5	0	0	107.9	Q229 A233 N234 E235	Q229-Q231 PolarHBondContact O-N 3.49Å; Q231-A233 PolarHBondContact O-N 2.72Å; Q231-A233 VanDerWaalsContact O-N 3.11Å; Q231-N234 CarbonylContact O-C 3.6Å; Q231-N234 PolarHBondContact O-N 3.42Å; Q231-N234 PolarHBondContact OE1-ND2 3.15Å; Q231-E235 PolarHBondContact O-N 3.39Å
232	E	90	Very high	92.1	Very high	134 Å²	134	76 Å²	76	63%	0.626	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-56	-32.6	-177.7	-171.1	178.2	-179.7	0	0	112.9	N234 E235	E232-N234 VanDerWaalsContact C-N 3.3Å; E232-N234 PolarHBondContact O-N 2.97Å; E232-E235 WeakPolarHBondContact O-CB 3.34Å
233	A	90.4	Very high	91.9	Very high	96 Å²	96	76.5 Å²	76.5	79%	0.793	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-64.6	-31.4	177.1	0	0	0	0	0	113.8	Q231	Q231-A233 PolarHBondContact O-N 2.72Å; Q231-A233 VanDerWaalsContact O-N 3.11Å
234	N	91.2	Very high	91.9	Very high	64 Å²	64	79.1 Å²	79.1	34%	0.342	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-108.8	10.6	-174.9	-68.1	-30	0	0	0	112.7	M208 S209 Q231 E232	M208-N234 HydrophobicContact CE-CB 3.61Å; S209-N234 WeakPolarHBondContact CB-O 3.37Å; S209-N234 PolarHBondContact N-O 2.76Å; S209-N234 VanDerWaalsContact N-O 3.09Å; S209-N234 PolarHBondContact OG-O 3.4Å; S209-N234 VanDerWaalsContact OG-O 3.07Å; Q231-N234 CarbonylContact O-C 3.6Å; Q231-N234 PolarHBondContact O-N 3.42Å; Q231-N234 PolarHBondContact OE1-ND2 3.15Å; E232-N234 VanDerWaalsContact C-N 3.3Å; E232-N234 PolarHBondContact O-N 2.97Å
235	E	93.4	Very high	92	Very high	10 Å²	10	74.4 Å²	74.4	5%	0.047	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-60.2	134.5	177	-173	175.4	145.7	0	0	111.1	L206 Y230 Q231 E232 K237 Y250	L206-E235 VanDerWaalsContact CD2-OE1 3.31Å; L206-E235 WeakPolarHBondContact CD2-OE1 3.21Å; Y230-E235 HydrophobicContact CE2-CG 4.23Å; Y230-E235 PolarHBondContact OH-OE2 3.39Å; Q231-E235 PolarHBondContact O-N 3.39Å; E232-E235 WeakPolarHBondContact O-CB 3.34Å; E235-K237 PolarHBondContact O-N 2.88Å; E235-Y250 WeakPolarHBondContact OE1-CE2 3.39Å; E235-Y250 PolarHBondContact OE1-OH 3.5Å
236	D	94.2	Very high	92.1	Very high	20 Å²	20	71.3 Å²	71.3	11%	0.107	39%	0.387	C	S	.	.			trans	-75.4	107	177.7	-174.7	14.6	0	0	0	110.2	R207 S209 K238 Y273	R207-D236 HydrophobicContact CB-CB 4.21Å; R207-D236 IonicContact CZ-OD2 3.93Å; R207-D236 IonicContact NH1-OD2 2.99Å; R207-D236 PolarHBondContact NH1-OD2 3.46Å; R207-D236 PolarHBondContact O-N 3.34Å; S209-D236 WeakPolarHBondContact OG-CA 3.12Å; D236-K238 WeakPolarHBondContact OD1-CB 3.29Å; D236-K238 PolarHBondContact OD1-N 2.88Å; D236-Y273 VanDerWaalsContact O-CE2 3.3Å; D236-Y273 WeakPolarHBondContact O-CE2 3.43Å; D236-Y273 PolarHBondContact O-OH 3.49Å
237	K	94.1	Very high	92.3	Very high	114 Å²	114	70.4 Å²	70.4	50%	0.496	38%	0.381	S	S	.	.			trans	-99.2	2.3	176.8	-59.6	-178.2	-177.6	177.5	0	113	E235 Y250	E235-K237 PolarHBondContact O-N 2.88Å; K237-Y250 HydrophobicContact CB-CD1 4.01Å; K237-Y250 HydrophobicContact CB-CE1 4.44Å; K237-Y250 HydrophobicContact CB-CG 4.06Å; K237-Y250 HydrophobicContact CD-CD1 4.37Å; K237-Y250 HydrophobicContact CD-CE1 4Å; K237-Y250 HydrophobicContact CG-CD1 3.95Å; K237-Y250 HydrophobicContact CG-CD2 4.35Å; K237-Y250 HydrophobicContact CG-CE1 3.87Å; K237-Y250 HydrophobicContact CG-CE2 4.3Å; K237-Y250 HydrophobicContact CG-CG 4.16Å; K237-Y250 WeakPolarHBondContact O-CB 3.19Å
238	K	93.3	Very high	92.4	Very high	157 Å²	157	68.6 Å²	68.6	68%	0.683	37%	0.373	S	S	*	.	S	Bend	trans	-87	141.7	-176.5	-63.5	176.5	-175.5	171.5	0	111	D236 F240 Y273	D236-K238 WeakPolarHBondContact OD1-CB 3.29Å; D236-K238 PolarHBondContact OD1-N 2.88Å; K238-F240 PolarHBondContact O-N 2.97Å; K238-Y273 PolarHBondContact N-OH 2.71Å; K238-Y273 PolarHBondContact O-OH 2.9Å
239	P	94.1	Very high	92.6	Very high	71 Å²	71	70.3 Å²	70.3	46%	0.461	38%	0.382	S	S	.	.			trans	-57.7	136.1	173.8	-24.1	33.5	0	0	0	112.7	K243 W248 T249	P239-K243 HydrophobicContact CB-CB 4.24Å; P239-K243 HydrophobicContact CB-CG 4.23Å; P239-W248 WeakPolarHBondContact CA-O 3.35Å; P239-T249 HydrophobicContact CB-CG2 4.32Å; P239-T249 HydrophobicContact CG-CG2 4.39Å
240	F	93.1	Very high	92.8	Very high	18 Å²	18	66.1 Å²	66.1	8%	0.079	36%	0.361	C	S	.	.			trans	-130.8	174.2	-176.8	81.3	-75.7	0	0	0	112.4	Q205 R207 K238 L242 K243 W248 Y273 W296	Q205-F240 VanDerWaalsContact NE2-CZ 3.33Å; R207-F240 VanDerWaalsContact CZ-CG 3.48Å; R207-F240 VanDerWaalsContact NH1-CB 3.34Å; K238-F240 PolarHBondContact O-N 2.97Å; F240-L242 PolarHBondContact O-N 3.21Å; F240-K243 PolarHBondContact O-N 2.91Å; F240-W248 HydrophobicContact CD1-CE3 4.41Å; F240-W248 AromaticContact CD2-CE3 3.95Å; F240-W248 HydrophobicContact CD2-CE3 3.95Å; F240-W248 AromaticContact CD2-CZ3 3.99Å; F240-W248 HydrophobicContact CD2-CZ3 3.99Å; F240-W248 HydrophobicContact CE1-CE3 4.12Å; F240-W248 AromaticContact CE2-CE3 3.65Å; F240-W248 HydrophobicContact CE2-CE3 3.65Å; F240-W248 AromaticContact CE2-CZ3 3.49Å; F240-W248 HydrophobicContact CE2-CZ3 3.49Å; F240-W248 VanDerWaalsContact CE2-CZ3 3.49Å; F240-W248 HydrophobicContact CG-CE3 4.31Å; F240-W248 AromaticContact CZ-CE3 3.72Å; F240-W248 HydrophobicContact CZ-CE3 3.72Å; F240-W248 AromaticContact CZ-CZ3 3.88Å; F240-W248 HydrophobicContact CZ-CZ3 3.88Å; F240-W248 PolarHBondContact N-O 3.4Å; F240-W248 VanDerWaalsContact N-O 3.09Å; F240-W248 WeakPolarHBondContact O-CB 3.28Å; F240-Y273 AromaticContact CD1-CD1 3.82Å; F240-Y273 HydrophobicContact CD1-CD1 3.82Å; F240-Y273 AromaticContact CD1-CE1 3.56Å; F240-Y273 HydrophobicContact CD1-CE1 3.56Å; F240-Y273 HydrophobicContact CD1-CE2 4.45Å; F240-Y273 HydrophobicContact CD1-CG 4.34Å; F240-Y273 AromaticContact CD1-CZ 3.94Å; F240-Y273 AromaticContact CE1-CD1 3.45Å; F240-Y273 HydrophobicContact CE1-CD1 3.45Å; F240-Y273 VanDerWaalsContact CE1-CD1 3.45Å; F240-Y273 HydrophobicContact CE1-CD2 4.06Å; F240-Y273 AromaticContact CE1-CE1 3.71Å; F240-Y273 HydrophobicContact CE1-CE1 3.71Å; F240-Y273 HydrophobicContact CE1-CE2 4.31Å; F240-Y273 AromaticContact CE1-CG 3.64Å; F240-Y273 HydrophobicContact CE1-CG 3.64Å; F240-W296 AromaticContact CZ-CD1 3.64Å; F240-W296 HydrophobicContact CZ-CG 4.49Å; F240-W296 AromaticContact CZ-NE1 3.96Å
241	G	91.4	Very high	92.9	Very high	50 Å²	50	66 Å²	66	52%	0.515	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	-120.2	-178.8	0	0	0	0	0	112.6	K243	G241-K243 PolarHBondContact O-N 2.77Å
242	L	92.6	Very high	93.1	Very high	72 Å²	72	63.6 Å²	63.6	38%	0.377	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.8	179.8	-67	177.6	0	0	0	114.3	F240 N244 W248 K290 N294	F240-L242 PolarHBondContact O-N 3.21Å; L242-N244 PolarHBondContact O-N 2.8Å; L242-W248 HydrophobicContact CB-CD2 4.11Å; L242-W248 HydrophobicContact CB-CG 4.11Å; L242-W248 HydrophobicContact CD1-CZ2 4.17Å; L242-W248 HydrophobicContact CG-CZ2 4.26Å; L242-K290 HydrophobicContact CD1-CD 4.42Å; L242-K290 HydrophobicContact CD1-CG 4.27Å; L242-N294 HydrophobicContact CD1-CB 4.46Å; L242-N294 WeakPolarHBondContact CD2-OD1 3.17Å; L242-N294 HydrophobicContact CG-CB 4.31Å
243	K	89.6	Confident	93.2	Very high	145 Å²	145	59 Å²	59	63%	0.63	34%	0.339	S	S	*	.			trans	54.9	10.2	-179.6	-56.1	177.5	-177.1	176.2	0	115.3	P239 F240 G241	P239-K243 HydrophobicContact CB-CB 4.24Å; P239-K243 HydrophobicContact CB-CG 4.23Å; F240-K243 PolarHBondContact O-N 2.91Å; G241-K243 PolarHBondContact O-N 2.77Å
244	N	90	Very high	93.3	Very high	132 Å²	132	61.6 Å²	61.6	71%	0.706	34%	0.339	S	S	*	.			trans	-127.1	124	-175.9	-175	12.3	0	0	0	110.1	L242	L242-N244 PolarHBondContact O-N 2.8Å
245	G	90.9	Very high	93.4	Very high	36 Å²	36	66.3 Å²	66.3	37%	0.371	36%	0.357	S	S	.	.	S	Bend	trans	92.8	165.5	-177.5	0	0	0	0	0	113.7	A247 W248 T249	G245-A247 PolarHBondContact O-N 2.84Å; G245-W248 PolarHBondContact O-N 3.05Å; G245-T249 PolarHBondContact O-N 3.26Å; G245-T249 PolarHBondContact O-OG1 3.21Å; G245-T249 VanDerWaalsContact O-OG1 3.1Å
246	T	93.4	Very high	93.3	Very high	48 Å²	48	66.4 Å²	66.4	29%	0.294	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.3	-172.9	57.1	0	0	0	0	113.5	W248 T249 Y274	T246-W248 PolarHBondContact O-N 3.33Å; T246-T249 VanDerWaalsContact O-O 3.13Å; T246-Y274 CarbonylContact C-O 3.57Å; T246-Y274 VanDerWaalsContact CB-O 3.29Å; T246-Y274 WeakPolarHBondContact CB-O 3.27Å; T246-Y274 HydrophobicContact CG2-CE1 4.06Å; T246-Y274 HydrophobicContact CG2-CE2 4.36Å; T246-Y274 PolarHBondContact O-N 2.98Å; T246-Y274 PolarHBondContact OG1-O 3.01Å
247	A	94.7	Very high	93	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.5	176.1	0	0	0	0	0	113	G245 Y273 Y274 Q275 L291 W296	G245-A247 PolarHBondContact O-N 2.84Å; A247-Y273 WeakPolarHBondContact O-CB 3.25Å; A247-Y274 VanDerWaalsContact CA-O 3.29Å; A247-Y274 WeakPolarHBondContact CA-O 3.44Å; A247-Y274 PolarHBondContact N-O 3.36Å; A247-Q275 HydrophobicContact CB-CB 4.09Å; A247-L291 HydrophobicContact CB-CD2 3.7Å; A247-W296 PolarHBondContact O-NE1 3.11Å
248	W	96.3	Very high	92.9	Very high	5 Å²	5	61.8 Å²	61.8	2%	0.019	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-8.6	-171.8	-57.7	100	0	0	0	112.9	P239 F240 L242 G245 T246 L291 N294 W296	P239-W248 WeakPolarHBondContact CA-O 3.35Å; F240-W248 HydrophobicContact CD1-CE3 4.41Å; F240-W248 AromaticContact CD2-CE3 3.95Å; F240-W248 HydrophobicContact CD2-CE3 3.95Å; F240-W248 AromaticContact CD2-CZ3 3.99Å; F240-W248 HydrophobicContact CD2-CZ3 3.99Å; F240-W248 HydrophobicContact CE1-CE3 4.12Å; F240-W248 AromaticContact CE2-CE3 3.65Å; F240-W248 HydrophobicContact CE2-CE3 3.65Å; F240-W248 AromaticContact CE2-CZ3 3.49Å; F240-W248 HydrophobicContact CE2-CZ3 3.49Å; F240-W248 VanDerWaalsContact CE2-CZ3 3.49Å; F240-W248 HydrophobicContact CG-CE3 4.31Å; F240-W248 AromaticContact CZ-CE3 3.72Å; F240-W248 HydrophobicContact CZ-CE3 3.72Å; F240-W248 AromaticContact CZ-CZ3 3.88Å; F240-W248 HydrophobicContact CZ-CZ3 3.88Å; F240-W248 PolarHBondContact N-O 3.4Å; F240-W248 VanDerWaalsContact N-O 3.09Å; F240-W248 WeakPolarHBondContact O-CB 3.28Å; L242-W248 HydrophobicContact CB-CD2 4.11Å; L242-W248 HydrophobicContact CB-CG 4.11Å; L242-W248 HydrophobicContact CD1-CZ2 4.17Å; L242-W248 HydrophobicContact CG-CZ2 4.26Å; G245-W248 PolarHBondContact O-N 3.05Å; T246-W248 PolarHBondContact O-N 3.33Å; W248-L291 HydrophobicContact CZ2-CD2 3.97Å; W248-N294 HydrophobicContact CH2-CB 3.45Å; W248-N294 VanDerWaalsContact CH2-CB 3.45Å; W248-N294 WeakPolarHBondContact CH2-O 3.36Å; W248-N294 HydrophobicContact CZ2-CB 3.64Å; W248-N294 HydrophobicContact CZ3-CB 4.49Å; W248-W296 HydrophobicContact CH2-CB 3.81Å; W248-W296 AromaticContact CH2-CD1 3.91Å; W248-W296 HydrophobicContact CH2-CG 4.3Å; W248-W296 HydrophobicContact CZ2-CB 4.44Å; W248-W296 HydrophobicContact CZ3-CB 4.26Å; W248-W296 AromaticContact CZ3-CD1 3.82Å; W248-W296 HydrophobicContact CZ3-CG 4.47Å
249	T	95.5	Very high	92.8	Very high	45 Å²	45	59.8 Å²	59.8	28%	0.276	34%	0.335	S	S	.	.	S	Bend	trans	-115.9	129.2	178.1	58.6	0	0	0	0	111	P239 G245 T246 T251 Y273	P239-T249 HydrophobicContact CB-CG2 4.32Å; P239-T249 HydrophobicContact CG-CG2 4.39Å; G245-T249 PolarHBondContact O-N 3.26Å; G245-T249 PolarHBondContact O-OG1 3.21Å; G245-T249 VanDerWaalsContact O-OG1 3.1Å; T246-T249 VanDerWaalsContact O-O 3.13Å; T249-T251 PolarHBondContact O-N 3.47Å; T249-Y273 VanDerWaalsContact C-CD1 3.47Å
250	Y	95.3	Very high	92.7	Very high	54 Å²	54	60 Å²	60	21%	0.212	34%	0.338	C	S	.	.			trans	-63	135	-179.7	-176.4	-99.8	0	0	0	111.9	E235 K237 Y273	E235-Y250 WeakPolarHBondContact OE1-CE2 3.39Å; E235-Y250 PolarHBondContact OE1-OH 3.5Å; K237-Y250 HydrophobicContact CB-CD1 4.01Å; K237-Y250 HydrophobicContact CB-CE1 4.44Å; K237-Y250 HydrophobicContact CB-CG 4.06Å; K237-Y250 HydrophobicContact CD-CD1 4.37Å; K237-Y250 HydrophobicContact CD-CE1 4Å; K237-Y250 HydrophobicContact CG-CD1 3.95Å; K237-Y250 HydrophobicContact CG-CD2 4.35Å; K237-Y250 HydrophobicContact CG-CE1 3.87Å; K237-Y250 HydrophobicContact CG-CE2 4.3Å; K237-Y250 HydrophobicContact CG-CG 4.16Å; K237-Y250 WeakPolarHBondContact O-CB 3.19Å; Y250-Y273 HydrophobicContact CD2-CD2 4.45Å; Y250-Y273 AromaticContact CD2-CE2 4Å; Y250-Y273 HydrophobicContact CD2-CE2 4Å
251	T	95.6	Very high	92.7	Very high	10 Å²	10	60 Å²	60	6%	0.061	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-118.8	132.5	173.7	-55.2	0	0	0	0	109.9	T249 K255 L256 G271 G272 Y274	T249-T251 PolarHBondContact O-N 3.47Å; T251-K255 HydrophobicContact CG2-CB 3.92Å; T251-K255 HydrophobicContact CG2-CD 3.91Å; T251-K255 HydrophobicContact CG2-CG 3.98Å; T251-L256 HydrophobicContact CG2-CD1 4.44Å; T251-L256 HydrophobicContact CG2-CD2 3.8Å; T251-L256 HydrophobicContact CG2-CG 3.76Å; T251-G271 CarbonylContact O-C 3.6Å; T251-G271 VanDerWaalsContact O-CA 3.28Å; T251-G271 WeakPolarHBondContact O-CA 3.41Å; T251-G272 PolarHBondContact N-O 3.19Å; T251-G272 PolarHBondContact O-N 2.87Å; T251-Y274 HydrophobicContact CG2-CE1 4.16Å; T251-Y274 WeakPolarHBondContact OG1-CE1 3.12Å
252	S	95.2	Very high	92.8	Very high	55 Å²	55	68 Å²	68	39%	0.385	35%	0.353	S	S	.	.			trans	-69.3	157	179.4	60.2	0	0	0	0	112.5	D254 K255 L256	S252-D254 VanDerWaalsContact C-N 3.31Å; S252-D254 PolarHBondContact O-N 3Å; S252-K255 PolarHBondContact O-N 2.99Å; S252-L256 PolarHBondContact O-N 3.42Å
253	S	93.5	Very high	92.7	Very high	38 Å²	38	65 Å²	65	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-52.8	-45.5	177.9	-147.6	0	0	0	0	112.7	K255 L256 G257 M258 G270	S253-K255 VanDerWaalsContact C-N 3.31Å; S253-K255 PolarHBondContact O-N 3.41Å; S253-L256 PolarHBondContact O-N 2.97Å; S253-G257 PolarHBondContact O-N 3.41Å; S253-M258 PolarHBondContact O-N 2.76Å; S253-M258 PolarHBondContact OG-O 3.29Å; S253-G270 VanDerWaalsContact OG-C 3.31Å; S253-G270 WeakPolarHBondContact OG-CA 3.37Å; S253-G270 PolarHBondContact OG-N 3.07Å
254	D	92.4	Very high	92.7	Very high	150 Å²	150	62.2 Å²	62.2	80%	0.802	34%	0.338	S	S	*	.	H	α-helix	trans	-63	-37.3	-176.2	-54.4	-44.3	0	0	0	112.5	S252 G257	S252-D254 VanDerWaalsContact C-N 3.31Å; S252-D254 PolarHBondContact O-N 3Å; D254-G257 PolarHBondContact O-N 3.23Å
255	K	92.1	Very high	92.7	Very high	162 Å²	162	59 Å²	59	70%	0.704	32%	0.323	S	S	*	.	H	α-helix	trans	-75.7	-31.2	179.5	-176.3	173.1	174.2	-168.7	0	112	T251 S252 S253 G257	T251-K255 HydrophobicContact CG2-CB 3.92Å; T251-K255 HydrophobicContact CG2-CD 3.91Å; T251-K255 HydrophobicContact CG2-CG 3.98Å; S252-K255 PolarHBondContact O-N 2.99Å; S253-K255 VanDerWaalsContact C-N 3.31Å; S253-K255 PolarHBondContact O-N 3.41Å; K255-G257 VanDerWaalsContact C-N 3.34Å
256	L	91.5	Very high	92.7	Very high	12 Å²	12	59.1 Å²	59.1	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-77.4	-22.5	174	-66.7	177.6	0	0	0	112.6	T251 S252 S253 M258 G270 Y274 N430	T251-L256 HydrophobicContact CG2-CD1 4.44Å; T251-L256 HydrophobicContact CG2-CD2 3.8Å; T251-L256 HydrophobicContact CG2-CG 3.76Å; S252-L256 PolarHBondContact O-N 3.42Å; S253-L256 PolarHBondContact O-N 2.97Å; L256-M258 HydrophobicContact CB-CB 4.17Å; L256-M258 HydrophobicContact CB-CG 4.02Å; L256-M258 HydrophobicContact CB-SD 4.37Å; L256-M258 PolarHBondContact O-N 3.12Å; L256-G270 WeakPolarHBondContact CD1-O 3.04Å; L256-Y274 HydrophobicContact CD1-CD1 4.47Å; L256-Y274 HydrophobicContact CD2-CD1 3.55Å; L256-Y274 HydrophobicContact CD2-CE1 3.43Å; L256-Y274 VanDerWaalsContact CD2-CE1 3.43Å; L256-Y274 HydrophobicContact CD2-CE2 4.42Å; L256-Y274 HydrophobicContact CD2-CG 4.11Å; L256-N430 PolarHBondContact O-ND2 3.18Å
257	G	89.1	Confident	92.7	Very high	34 Å²	34	59.5 Å²	59.5	35%	0.351	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	21.4	-170.2	0	0	0	0	0	112.8	S253 D254 K255 N430	S253-G257 PolarHBondContact O-N 3.41Å; D254-G257 PolarHBondContact O-N 3.23Å; K255-G257 VanDerWaalsContact C-N 3.34Å; G257-N430 PolarHBondContact O-ND2 3.28Å
258	M	91.5	Very high	92.8	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.015	32%	0.323	C	S	.	.			trans	-103	150.7	-178.3	-66.1	-176.9	75.8	0	0	110	S253 L256 G270 H307	S253-M258 PolarHBondContact O-N 2.76Å; S253-M258 PolarHBondContact OG-O 3.29Å; L256-M258 HydrophobicContact CB-CB 4.17Å; L256-M258 HydrophobicContact CB-CG 4.02Å; L256-M258 HydrophobicContact CB-SD 4.37Å; L256-M258 PolarHBondContact O-N 3.12Å; M258-G270 WeakPolarHBondContact CB-O 2.94Å; M258-H307 WeakPolarHBondContact CE-CE1 3.02Å; M258-H307 WeakPolarHBondContact CE-ND1 3.17Å
259	Y	91.1	Very high	92.6	Very high	116 Å²	116	60 Å²	60	46%	0.455	33%	0.328	S	S	.	.			trans	-107.2	168.4	-176.1	-75.5	-95	0	0	0	111.4	G270 M433	Y259-G270 WeakPolarHBondContact O-CA 3.39Å; Y259-M433 HydrophobicContact CD1-SD 4.36Å; Y259-M433 HydrophobicContact CD2-CB 3.91Å; Y259-M433 HydrophobicContact CD2-CE 4.35Å; Y259-M433 HydrophobicContact CD2-CG 4.01Å; Y259-M433 HydrophobicContact CD2-SD 3.47Å; Y259-M433 WeakPolarHBondContact CD2-SD 3.43Å; Y259-M433 HydrophobicContact CE1-CE 3.94Å; Y259-M433 HydrophobicContact CE1-SD 4.17Å; Y259-M433 HydrophobicContact CE2-CB 3.83Å; Y259-M433 HydrophobicContact CE2-CE 3.58Å; Y259-M433 HydrophobicContact CE2-CG 3.56Å; Y259-M433 HydrophobicContact CE2-SD 3.23Å; Y259-M433 WeakPolarHBondContact CE2-SD 3.4Å; Y259-M433 HydrophobicContact CG-SD 4.04Å; Y259-M433 VanDerWaalsContact OH-CE 3.31Å; Y259-M433 WeakPolarHBondContact OH-CE 3.43Å
260	S	93	Very high	92.5	Very high	75 Å²	75	58 Å²	58	52%	0.524	32%	0.316	S	S	.	.			trans	-61.6	137.4	173.7	55.6	0	0	0	0	111.4	Y268	S260-Y268 CarbonylContact C-O 3.58Å; S260-Y268 WeakPolarHBondContact CA-O 3.46Å; S260-Y268 WeakPolarHBondContact CB-O 3.32Å
261	Y	93.1	Very high	92.5	Very high	19 Å²	19	55.4 Å²	55.4	8%	0.075	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.9	174.4	179.8	-93.6	0	0	0	109.9	S267 Y268 F305 E322 V324	Y261-S267 CarbonylContact O-C 3.6Å; Y261-S267 WeakPolarHBondContact O-CA 3.5Å; Y261-S267 PolarHBondContact O-OG 3.34Å; Y261-Y268 HydrophobicContact CD1-CD2 4.28Å; Y261-Y268 PolarHBondContact N-O 3.48Å; Y261-Y268 PolarHBondContact O-N 2.84Å; Y261-F305 AromaticContact CD1-CE1 3.93Å; Y261-F305 HydrophobicContact CD1-CE1 3.93Å; Y261-F305 HydrophobicContact CD1-CZ 4.19Å; Y261-F305 HydrophobicContact CD2-CE1 4.32Å; Y261-F305 AromaticContact CG-CE1 3.76Å; Y261-F305 HydrophobicContact CG-CE1 3.76Å; Y261-F305 HydrophobicContact CG-CZ 4.17Å; Y261-E322 WeakPolarHBondContact CD2-OE1 3.5Å; Y261-E322 HydrophobicContact CE2-CG 4.5Å; Y261-V324 HydrophobicContact CD1-CG1 4.12Å; Y261-V324 HydrophobicContact CD1-CG2 4.31Å; Y261-V324 HydrophobicContact CD2-CG2 4.35Å; Y261-V324 HydrophobicContact CE1-CB 4.03Å; Y261-V324 HydrophobicContact CE1-CG1 3.73Å; Y261-V324 HydrophobicContact CE1-CG2 3.78Å; Y261-V324 HydrophobicContact CE2-CG2 3.84Å
262	W	92.1	Very high	92.4	Very high	218 Å²	218	55 Å²	55	83%	0.826	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	100.6	176.5	-168.6	62.2	0	0	0	109.4
263	G	91.7	Very high	92.5	Very high	9 Å²	9	52.3 Å²	52.3	9%	0.093	29%	0.285	C	S	.	.			trans	-88	-177.3	-179.3	0	0	0	0	0	113.6	S266	G263-S266 WeakPolarHBondContact CA-O 3.49Å; G263-S266 PolarHBondContact N-O 2.96Å
264	S	89	Confident	92.7	Very high	85 Å²	85	51.9 Å²	51.9	59%	0.594	28%	0.278	S	S	*	.	S	Bend	trans	-70.1	-34.4	176.3	-168.6	0	0	0	0	111.9	E326	S264-E326 VanDerWaalsContact CB-OE2 3.31Å; S264-E326 WeakPolarHBondContact CB-OE2 3.32Å; S264-E326 PolarHBondContact N-OE2 3.47Å
265	V	89.6	Confident	92.8	Very high	66 Å²	66	46.3 Å²	46.3	40%	0.4	25%	0.247	S	C	.	.	S	Bend	trans	-97.3	-48.4	-175.3	-173.8	0	0	0	0	111.8	E326 P328 I334	V265-E326 WeakPolarHBondContact CB-OE1 3.39Å; V265-E326 HydrophobicContact CG2-CB 4.3Å; V265-E326 WeakPolarHBondContact CG2-OE1 3.41Å; V265-E326 PolarHBondContact N-OE1 3.39Å; V265-P328 HydrophobicContact CG1-CB 4.32Å; V265-P328 HydrophobicContact CG2-CB 4.4Å; V265-P328 HydrophobicContact CG2-CG 3.96Å; V265-I334 HydrophobicContact CG2-CD1 3.75Å
266	S	91.6	Very high	93	Very high	37 Å²	37	40.2 Å²	40.2	26%	0.259	22%	0.222	S	C	.	.			trans	-150.3	169.6	-176	-164.2	0	0	0	0	111.6	Y230 G263 Y268	Y230-S266 PolarHBondContact O-OG 2.94Å; G263-S266 WeakPolarHBondContact CA-O 3.49Å; G263-S266 PolarHBondContact N-O 2.96Å; S266-Y268 WeakPolarHBondContact O-CD2 3.5Å; S266-Y268 VanDerWaalsContact O-CE2 3.23Å; S266-Y268 WeakPolarHBondContact O-CE2 3.35Å
267	S	93.8	Very high	93.2	Very high	56 Å²	56	39.9 Å²	39.9	39%	0.392	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.4	168.5	-170	0	0	0	0	109.3	Y230 Y261	Y230-S267 WeakPolarHBondContact CD1-O 3.26Å; Y230-S267 WeakPolarHBondContact CE1-O 3.42Å; Y261-S267 CarbonylContact O-C 3.6Å; Y261-S267 WeakPolarHBondContact O-CA 3.5Å; Y261-S267 PolarHBondContact O-OG 3.34Å
268	Y	95	Very high	93.3	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.1	-175.5	-61.6	-74.9	0	0	0	110.9	L206 Y230 S260 Y261 S266 R302 V303 F305 E326	L206-Y268 HydrophobicContact CD1-CD1 4.13Å; L206-Y268 HydrophobicContact CD1-CG 4.3Å; Y230-Y268 AromaticContact CD1-CD1 3.73Å; Y230-Y268 HydrophobicContact CD1-CD1 3.73Å; Y230-Y268 HydrophobicContact CD1-CE1 4.18Å; Y230-Y268 HydrophobicContact CD2-CD1 4.04Å; Y230-Y268 HydrophobicContact CD2-CE1 4.4Å; Y230-Y268 HydrophobicContact CE1-CD1 4.12Å; Y230-Y268 HydrophobicContact CE2-CD1 4.4Å; Y230-Y268 AromaticContact CG-CD1 3.68Å; Y230-Y268 HydrophobicContact CG-CD1 3.68Å; Y230-Y268 AromaticContact CG-CE1 3.85Å; Y230-Y268 HydrophobicContact CG-CE1 3.85Å; S260-Y268 CarbonylContact C-O 3.58Å; S260-Y268 WeakPolarHBondContact CA-O 3.46Å; S260-Y268 WeakPolarHBondContact CB-O 3.32Å; Y261-Y268 HydrophobicContact CD1-CD2 4.28Å; Y261-Y268 PolarHBondContact N-O 3.48Å; Y261-Y268 PolarHBondContact O-N 2.84Å; S266-Y268 WeakPolarHBondContact O-CD2 3.5Å; S266-Y268 VanDerWaalsContact O-CE2 3.23Å; S266-Y268 WeakPolarHBondContact O-CE2 3.35Å; Y268-R302 HydrophobicContact CE1-CB 4.35Å; Y268-V303 HydrophobicContact CD1-CB 3.98Å; Y268-V303 HydrophobicContact CD1-CG1 3.38Å; Y268-V303 HydrophobicContact CD2-CB 4.49Å; Y268-V303 HydrophobicContact CD2-CG1 4.35Å; Y268-V303 HydrophobicContact CD2-CG2 4.45Å; Y268-V303 HydrophobicContact CE1-CB 3.84Å; Y268-V303 HydrophobicContact CE1-CG1 3.74Å; Y268-V303 HydrophobicContact CE2-CB 4.37Å; Y268-V303 HydrophobicContact CE2-CG2 4.43Å; Y268-V303 HydrophobicContact CG-CB 4.3Å; Y268-V303 HydrophobicContact CG-CG1 3.72Å; Y268-F305 HydrophobicContact CG-CZ 4.46Å; Y268-E326 HydrophobicContact CE2-CG 3.77Å; Y268-E326 WeakPolarHBondContact CE2-OE1 3.28Å; Y268-E326 VanDerWaalsContact CZ-OE1 3.29Å; Y268-E326 WeakPolarHBondContact OH-CG 3.29Å; Y268-E326 PolarHBondContact OH-OE1 3.49Å
269	G	93.4	Very high	93.1	Very high	12 Å²	12	42 Å²	42	12%	0.124	22%	0.221	C	C	.	.			trans	-65	163	175.9	0	0	0	0	0	113.9	R204 Y230 G271	R204-G269 PolarHBondContact NH1-O 3.42Å; Y230-G269 PolarHBondContact OH-N 3.32Å; G269-G271 VanDerWaalsContact C-N 3.32Å
270	G	93	Very high	93	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	22%	0.223	C	C	.	.	S	Bend	trans	-82	-6.9	175.8	0	0	0	0	0	114.3	R204 S253 L256 M258 Y259	R204-G270 PolarHBondContact NH1-O 3.01Å; R204-G270 VanDerWaalsContact NH1-O 3.15Å; S253-G270 VanDerWaalsContact OG-C 3.31Å; S253-G270 WeakPolarHBondContact OG-CA 3.37Å; S253-G270 PolarHBondContact OG-N 3.07Å; L256-G270 WeakPolarHBondContact CD1-O 3.04Å; M258-G270 WeakPolarHBondContact CB-O 2.94Å; Y259-G270 WeakPolarHBondContact O-CA 3.39Å
271	G	94.5	Very high	92.7	Very high	1 Å²	1	41 Å²	41	1%	0.01	22%	0.216	C	C	.	.			trans	-73.8	-172.7	173.5	0	0	0	0	0	113.5	R204 L206 T251 G269	R204-G271 PolarHBondContact NH1-O 3.48Å; L206-G271 VanDerWaalsContact CD2-O 3.22Å; L206-G271 WeakPolarHBondContact CD2-O 3.24Å; T251-G271 CarbonylContact O-C 3.6Å; T251-G271 VanDerWaalsContact O-CA 3.28Å; T251-G271 WeakPolarHBondContact O-CA 3.41Å; G269-G271 VanDerWaalsContact C-N 3.32Å
272	G	95.4	Very high	92.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	141.1	-174.4	167.8	0	0	0	0	0	115.1	Q205 T251	Q205-G272 WeakPolarHBondContact O-CA 3.24Å; T251-G272 PolarHBondContact N-O 3.19Å; T251-G272 PolarHBondContact O-N 2.87Å
273	Y	97	Very high	92.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127	173.5	-58.7	-87.9	0	0	0	108.2	R204 Q205 R207 D236 K238 F240 A247 T249 Y250	R204-Y273 CarbonylContact C-O 3.4Å; R204-Y273 VanDerWaalsContact CA-O 3.29Å; R204-Y273 WeakPolarHBondContact CA-O 3.38Å; Q205-Y273 HydrophobicContact CG-CD2 4.44Å; Q205-Y273 PolarHBondContact N-O 3.42Å; Q205-Y273 PolarHBondContact O-N 3.05Å; R207-Y273 HydrophobicContact CB-CE2 4.27Å; R207-Y273 HydrophobicContact CG-CD2 4.33Å; R207-Y273 HydrophobicContact CG-CE2 4.39Å; D236-Y273 VanDerWaalsContact O-CE2 3.3Å; D236-Y273 WeakPolarHBondContact O-CE2 3.43Å; D236-Y273 PolarHBondContact O-OH 3.49Å; K238-Y273 PolarHBondContact N-OH 2.71Å; K238-Y273 PolarHBondContact O-OH 2.9Å; F240-Y273 AromaticContact CD1-CD1 3.82Å; F240-Y273 HydrophobicContact CD1-CD1 3.82Å; F240-Y273 AromaticContact CD1-CE1 3.56Å; F240-Y273 HydrophobicContact CD1-CE1 3.56Å; F240-Y273 HydrophobicContact CD1-CE2 4.45Å; F240-Y273 HydrophobicContact CD1-CG 4.34Å; F240-Y273 AromaticContact CD1-CZ 3.94Å; F240-Y273 AromaticContact CE1-CD1 3.45Å; F240-Y273 HydrophobicContact CE1-CD1 3.45Å; F240-Y273 VanDerWaalsContact CE1-CD1 3.45Å; F240-Y273 HydrophobicContact CE1-CD2 4.06Å; F240-Y273 AromaticContact CE1-CE1 3.71Å; F240-Y273 HydrophobicContact CE1-CE1 3.71Å; F240-Y273 HydrophobicContact CE1-CE2 4.31Å; F240-Y273 AromaticContact CE1-CG 3.64Å; F240-Y273 HydrophobicContact CE1-CG 3.64Å; A247-Y273 WeakPolarHBondContact O-CB 3.25Å; T249-Y273 VanDerWaalsContact C-CD1 3.47Å; Y250-Y273 HydrophobicContact CD2-CD2 4.45Å; Y250-Y273 AromaticContact CD2-CE2 4Å; Y250-Y273 HydrophobicContact CD2-CE2 4Å
274	Y	96.2	Very high	92.7	Very high	29 Å²	29	39.9 Å²	39.9	11%	0.114	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	146.6	-173.4	77.7	-79.9	0	0	0	113.1	R202 L203 T246 A247 T251 L256 D276	R202-Y274 HydrophobicContact CG-CD2 4.27Å; L203-Y274 CarbonylContact O-C 3.44Å; L203-Y274 WeakPolarHBondContact O-CA 3.29Å; L203-Y274 WeakPolarHBondContact O-CB 3.43Å; T246-Y274 CarbonylContact C-O 3.57Å; T246-Y274 VanDerWaalsContact CB-O 3.29Å; T246-Y274 WeakPolarHBondContact CB-O 3.27Å; T246-Y274 HydrophobicContact CG2-CE1 4.06Å; T246-Y274 HydrophobicContact CG2-CE2 4.36Å; T246-Y274 PolarHBondContact O-N 2.98Å; T246-Y274 PolarHBondContact OG1-O 3.01Å; A247-Y274 VanDerWaalsContact CA-O 3.29Å; A247-Y274 WeakPolarHBondContact CA-O 3.44Å; A247-Y274 PolarHBondContact N-O 3.36Å; T251-Y274 HydrophobicContact CG2-CE1 4.16Å; T251-Y274 WeakPolarHBondContact OG1-CE1 3.12Å; L256-Y274 HydrophobicContact CD1-CD1 4.47Å; L256-Y274 HydrophobicContact CD2-CD1 3.55Å; L256-Y274 HydrophobicContact CD2-CE1 3.43Å; L256-Y274 VanDerWaalsContact CD2-CE1 3.43Å; L256-Y274 HydrophobicContact CD2-CE2 4.42Å; L256-Y274 HydrophobicContact CD2-CG 4.11Å; Y274-D276 WeakPolarHBondContact CE2-OD2 3.32Å
275	Q	96.2	Very high	92.9	Very high	33 Å²	33	38 Å²	38	15%	0.154	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.7	172.7	-175.6	59.9	52.5	0	0	108.9	L203 A247 L277 L291	L203-Q275 PolarHBondContact N-O 2.94Å; L203-Q275 PolarHBondContact O-N 3.27Å; A247-Q275 HydrophobicContact CB-CB 4.09Å; Q275-L277 HydrophobicContact CG-CD2 4.48Å; Q275-L291 HydrophobicContact CB-CD1 4Å; Q275-L291 HydrophobicContact CG-CD1 4.09Å
276	D	95.4	Very high	93.2	Very high	34 Å²	34	36.6 Å²	36.6	18%	0.182	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.1	167.3	-68.4	-18	0	0	0	108	V200 R202 Y274	V200-D276 HydrophobicContact CG2-CB 3.89Å; R202-D276 WeakPolarHBondContact CB-OD1 3.38Å; R202-D276 VanDerWaalsContact CG-OD1 3.31Å; R202-D276 WeakPolarHBondContact CG-OD1 3.27Å; R202-D276 IonicContact CZ-OD1 3.99Å; R202-D276 IonicContact CZ-OD2 3.43Å; R202-D276 IonicContact NE-OD1 3.21Å; R202-D276 PolarHBondContact NE-OD1 3.38Å; R202-D276 IonicContact NE-OD2 2.68Å; R202-D276 IonicContact NH2-OD1 3.1Å; R202-D276 PolarHBondContact NH2-OD1 3.18Å; R202-D276 IonicContact NH2-OD2 3.32Å; R202-D276 PolarHBondContact NH2-OD2 3.43Å; Y274-D276 WeakPolarHBondContact CE2-OD2 3.32Å
277	L	94.7	Very high	93.4	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-76.8	145.9	179.4	-64.7	-177.4	0	0	0	110.6	M169 W172 V200 P201 L203 Q275 A284 Q287 L288	M169-L277 HydrophobicContact CE-CD1 3.95Å; W172-L277 HydrophobicContact CE3-CD1 4.02Å; W172-L277 HydrophobicContact CH2-CD1 4.47Å; W172-L277 HydrophobicContact CZ3-CD1 3.57Å; V200-L277 WeakPolarHBondContact CB-O 3.34Å; V200-L277 VanDerWaalsContact CG1-O 3.26Å; V200-L277 WeakPolarHBondContact CG1-O 3.49Å; P201-L277 HydrophobicContact CB-CD1 4.26Å; P201-L277 PolarHBondContact O-N 3.17Å; L203-L277 HydrophobicContact CD1-CD1 3.69Å; L203-L277 HydrophobicContact CD1-CD2 4.04Å; L203-L277 HydrophobicContact CD1-CG 3.74Å; Q275-L277 HydrophobicContact CG-CD2 4.48Å; L277-A284 HydrophobicContact CB-CB 4.22Å; L277-Q287 VanDerWaalsContact CA-OE1 3.28Å; L277-Q287 HydrophobicContact CD2-CB 4.31Å; L277-L288 HydrophobicContact CD2-CD2 3.89Å; L277-L288 HydrophobicContact CD2-CG 4.19Å
278	S	92.2	Very high	93.5	Very high	25 Å²	25	34.8 Å²	34.8	18%	0.175	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-66.9	158.2	173	-169.7	0	0	0	0	111	Y173 D280 E283	Y173-S278 WeakPolarHBondContact CE1-O 3.41Å; Y173-S278 PolarHBondContact OH-O 3.12Å; S278-D280 PolarHBondContact O-N 2.91Å; S278-D280 PolarHBondContact OG-N 2.96Å; S278-E283 WeakPolarHBondContact CB-OE2 3.37Å; S278-E283 PolarHBondContact OG-OE2 3.47Å
279	R	88.2	Confident	93.6	Very high	56 Å²	56	38 Å²	38	21%	0.211	21%	0.213	C	C	.	.	S	Bend	trans	-70	-25.1	171.4	-74	-168.7	153.4	-154.3	-11.2	112.8	Y173 L189 V200 P425 N426	Y173-R279 WeakPolarHBondContact CD1-O 3.49Å; Y173-R279 WeakPolarHBondContact CE1-O 3.32Å; L189-R279 HydrophobicContact CD1-CB 3.96Å; L189-R279 HydrophobicContact CD1-CG 3.8Å; V200-R279 HydrophobicContact CG1-CG 3.78Å; R279-P425 PolarHBondContact NE-O 3.4Å; R279-P425 PolarHBondContact NH2-O 3.28Å; R279-N426 WeakPolarHBondContact CD-OD1 3.38Å
280	D	88.1	Confident	93.7	Very high	93 Å²	93	42.7 Å²	42.7	50%	0.497	23%	0.23	S	C	.	.	S	Bend	trans	-82.7	124	178.7	-68.3	-26.9	0	0	0	110	S278 T282 E283 A284	S278-D280 PolarHBondContact O-N 2.91Å; S278-D280 PolarHBondContact OG-N 2.96Å; D280-T282 VanDerWaalsContact C-N 3.27Å; D280-T282 PolarHBondContact O-N 3.46Å; D280-E283 HydrophobicContact CB-CB 4.16Å; D280-E283 HydrophobicContact CB-CG 3.98Å; D280-E283 PolarHBondContact O-N 3.46Å; D280-A284 WeakPolarHBondContact O-CB 3.22Å; D280-A284 PolarHBondContact O-N 3.16Å
281	Q	86.9	Confident	93.8	Very high	78 Å²	78	42.7 Å²	42.7	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-56.4	-40.8	-176.5	-173.8	-177.6	7.2	0	0	112.5	Y173 A284 A285	Y173-Q281 HydrophobicContact CD1-CB 4.13Å; Y173-Q281 HydrophobicContact CD2-CG 4.46Å; Y173-Q281 HydrophobicContact CG-CB 3.97Å; Y173-Q281 HydrophobicContact CG-CG 4.05Å; Q281-A284 PolarHBondContact O-N 3.07Å; Q281-A285 VanDerWaalsContact O-CB 3.24Å; Q281-A285 WeakPolarHBondContact O-CB 3.1Å; Q281-A285 PolarHBondContact O-N 2.93Å
282	T	90.8	Very high	93.9	Very high	118 Å²	118	46.7 Å²	46.7	72%	0.724	25%	0.247	S	C	*	.	H	α-helix	trans	-67.5	-42	-178.8	48.7	0	0	0	0	111.7	D280 G286	D280-T282 VanDerWaalsContact C-N 3.27Å; D280-T282 PolarHBondContact O-N 3.46Å; T282-G286 PolarHBondContact O-N 3.36Å
283	E	92.3	Very high	93.9	Very high	105 Å²	105	52.8 Å²	52.8	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-67.5	-44	175.1	-64.4	-167.8	156.4	0	0	111.4	S278 D280 A285 G286 Q287	S278-E283 WeakPolarHBondContact CB-OE2 3.37Å; S278-E283 PolarHBondContact OG-OE2 3.47Å; D280-E283 HydrophobicContact CB-CB 4.16Å; D280-E283 HydrophobicContact CB-CG 3.98Å; D280-E283 PolarHBondContact O-N 3.46Å; E283-A285 VanDerWaalsContact C-N 3.35Å; E283-A285 PolarHBondContact O-N 2.99Å; E283-G286 CarbonylContact O-C 3.24Å; E283-G286 PolarHBondContact O-N 3.06Å; E283-Q287 WeakPolarHBondContact O-CG 3.49Å; E283-Q287 PolarHBondContact O-N 3.2Å
284	A	93	Very high	93.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-41.3	176.9	0	0	0	0	0	112	M169 Y173 L277 D280 Q281 Q287 L288	M169-A284 HydrophobicContact CE-CB 4.07Å; M169-A284 HydrophobicContact SD-CB 4.14Å; Y173-A284 HydrophobicContact CE1-CB 4.46Å; Y173-A284 HydrophobicContact CE2-CB 4.12Å; L277-A284 HydrophobicContact CB-CB 4.22Å; D280-A284 WeakPolarHBondContact O-CB 3.22Å; D280-A284 PolarHBondContact O-N 3.16Å; Q281-A284 PolarHBondContact O-N 3.07Å; A284-Q287 WeakPolarHBondContact O-CB 3.5Å; A284-Q287 PolarHBondContact O-N 2.84Å; A284-L288 PolarHBondContact O-N 2.85Å
285	A	94.1	Very high	93.8	Very high	45 Å²	45	60.1 Å²	60.1	37%	0.372	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-43.4	173.5	0	0	0	0	0	111.5	Q281 E283 Q287 L288 D289	Q281-A285 VanDerWaalsContact O-CB 3.24Å; Q281-A285 WeakPolarHBondContact O-CB 3.1Å; Q281-A285 PolarHBondContact O-N 2.93Å; E283-A285 VanDerWaalsContact C-N 3.35Å; E283-A285 PolarHBondContact O-N 2.99Å; A285-Q287 VanDerWaalsContact C-N 3.33Å; A285-Q287 PolarHBondContact O-N 3.12Å; A285-L288 PolarHBondContact O-N 3.08Å; A285-D289 WeakPolarHBondContact O-CB 3.13Å; A285-D289 PolarHBondContact O-N 3.38Å
286	G	96.1	Very high	93.8	Very high	37 Å²	37	58.6 Å²	58.6	38%	0.381	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-35.9	174.5	0	0	0	0	0	113.3	T282 E283 K290	T282-G286 PolarHBondContact O-N 3.36Å; E283-G286 CarbonylContact O-C 3.24Å; E283-G286 PolarHBondContact O-N 3.06Å; G286-K290 VanDerWaalsContact O-CB 3.31Å; G286-K290 WeakPolarHBondContact O-CB 3.49Å; G286-K290 PolarHBondContact O-N 2.91Å
287	Q	95.6	Very high	93.8	Very high	54 Å²	54	57.4 Å²	57.4	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-47.2	172.6	-73.8	171.9	-28.9	0	0	111.1	L277 E283 A284 A285 K290 L291	L277-Q287 VanDerWaalsContact CA-OE1 3.28Å; L277-Q287 HydrophobicContact CD2-CB 4.31Å; E283-Q287 WeakPolarHBondContact O-CG 3.49Å; E283-Q287 PolarHBondContact O-N 3.2Å; A284-Q287 WeakPolarHBondContact O-CB 3.5Å; A284-Q287 PolarHBondContact O-N 2.84Å; A285-Q287 VanDerWaalsContact C-N 3.33Å; A285-Q287 PolarHBondContact O-N 3.12Å; Q287-K290 PolarHBondContact O-N 3.26Å; Q287-L291 WeakPolarHBondContact O-CG 3.46Å; Q287-L291 PolarHBondContact O-N 2.84Å
288	L	96	Very high	93.7	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-42.2	177.2	-74.1	-164.8	0	0	0	113.1	W161 I164 Q165 M169 L203 L277 A284 A285 K290 L291 F292	W161-L288 HydrophobicContact CZ3-CD2 4.3Å; I164-L288 HydrophobicContact CG2-CD1 3.74Å; I164-L288 HydrophobicContact CG2-CD2 4.37Å; Q165-L288 HydrophobicContact CG-CB 4.3Å; Q165-L288 HydrophobicContact CG-CD1 4.04Å; M169-L288 HydrophobicContact CE-CD1 3.13Å; M169-L288 HydrophobicContact CE-CG 3.6Å; L203-L288 HydrophobicContact CD1-CD2 4.26Å; L203-L288 HydrophobicContact CD2-CD2 3.91Å; L277-L288 HydrophobicContact CD2-CD2 3.89Å; L277-L288 HydrophobicContact CD2-CG 4.19Å; A284-L288 PolarHBondContact O-N 2.85Å; A285-L288 PolarHBondContact O-N 3.08Å; L288-K290 VanDerWaalsContact C-N 3.3Å; L288-K290 PolarHBondContact O-N 2.84Å; L288-L291 HydrophobicContact CD2-CD1 4.39Å; L288-L291 PolarHBondContact O-N 3.5Å; L288-L291 VanDerWaalsContact O-N 3.17Å; L288-F292 WeakPolarHBondContact O-CB 3.22Å; L288-F292 PolarHBondContact O-N 3.1Å
289	D	96	Very high	93.6	Very high	70 Å²	70	68.2 Å²	68.2	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-42.6	176.2	178.2	51.4	0	0	0	110.7	A285 L291 F292 Q293	A285-D289 WeakPolarHBondContact O-CB 3.13Å; A285-D289 PolarHBondContact O-N 3.38Å; D289-L291 VanDerWaalsContact C-N 3.34Å; D289-L291 PolarHBondContact O-N 3.18Å; D289-F292 PolarHBondContact O-N 3.25Å; D289-Q293 WeakPolarHBondContact O-CB 3.45Å; D289-Q293 VanDerWaalsContact O-CG 3.3Å; D289-Q293 WeakPolarHBondContact O-CG 3.42Å; D289-Q293 PolarHBondContact O-N 2.94Å; D289-Q293 PolarHBondContact OD1-NE2 2.97Å; D289-Q293 PolarHBondContact OD2-NE2 3.01Å
290	K	95.8	Very high	93.8	Very high	111 Å²	111	65.5 Å²	65.5	48%	0.483	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-40	173.3	-174.3	177.4	-179.3	178.9	0	112.6	L242 G286 Q287 L288 N294	L242-K290 HydrophobicContact CD1-CD 4.42Å; L242-K290 HydrophobicContact CD1-CG 4.27Å; G286-K290 VanDerWaalsContact O-CB 3.31Å; G286-K290 WeakPolarHBondContact O-CB 3.49Å; G286-K290 PolarHBondContact O-N 2.91Å; Q287-K290 PolarHBondContact O-N 3.26Å; L288-K290 VanDerWaalsContact C-N 3.3Å; L288-K290 PolarHBondContact O-N 2.84Å; K290-N294 WeakPolarHBondContact O-CB 3.03Å; K290-N294 PolarHBondContact O-N 2.68Å; K290-N294 PolarHBondContact O-ND2 3.02Å
291	L	96.5	Very high	94.2	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-66.8	-41.6	175.7	-66.6	-178.7	0	0	0	111.8	W161 A247 W248 Q275 Q287 L288 D289 L295 W296	W161-L291 HydrophobicContact CH2-CB 3.69Å; W161-L291 HydrophobicContact CZ2-CB 4.44Å; W161-L291 HydrophobicContact CZ3-CB 4.47Å; A247-L291 HydrophobicContact CB-CD2 3.7Å; W248-L291 HydrophobicContact CZ2-CD2 3.97Å; Q275-L291 HydrophobicContact CB-CD1 4Å; Q275-L291 HydrophobicContact CG-CD1 4.09Å; Q287-L291 WeakPolarHBondContact O-CG 3.46Å; Q287-L291 PolarHBondContact O-N 2.84Å; L288-L291 HydrophobicContact CD2-CD1 4.39Å; L288-L291 PolarHBondContact O-N 3.5Å; L288-L291 VanDerWaalsContact O-N 3.17Å; D289-L291 VanDerWaalsContact C-N 3.34Å; D289-L291 PolarHBondContact O-N 3.18Å; L291-L295 PolarHBondContact O-N 3.2Å; L291-W296 HydrophobicContact CB-CB 3.82Å; L291-W296 HydrophobicContact CB-CG 4.24Å; L291-W296 HydrophobicContact CD1-CD2 4.17Å; L291-W296 HydrophobicContact CD1-CE3 4.17Å; L291-W296 HydrophobicContact CD1-CG 4.5Å; L291-W296 HydrophobicContact CD2-CB 4.05Å; L291-W296 HydrophobicContact CD2-CD2 4.17Å; L291-W296 HydrophobicContact CD2-CG 3.75Å; L291-W296 HydrophobicContact CG-CB 4.44Å; L291-W296 HydrophobicContact CG-CG 4.37Å; L291-W296 VanDerWaalsContact O-CB 3.28Å; L291-W296 WeakPolarHBondContact O-CB 3.31Å; L291-W296 PolarHBondContact O-N 3.4Å
292	F	95.6	Very high	94.6	Very high	84 Å²	84	58 Å²	58	37%	0.368	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-52.1	178.4	178.1	-106.4	0	0	0	111.9	W161 L288 D289 N294 L295	W161-F292 HydrophobicContact CB-CD2 3.83Å; W161-F292 HydrophobicContact CB-CE2 3.9Å; W161-F292 AromaticContact CD1-CD2 3.6Å; W161-F292 AromaticContact CD1-CE2 3.86Å; W161-F292 HydrophobicContact CD2-CB 4.32Å; W161-F292 AromaticContact CD2-CD2 3.68Å; W161-F292 HydrophobicContact CD2-CD2 3.68Å; W161-F292 HydrophobicContact CD2-CG 4.46Å; W161-F292 AromaticContact CE2-CD2 3.97Å; W161-F292 HydrophobicContact CE3-CB 4.26Å; W161-F292 HydrophobicContact CE3-CD2 4.31Å; W161-F292 AromaticContact CG-CD2 3.44Å; W161-F292 HydrophobicContact CG-CD2 3.44Å; W161-F292 VanDerWaalsContact CG-CD2 3.44Å; W161-F292 AromaticContact CG-CE2 3.85Å; W161-F292 HydrophobicContact CG-CE2 3.85Å; W161-F292 HydrophobicContact CZ3-CB 4.39Å; W161-F292 AromaticContact NE1-CD2 3.88Å; L288-F292 WeakPolarHBondContact O-CB 3.22Å; L288-F292 PolarHBondContact O-N 3.1Å; D289-F292 PolarHBondContact O-N 3.25Å; F292-N294 PolarHBondContact O-N 3.41Å; F292-L295 PolarHBondContact O-N 2.97Å; F292-L295 VanDerWaalsContact O-N 3.12Å
293	Q	95.6	Very high	94.9	Very high	128 Å²	128	52.4 Å²	52.4	60%	0.598	26%	0.259	S	S	*	.	H	α-helix	trans	-60.4	-30.6	-179.5	-71.5	177.2	10.7	0	0	113.3	D289	D289-Q293 WeakPolarHBondContact O-CB 3.45Å; D289-Q293 VanDerWaalsContact O-CG 3.3Å; D289-Q293 WeakPolarHBondContact O-CG 3.42Å; D289-Q293 PolarHBondContact O-N 2.94Å; D289-Q293 PolarHBondContact OD1-NE2 2.97Å; D289-Q293 PolarHBondContact OD2-NE2 3.01Å
294	N	95.5	Very high	95	Very high	57 Å²	57	47.5 Å²	47.5	31%	0.305	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	17.1	-178.7	-66.7	-81	0	0	0	113.3	L242 W248 K290 F292 W296	L242-N294 HydrophobicContact CD1-CB 4.46Å; L242-N294 WeakPolarHBondContact CD2-OD1 3.17Å; L242-N294 HydrophobicContact CG-CB 4.31Å; W248-N294 HydrophobicContact CH2-CB 3.45Å; W248-N294 VanDerWaalsContact CH2-CB 3.45Å; W248-N294 WeakPolarHBondContact CH2-O 3.36Å; W248-N294 HydrophobicContact CZ2-CB 3.64Å; W248-N294 HydrophobicContact CZ3-CB 4.49Å; K290-N294 WeakPolarHBondContact O-CB 3.03Å; K290-N294 PolarHBondContact O-N 2.68Å; K290-N294 PolarHBondContact O-ND2 3.02Å; F292-N294 PolarHBondContact O-N 3.41Å; N294-W296 PolarHBondContact O-N 3.05Å
295	L	94.9	Very high	95.2	Very high	127 Å²	127	47.5 Å²	47.5	67%	0.665	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	49.8	176.7	-61.3	172.9	0	0	0	112.9	L291 F292 L297	L291-L295 PolarHBondContact O-N 3.2Å; F292-L295 PolarHBondContact O-N 2.97Å; F292-L295 VanDerWaalsContact O-N 3.12Å; L295-L297 VanDerWaalsContact C-N 3.25Å; L295-L297 PolarHBondContact O-N 3.46Å
296	W	96.1	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-59	-39.9	177.9	-172.5	68.6	0	0	0	111.8	W161 L203 Q205 F240 A247 W248 L291 N294 L304	W161-W296 HydrophobicContact CH2-CE3 4.34Å; W161-W296 HydrophobicContact CZ2-CB 4.5Å; W161-W296 HydrophobicContact CZ2-CE3 4.42Å; L203-W296 HydrophobicContact CB-CH2 3.94Å; L203-W296 HydrophobicContact CB-CZ3 4.17Å; L203-W296 HydrophobicContact CD2-CZ3 4.39Å; Q205-W296 HydrophobicContact CB-CH2 3.9Å; Q205-W296 HydrophobicContact CB-CZ2 4.13Å; Q205-W296 HydrophobicContact CB-CZ3 4.39Å; Q205-W296 HydrophobicContact CG-CD2 4.5Å; Q205-W296 HydrophobicContact CG-CH2 3.83Å; Q205-W296 HydrophobicContact CG-CZ2 3.54Å; Q205-W296 HydrophobicContact CG-CZ3 4.43Å; Q205-W296 VanDerWaalsContact NE2-CD1 3.27Å; Q205-W296 PolarHBondContact NE2-O 3.45Å; Q205-W296 PolarHBondContact OE1-O 2.91Å; F240-W296 AromaticContact CZ-CD1 3.64Å; F240-W296 HydrophobicContact CZ-CG 4.49Å; F240-W296 AromaticContact CZ-NE1 3.96Å; A247-W296 PolarHBondContact O-NE1 3.11Å; W248-W296 HydrophobicContact CH2-CB 3.81Å; W248-W296 AromaticContact CH2-CD1 3.91Å; W248-W296 HydrophobicContact CH2-CG 4.3Å; W248-W296 HydrophobicContact CZ2-CB 4.44Å; W248-W296 HydrophobicContact CZ3-CB 4.26Å; W248-W296 AromaticContact CZ3-CD1 3.82Å; W248-W296 HydrophobicContact CZ3-CG 4.47Å; L291-W296 HydrophobicContact CB-CB 3.82Å; L291-W296 HydrophobicContact CB-CG 4.24Å; L291-W296 HydrophobicContact CD1-CD2 4.17Å; L291-W296 HydrophobicContact CD1-CE3 4.17Å; L291-W296 HydrophobicContact CD1-CG 4.5Å; L291-W296 HydrophobicContact CD2-CB 4.05Å; L291-W296 HydrophobicContact CD2-CD2 4.17Å; L291-W296 HydrophobicContact CD2-CG 3.75Å; L291-W296 HydrophobicContact CG-CB 4.44Å; L291-W296 HydrophobicContact CG-CG 4.37Å; L291-W296 VanDerWaalsContact O-CB 3.28Å; L291-W296 WeakPolarHBondContact O-CB 3.31Å; L291-W296 PolarHBondContact O-N 3.4Å; N294-W296 PolarHBondContact O-N 3.05Å; W296-L304 HydrophobicContact CH2-CD1 3.98Å; W296-L304 HydrophobicContact CZ3-CD1 3.62Å
297	L	95.2	Very high	95.3	Very high	9 Å²	9	43.9 Å²	43.9	5%	0.047	20%	0.202	C	C	.	.	S	Bend	trans	-93.7	119.4	168.7	-56.4	178	0	0	0	109	L157 L160 W161 L295 T301 L304	L157-L297 HydrophobicContact CD2-CB 4.41Å; L157-L297 HydrophobicContact CD2-CD1 4.41Å; L160-L297 HydrophobicContact CD2-CD1 4.16Å; W161-L297 HydrophobicContact CD2-CD1 4.48Å; W161-L297 HydrophobicContact CZ2-CB 4.34Å; W161-L297 HydrophobicContact CZ2-CD1 3.76Å; W161-L297 HydrophobicContact CZ2-CG 3.7Å; L295-L297 VanDerWaalsContact C-N 3.25Å; L295-L297 PolarHBondContact O-N 3.46Å; L297-T301 HydrophobicContact CD2-CG2 3.97Å; L297-L304 HydrophobicContact CD1-CD2 3.93Å; L297-L304 HydrophobicContact CD2-CB 4.44Å; L297-L304 HydrophobicContact CD2-CD1 4.28Å; L297-L304 HydrophobicContact CD2-CD2 4.43Å
298	D	92.4	Very high	95.3	Very high	40 Å²	40	41.4 Å²	41.4	21%	0.214	19%	0.19	C	C	.	.			trans	-133.7	-171.7	-178.9	68.8	9.1	0	0	0	111.8	R207 G300 T301	R207-D298 IonicContact CZ-OD2 3.59Å; R207-D298 IonicContact NE-OD1 3.47Å; R207-D298 PolarHBondContact NE-OD1 3.43Å; R207-D298 IonicContact NE-OD2 3.69Å; R207-D298 IonicContact NH2-OD1 3.66Å; R207-D298 IonicContact NH2-OD2 2.69Å; R207-D298 PolarHBondContact NH2-OD2 3.33Å; D298-G300 PolarHBondContact O-N 2.84Å; D298-G300 WeakPolarHBondContact OD1-CA 3.41Å; D298-G300 PolarHBondContact OD1-N 3.1Å; D298-T301 PolarHBondContact N-OG1 3.28Å; D298-T301 WeakPolarHBondContact O-CB 3.29Å; D298-T301 PolarHBondContact O-N 3.43Å; D298-T301 PolarHBondContact OD1-N 2.97Å; D298-T301 VanDerWaalsContact OD1-N 3.14Å; D298-T301 PolarHBondContact OD1-OG1 2.9Å
299	R	91.4	Very high	95.2	Very high	216 Å²	216	41.5 Å²	41.5	82%	0.815	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.3	178.8	-65.4	-178.4	178.9	-176.6	-0.4	113.4	Y227 R302	Y227-R299 HydrophobicContact CD2-CB 3.97Å; Y227-R299 HydrophobicContact CE2-CB 3.96Å; R299-R302 PolarHBondContact O-NH1 2.89Å
300	G	93	Very high	95	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-19.1	178.7	0	0	0	0	0	113.5	R207 M208 D298 R302	R207-G300 CarbonylContact C-O 3.6Å; R207-G300 WeakPolarHBondContact CA-O 3.39Å; M208-G300 PolarHBondContact N-O 2.93Å; D298-G300 PolarHBondContact O-N 2.84Å; D298-G300 WeakPolarHBondContact OD1-CA 3.41Å; D298-G300 PolarHBondContact OD1-N 3.1Å; G300-R302 PolarHBondContact O-N 3.34Å
301	T	95.4	Very high	94.9	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	133.6	173.1	-53.1	0	0	0	0	110.7	Q205 L297 D298	Q205-T301 HydrophobicContact CB-CG2 4.21Å; Q205-T301 VanDerWaalsContact OE1-CG2 3.28Å; Q205-T301 PolarHBondContact OE1-OG1 3.45Å; L297-T301 HydrophobicContact CD2-CG2 3.97Å; D298-T301 PolarHBondContact N-OG1 3.28Å; D298-T301 WeakPolarHBondContact O-CB 3.29Å; D298-T301 PolarHBondContact O-N 3.43Å; D298-T301 PolarHBondContact OD1-N 2.97Å; D298-T301 VanDerWaalsContact OD1-N 3.14Å; D298-T301 PolarHBondContact OD1-OG1 2.9Å
302	R	95.2	Very high	94.7	Very high	13 Å²	13	35.3 Å²	35.3	5%	0.049	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-25.4	176.9	-72	-64.3	168.3	-104.3	15.3	114	L206 M208 Y227 G228 Y230 Y268 R299 G300 V327	L206-R302 PolarHBondContact O-N 2.98Å; M208-R302 HydrophobicContact CB-CG 4.34Å; M208-R302 HydrophobicContact CG-CG 3.44Å; M208-R302 VanDerWaalsContact CG-CG 3.44Å; Y227-R302 PolarHBondContact O-NH2 3.32Å; G228-R302 PolarHBondContact O-NE 3.2Å; G228-R302 PolarHBondContact O-NH2 3.48Å; G228-R302 VanDerWaalsContact O-NH2 3.1Å; Y230-R302 HydrophobicContact CD2-CB 4.44Å; Y268-R302 HydrophobicContact CE1-CB 4.35Å; R299-R302 PolarHBondContact O-NH1 2.89Å; G300-R302 PolarHBondContact O-N 3.34Å; R302-V327 VanDerWaalsContact CD-O 3.23Å; R302-V327 WeakPolarHBondContact CD-O 3.35Å; R302-V327 PolarHBondContact O-N 2.98Å
303	V	96.4	Very high	94.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	140.5	174	58.7	0	0	0	0	110	Q205 L206 Y268 F305 V324 I325 E326	Q205-V303 VanDerWaalsContact CA-O 3.22Å; Q205-V303 WeakPolarHBondContact CA-O 3.11Å; Q205-V303 WeakPolarHBondContact CB-O 3.16Å; L206-V303 HydrophobicContact CB-CG1 3.74Å; L206-V303 HydrophobicContact CD1-CG1 3.78Å; L206-V303 HydrophobicContact CG-CG1 4.01Å; L206-V303 PolarHBondContact N-O 3.15Å; L206-V303 VanDerWaalsContact N-O 3.1Å; Y268-V303 HydrophobicContact CD1-CB 3.98Å; Y268-V303 HydrophobicContact CD1-CG1 3.38Å; Y268-V303 HydrophobicContact CD2-CB 4.49Å; Y268-V303 HydrophobicContact CD2-CG1 4.35Å; Y268-V303 HydrophobicContact CD2-CG2 4.45Å; Y268-V303 HydrophobicContact CE1-CB 3.84Å; Y268-V303 HydrophobicContact CE1-CG1 3.74Å; Y268-V303 HydrophobicContact CE2-CB 4.37Å; Y268-V303 HydrophobicContact CE2-CG2 4.43Å; Y268-V303 HydrophobicContact CG-CB 4.3Å; Y268-V303 HydrophobicContact CG-CG1 3.72Å; V303-F305 HydrophobicContact CB-CE2 4.13Å; V303-F305 HydrophobicContact CG1-CD2 4.11Å; V303-F305 HydrophobicContact CG1-CE2 3.42Å; V303-F305 VanDerWaalsContact CG1-CE2 3.42Å; V303-F305 HydrophobicContact CG1-CZ 4.09Å; V303-F305 HydrophobicContact CG2-CD2 3.97Å; V303-F305 HydrophobicContact CG2-CE1 4.22Å; V303-F305 HydrophobicContact CG2-CE2 3.56Å; V303-F305 HydrophobicContact CG2-CG 4.46Å; V303-F305 HydrophobicContact CG2-CZ 3.67Å; V303-V324 HydrophobicContact CG2-CG1 3.42Å; V303-V324 VanDerWaalsContact CG2-CG1 3.42Å; V303-I325 CarbonylContact C-O 3.58Å; V303-I325 VanDerWaalsContact CA-O 3.29Å; V303-I325 WeakPolarHBondContact CA-O 3.37Å; V303-E326 HydrophobicContact CG2-CG 4.34Å
304	L	96.3	Very high	94	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.9	167.5	171.5	64.2	0	0	0	108.7	L160 I164 L203 R204 W296 L297 I306 V324 I325	L160-L304 HydrophobicContact CD2-CD2 4Å; I164-L304 HydrophobicContact CD1-CD2 3.76Å; L203-L304 HydrophobicContact CB-CD1 4.5Å; R204-L304 CarbonylContact O-C 3.6Å; W296-L304 HydrophobicContact CH2-CD1 3.98Å; W296-L304 HydrophobicContact CZ3-CD1 3.62Å; L297-L304 HydrophobicContact CD1-CD2 3.93Å; L297-L304 HydrophobicContact CD2-CB 4.44Å; L297-L304 HydrophobicContact CD2-CD1 4.28Å; L297-L304 HydrophobicContact CD2-CD2 4.43Å; L304-I306 HydrophobicContact CG-CG1 4.38Å; L304-V324 CarbonylContact O-C 3.1Å; L304-V324 WeakPolarHBondContact O-CA 3.24Å; L304-I325 HydrophobicContact CB-CB 4.32Å; L304-I325 HydrophobicContact CB-CD1 4.47Å; L304-I325 HydrophobicContact CD2-CD1 4.18Å; L304-I325 HydrophobicContact CG-CD1 4.25Å; L304-I325 PolarHBondContact N-O 3Å; L304-I325 PolarHBondContact O-N 2.91Å
305	F	96.8	Very high	93.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.6	176.7	-73.3	-77.5	0	0	0	108.9	L203 R204 L206 Y261 Y268 V303 H307 I323 V324	L203-F305 CarbonylContact C-O 3.6Å; L203-F305 WeakPolarHBondContact CA-O 3.4Å; R204-F305 HydrophobicContact CB-CB 4.06Å; R204-F305 PolarHBondContact N-O 2.9Å; R204-F305 VanDerWaalsContact NH2-CD2 3.33Å; R204-F305 VanDerWaalsContact NH2-CE2 3.3Å; R204-F305 WeakPolarHBondContact O-CB 3.46Å; R204-F305 PolarHBondContact O-N 3.21Å; L206-F305 HydrophobicContact CD1-CE2 4.33Å; Y261-F305 AromaticContact CD1-CE1 3.93Å; Y261-F305 HydrophobicContact CD1-CE1 3.93Å; Y261-F305 HydrophobicContact CD1-CZ 4.19Å; Y261-F305 HydrophobicContact CD2-CE1 4.32Å; Y261-F305 AromaticContact CG-CE1 3.76Å; Y261-F305 HydrophobicContact CG-CE1 3.76Å; Y261-F305 HydrophobicContact CG-CZ 4.17Å; Y268-F305 HydrophobicContact CG-CZ 4.46Å; V303-F305 HydrophobicContact CB-CE2 4.13Å; V303-F305 HydrophobicContact CG1-CD2 4.11Å; V303-F305 HydrophobicContact CG1-CE2 3.42Å; V303-F305 VanDerWaalsContact CG1-CE2 3.42Å; V303-F305 HydrophobicContact CG1-CZ 4.09Å; V303-F305 HydrophobicContact CG2-CD2 3.97Å; V303-F305 HydrophobicContact CG2-CE1 4.22Å; V303-F305 HydrophobicContact CG2-CE2 3.56Å; V303-F305 HydrophobicContact CG2-CG 4.46Å; V303-F305 HydrophobicContact CG2-CZ 3.67Å; F305-H307 WeakPolarHBondContact CB-NE2 3.29Å; F305-H307 AromaticContact CD1-NE2 3.38Å; F305-H307 WeakPolarHBondContact CD1-NE2 3.47Å; F305-H307 AromaticContact CG-NE2 3.71Å; F305-I323 CarbonylContact C-O 3.54Å; F305-I323 WeakPolarHBondContact CA-O 3.49Å; F305-V324 HydrophobicContact CD1-CB 4.33Å; F305-V324 HydrophobicContact CD1-CG1 4.03Å; F305-V324 HydrophobicContact CD1-CG2 3.64Å; F305-V324 HydrophobicContact CE1-CB 4.24Å; F305-V324 HydrophobicContact CE1-CG1 3.63Å; F305-V324 HydrophobicContact CE1-CG2 3.62Å; F305-V324 HydrophobicContact CZ-CG1 4.16Å
306	I	96.5	Very high	93.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	111.8	170.8	-59.7	173.1	0	0	0	107.6	I164 I168 W172 L203 L304 F308 I323 I325	I164-I306 HydrophobicContact CD1-CD1 4.16Å; I164-I306 HydrophobicContact CG1-CD1 4.08Å; I168-I306 HydrophobicContact CD1-CD1 4.3Å; W172-I306 HydrophobicContact CH2-CG2 3.46Å; W172-I306 VanDerWaalsContact CH2-CG2 3.46Å; W172-I306 HydrophobicContact CZ2-CG2 3.38Å; L203-I306 HydrophobicContact CG-CG1 4.44Å; L304-I306 HydrophobicContact CG-CG1 4.38Å; I306-F308 HydrophobicContact CG2-CD1 4.43Å; I306-I323 HydrophobicContact CB-CB 4.2Å; I306-I323 PolarHBondContact N-O 3.45Å; I306-I323 PolarHBondContact O-N 3.47Å; I306-I325 HydrophobicContact CD1-CD1 4.2Å
307	H	95.9	Very high	93.3	Very high	6 Å²	6	29.4 Å²	29.4	3%	0.028	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.1	-172.8	-71.4	-139.6	0	0	0	110.3	P201 R202 M258 F305 V321 E322 F428	P201-H307 WeakPolarHBondContact CA-O 3.49Å; R202-H307 HydrophobicContact CB-CB 4.49Å; R202-H307 PolarHBondContact N-O 2.85Å; R202-H307 PolarHBondContact O-N 2.74Å; M258-H307 WeakPolarHBondContact CE-CE1 3.02Å; M258-H307 WeakPolarHBondContact CE-ND1 3.17Å; F305-H307 WeakPolarHBondContact CB-NE2 3.29Å; F305-H307 AromaticContact CD1-NE2 3.38Å; F305-H307 WeakPolarHBondContact CD1-NE2 3.47Å; F305-H307 AromaticContact CG-NE2 3.71Å; H307-V321 WeakPolarHBondContact CA-O 3.42Å; H307-E322 VanDerWaalsContact CE1-CD 3.43Å; H307-E322 IonicContact CE1-OE1 2.63Å; H307-E322 PolarHBondContact CE1-OE1 2.92Å; H307-E322 IonicContact CE1-OE2 2.9Å; H307-E322 IonicContact NE2-OE1 3.67Å; H307-E322 PolarHBondContact NE2-OE1 3.28Å; H307-F428 HydrophobicContact CB-CE2 3.66Å; H307-F428 HydrophobicContact CB-CZ 3.7Å
308	F	94.9	Very high	93.1	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	158.2	168.7	61.6	-82.4	0	0	0	110.6	F139 W172 L191 L197 P201 I306 T310 V321	F139-F308 HydrophobicContact CD1-CZ 4.28Å; F139-F308 AromaticContact CD2-CZ 3.77Å; F139-F308 HydrophobicContact CD2-CZ 3.77Å; F139-F308 HydrophobicContact CE1-CE1 4.25Å; F139-F308 AromaticContact CE1-CZ 3.86Å; F139-F308 HydrophobicContact CE1-CZ 3.86Å; F139-F308 HydrophobicContact CE2-CE1 4.37Å; F139-F308 AromaticContact CE2-CE2 3.7Å; F139-F308 HydrophobicContact CE2-CE2 3.7Å; F139-F308 AromaticContact CE2-CZ 3.28Å; F139-F308 HydrophobicContact CE2-CZ 3.28Å; F139-F308 HydrophobicContact CG-CZ 4.24Å; F139-F308 HydrophobicContact CZ-CE1 4.14Å; F139-F308 AromaticContact CZ-CE2 3.75Å; F139-F308 HydrophobicContact CZ-CE2 3.75Å; F139-F308 AromaticContact CZ-CZ 3.34Å; F139-F308 HydrophobicContact CZ-CZ 3.34Å; W172-F308 AromaticContact CE2-CD1 3.88Å; W172-F308 AromaticContact CZ2-CD1 3.76Å; W172-F308 HydrophobicContact CZ2-CD1 3.76Å; W172-F308 AromaticContact CZ2-CE1 3.97Å; W172-F308 HydrophobicContact CZ2-CE1 3.97Å; W172-F308 AromaticContact NE1-CD1 3.44Å; W172-F308 AromaticContact NE1-CD2 3.84Å; W172-F308 AromaticContact NE1-CE1 3.42Å; W172-F308 AromaticContact NE1-CE2 3.82Å; W172-F308 AromaticContact NE1-CG 3.66Å; W172-F308 AromaticContact NE1-CZ 3.62Å; L191-F308 HydrophobicContact CD2-CE2 4.13Å; L197-F308 HydrophobicContact CD1-CB 4Å; L197-F308 HydrophobicContact CD1-CD2 3.91Å; L197-F308 HydrophobicContact CD1-CG 4.36Å; P201-F308 HydrophobicContact CB-CB 4.17Å; I306-F308 HydrophobicContact CG2-CD1 4.43Å; F308-T310 HydrophobicContact CD2-CG2 3.91Å; F308-T310 HydrophobicContact CE2-CG2 4.04Å; F308-V321 HydrophobicContact CD1-CB 4.14Å; F308-V321 HydrophobicContact CD1-CG1 4.33Å; F308-V321 HydrophobicContact CD2-CB 4.28Å; F308-V321 HydrophobicContact CD2-CG2 4.41Å; F308-V321 HydrophobicContact CE1-CB 3.67Å; F308-V321 HydrophobicContact CE1-CG1 3.5Å; F308-V321 VanDerWaalsContact CE1-CG1 3.5Å; F308-V321 HydrophobicContact CE1-CG2 4.38Å; F308-V321 HydrophobicContact CE2-CB 3.83Å; F308-V321 HydrophobicContact CE2-CG1 4.33Å; F308-V321 HydrophobicContact CE2-CG2 3.71Å; F308-V321 HydrophobicContact CG-CB 4.41Å; F308-V321 HydrophobicContact CZ-CB 3.48Å; F308-V321 VanDerWaalsContact CZ-CB 3.48Å; F308-V321 HydrophobicContact CZ-CG1 3.49Å; F308-V321 VanDerWaalsContact CZ-CG1 3.49Å; F308-V321 HydrophobicContact CZ-CG2 3.69Å; F308-V321 PolarHBondContact N-O 3.43Å; F308-V321 VanDerWaalsContact N-O 3.14Å; F308-V321 PolarHBondContact O-N 3.1Å
309	T	93.7	Very high	93.2	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.018	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.6	177.1	-57.5	0	0	0	0	109.6	I198 F318 S319 I320 F431	I198-T309 PolarHBondContact N-O 3.39Å; T309-F318 HydrophobicContact CG2-CD1 4.34Å; T309-S319 WeakPolarHBondContact CA-O 3.44Å; T309-I320 HydrophobicContact CG2-CG1 3.85Å; T309-F431 HydrophobicContact CG2-CD2 3.69Å; T309-F431 HydrophobicContact CG2-CE2 4.11Å; T309-F431 HydrophobicContact CG2-CG 4.36Å
310	T	93	Very high	93.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	158.7	173.6	66	0	0	0	0	110.8	M135 L191 R196 L197 F308 F318 S319	M135-T310 HydrophobicContact CE-CG2 4.34Å; L191-T310 HydrophobicContact CD1-CG2 3.87Å; L191-T310 HydrophobicContact CD2-CG2 3.92Å; L191-T310 HydrophobicContact CG-CG2 4.42Å; R196-T310 CarbonylContact O-C 3.54Å; R196-T310 WeakPolarHBondContact O-CA 3.27Å; L197-T310 HydrophobicContact CD1-CG2 4Å; F308-T310 HydrophobicContact CD2-CG2 3.91Å; F308-T310 HydrophobicContact CE2-CG2 4.04Å; T310-F318 CarbonylContact O-C 3.59Å; T310-F318 VanDerWaalsContact O-CA 3.24Å; T310-F318 WeakPolarHBondContact O-CA 3.46Å; T310-S319 PolarHBondContact N-O 3.49Å; T310-S319 PolarHBondContact O-N 2.81Å; T310-S319 WeakPolarHBondContact OG1-CB 3.33Å; T310-S319 PolarHBondContact OG1-O 3.34Å
311	Y	92.3	Very high	93.4	Very high	49 Å²	49	17.5 Å²	17.5	19%	0.192	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	125.8	176	173.6	-111.6	0	0	0	111.1	R196 I198 A313 N316 L317 F318 L345	R196-Y311 PolarHBondContact N-O 3.1Å; R196-Y311 PolarHBondContact O-N 3.06Å; I198-Y311 HydrophobicContact CD1-CG 4.16Å; Y311-A313 HydrophobicContact CE1-CB 3.99Å; Y311-N316 WeakPolarHBondContact CE2-OD1 3.45Å; Y311-N316 PolarHBondContact OH-OD1 3.35Å; Y311-L317 WeakPolarHBondContact CA-O 3.31Å; Y311-L317 WeakPolarHBondContact CD2-O 3.44Å; Y311-F318 HydrophobicContact CD2-CD1 4.03Å; Y311-F318 AromaticContact CD2-CD2 3.56Å; Y311-F318 HydrophobicContact CD2-CD2 3.56Å; Y311-F318 AromaticContact CD2-CE1 3.89Å; Y311-F318 HydrophobicContact CD2-CE1 3.89Å; Y311-F318 AromaticContact CD2-CE2 3.36Å; Y311-F318 HydrophobicContact CD2-CE2 3.36Å; Y311-F318 AromaticContact CD2-CG 3.88Å; Y311-F318 HydrophobicContact CD2-CG 3.88Å; Y311-F318 AromaticContact CD2-CZ 3.55Å; Y311-F318 HydrophobicContact CD2-CZ 3.55Å; Y311-F318 AromaticContact CE2-CD2 3.92Å; Y311-F318 HydrophobicContact CE2-CD2 3.92Å; Y311-F318 AromaticContact CE2-CE2 3.44Å; Y311-F318 HydrophobicContact CE2-CE2 3.44Å; Y311-F318 VanDerWaalsContact CE2-CE2 3.44Å; Y311-F318 AromaticContact CE2-CZ 3.85Å; Y311-F318 HydrophobicContact CE2-CZ 3.85Å; Y311-F318 HydrophobicContact CG-CD1 4.47Å; Y311-F318 HydrophobicContact CG-CE1 4.23Å; Y311-F318 HydrophobicContact CG-CE2 4.4Å; Y311-F318 HydrophobicContact CG-CZ 4.18Å; Y311-L345 HydrophobicContact CE2-CD1 4.45Å
312	N	91.9	Very high	93.4	Very high	5 Å²	5	17.7 Å²	17.7	3%	0.027	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	110.5	173.7	-166.1	-60.6	0	0	0	109.5	N195 N314 M315 N316 L317	N195-N312 WeakPolarHBondContact OD1-CB 3.44Å; N195-N312 PolarHBondContact OD1-ND2 2.7Å; N312-N314 WeakPolarHBondContact OD1-CB 3.34Å; N312-N314 PolarHBondContact OD1-N 3Å; N312-N314 VanDerWaalsContact OD1-N 3.08Å; N312-M315 HydrophobicContact CB-CE 4.07Å; N312-M315 WeakPolarHBondContact ND2-CE 3.35Å; N312-M315 PolarHBondContact OD1-N 3.2Å; N312-M315 VanDerWaalsContact OD1-N 3.17Å; N312-N316 VanDerWaalsContact O-CA 3.28Å; N312-N316 WeakPolarHBondContact O-CA 3.45Å; N312-N316 PolarHBondContact O-N 2.93Å; N312-L317 PolarHBondContact N-O 2.91Å; N312-L317 PolarHBondContact O-N 3.03Å
313	A	89.1	Confident	93.4	Very high	68 Å²	68	17.1 Å²	17.1	56%	0.562	10%	0.096	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-32.4	-178.8	0	0	0	0	0	113.1	Y311 M315 N316	Y311-A313 HydrophobicContact CE1-CB 3.99Å; A313-M315 VanDerWaalsContact C-N 3.29Å; A313-M315 PolarHBondContact O-N 3.2Å; A313-N316 PolarHBondContact O-N 3.46Å
314	N	89	Confident	93.4	Very high	120 Å²	120	17.1 Å²	17.1	64%	0.642	10%	0.096	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.8	-178.8	-62	-30.5	0	0	0	111.8	Q194 N312	Q194-N314 VanDerWaalsContact CD-ND2 3.33Å; Q194-N314 PolarHBondContact OE1-ND2 3.41Å; N312-N314 WeakPolarHBondContact OD1-CB 3.34Å; N312-N314 PolarHBondContact OD1-N 3Å; N312-N314 VanDerWaalsContact OD1-N 3.08Å
315	M	87.6	Confident	93.4	Very high	57 Å²	57	17.2 Å²	17.2	28%	0.281	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-9.4	180	-59.7	-172.6	-68.4	0	0	113.6	N127 L131 N312 A313 L317	N127-M315 HydrophobicContact CB-SD 3.7Å; L131-M315 HydrophobicContact CB-CE 4Å; L131-M315 HydrophobicContact CD1-CE 4.06Å; L131-M315 HydrophobicContact CD2-CE 3.98Å; L131-M315 HydrophobicContact CG-CE 4.23Å; N312-M315 HydrophobicContact CB-CE 4.07Å; N312-M315 WeakPolarHBondContact ND2-CE 3.35Å; N312-M315 PolarHBondContact OD1-N 3.2Å; N312-M315 VanDerWaalsContact OD1-N 3.17Å; A313-M315 VanDerWaalsContact C-N 3.29Å; A313-M315 PolarHBondContact O-N 3.2Å; M315-L317 VanDerWaalsContact C-N 3.32Å; M315-L317 HydrophobicContact CB-CB 4.4Å; M315-L317 HydrophobicContact CB-CD1 3.99Å; M315-L317 HydrophobicContact CB-CG 4.01Å; M315-L317 HydrophobicContact CE-CD1 4.4Å; M315-L317 PolarHBondContact O-N 3.19Å; M315-L317 HydrophobicContact SD-CD1 4.44Å
316	N	90.5	Very high	93.4	Very high	20 Å²	20	17.2 Å²	17.2	11%	0.107	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	50.2	-170.3	-177.6	22.6	0	0	0	112	Y311 N312 A313 L345	Y311-N316 WeakPolarHBondContact CE2-OD1 3.45Å; Y311-N316 PolarHBondContact OH-OD1 3.35Å; N312-N316 VanDerWaalsContact O-CA 3.28Å; N312-N316 WeakPolarHBondContact O-CA 3.45Å; N312-N316 PolarHBondContact O-N 2.93Å; A313-N316 PolarHBondContact O-N 3.46Å; N316-L345 PolarHBondContact ND2-O 2.63Å; N316-L345 WeakPolarHBondContact OD1-CB 3.24Å
317	L	92.1	Very high	93.3	Very high	6 Å²	6	17.8 Å²	17.8	3%	0.031	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.9	-179.9	-69.3	177.6	0	0	0	110.5	L131 Y311 N312 M315 K343	L131-L317 HydrophobicContact CD2-CB 3.83Å; L131-L317 HydrophobicContact CD2-CD1 4.15Å; Y311-L317 WeakPolarHBondContact CA-O 3.31Å; Y311-L317 WeakPolarHBondContact CD2-O 3.44Å; N312-L317 PolarHBondContact N-O 2.91Å; N312-L317 PolarHBondContact O-N 3.03Å; M315-L317 VanDerWaalsContact C-N 3.32Å; M315-L317 HydrophobicContact CB-CB 4.4Å; M315-L317 HydrophobicContact CB-CD1 3.99Å; M315-L317 HydrophobicContact CB-CG 4.01Å; M315-L317 HydrophobicContact CE-CD1 4.4Å; M315-L317 PolarHBondContact O-N 3.19Å; M315-L317 HydrophobicContact SD-CD1 4.44Å; L317-K343 HydrophobicContact CD2-CB 3.9Å
318	F	92.5	Very high	93.2	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.018	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.8	168.9	-67.6	-107	0	0	0	108.1	I198 T309 T310 Y311 S341 V342 L344 L345 F431	I198-F318 HydrophobicContact CD1-CD1 3.79Å; I198-F318 HydrophobicContact CD1-CE1 3.38Å; I198-F318 HydrophobicContact CD1-CZ 4.39Å; T309-F318 HydrophobicContact CG2-CD1 4.34Å; T310-F318 CarbonylContact O-C 3.59Å; T310-F318 VanDerWaalsContact O-CA 3.24Å; T310-F318 WeakPolarHBondContact O-CA 3.46Å; Y311-F318 HydrophobicContact CD2-CD1 4.03Å; Y311-F318 AromaticContact CD2-CD2 3.56Å; Y311-F318 HydrophobicContact CD2-CD2 3.56Å; Y311-F318 AromaticContact CD2-CE1 3.89Å; Y311-F318 HydrophobicContact CD2-CE1 3.89Å; Y311-F318 AromaticContact CD2-CE2 3.36Å; Y311-F318 HydrophobicContact CD2-CE2 3.36Å; Y311-F318 AromaticContact CD2-CG 3.88Å; Y311-F318 HydrophobicContact CD2-CG 3.88Å; Y311-F318 AromaticContact CD2-CZ 3.55Å; Y311-F318 HydrophobicContact CD2-CZ 3.55Å; Y311-F318 AromaticContact CE2-CD2 3.92Å; Y311-F318 HydrophobicContact CE2-CD2 3.92Å; Y311-F318 AromaticContact CE2-CE2 3.44Å; Y311-F318 HydrophobicContact CE2-CE2 3.44Å; Y311-F318 VanDerWaalsContact CE2-CE2 3.44Å; Y311-F318 AromaticContact CE2-CZ 3.85Å; Y311-F318 HydrophobicContact CE2-CZ 3.85Å; Y311-F318 HydrophobicContact CG-CD1 4.47Å; Y311-F318 HydrophobicContact CG-CE1 4.23Å; Y311-F318 HydrophobicContact CG-CE2 4.4Å; Y311-F318 HydrophobicContact CG-CZ 4.18Å; F318-S341 CarbonylContact O-C 3.58Å; F318-S341 VanDerWaalsContact O-CA 3.25Å; F318-S341 WeakPolarHBondContact O-CA 3.34Å; F318-V342 HydrophobicContact CB-CG2 4.24Å; F318-V342 PolarHBondContact N-O 2.93Å; F318-V342 PolarHBondContact O-N 3.06Å; F318-L344 HydrophobicContact CB-CD1 4.01Å; F318-L344 HydrophobicContact CB-CG 4.2Å; F318-L344 HydrophobicContact CD1-CD1 3.92Å; F318-L344 HydrophobicContact CD2-CB 3.72Å; F318-L344 HydrophobicContact CD2-CD1 3.94Å; F318-L344 HydrophobicContact CD2-CG 3.81Å; F318-L344 HydrophobicContact CE1-CD1 4.37Å; F318-L344 HydrophobicContact CE2-CB 3.86Å; F318-L344 HydrophobicContact CE2-CD1 4.42Å; F318-L344 HydrophobicContact CE2-CG 4.4Å; F318-L344 HydrophobicContact CG-CB 4.35Å; F318-L344 HydrophobicContact CG-CD1 3.68Å; F318-L344 HydrophobicContact CG-CG 3.98Å; F318-L345 HydrophobicContact CE2-CD1 4.07Å; F318-L345 HydrophobicContact CE2-CG 3.9Å; F318-L345 HydrophobicContact CZ-CD1 4.16Å; F318-L345 HydrophobicContact CZ-CG 4.2Å; F318-F431 HydrophobicContact CE1-CZ 4.36Å
319	S	93.7	Very high	93	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.9	171.2	-158.4	0	0	0	0	108.7	T309 T310 S341	T309-S319 WeakPolarHBondContact CA-O 3.44Å; T310-S319 PolarHBondContact N-O 3.49Å; T310-S319 PolarHBondContact O-N 2.81Å; T310-S319 WeakPolarHBondContact OG1-CB 3.33Å; T310-S319 PolarHBondContact OG1-O 3.34Å; S319-S341 PolarHBondContact OG-OG 3.11Å
320	I	94.6	Very high	92.7	Very high	10 Å²	10	25.4 Å²	25.4	5%	0.051	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.3	-179.5	-57.9	160.1	0	0	0	106.4	T309 R340 V342 F431	T309-I320 HydrophobicContact CG2-CG1 3.85Å; I320-R340 PolarHBondContact N-O 3.06Å; I320-R340 PolarHBondContact O-N 3.09Å; I320-V342 HydrophobicContact CD1-CG2 3.71Å; I320-F431 HydrophobicContact CD1-CB 3.67Å; I320-F431 HydrophobicContact CD1-CG 4.49Å; I320-F431 HydrophobicContact CG1-CB 3.92Å; I320-F431 HydrophobicContact CG2-CB 4.4Å
321	V	95	Very high	92.5	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.1	-173.1	-177.5	0	0	0	0	109.6	H307 F308 I323 F339	H307-V321 WeakPolarHBondContact CA-O 3.42Å; F308-V321 HydrophobicContact CD1-CB 4.14Å; F308-V321 HydrophobicContact CD1-CG1 4.33Å; F308-V321 HydrophobicContact CD2-CB 4.28Å; F308-V321 HydrophobicContact CD2-CG2 4.41Å; F308-V321 HydrophobicContact CE1-CB 3.67Å; F308-V321 HydrophobicContact CE1-CG1 3.5Å; F308-V321 VanDerWaalsContact CE1-CG1 3.5Å; F308-V321 HydrophobicContact CE1-CG2 4.38Å; F308-V321 HydrophobicContact CE2-CB 3.83Å; F308-V321 HydrophobicContact CE2-CG1 4.33Å; F308-V321 HydrophobicContact CE2-CG2 3.71Å; F308-V321 HydrophobicContact CG-CB 4.41Å; F308-V321 HydrophobicContact CZ-CB 3.48Å; F308-V321 VanDerWaalsContact CZ-CB 3.48Å; F308-V321 HydrophobicContact CZ-CG1 3.49Å; F308-V321 VanDerWaalsContact CZ-CG1 3.49Å; F308-V321 HydrophobicContact CZ-CG2 3.69Å; F308-V321 PolarHBondContact N-O 3.43Å; F308-V321 VanDerWaalsContact N-O 3.14Å; F308-V321 PolarHBondContact O-N 3.1Å; V321-I323 HydrophobicContact CG1-CD1 4.28Å; V321-I323 HydrophobicContact CG1-CG1 3.96Å; V321-F339 HydrophobicContact CB-CD1 4.24Å; V321-F339 HydrophobicContact CB-CE1 4.35Å; V321-F339 HydrophobicContact CG1-CD1 3.67Å; V321-F339 HydrophobicContact CG1-CE1 3.39Å; V321-F339 HydrophobicContact CG1-CG 4.5Å; V321-F339 HydrophobicContact CG1-CZ 4.03Å; V321-F339 HydrophobicContact CG2-CD1 3.66Å; V321-F339 HydrophobicContact CG2-CE1 4.02Å
322	E	94.9	Very high	92.4	Very high	5 Å²	5	28.2 Å²	28.2	2%	0.023	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	103.7	174.9	174.6	163.4	-161.9	0	0	108.2	Y261 H307 V324 S337 D338 Q432	Y261-E322 WeakPolarHBondContact CD2-OE1 3.5Å; Y261-E322 HydrophobicContact CE2-CG 4.5Å; H307-E322 VanDerWaalsContact CE1-CD 3.43Å; H307-E322 IonicContact CE1-OE1 2.63Å; H307-E322 PolarHBondContact CE1-OE1 2.92Å; H307-E322 IonicContact CE1-OE2 2.9Å; H307-E322 IonicContact NE2-OE1 3.67Å; H307-E322 PolarHBondContact NE2-OE1 3.28Å; E322-V324 HydrophobicContact CG-CG2 3.78Å; E322-S337 WeakPolarHBondContact O-CA 3.2Å; E322-D338 HydrophobicContact CB-CB 4.36Å; E322-D338 PolarHBondContact N-O 2.98Å; E322-D338 PolarHBondContact O-N 3.31Å; E322-Q432 PolarHBondContact OE1-NE2 2.83Å; E322-Q432 PolarHBondContact OE2-NE2 3.3Å
323	I	95.9	Very high	92.4	Very high	0 Å²	0	29 Å²	29	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.4	173.8	-58.7	169	0	0	0	107.6	F139 L151 F305 I306 V321 I325 L335 F339	F139-I323 HydrophobicContact CB-CD1 4.12Å; L151-I323 HydrophobicContact CD2-CD1 3.99Å; L151-I323 HydrophobicContact CD2-CG2 3.64Å; F305-I323 CarbonylContact C-O 3.54Å; F305-I323 WeakPolarHBondContact CA-O 3.49Å; I306-I323 HydrophobicContact CB-CB 4.2Å; I306-I323 PolarHBondContact N-O 3.45Å; I306-I323 PolarHBondContact O-N 3.47Å; V321-I323 HydrophobicContact CG1-CD1 4.28Å; V321-I323 HydrophobicContact CG1-CG1 3.96Å; I323-I325 HydrophobicContact CG2-CD1 3.81Å; I323-L335 HydrophobicContact CG2-CD1 3.74Å; I323-F339 HydrophobicContact CG1-CZ 4.38Å
324	V	95.9	Very high	92.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.3	-174.5	-171.3	0	0	0	0	109.4	Y261 V303 L304 F305 E322 E326 N336	Y261-V324 HydrophobicContact CD1-CG1 4.12Å; Y261-V324 HydrophobicContact CD1-CG2 4.31Å; Y261-V324 HydrophobicContact CD2-CG2 4.35Å; Y261-V324 HydrophobicContact CE1-CB 4.03Å; Y261-V324 HydrophobicContact CE1-CG1 3.73Å; Y261-V324 HydrophobicContact CE1-CG2 3.78Å; Y261-V324 HydrophobicContact CE2-CG2 3.84Å; V303-V324 HydrophobicContact CG2-CG1 3.42Å; V303-V324 VanDerWaalsContact CG2-CG1 3.42Å; L304-V324 CarbonylContact O-C 3.1Å; L304-V324 WeakPolarHBondContact O-CA 3.24Å; F305-V324 HydrophobicContact CD1-CB 4.33Å; F305-V324 HydrophobicContact CD1-CG1 4.03Å; F305-V324 HydrophobicContact CD1-CG2 3.64Å; F305-V324 HydrophobicContact CE1-CB 4.24Å; F305-V324 HydrophobicContact CE1-CG1 3.63Å; F305-V324 HydrophobicContact CE1-CG2 3.62Å; F305-V324 HydrophobicContact CZ-CG1 4.16Å; E322-V324 HydrophobicContact CG-CG2 3.78Å; V324-E326 HydrophobicContact CG1-CG 4.23Å; V324-N336 CarbonylContact C-O 3.55Å; V324-N336 HydrophobicContact CB-CB 4.31Å; V324-N336 PolarHBondContact N-O 3.08Å; V324-N336 PolarHBondContact O-N 3.46Å
325	I	96.2	Very high	92.9	Very high	4 Å²	4	25 Å²	25	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	105	175.9	-55.1	91.5	0	0	0	107.6	L160 V303 L304 I306 I323 L333 L335	L160-I325 HydrophobicContact CD1-CD1 4.36Å; L160-I325 HydrophobicContact CD1-CG1 4.09Å; L160-I325 HydrophobicContact CD2-CG2 4.11Å; V303-I325 CarbonylContact C-O 3.58Å; V303-I325 VanDerWaalsContact CA-O 3.29Å; V303-I325 WeakPolarHBondContact CA-O 3.37Å; L304-I325 HydrophobicContact CB-CB 4.32Å; L304-I325 HydrophobicContact CB-CD1 4.47Å; L304-I325 HydrophobicContact CD2-CD1 4.18Å; L304-I325 HydrophobicContact CG-CD1 4.25Å; L304-I325 PolarHBondContact N-O 3Å; L304-I325 PolarHBondContact O-N 2.91Å; I306-I325 HydrophobicContact CD1-CD1 4.2Å; I323-I325 HydrophobicContact CG2-CD1 3.81Å; I325-L333 HydrophobicContact CG2-CB 4.16Å; I325-L333 HydrophobicContact CG2-CD1 4.35Å; I325-L333 HydrophobicContact CG2-CD2 4.03Å; I325-L333 HydrophobicContact CG2-CG 4.41Å; I325-L335 HydrophobicContact CG1-CD1 3.89Å
326	E	95.8	Very high	93.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136.5	175.8	-61.2	-179.9	76.3	0	0	110.1	S264 V265 Y268 V303 V324 I334	S264-E326 VanDerWaalsContact CB-OE2 3.31Å; S264-E326 WeakPolarHBondContact CB-OE2 3.32Å; S264-E326 PolarHBondContact N-OE2 3.47Å; V265-E326 WeakPolarHBondContact CB-OE1 3.39Å; V265-E326 HydrophobicContact CG2-CB 4.3Å; V265-E326 WeakPolarHBondContact CG2-OE1 3.41Å; V265-E326 PolarHBondContact N-OE1 3.39Å; Y268-E326 HydrophobicContact CE2-CG 3.77Å; Y268-E326 WeakPolarHBondContact CE2-OE1 3.28Å; Y268-E326 VanDerWaalsContact CZ-OE1 3.29Å; Y268-E326 WeakPolarHBondContact OH-CG 3.29Å; Y268-E326 PolarHBondContact OH-OE1 3.49Å; V303-E326 HydrophobicContact CG2-CG 4.34Å; V324-E326 HydrophobicContact CG1-CG 4.23Å; E326-I334 HydrophobicContact CB-CB 4.32Å; E326-I334 PolarHBondContact N-O 3.08Å; E326-I334 PolarHBondContact O-N 3.22Å
327	V	95.1	Very high	93.3	Very high	13 Å²	13	25.1 Å²	25.1	8%	0.079	17%	0.17	C	C	.	.			trans	-116.3	88.9	176.5	-168.3	0	0	0	0	107.2	R302 L333	R302-V327 VanDerWaalsContact CD-O 3.23Å; R302-V327 WeakPolarHBondContact CD-O 3.35Å; R302-V327 PolarHBondContact O-N 2.98Å; V327-L333 HydrophobicContact CB-CD2 4.33Å; V327-L333 HydrophobicContact CG1-CD2 4.22Å; V327-L333 HydrophobicContact CG2-CD2 3.57Å
328	P	92.6	Very high	93.4	Very high	15 Å²	15	27.1 Å²	27.1	10%	0.097	18%	0.181	C	C	.	.			trans	-65.2	165.1	178.6	-7	22.8	0	0	0	110.4	V265 S330 G331 S332 I334	V265-P328 HydrophobicContact CG1-CB 4.32Å; V265-P328 HydrophobicContact CG2-CB 4.4Å; V265-P328 HydrophobicContact CG2-CG 3.96Å; P328-S330 PolarHBondContact O-N 3.46Å; P328-G331 PolarHBondContact O-N 3.39Å; P328-S332 WeakPolarHBondContact CD-O 3.48Å; P328-I334 HydrophobicContact CG-CD1 3.57Å; P328-I334 HydrophobicContact CG-CG1 4.02Å
329	A	91.1	Very high	93.4	Very high	59 Å²	59	28 Å²	28	49%	0.488	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-13	176.9	0	0	0	0	0	113.8	G331	A329-G331 PolarHBondContact O-N 2.93Å
330	S	88.4	Confident	93.4	Very high	96 Å²	96	30.1 Å²	30.1	67%	0.671	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-15.5	171	55.2	0	0	0	0	113.9	P328 S332	P328-S330 PolarHBondContact O-N 3.46Å; S330-S332 PolarHBondContact OG-OG 3.49Å
331	G	88.1	Confident	93.3	Very high	57 Å²	57	30.3 Å²	30.3	59%	0.588	20%	0.195	S	C	*	.	S	Bend	trans	85.7	0.3	178.1	0	0	0	0	0	115.7	P328 A329	P328-G331 PolarHBondContact O-N 3.39Å; A329-G331 PolarHBondContact O-N 2.93Å
332	S	89.7	Confident	93.1	Very high	51 Å²	51	30.8 Å²	30.8	36%	0.357	20%	0.198	S	C	.	.			trans	-79.3	166.2	171.6	56.1	0	0	0	0	111.8	P328 S330	P328-S332 WeakPolarHBondContact CD-O 3.48Å; S330-S332 PolarHBondContact OG-OG 3.49Å
333	L	93.5	Very high	92.9	Very high	22 Å²	22	32.7 Å²	32.7	12%	0.115	21%	0.206	C	C	.	.			trans	-102.8	136.9	167.7	-59.3	-177.8	0	0	0	110.5	S156 L157 L160 I325 V327	S156-L333 VanDerWaalsContact C-CD1 3.46Å; S156-L333 VanDerWaalsContact O-CD1 3.29Å; S156-L333 WeakPolarHBondContact O-CD1 3.36Å; L157-L333 HydrophobicContact CD2-CD2 3.93Å; L160-L333 HydrophobicContact CB-CD1 3.99Å; L160-L333 HydrophobicContact CD2-CD1 4.13Å; I325-L333 HydrophobicContact CG2-CB 4.16Å; I325-L333 HydrophobicContact CG2-CD1 4.35Å; I325-L333 HydrophobicContact CG2-CD2 4.03Å; I325-L333 HydrophobicContact CG2-CG 4.41Å; V327-L333 HydrophobicContact CB-CD2 4.33Å; V327-L333 HydrophobicContact CG1-CD2 4.22Å; V327-L333 HydrophobicContact CG2-CD2 3.57Å
334	I	93	Very high	92.5	Very high	54 Å²	54	33 Å²	33	28%	0.277	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120	172.8	-57.6	178.3	0	0	0	107.4	V265 E326 P328	V265-I334 HydrophobicContact CG2-CD1 3.75Å; E326-I334 HydrophobicContact CB-CB 4.32Å; E326-I334 PolarHBondContact N-O 3.08Å; E326-I334 PolarHBondContact O-N 3.22Å; P328-I334 HydrophobicContact CG-CD1 3.57Å; P328-I334 HydrophobicContact CG-CG1 4.02Å
335	L	94.2	Very high	92.1	Very high	51 Å²	51	35.5 Å²	35.5	27%	0.267	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.5	-179.6	178.4	71.1	0	0	0	110.8	L140 L151 I323 I325	L140-L335 HydrophobicContact CD2-CD2 4.23Å; L151-L335 HydrophobicContact CD1-CD1 4.3Å; L151-L335 HydrophobicContact CD2-CD1 4.16Å; L151-L335 HydrophobicContact CG-CD1 3.93Å; L151-L335 HydrophobicContact CG-CD2 4.05Å; I323-L335 HydrophobicContact CG2-CD1 3.74Å; I325-L335 HydrophobicContact CG1-CD1 3.89Å
336	N	94	Very high	91.4	Very high	45 Å²	45	36.1 Å²	36.1	24%	0.241	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	149.4	165.5	-73.5	40.3	0	0	0	108.7	V324	V324-N336 CarbonylContact C-O 3.55Å; V324-N336 HydrophobicContact CB-CB 4.31Å; V324-N336 PolarHBondContact N-O 3.08Å; V324-N336 PolarHBondContact O-N 3.46Å
337	S	93.3	Very high	90.9	Very high	33 Å²	33	39.4 Å²	39.4	23%	0.231	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	132.7	-179	65	0	0	0	0	111.6	L140 E322	L140-S337 WeakPolarHBondContact CD1-OG 3.42Å; E322-S337 WeakPolarHBondContact O-CA 3.2Å
338	D	93	Very high	90.5	Very high	49 Å²	49	43.1 Å²	43.1	26%	0.262	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.6	178	-80.7	-16.9	0	0	0	109.9	E322 R340	E322-D338 HydrophobicContact CB-CB 4.36Å; E322-D338 PolarHBondContact N-O 2.98Å; E322-D338 PolarHBondContact O-N 3.31Å; D338-R340 IonicContact OD2-CZ 2.76Å; D338-R340 IonicContact OD2-NE 2.77Å; D338-R340 IonicContact OD2-NH2 2.85Å; D338-R340 PolarHBondContact OD2-NH2 3.1Å
339	F	94.2	Very high	90.2	Very high	21 Å²	21	45.2 Å²	45.2	9%	0.092	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	107	173.6	-65	-94.2	0	0	0	108.8	T132 M135 N136 F139 L140 V321 I323	T132-F339 HydrophobicContact CG2-CB 3.75Å; T132-F339 WeakPolarHBondContact CG2-O 3.33Å; M135-F339 HydrophobicContact CB-CD1 3.8Å; M135-F339 HydrophobicContact CB-CE1 4.16Å; M135-F339 WeakPolarHBondContact O-CE1 3.29Å; N136-F339 HydrophobicContact CB-CD2 3.85Å; N136-F339 HydrophobicContact CB-CE2 3.91Å; N136-F339 HydrophobicContact CB-CG 4.2Å; N136-F339 HydrophobicContact CB-CZ 4.31Å; F139-F339 HydrophobicContact CB-CE1 4.36Å; F139-F339 HydrophobicContact CB-CZ 4.19Å; F139-F339 HydrophobicContact CD2-CE1 4.3Å; L140-F339 HydrophobicContact CD1-CE2 4.12Å; L140-F339 HydrophobicContact CD2-CE2 4.17Å; L140-F339 HydrophobicContact CD2-CZ 4.11Å; L140-F339 HydrophobicContact CG-CE2 4Å; L140-F339 HydrophobicContact CG-CZ 4.1Å; V321-F339 HydrophobicContact CB-CD1 4.24Å; V321-F339 HydrophobicContact CB-CE1 4.35Å; V321-F339 HydrophobicContact CG1-CD1 3.67Å; V321-F339 HydrophobicContact CG1-CE1 3.39Å; V321-F339 HydrophobicContact CG1-CG 4.5Å; V321-F339 HydrophobicContact CG1-CZ 4.03Å; V321-F339 HydrophobicContact CG2-CD1 3.66Å; V321-F339 HydrophobicContact CG2-CE1 4.02Å; I323-F339 HydrophobicContact CG1-CZ 4.38Å
340	R	93.5	Very high	90.1	Very high	45 Å²	45	47.9 Å²	47.9	17%	0.17	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	98.8	-173.5	-62	175.9	-172.1	169.6	4.1	110.2	I320 D338 S435 V439	I320-R340 PolarHBondContact N-O 3.06Å; I320-R340 PolarHBondContact O-N 3.09Å; D338-R340 IonicContact OD2-CZ 2.76Å; D338-R340 IonicContact OD2-NE 2.77Å; D338-R340 IonicContact OD2-NH2 2.85Å; D338-R340 PolarHBondContact OD2-NH2 3.1Å; R340-S435 PolarHBondContact NH1-OG 2.88Å; R340-V439 HydrophobicContact CG-CG2 4.38Å
341	S	92.7	Very high	90.1	Very high	14 Å²	14	48.5 Å²	48.5	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	121.8	173.4	-58.1	0	0	0	0	110.6	T128 T132 F318 S319	T128-S341 VanDerWaalsContact CG2-O 3.27Å; T128-S341 WeakPolarHBondContact CG2-O 3.41Å; T132-S341 VanDerWaalsContact OG1-CB 3.24Å; T132-S341 WeakPolarHBondContact OG1-CB 3.45Å; T132-S341 PolarHBondContact OG1-OG 3.22Å; F318-S341 CarbonylContact O-C 3.58Å; F318-S341 VanDerWaalsContact O-CA 3.25Å; F318-S341 WeakPolarHBondContact O-CA 3.34Å; S319-S341 PolarHBondContact OG-OG 3.11Å
342	V	90.7	Very high	90	Very high	13 Å²	13	46.2 Å²	46.2	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.1	-171.7	-66.5	0	0	0	0	111.6	F318 I320 L344 Q438	F318-V342 HydrophobicContact CB-CG2 4.24Å; F318-V342 PolarHBondContact N-O 2.93Å; F318-V342 PolarHBondContact O-N 3.06Å; I320-V342 HydrophobicContact CD1-CG2 3.71Å; V342-L344 HydrophobicContact CB-CD2 4.23Å; V342-L344 HydrophobicContact CG2-CD1 4.43Å; V342-L344 HydrophobicContact CG2-CD2 3.64Å; V342-L344 HydrophobicContact CG2-CG 3.85Å; V342-L344 PolarHBondContact O-N 3.35Å; V342-Q438 HydrophobicContact CB-CG 4.27Å; V342-Q438 HydrophobicContact CG1-CB 4.38Å; V342-Q438 HydrophobicContact CG1-CG 3.7Å
343	K	89.3	Confident	90	Very high	45 Å²	45	50 Å²	50	20%	0.196	26%	0.256	C	S	.	.			trans	-87.5	90.2	172.3	-172.5	176.3	-177.9	-176.3	0	109.7	L317 L345 D352	L317-K343 HydrophobicContact CD2-CB 3.9Å; K343-L345 WeakPolarHBondContact CE-O 3.23Å; K343-D352 IonicContact NZ-OD1 2.79Å; K343-D352 PolarHBondContact NZ-OD1 2.99Å; K343-D352 IonicContact NZ-OD2 3.14Å; K343-D352 PolarHBondContact NZ-OD2 3.23Å
344	L	87.3	Confident	89.9	Confident	7 Å²	7	53.6 Å²	53.6	4%	0.037	27%	0.27	C	S	.	.			trans	-76.6	-41.1	179.7	-59.3	-177.4	0	0	0	112.3	F318 V342 R346 V414 F431 L434	F318-L344 HydrophobicContact CB-CD1 4.01Å; F318-L344 HydrophobicContact CB-CG 4.2Å; F318-L344 HydrophobicContact CD1-CD1 3.92Å; F318-L344 HydrophobicContact CD2-CB 3.72Å; F318-L344 HydrophobicContact CD2-CD1 3.94Å; F318-L344 HydrophobicContact CD2-CG 3.81Å; F318-L344 HydrophobicContact CE1-CD1 4.37Å; F318-L344 HydrophobicContact CE2-CB 3.86Å; F318-L344 HydrophobicContact CE2-CD1 4.42Å; F318-L344 HydrophobicContact CE2-CG 4.4Å; F318-L344 HydrophobicContact CG-CB 4.35Å; F318-L344 HydrophobicContact CG-CD1 3.68Å; F318-L344 HydrophobicContact CG-CG 3.98Å; V342-L344 HydrophobicContact CB-CD2 4.23Å; V342-L344 HydrophobicContact CG2-CD1 4.43Å; V342-L344 HydrophobicContact CG2-CD2 3.64Å; V342-L344 HydrophobicContact CG2-CG 3.85Å; V342-L344 PolarHBondContact O-N 3.35Å; L344-R346 PolarHBondContact O-N 3.06Å; L344-V414 HydrophobicContact CB-CG1 4.08Å; L344-V414 HydrophobicContact CB-CG2 4.22Å; L344-V414 HydrophobicContact CD2-CG2 4.42Å; L344-F431 HydrophobicContact CD1-CD1 3.71Å; L344-F431 HydrophobicContact CD1-CE1 3.62Å; L344-L434 HydrophobicContact CD1-CD2 3.78Å; L344-L434 HydrophobicContact CD2-CD2 3.6Å; L344-L434 HydrophobicContact CD2-CG 4.28Å; L344-L434 HydrophobicContact CG-CD2 4.29Å
345	L	87.7	Confident	89.8	Confident	51 Å²	51	51.2 Å²	51.2	27%	0.267	26%	0.259	S	S	.	.			trans	-84.6	90.2	176.3	-62.9	174.1	0	0	0	109.8	Y311 N316 F318 K343 V348 V414 L418	Y311-L345 HydrophobicContact CE2-CD1 4.45Å; N316-L345 PolarHBondContact ND2-O 2.63Å; N316-L345 WeakPolarHBondContact OD1-CB 3.24Å; F318-L345 HydrophobicContact CE2-CD1 4.07Å; F318-L345 HydrophobicContact CE2-CG 3.9Å; F318-L345 HydrophobicContact CZ-CD1 4.16Å; F318-L345 HydrophobicContact CZ-CG 4.2Å; K343-L345 WeakPolarHBondContact CE-O 3.23Å; L345-V348 HydrophobicContact CB-CG2 4.41Å; L345-V414 HydrophobicContact CD2-CG1 4.38Å; L345-L418 HydrophobicContact CD2-CD2 3.97Å
346	R	83	Confident	89.5	Confident	18 Å²	18	51.5 Å²	51.5	7%	0.068	26%	0.26	C	S	.	.			trans	-79.4	-47.4	-170.9	-65.3	-178.2	79.4	-147	7.7	113.3	L344 V348 D352 E359	L344-R346 PolarHBondContact O-N 3.06Å; R346-V348 PolarHBondContact O-N 2.99Å; R346-V348 VanDerWaalsContact O-N 3.12Å; R346-D352 WeakPolarHBondContact O-CB 3.45Å; R346-E359 IonicContact CZ-OE1 2.68Å; R346-E359 IonicContact NH1-OE1 3.19Å; R346-E359 PolarHBondContact NH1-OE1 2.99Å; R346-E359 IonicContact NH1-OE2 3.31Å; R346-E359 PolarHBondContact NH1-OE2 3.4Å; R346-E359 IonicContact NH2-OE1 2.79Å; R346-E359 PolarHBondContact NH2-OE1 2.97Å
347	Y	85.3	Confident	89.4	Confident	68 Å²	68	52.1 Å²	52.1	27%	0.267	27%	0.271	S	S	.	.	S	Bend	trans	-92.2	69.6	-166.4	-49.1	-61.2	0	0	0	113	Y353 L356 E359 T411	Y347-Y353 PolarHBondContact O-OH 3.1Å; Y347-L356 HydrophobicContact CD1-CB 3.97Å; Y347-L356 HydrophobicContact CD1-CD1 4.49Å; Y347-L356 HydrophobicContact CD1-CD2 4.26Å; Y347-L356 HydrophobicContact CD1-CG 4.47Å; Y347-L356 HydrophobicContact CE1-CB 3.68Å; Y347-L356 HydrophobicContact CE1-CD1 3.71Å; Y347-L356 HydrophobicContact CE1-CD2 4.29Å; Y347-L356 HydrophobicContact CE1-CG 4.08Å; Y347-E359 PolarHBondContact OH-OE2 3.47Å; Y347-T411 HydrophobicContact CE2-CG2 4.16Å
348	V	85.8	Confident	89.3	Confident	91 Å²	91	51.1 Å²	51.1	55%	0.552	26%	0.264	S	S	*	.			trans	-116.6	-49.8	-179	-176.5	0	0	0	0	111.6	L345 R346	L345-V348 HydrophobicContact CB-CG2 4.41Å; R346-V348 PolarHBondContact O-N 2.99Å; R346-V348 VanDerWaalsContact O-N 3.12Å
349	T	86.6	Confident	89.3	Confident	60 Å²	60	49.7 Å²	49.7	37%	0.368	26%	0.256	S	S	.	.	S	Bend	trans	-88.1	157.4	-176.2	70.8	0	0	0	0	111.7	F351 D352 Y353	T349-F351 PolarHBondContact O-N 3.34Å; T349-D352 WeakPolarHBondContact CB-OD2 3.25Å; T349-D352 PolarHBondContact N-OD2 2.83Å; T349-D352 WeakPolarHBondContact O-CA 3.27Å; T349-D352 VanDerWaalsContact O-CB 3.31Å; T349-D352 WeakPolarHBondContact O-CB 3.2Å; T349-D352 PolarHBondContact O-N 3.35Å; T349-D352 PolarHBondContact OG1-N 2.77Å; T349-D352 PolarHBondContact OG1-OD2 2.89Å; T349-Y353 VanDerWaalsContact O-CD2 3.25Å; T349-Y353 WeakPolarHBondContact O-CD2 3.44Å; T349-Y353 PolarHBondContact O-N 3.49Å
350	P	88.6	Confident	89.2	Confident	115 Å²	115	51.9 Å²	51.9	75%	0.747	27%	0.273	S	S	*	.	H	α-helix	trans	-54.3	-35.5	174	-27.3	35.5	0	0	0	113.6	D352 Y353 F354	P350-D352 VanDerWaalsContact C-N 3.32Å; P350-Y353 PolarHBondContact O-N 3.31Å; P350-F354 PolarHBondContact O-N 3.42Å
351	F	88.2	Confident	89.1	Confident	108 Å²	108	51.3 Å²	51.3	47%	0.474	28%	0.278	S	S	.	.	H	α-helix	trans	-66.7	-34.1	175.4	-176	-102.3	0	0	0	112.1	T349 Y353 F354 V355	T349-F351 PolarHBondContact O-N 3.34Å; F351-Y353 VanDerWaalsContact C-N 3.31Å; F351-Y353 PolarHBondContact O-N 3.43Å; F351-F354 HydrophobicContact CD2-CD1 4.39Å; F351-F354 HydrophobicContact CE2-CD1 4.14Å; F351-F354 WeakPolarHBondContact O-CB 3.42Å; F351-F354 PolarHBondContact O-N 3.01Å; F351-F354 VanDerWaalsContact O-N 3.12Å; F351-V355 HydrophobicContact CD1-CG2 4.16Å; F351-V355 HydrophobicContact CE1-CG2 3.82Å; F351-V355 HydrophobicContact CZ-CG2 4.25Å; F351-V355 WeakPolarHBondContact O-CG2 3.38Å; F351-V355 PolarHBondContact O-N 3.49Å
352	D	87	Confident	89	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.048	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-34.1	176.1	-61.7	-46	0	0	0	112.4	K343 R346 T349 P350 F354 V355 L356	K343-D352 IonicContact NZ-OD1 2.79Å; K343-D352 PolarHBondContact NZ-OD1 2.99Å; K343-D352 IonicContact NZ-OD2 3.14Å; K343-D352 PolarHBondContact NZ-OD2 3.23Å; R346-D352 WeakPolarHBondContact O-CB 3.45Å; T349-D352 WeakPolarHBondContact CB-OD2 3.25Å; T349-D352 PolarHBondContact N-OD2 2.83Å; T349-D352 WeakPolarHBondContact O-CA 3.27Å; T349-D352 VanDerWaalsContact O-CB 3.31Å; T349-D352 WeakPolarHBondContact O-CB 3.2Å; T349-D352 PolarHBondContact O-N 3.35Å; T349-D352 PolarHBondContact OG1-N 2.77Å; T349-D352 PolarHBondContact OG1-OD2 2.89Å; P350-D352 VanDerWaalsContact C-N 3.32Å; D352-F354 VanDerWaalsContact C-N 3.32Å; D352-V355 PolarHBondContact O-N 3.34Å; D352-L356 PolarHBondContact O-N 2.87Å
353	Y	89.6	Confident	89.1	Confident	132 Å²	132	54.7 Å²	54.7	52%	0.518	29%	0.293	S	S	.	.	H	α-helix	trans	-68.5	-31.9	172	-69.5	-76	0	0	0	112.4	Y347 T349 P350 F351 L356 A357	Y347-Y353 PolarHBondContact O-OH 3.1Å; T349-Y353 VanDerWaalsContact O-CD2 3.25Å; T349-Y353 WeakPolarHBondContact O-CD2 3.44Å; T349-Y353 PolarHBondContact O-N 3.49Å; P350-Y353 PolarHBondContact O-N 3.31Å; F351-Y353 VanDerWaalsContact C-N 3.31Å; F351-Y353 PolarHBondContact O-N 3.43Å; Y353-L356 WeakPolarHBondContact O-CB 3.32Å; Y353-L356 PolarHBondContact O-N 3.32Å; Y353-A357 PolarHBondContact O-N 3.14Å; Y353-A357 VanDerWaalsContact O-N 3.08Å
354	F	91.1	Very high	89.2	Confident	96 Å²	96	58.4 Å²	58.4	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-42.9	170.3	175.5	-104.3	0	0	0	111.5	V118 P350 F351 D352 L356 A357 C358	V118-F354 HydrophobicContact CG1-CD1 4.31Å; V118-F354 HydrophobicContact CG1-CE1 3.83Å; P350-F354 PolarHBondContact O-N 3.42Å; F351-F354 HydrophobicContact CD2-CD1 4.39Å; F351-F354 HydrophobicContact CE2-CD1 4.14Å; F351-F354 WeakPolarHBondContact O-CB 3.42Å; F351-F354 PolarHBondContact O-N 3.01Å; F351-F354 VanDerWaalsContact O-N 3.12Å; D352-F354 VanDerWaalsContact C-N 3.32Å; F354-L356 VanDerWaalsContact C-N 3.28Å; F354-L356 PolarHBondContact O-N 2.66Å; F354-A357 WeakPolarHBondContact O-CB 3.36Å; F354-A357 PolarHBondContact O-N 3.08Å; F354-A357 VanDerWaalsContact O-N 3.14Å; F354-C358 PolarHBondContact O-N 3.15Å
355	V	89.9	Confident	89.4	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-39	173	175.6	0	0	0	0	111.1	V118 F351 D352 A357 C358 E359	V118-V355 HydrophobicContact CG1-CG2 4.47Å; F351-V355 HydrophobicContact CD1-CG2 4.16Å; F351-V355 HydrophobicContact CE1-CG2 3.82Å; F351-V355 HydrophobicContact CZ-CG2 4.25Å; F351-V355 WeakPolarHBondContact O-CG2 3.38Å; F351-V355 PolarHBondContact O-N 3.49Å; D352-V355 PolarHBondContact O-N 3.34Å; V355-A357 PolarHBondContact O-N 3.35Å; V355-C358 VanDerWaalsContact O-CB 3.28Å; V355-C358 WeakPolarHBondContact O-CB 3.35Å; V355-C358 PolarHBondContact O-N 3.04Å; V355-E359 WeakPolarHBondContact O-CG 3.3Å; V355-E359 PolarHBondContact O-N 3.26Å
356	L	89.6	Confident	89.5	Confident	56 Å²	56	57.7 Å²	57.7	29%	0.293	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-44	173.7	178.5	61.4	0	0	0	112.3	Y347 D352 Y353 F354 C358 E359 C360	Y347-L356 HydrophobicContact CD1-CB 3.97Å; Y347-L356 HydrophobicContact CD1-CD1 4.49Å; Y347-L356 HydrophobicContact CD1-CD2 4.26Å; Y347-L356 HydrophobicContact CD1-CG 4.47Å; Y347-L356 HydrophobicContact CE1-CB 3.68Å; Y347-L356 HydrophobicContact CE1-CD1 3.71Å; Y347-L356 HydrophobicContact CE1-CD2 4.29Å; Y347-L356 HydrophobicContact CE1-CG 4.08Å; D352-L356 PolarHBondContact O-N 2.87Å; Y353-L356 WeakPolarHBondContact O-CB 3.32Å; Y353-L356 PolarHBondContact O-N 3.32Å; F354-L356 VanDerWaalsContact C-N 3.28Å; F354-L356 PolarHBondContact O-N 2.66Å; L356-C358 VanDerWaalsContact C-N 3.3Å; L356-C358 PolarHBondContact O-N 3.46Å; L356-E359 WeakPolarHBondContact O-CB 3.5Å; L356-E359 PolarHBondContact O-N 3.08Å; L356-E359 VanDerWaalsContact O-N 3.16Å; L356-C360 PolarHBondContact O-N 2.88Å; L356-C360 PolarHBondContact O-SG 3.49Å
357	A	91.5	Very high	89.9	Confident	58 Å²	58	59.4 Å²	59.4	48%	0.479	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-40.2	176.1	0	0	0	0	0	111.7	Y353 F354 V355 C360 A361	Y353-A357 PolarHBondContact O-N 3.14Å; Y353-A357 VanDerWaalsContact O-N 3.08Å; F354-A357 WeakPolarHBondContact O-CB 3.36Å; F354-A357 PolarHBondContact O-N 3.08Å; F354-A357 VanDerWaalsContact O-N 3.14Å; V355-A357 PolarHBondContact O-N 3.35Å; A357-C360 PolarHBondContact O-N 3.22Å; A357-A361 PolarHBondContact O-N 3.5Å
358	C	91.9	Very high	90.1	Very high	12 Å²	12	58.1 Å²	58.1	8%	0.081	32%	0.322	C	S	.	.	H	α-helix	trans	-59.9	-43.8	171.8	-81.4	0	0	0	0	112.3	N115 V118 I119 F354 V355 L356 C360 A361 F362	N115-C358 PolarHBondContact ND2-O 3.39Å; N115-C358 WeakPolarHBondContact OD1-CA 3.44Å; N115-C358 WeakPolarHBondContact OD1-CB 3.07Å; N115-C358 PolarHBondContact OD1-O 3.02Å; N115-C358 VanDerWaalsContact OD1-O 3.12Å; N115-C358 PolarHBondContact OD1-SG 3.49Å; V118-C358 HydrophobicContact CG1-CB 4.24Å; I119-C358 HydrophobicContact CG1-CB 4.08Å; F354-C358 PolarHBondContact O-N 3.15Å; V355-C358 VanDerWaalsContact O-CB 3.28Å; V355-C358 WeakPolarHBondContact O-CB 3.35Å; V355-C358 PolarHBondContact O-N 3.04Å; L356-C358 VanDerWaalsContact C-N 3.3Å; L356-C358 PolarHBondContact O-N 3.46Å; C358-C360 PolarHBondContact O-N 2.91Å; C358-A361 PolarHBondContact O-N 3.01Å; C358-F362 WeakPolarHBondContact O-CB 3.41Å; C358-F362 PolarHBondContact O-N 3.19Å
359	E	91.2	Very high	90.2	Very high	20 Å²	20	54.2 Å²	54.2	9%	0.093	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-44.7	175.4	-72	177	166.1	0	0	112.1	I119 R346 Y347 V355 L356 A361 F362 L363	I119-E359 HydrophobicContact CD1-CG 4.24Å; I119-E359 HydrophobicContact CG1-CG 4.15Å; R346-E359 IonicContact CZ-OE1 2.68Å; R346-E359 IonicContact NH1-OE1 3.19Å; R346-E359 PolarHBondContact NH1-OE1 2.99Å; R346-E359 IonicContact NH1-OE2 3.31Å; R346-E359 PolarHBondContact NH1-OE2 3.4Å; R346-E359 IonicContact NH2-OE1 2.79Å; R346-E359 PolarHBondContact NH2-OE1 2.97Å; Y347-E359 PolarHBondContact OH-OE2 3.47Å; V355-E359 WeakPolarHBondContact O-CG 3.3Å; V355-E359 PolarHBondContact O-N 3.26Å; L356-E359 WeakPolarHBondContact O-CB 3.5Å; L356-E359 PolarHBondContact O-N 3.08Å; L356-E359 VanDerWaalsContact O-N 3.16Å; E359-A361 PolarHBondContact O-N 3.44Å; E359-F362 WeakPolarHBondContact O-CB 3.45Å; E359-F362 PolarHBondContact O-N 2.88Å; E359-L363 WeakPolarHBondContact O-CG 3.35Å; E359-L363 PolarHBondContact O-N 2.94Å
360	C	92	Very high	90.4	Very high	66 Å²	66	53.7 Å²	53.7	45%	0.446	29%	0.292	S	S	.	.	H	α-helix	trans	-61.6	-44.4	174.3	-66.2	0	0	0	0	111.8	L356 A357 C358 F362 L363 I364	L356-C360 PolarHBondContact O-N 2.88Å; L356-C360 PolarHBondContact O-SG 3.49Å; A357-C360 PolarHBondContact O-N 3.22Å; C358-C360 PolarHBondContact O-N 2.91Å; C360-F362 VanDerWaalsContact C-N 3.26Å; C360-F362 PolarHBondContact O-N 3.35Å; C360-L363 PolarHBondContact O-N 3.39Å; C360-I364 WeakPolarHBondContact O-CG1 3.39Å; C360-I364 PolarHBondContact O-N 2.92Å
361	A	91.9	Very high	90.5	Very high	33 Å²	33	51.4 Å²	51.4	27%	0.273	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-35.2	175.5	0	0	0	0	0	112	N115 A357 C358 E359 I364 F365	N115-A361 WeakPolarHBondContact ND2-CB 3.43Å; A357-A361 PolarHBondContact O-N 3.5Å; C358-A361 PolarHBondContact O-N 3.01Å; E359-A361 PolarHBondContact O-N 3.44Å; A361-I364 WeakPolarHBondContact O-CB 3.35Å; A361-I364 PolarHBondContact O-N 3.34Å; A361-F365 WeakPolarHBondContact O-CD2 3.34Å; A361-F365 PolarHBondContact O-N 2.92Å
362	F	91.6	Very high	90.4	Very high	21 Å²	21	47.3 Å²	47.3	9%	0.092	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-39	176.5	-176.6	-111.4	0	0	0	112.3	N115 L116 I119 C358 E359 C360 I364 F365 I366	N115-F362 PolarHBondContact ND2-N 2.92Å; L116-F362 HydrophobicContact CD1-CE2 3.85Å; L116-F362 HydrophobicContact CD1-CZ 4Å; I119-F362 HydrophobicContact CD1-CB 3.46Å; I119-F362 VanDerWaalsContact CD1-CB 3.46Å; I119-F362 HydrophobicContact CD1-CD1 4.23Å; I119-F362 HydrophobicContact CD1-CD2 4.34Å; I119-F362 HydrophobicContact CD1-CG 3.78Å; C358-F362 WeakPolarHBondContact O-CB 3.41Å; C358-F362 PolarHBondContact O-N 3.19Å; E359-F362 WeakPolarHBondContact O-CB 3.45Å; E359-F362 PolarHBondContact O-N 2.88Å; C360-F362 VanDerWaalsContact C-N 3.26Å; C360-F362 PolarHBondContact O-N 3.35Å; F362-I364 VanDerWaalsContact C-N 3.3Å; F362-I364 PolarHBondContact O-N 2.93Å; F362-F365 PolarHBondContact O-N 3.35Å; F362-I366 HydrophobicContact CD1-CD1 3.67Å; F362-I366 HydrophobicContact CD1-CG1 4.36Å; F362-I366 HydrophobicContact CE1-CD1 3.4Å; F362-I366 HydrophobicContact CE1-CG1 4.12Å; F362-I366 HydrophobicContact CG-CD1 4.44Å; F362-I366 HydrophobicContact CZ-CD1 3.94Å; F362-I366 HydrophobicContact CZ-CG1 4.2Å; F362-I366 WeakPolarHBondContact O-CG1 3.48Å; F362-I366 PolarHBondContact O-N 3.47Å
363	L	92	Very high	90.4	Very high	77 Å²	77	47.4 Å²	47.4	40%	0.403	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-39.7	172.5	-65.1	177	0	0	0	112.1	E359 C360 I366 A367 A404	E359-L363 WeakPolarHBondContact O-CG 3.35Å; E359-L363 PolarHBondContact O-N 2.94Å; C360-L363 PolarHBondContact O-N 3.39Å; L363-I366 HydrophobicContact CD2-CD1 4.49Å; L363-I366 PolarHBondContact O-N 2.99Å; L363-A367 PolarHBondContact O-N 3.14Å; L363-A404 HydrophobicContact CD2-CB 3.58Å
364	I	92	Very high	90.4	Very high	123 Å²	123	44.8 Å²	44.8	63%	0.631	25%	0.252	S	S	*	.	H	α-helix	trans	-63.9	-43.3	175.2	-63.3	168.7	0	0	0	110.4	C360 A361 F362 A367 Y368	C360-I364 WeakPolarHBondContact O-CG1 3.39Å; C360-I364 PolarHBondContact O-N 2.92Å; A361-I364 WeakPolarHBondContact O-CB 3.35Å; A361-I364 PolarHBondContact O-N 3.34Å; F362-I364 VanDerWaalsContact C-N 3.3Å; F362-I364 PolarHBondContact O-N 2.93Å; I364-A367 PolarHBondContact O-N 3.34Å; I364-Y368 PolarHBondContact O-N 2.93Å
365	F	90.9	Very high	90.1	Very high	30 Å²	30	44.4 Å²	44.4	13%	0.132	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-42.7	174.9	-76	-59.9	0	0	0	112.3	L108 T111 K112 A361 F362 A367 Y368 Y369	L108-F365 HydrophobicContact CD1-CE1 3.69Å; L108-F365 HydrophobicContact CG-CE1 4.1Å; T111-F365 HydrophobicContact CG2-CZ 4.11Å; K112-F365 HydrophobicContact CG-CG 4.46Å; A361-F365 WeakPolarHBondContact O-CD2 3.34Å; A361-F365 PolarHBondContact O-N 2.92Å; F362-F365 PolarHBondContact O-N 3.35Å; F365-A367 VanDerWaalsContact C-N 3.35Å; F365-A367 PolarHBondContact O-N 3.41Å; F365-Y368 WeakPolarHBondContact O-CB 3.41Å; F365-Y368 PolarHBondContact O-N 3.38Å; F365-Y369 HydrophobicContact CB-CE2 4.33Å; F365-Y369 WeakPolarHBondContact O-CD2 3.49Å; F365-Y369 PolarHBondContact O-N 2.88Å
366	I	90	Very high	89.9	Confident	13 Å²	13	46 Å²	46	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-48.3	175.6	-69.6	168	0	0	0	110.1	F362 L363 Y368 Y369 I370 I401 A404	F362-I366 HydrophobicContact CD1-CD1 3.67Å; F362-I366 HydrophobicContact CD1-CG1 4.36Å; F362-I366 HydrophobicContact CE1-CD1 3.4Å; F362-I366 HydrophobicContact CE1-CG1 4.12Å; F362-I366 HydrophobicContact CG-CD1 4.44Å; F362-I366 HydrophobicContact CZ-CD1 3.94Å; F362-I366 HydrophobicContact CZ-CG1 4.2Å; F362-I366 WeakPolarHBondContact O-CG1 3.48Å; F362-I366 PolarHBondContact O-N 3.47Å; L363-I366 HydrophobicContact CD2-CD1 4.49Å; L363-I366 PolarHBondContact O-N 2.99Å; I366-Y368 VanDerWaalsContact C-N 3.31Å; I366-Y368 PolarHBondContact O-N 3.45Å; I366-Y369 PolarHBondContact O-N 3.5Å; I366-I370 HydrophobicContact CG2-CD1 3.59Å; I366-I370 HydrophobicContact CG2-CG1 4.19Å; I366-I370 VanDerWaalsContact O-CG1 3.29Å; I366-I370 WeakPolarHBondContact O-CG1 3.1Å; I366-I370 PolarHBondContact O-N 2.96Å; I366-I401 HydrophobicContact CG2-CG1 4.08Å; I366-A404 HydrophobicContact CD1-CB 4.39Å
367	A	91.7	Very high	89.7	Confident	54 Å²	54	46.1 Å²	46.1	45%	0.446	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-41.5	178.5	0	0	0	0	0	112.1	L363 I364 F365 I370 V371	L363-A367 PolarHBondContact O-N 3.14Å; I364-A367 PolarHBondContact O-N 3.34Å; F365-A367 VanDerWaalsContact C-N 3.35Å; F365-A367 PolarHBondContact O-N 3.41Å; A367-I370 PolarHBondContact O-N 3.27Å; A367-V371 WeakPolarHBondContact O-CG2 3.35Å; A367-V371 PolarHBondContact O-N 2.96Å; A367-V371 VanDerWaalsContact O-N 3.15Å
368	Y	89.4	Confident	89.5	Confident	41 Å²	41	51.7 Å²	51.7	16%	0.161	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-49.5	174	169.2	-90.6	0	0	0	111.7	W78 L108 I364 F365 I366 V371 E372	W78-Y368 HydrophobicContact CH2-CD2 4.37Å; W78-Y368 HydrophobicContact CZ2-CD2 4.14Å; L108-Y368 HydrophobicContact CD2-CD1 4.33Å; L108-Y368 HydrophobicContact CD2-CE1 3.77Å; I364-Y368 PolarHBondContact O-N 2.93Å; F365-Y368 WeakPolarHBondContact O-CB 3.41Å; F365-Y368 PolarHBondContact O-N 3.38Å; I366-Y368 VanDerWaalsContact C-N 3.31Å; I366-Y368 PolarHBondContact O-N 3.45Å; Y368-V371 PolarHBondContact O-N 3.24Å; Y368-E372 WeakPolarHBondContact CE1-OE2 3.48Å; Y368-E372 PolarHBondContact O-N 3.21Å; Y368-E372 PolarHBondContact OH-OE2 3.02Å
369	Y	87.9	Confident	89	Confident	9 Å²	9	57.9 Å²	57.9	4%	0.035	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-37.7	179.8	-73	-61	0	0	0	113	K112 F365 I366 V371 E372 E373	K112-Y369 HydrophobicContact CD-CD2 4.36Å; K112-Y369 HydrophobicContact CD-CE2 3.41Å; K112-Y369 VanDerWaalsContact CD-CE2 3.41Å; K112-Y369 VanDerWaalsContact CE-CE2 3.4Å; K112-Y369 HydrophobicContact CG-CE2 4.1Å; F365-Y369 HydrophobicContact CB-CE2 4.33Å; F365-Y369 WeakPolarHBondContact O-CD2 3.49Å; F365-Y369 PolarHBondContact O-N 2.88Å; I366-Y369 PolarHBondContact O-N 3.5Å; Y369-V371 VanDerWaalsContact C-N 3.29Å; Y369-V371 PolarHBondContact O-N 3.43Å; Y369-E372 PolarHBondContact O-N 3.37Å; Y369-E373 WeakPolarHBondContact O-CG 3.21Å; Y369-E373 PolarHBondContact O-N 2.9Å
370	I	90.3	Very high	88.4	Confident	50 Å²	50	60.9 Å²	60.9	26%	0.256	31%	0.313	S	S	.	.	H	α-helix	trans	-57.5	-46.3	175.4	-72.4	168	0	0	0	110.3	I366 A367 E373 I374 I397 I401	I366-I370 HydrophobicContact CG2-CD1 3.59Å; I366-I370 HydrophobicContact CG2-CG1 4.19Å; I366-I370 VanDerWaalsContact O-CG1 3.29Å; I366-I370 WeakPolarHBondContact O-CG1 3.1Å; I366-I370 PolarHBondContact O-N 2.96Å; A367-I370 PolarHBondContact O-N 3.27Å; I370-E373 PolarHBondContact O-N 2.84Å; I370-I374 HydrophobicContact CG2-CD1 3.55Å; I370-I374 HydrophobicContact CG2-CG1 4.35Å; I370-I374 WeakPolarHBondContact O-CB 3.41Å; I370-I374 WeakPolarHBondContact O-CD1 3.33Å; I370-I374 WeakPolarHBondContact O-CG1 3.3Å; I370-I374 PolarHBondContact O-N 3.5Å; I370-I397 HydrophobicContact CD1-CG2 4.4Å; I370-I397 HydrophobicContact CG1-CG2 3.7Å; I370-I401 HydrophobicContact CD1-CD1 3.91Å; I370-I401 HydrophobicContact CD1-CG1 4.33Å
371	V	90.1	Very high	88	Confident	67 Å²	67	59.2 Å²	59.2	41%	0.406	31%	0.307	S	S	.	.	H	α-helix	trans	-71.9	-35.5	-178.7	178.4	0	0	0	0	110.9	W78 A367 Y368 Y369 M375	W78-V371 HydrophobicContact CE3-CG1 4.42Å; W78-V371 HydrophobicContact CH2-CB 3.28Å; W78-V371 HydrophobicContact CH2-CG1 3.12Å; W78-V371 HydrophobicContact CZ2-CB 3.98Å; W78-V371 HydrophobicContact CZ2-CG1 3.75Å; W78-V371 HydrophobicContact CZ3-CB 3.99Å; W78-V371 HydrophobicContact CZ3-CG1 3.45Å; W78-V371 VanDerWaalsContact CZ3-CG1 3.45Å; A367-V371 WeakPolarHBondContact O-CG2 3.35Å; A367-V371 PolarHBondContact O-N 2.96Å; A367-V371 VanDerWaalsContact O-N 3.15Å; Y368-V371 PolarHBondContact O-N 3.24Å; Y369-V371 VanDerWaalsContact C-N 3.29Å; Y369-V371 PolarHBondContact O-N 3.43Å; V371-M375 HydrophobicContact CG1-SD 4.45Å; V371-M375 VanDerWaalsContact O-CG 3.31Å; V371-M375 WeakPolarHBondContact O-CG 3.32Å; V371-M375 PolarHBondContact O-N 3.25Å; V371-M375 VanDerWaalsContact O-N 3.11Å
372	E	87.1	Confident	87.4	Confident	22 Å²	22	68.9 Å²	68.9	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-57.2	-52	170.8	-173.3	171.1	-167.5	0	0	110.9	K105 Y368 Y369 I374 M375 E376	K105-E372 IonicContact NZ-OE1 2.84Å; K105-E372 PolarHBondContact NZ-OE1 2.98Å; Y368-E372 WeakPolarHBondContact CE1-OE2 3.48Å; Y368-E372 PolarHBondContact O-N 3.21Å; Y368-E372 PolarHBondContact OH-OE2 3.02Å; Y369-E372 PolarHBondContact O-N 3.37Å; E372-I374 PolarHBondContact O-N 3.5Å; E372-M375 WeakPolarHBondContact O-CB 3.44Å; E372-M375 PolarHBondContact O-N 3.37Å; E372-E376 PolarHBondContact O-N 2.77Å; E372-E376 VanDerWaalsContact O-N 3.08Å
373	E	87.5	Confident	86.9	Confident	10 Å²	10	73.3 Å²	73.3	5%	0.047	36%	0.36	C	S	.	.	H	α-helix	trans	-67.7	-38.4	-178.7	-63.7	-50.2	154	0	0	113	Y369 I370 M375 E376 I377 Y384 I397	Y369-E373 WeakPolarHBondContact O-CG 3.21Å; Y369-E373 PolarHBondContact O-N 2.9Å; I370-E373 PolarHBondContact O-N 2.84Å; E373-M375 PolarHBondContact O-N 3.09Å; E373-E376 PolarHBondContact O-N 3.24Å; E373-I377 WeakPolarHBondContact O-CB 3.27Å; E373-I377 VanDerWaalsContact O-CG1 3.23Å; E373-I377 WeakPolarHBondContact O-CG1 3.11Å; E373-I377 PolarHBondContact O-N 3.38Å; E373-Y384 WeakPolarHBondContact OE2-CE2 3.32Å; E373-Y384 VanDerWaalsContact OE2-CZ 3.28Å; E373-Y384 PolarHBondContact OE2-OH 3.38Å; E373-I397 HydrophobicContact CB-CD1 4.27Å; E373-I397 HydrophobicContact CG-CD1 3.4Å
374	I	87.8	Confident	86.2	Confident	77 Å²	77	69.7 Å²	69.7	40%	0.395	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-38.1	175.6	-71.9	167.8	0	0	0	110.7	I370 E372 K378	I370-I374 HydrophobicContact CG2-CD1 3.55Å; I370-I374 HydrophobicContact CG2-CG1 4.35Å; I370-I374 WeakPolarHBondContact O-CB 3.41Å; I370-I374 WeakPolarHBondContact O-CD1 3.33Å; I370-I374 WeakPolarHBondContact O-CG1 3.3Å; I370-I374 PolarHBondContact O-N 3.5Å; E372-I374 PolarHBondContact O-N 3.5Å; I374-K378 HydrophobicContact CG2-CD 4.28Å; I374-K378 WeakPolarHBondContact O-CB 3.42Å; I374-K378 VanDerWaalsContact O-CG 3.3Å; I374-K378 WeakPolarHBondContact O-CG 3.12Å; I374-K378 PolarHBondContact O-N 2.87Å
375	M	85.9	Confident	85.6	Confident	88 Å²	88	69.3 Å²	69.3	43%	0.433	34%	0.335	S	S	.	.	H	α-helix	trans	-67.4	-42.1	176.1	-72.6	179.9	63	0	0	111.8	W78 V371 E372 E373 K378 K379	W78-M375 HydrophobicContact CE3-SD 3.61Å; W78-M375 HydrophobicContact CZ3-SD 3.63Å; V371-M375 HydrophobicContact CG1-SD 4.45Å; V371-M375 VanDerWaalsContact O-CG 3.31Å; V371-M375 WeakPolarHBondContact O-CG 3.32Å; V371-M375 PolarHBondContact O-N 3.25Å; V371-M375 VanDerWaalsContact O-N 3.11Å; E372-M375 WeakPolarHBondContact O-CB 3.44Å; E372-M375 PolarHBondContact O-N 3.37Å; E373-M375 PolarHBondContact O-N 3.09Å; M375-K378 PolarHBondContact O-N 3.19Å; M375-K379 PolarHBondContact O-N 2.84Å; M375-K379 VanDerWaalsContact O-N 3.16Å
376	E	84.8	Confident	85	Confident	40 Å²	40	73.7 Å²	73.7	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-64.4	-45.1	176.9	-69	-168.3	-178.3	0	0	112	E372 E373 K378 K379 Q380 Y384	E372-E376 PolarHBondContact O-N 2.77Å; E372-E376 VanDerWaalsContact O-N 3.08Å; E373-E376 PolarHBondContact O-N 3.24Å; E376-K378 PolarHBondContact O-N 3.27Å; E376-K379 PolarHBondContact O-N 2.97Å; E376-Q380 WeakPolarHBondContact O-CB 3.37Å; E376-Q380 PolarHBondContact O-N 3.5Å; E376-Y384 HydrophobicContact CB-CD2 4.05Å; E376-Y384 HydrophobicContact CB-CE2 3.82Å
377	I	86.8	Confident	84.5	Confident	58 Å²	58	75 Å²	75	30%	0.297	38%	0.375	S	S	.	.	H	α-helix	trans	-62.3	-42.9	178	-66.3	166.5	0	0	0	110.9	E373 K379 G381 Y384 I394	E373-I377 WeakPolarHBondContact O-CB 3.27Å; E373-I377 VanDerWaalsContact O-CG1 3.23Å; E373-I377 WeakPolarHBondContact O-CG1 3.11Å; E373-I377 PolarHBondContact O-N 3.38Å; I377-K379 VanDerWaalsContact C-N 3.27Å; I377-K379 PolarHBondContact O-N 3.18Å; I377-G381 WeakPolarHBondContact O-CA 3.2Å; I377-G381 PolarHBondContact O-N 3.06Å; I377-Y384 HydrophobicContact CD1-CE1 4.4Å; I377-Y384 HydrophobicContact CG1-CD1 3.95Å; I377-Y384 HydrophobicContact CG1-CD2 4.12Å; I377-Y384 HydrophobicContact CG1-CE1 4Å; I377-Y384 HydrophobicContact CG1-CE2 4.12Å; I377-Y384 HydrophobicContact CG1-CG 4.04Å; I377-I394 HydrophobicContact CD1-CD1 4.4Å
378	K	85.7	Confident	84.1	Confident	175 Å²	175	77.9 Å²	77.9	76%	0.761	39%	0.386	S	S	*	.	H	α-helix	trans	-62.6	-34.4	177.4	-80	-179.1	178.2	-176.8	0	112.7	I374 M375 E376	I374-K378 HydrophobicContact CG2-CD 4.28Å; I374-K378 WeakPolarHBondContact O-CB 3.42Å; I374-K378 VanDerWaalsContact O-CG 3.3Å; I374-K378 WeakPolarHBondContact O-CG 3.12Å; I374-K378 PolarHBondContact O-N 2.87Å; M375-K378 PolarHBondContact O-N 3.19Å; E376-K378 PolarHBondContact O-N 3.27Å
379	K	83.2	Confident	83.8	Confident	142 Å²	142	79.1 Å²	79.1	62%	0.617	39%	0.391	S	S	*	.	H	α-helix	trans	-81.2	-42	-178.4	-166.3	179.8	-176.8	-170.3	0	112.5	L82 M375 E376 I377	L82-K379 PolarHBondContact O-NZ 3.18Å; M375-K379 PolarHBondContact O-N 2.84Å; M375-K379 VanDerWaalsContact O-N 3.16Å; E376-K379 PolarHBondContact O-N 2.97Å; I377-K379 VanDerWaalsContact C-N 3.27Å; I377-K379 PolarHBondContact O-N 3.18Å
380	Q	77.7	Confident	83.7	Confident	83 Å²	83	79.3 Å²	79.3	39%	0.388	39%	0.392	S	S	.	.	H	α-helix	trans	-100	-13.6	-169.8	-166.9	154.2	-0.1	0	0	113.6	E376 W382 I383	E376-Q380 WeakPolarHBondContact O-CB 3.37Å; E376-Q380 PolarHBondContact O-N 3.5Å; Q380-W382 PolarHBondContact O-N 2.91Å; Q380-I383 HydrophobicContact CG-CB 3.9Å; Q380-I383 HydrophobicContact CG-CG2 4.18Å; Q380-I383 PolarHBondContact O-N 3.47Å
381	G	83.8	Confident	83.6	Confident	31 Å²	31	78.9 Å²	78.9	32%	0.32	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	59.7	-127.7	178.9	0	0	0	0	0	111.7	I377 Y384	I377-G381 WeakPolarHBondContact O-CA 3.2Å; I377-G381 PolarHBondContact O-N 3.06Å; G381-Y384 WeakPolarHBondContact O-CB 3.46Å
382	W	80	Confident	83.6	Confident	235 Å²	235	76.8 Å²	76.8	89%	0.89	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-80	-21.1	-174.2	-73.3	50.6	0	0	0	113.9	Q380 Y384 F385	Q380-W382 PolarHBondContact O-N 2.91Å; W382-Y384 PolarHBondContact O-N 3.1Å; W382-Y384 VanDerWaalsContact O-N 3.16Å; W382-F385 PolarHBondContact O-N 3.41Å
383	I	81.3	Confident	83.7	Confident	115 Å²	115	76.1 Å²	76.1	59%	0.59	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-63	-24.1	177.5	-60.7	171.4	0	0	0	110.4	Q380 F385 V386	Q380-I383 HydrophobicContact CG-CB 3.9Å; Q380-I383 HydrophobicContact CG-CG2 4.18Å; Q380-I383 PolarHBondContact O-N 3.47Å; I383-F385 VanDerWaalsContact C-N 3.31Å; I383-F385 PolarHBondContact O-N 2.86Å; I383-V386 WeakPolarHBondContact O-CB 3.38Å; I383-V386 PolarHBondContact O-N 3.3Å
384	Y	76	Confident	83.9	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-55.1	-42.7	177.3	177.6	-84.7	0	0	0	112.8	E373 E376 I377 G381 W382 V386 S387 N390 I394	E373-Y384 WeakPolarHBondContact OE2-CE2 3.32Å; E373-Y384 VanDerWaalsContact OE2-CZ 3.28Å; E373-Y384 PolarHBondContact OE2-OH 3.38Å; E376-Y384 HydrophobicContact CB-CD2 4.05Å; E376-Y384 HydrophobicContact CB-CE2 3.82Å; I377-Y384 HydrophobicContact CD1-CE1 4.4Å; I377-Y384 HydrophobicContact CG1-CD1 3.95Å; I377-Y384 HydrophobicContact CG1-CD2 4.12Å; I377-Y384 HydrophobicContact CG1-CE1 4Å; I377-Y384 HydrophobicContact CG1-CE2 4.12Å; I377-Y384 HydrophobicContact CG1-CG 4.04Å; G381-Y384 WeakPolarHBondContact O-CB 3.46Å; W382-Y384 PolarHBondContact O-N 3.1Å; W382-Y384 VanDerWaalsContact O-N 3.16Å; Y384-V386 PolarHBondContact O-N 3.01Å; Y384-S387 PolarHBondContact O-N 3.49Å; Y384-N390 HydrophobicContact CD1-CB 4.15Å; Y384-N390 HydrophobicContact CD2-CB 4.25Å; Y384-N390 WeakPolarHBondContact CD2-ND2 3.4Å; Y384-N390 HydrophobicContact CE1-CB 3.62Å; Y384-N390 HydrophobicContact CE2-CB 3.78Å; Y384-N390 WeakPolarHBondContact CE2-ND2 3.4Å; Y384-N390 HydrophobicContact CG-CB 4.42Å; Y384-N390 VanDerWaalsContact CZ-CB 3.44Å; Y384-N390 PolarHBondContact OH-O 2.87Å; Y384-I394 HydrophobicContact CD1-CD1 4.4Å; Y384-I394 HydrophobicContact CE1-CD1 3.52Å; Y384-I394 HydrophobicContact CE1-CG1 4.14Å
385	F	79.1	Confident	84.1	Confident	115 Å²	115	77.9 Å²	77.9	50%	0.504	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-73.7	-11.9	-176.5	-69.5	-75	0	0	0	114.1	W382 I383 S387 S391 I394	W382-F385 PolarHBondContact O-N 3.41Å; I383-F385 VanDerWaalsContact C-N 3.31Å; I383-F385 PolarHBondContact O-N 2.86Å; F385-S387 PolarHBondContact O-N 3.43Å; F385-S391 PolarHBondContact O-OG 3.11Å; F385-I394 HydrophobicContact CD1-CD1 4.28Å; F385-I394 HydrophobicContact CE1-CD1 3.48Å; F385-I394 VanDerWaalsContact CE1-CD1 3.48Å; F385-I394 HydrophobicContact CZ-CD1 4.11Å
386	V	78	Confident	84.4	Confident	123 Å²	123	74 Å²	74	75%	0.745	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-71.7	-25.6	175.9	-178.3	0	0	0	0	110.9	I383 Y384 V388	I383-V386 WeakPolarHBondContact O-CB 3.38Å; I383-V386 PolarHBondContact O-N 3.3Å; Y384-V386 PolarHBondContact O-N 3.01Å; V386-V388 PolarHBondContact O-N 3.3Å
387	S	80.6	Confident	84.8	Confident	41 Å²	41	73 Å²	73	29%	0.287	36%	0.363	S	S	.	.			trans	-79.1	119.8	177.1	175.3	0	0	0	0	111.1	Y384 F385 W389 N390 S391	Y384-S387 PolarHBondContact O-N 3.49Å; F385-S387 PolarHBondContact O-N 3.43Å; S387-W389 PolarHBondContact O-N 3.43Å; S387-N390 PolarHBondContact O-N 3.25Å; S387-N390 PolarHBondContact OG-OD1 3.18Å; S387-S391 PolarHBondContact O-N 3.5Å; S387-S391 VanDerWaalsContact O-N 3.12Å; S387-S391 PolarHBondContact O-OG 3.24Å
388	V	82.5	Confident	85.1	Confident	114 Å²	114	74.8 Å²	74.8	69%	0.691	37%	0.372	S	S	*	.	H	α-helix	trans	-57.1	-38	175.6	178.1	0	0	0	0	111.4	V386 N390 S391 L392	V386-V388 PolarHBondContact O-N 3.3Å; V388-N390 VanDerWaalsContact C-N 3.35Å; V388-N390 PolarHBondContact O-N 2.92Å; V388-S391 PolarHBondContact O-N 3.44Å; V388-L392 WeakPolarHBondContact O-CB 3.38Å; V388-L392 PolarHBondContact O-N 3.17Å
389	W	84.8	Confident	85.6	Confident	67 Å²	67	68.3 Å²	68.3	25%	0.254	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-37.4	-179.7	-61.6	108.9	0	0	0	113	S387 L392 D393 F457 K458	S387-W389 PolarHBondContact O-N 3.43Å; W389-L392 WeakPolarHBondContact O-CB 3.43Å; W389-L392 PolarHBondContact O-N 2.88Å; W389-D393 PolarHBondContact O-N 3.48Å; W389-F457 HydrophobicContact CH2-CB 4.14Å; W389-K458 HydrophobicContact CB-CD 3.93Å; W389-K458 HydrophobicContact CD2-CB 4.02Å; W389-K458 HydrophobicContact CD2-CD 4.06Å; W389-K458 HydrophobicContact CD2-CG 4.04Å; W389-K458 HydrophobicContact CE3-CB 3.81Å; W389-K458 HydrophobicContact CE3-CD 4.19Å; W389-K458 HydrophobicContact CE3-CG 4.26Å; W389-K458 HydrophobicContact CG-CD 3.96Å; W389-K458 HydrophobicContact CG-CG 4.25Å; W389-K458 HydrophobicContact CH2-CB 4.21Å; W389-K458 HydrophobicContact CZ2-CB 4.4Å; W389-K458 HydrophobicContact CZ3-CB 3.91Å
390	N	85.7	Confident	86	Confident	13 Å²	13	61.8 Å²	61.8	7%	0.07	32%	0.318	C	S	.	.	H	α-helix	trans	-73.1	-38.5	-179.6	-72.6	21.9	0	0	0	110.5	Y384 S387 V388 L392 D393 I394	Y384-N390 HydrophobicContact CD1-CB 4.15Å; Y384-N390 HydrophobicContact CD2-CB 4.25Å; Y384-N390 WeakPolarHBondContact CD2-ND2 3.4Å; Y384-N390 HydrophobicContact CE1-CB 3.62Å; Y384-N390 HydrophobicContact CE2-CB 3.78Å; Y384-N390 WeakPolarHBondContact CE2-ND2 3.4Å; Y384-N390 HydrophobicContact CG-CB 4.42Å; Y384-N390 VanDerWaalsContact CZ-CB 3.44Å; Y384-N390 PolarHBondContact OH-O 2.87Å; S387-N390 PolarHBondContact O-N 3.25Å; S387-N390 PolarHBondContact OG-OD1 3.18Å; V388-N390 VanDerWaalsContact C-N 3.35Å; V388-N390 PolarHBondContact O-N 2.92Å; N390-L392 VanDerWaalsContact C-N 3.35Å; N390-L392 PolarHBondContact O-N 2.87Å; N390-D393 PolarHBondContact O-N 2.74Å; N390-I394 PolarHBondContact O-N 3.38Å
391	S	87.1	Confident	86.7	Confident	40 Å²	40	61.6 Å²	61.6	28%	0.28	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-42.1	171	-63.1	0	0	0	0	112.1	F385 S387 V388 D393 I394 I395	F385-S391 PolarHBondContact O-OG 3.11Å; S387-S391 PolarHBondContact O-N 3.5Å; S387-S391 VanDerWaalsContact O-N 3.12Å; S387-S391 PolarHBondContact O-OG 3.24Å; V388-S391 PolarHBondContact O-N 3.44Å; S391-D393 VanDerWaalsContact C-N 3.31Å; S391-D393 PolarHBondContact O-N 2.83Å; S391-I394 PolarHBondContact O-N 3.28Å; S391-I395 WeakPolarHBondContact O-CG1 3.33Å; S391-I395 PolarHBondContact O-N 3.27Å; S391-I395 VanDerWaalsContact O-N 3.08Å
392	L	89.5	Confident	87.2	Confident	24 Å²	24	63.9 Å²	63.9	13%	0.126	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-41	173.8	-173.3	162.4	0	0	0	111.2	V388 W389 N390 I395 I396 V454 K455	V388-L392 WeakPolarHBondContact O-CB 3.38Å; V388-L392 PolarHBondContact O-N 3.17Å; W389-L392 WeakPolarHBondContact O-CB 3.43Å; W389-L392 PolarHBondContact O-N 2.88Å; N390-L392 VanDerWaalsContact C-N 3.35Å; N390-L392 PolarHBondContact O-N 2.87Å; L392-I395 PolarHBondContact O-N 3.07Å; L392-I396 HydrophobicContact CD2-CD1 3.32Å; L392-I396 HydrophobicContact CD2-CG1 3.91Å; L392-I396 WeakPolarHBondContact O-CG1 3.28Å; L392-I396 PolarHBondContact O-N 3.27Å; L392-V454 HydrophobicContact CD1-CG1 4.16Å; L392-K455 HydrophobicContact CD2-CB 4.07Å
393	D	89.7	Confident	87.8	Confident	7 Å²	7	53 Å²	53	4%	0.037	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-42.7	178.9	-72.3	-20.5	0	0	0	112.3	W389 N390 S391 I395 I396 I397 K455 K458	W389-D393 PolarHBondContact O-N 3.48Å; N390-D393 PolarHBondContact O-N 2.74Å; S391-D393 VanDerWaalsContact C-N 3.31Å; S391-D393 PolarHBondContact O-N 2.83Å; D393-I395 PolarHBondContact O-N 3.47Å; D393-I396 PolarHBondContact O-N 3.2Å; D393-I397 VanDerWaalsContact O-CG1 3.29Å; D393-I397 WeakPolarHBondContact O-CG1 3.38Å; D393-I397 PolarHBondContact O-N 3.46Å; D393-K455 WeakPolarHBondContact OD1-CD 3.44Å; D393-K455 WeakPolarHBondContact OD1-CE 3.4Å; D393-K455 IonicContact OD1-NZ 3.86Å; D393-K455 PolarHBondContact OD1-NZ 3.1Å; D393-K455 IonicContact OD2-NZ 2.67Å; D393-K455 PolarHBondContact OD2-NZ 3.33Å; D393-K458 IonicContact OD2-NZ 3.6Å
394	I	91.4	Very high	88.2	Confident	38 Å²	38	48.1 Å²	48.1	20%	0.195	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-45.9	172	-69.5	179.6	0	0	0	111.3	I377 Y384 F385 N390 S391 I396 I397 I398	I377-I394 HydrophobicContact CD1-CD1 4.4Å; Y384-I394 HydrophobicContact CD1-CD1 4.4Å; Y384-I394 HydrophobicContact CE1-CD1 3.52Å; Y384-I394 HydrophobicContact CE1-CG1 4.14Å; F385-I394 HydrophobicContact CD1-CD1 4.28Å; F385-I394 HydrophobicContact CE1-CD1 3.48Å; F385-I394 VanDerWaalsContact CE1-CD1 3.48Å; F385-I394 HydrophobicContact CZ-CD1 4.11Å; N390-I394 PolarHBondContact O-N 3.38Å; S391-I394 PolarHBondContact O-N 3.28Å; I394-I396 PolarHBondContact O-N 3.37Å; I394-I397 PolarHBondContact O-N 3.38Å; I394-I398 HydrophobicContact CG2-CD1 3.63Å; I394-I398 HydrophobicContact CG2-CG1 4.27Å; I394-I398 WeakPolarHBondContact O-CG1 3.49Å; I394-I398 PolarHBondContact O-N 3.39Å
395	I	92.7	Very high	89	Confident	87 Å²	87	50.8 Å²	50.8	45%	0.446	29%	0.285	S	S	.	.	H	α-helix	trans	-60.9	-45.7	179.8	-69	166.8	0	0	0	110.7	S391 L392 D393 I397 I398 I399 L451	S391-I395 WeakPolarHBondContact O-CG1 3.33Å; S391-I395 PolarHBondContact O-N 3.27Å; S391-I395 VanDerWaalsContact O-N 3.08Å; L392-I395 PolarHBondContact O-N 3.07Å; D393-I395 PolarHBondContact O-N 3.47Å; I395-I397 VanDerWaalsContact C-N 3.31Å; I395-I397 PolarHBondContact O-N 2.92Å; I395-I398 PolarHBondContact O-N 3.47Å; I395-I399 HydrophobicContact CG2-CD1 3.7Å; I395-I399 HydrophobicContact CG2-CG1 4.39Å; I395-I399 VanDerWaalsContact O-CG1 3.31Å; I395-I399 WeakPolarHBondContact O-CG1 3.06Å; I395-I399 PolarHBondContact O-N 3.44Å; I395-L451 HydrophobicContact CG2-CD1 4.02Å
396	I	92.8	Very high	89.6	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-44.3	176.4	-71.4	-179.8	0	0	0	110.6	L392 D393 I394 S400 T448 L451 K455	L392-I396 HydrophobicContact CD2-CD1 3.32Å; L392-I396 HydrophobicContact CD2-CG1 3.91Å; L392-I396 WeakPolarHBondContact O-CG1 3.28Å; L392-I396 PolarHBondContact O-N 3.27Å; D393-I396 PolarHBondContact O-N 3.2Å; I394-I396 PolarHBondContact O-N 3.37Å; I396-S400 WeakPolarHBondContact O-CB 3.42Å; I396-S400 PolarHBondContact O-N 3.21Å; I396-S400 PolarHBondContact O-OG 3.14Å; I396-T448 HydrophobicContact CG2-CG2 4.4Å; I396-L451 HydrophobicContact CD1-CB 3.87Å; I396-L451 HydrophobicContact CG1-CB 3.83Å; I396-L451 HydrophobicContact CG1-CD1 4.19Å; I396-K455 HydrophobicContact CD1-CD 4.49Å
397	I	92.5	Very high	90.1	Very high	20 Å²	20	41.1 Å²	41.1	10%	0.103	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-48	-180	-70.5	167.4	0	0	0	110.5	I370 E373 D393 I394 I395 I399 S400 I401	I370-I397 HydrophobicContact CD1-CG2 4.4Å; I370-I397 HydrophobicContact CG1-CG2 3.7Å; E373-I397 HydrophobicContact CB-CD1 4.27Å; E373-I397 HydrophobicContact CG-CD1 3.4Å; D393-I397 VanDerWaalsContact O-CG1 3.29Å; D393-I397 WeakPolarHBondContact O-CG1 3.38Å; D393-I397 PolarHBondContact O-N 3.46Å; I394-I397 PolarHBondContact O-N 3.38Å; I395-I397 VanDerWaalsContact C-N 3.31Å; I395-I397 PolarHBondContact O-N 2.92Å; I397-I399 PolarHBondContact O-N 3.31Å; I397-S400 WeakPolarHBondContact CA-OG 3.21Å; I397-S400 PolarHBondContact O-N 2.9Å; I397-S400 PolarHBondContact O-OG 2.9Å; I397-I401 HydrophobicContact CG2-CD1 3.74Å; I397-I401 HydrophobicContact CG2-CG1 4.39Å; I397-I401 VanDerWaalsContact O-CG1 3.31Å; I397-I401 WeakPolarHBondContact O-CG1 3.43Å; I397-I401 PolarHBondContact O-N 3.29Å
398	I	93.5	Very high	90.5	Very high	96 Å²	96	43.7 Å²	43.7	49%	0.492	24%	0.243	S	C	.	.	H	α-helix	trans	-58.5	-50.5	179.4	-68.3	169.3	0	0	0	110.8	I394 I395 S400 I401 V402	I394-I398 HydrophobicContact CG2-CD1 3.63Å; I394-I398 HydrophobicContact CG2-CG1 4.27Å; I394-I398 WeakPolarHBondContact O-CG1 3.49Å; I394-I398 PolarHBondContact O-N 3.39Å; I395-I398 PolarHBondContact O-N 3.47Å; I398-S400 VanDerWaalsContact C-N 3.29Å; I398-S400 PolarHBondContact O-N 3.02Å; I398-I401 PolarHBondContact O-N 3.49Å; I398-V402 WeakPolarHBondContact O-CG2 3.41Å; I398-V402 PolarHBondContact O-N 3.28Å
399	I	94.8	Very high	90.9	Very high	39 Å²	39	43.8 Å²	43.8	20%	0.2	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-40.9	179.5	-61.9	170.5	0	0	0	110.2	I395 I397 I401 V402 C403 A444 I447 T448 L451	I395-I399 HydrophobicContact CG2-CD1 3.7Å; I395-I399 HydrophobicContact CG2-CG1 4.39Å; I395-I399 VanDerWaalsContact O-CG1 3.31Å; I395-I399 WeakPolarHBondContact O-CG1 3.06Å; I395-I399 PolarHBondContact O-N 3.44Å; I397-I399 PolarHBondContact O-N 3.31Å; I399-I401 PolarHBondContact O-N 3.49Å; I399-V402 PolarHBondContact O-N 2.88Å; I399-C403 WeakPolarHBondContact O-CB 3.43Å; I399-C403 PolarHBondContact O-N 2.6Å; I399-C403 PolarHBondContact O-SG 3.31Å; I399-A444 HydrophobicContact CG2-CB 3.97Å; I399-I447 HydrophobicContact CD1-CG2 4.18Å; I399-T448 WeakPolarHBondContact CG2-OG1 3.23Å; I399-L451 HydrophobicContact CD1-CD1 4.41Å
400	S	92.7	Very high	91.2	Very high	5 Å²	5	40.7 Å²	40.7	4%	0.035	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-36.3	179.2	74.2	0	0	0	0	113.5	I396 I397 I398 C403 A404	I396-S400 WeakPolarHBondContact O-CB 3.42Å; I396-S400 PolarHBondContact O-N 3.21Å; I396-S400 PolarHBondContact O-OG 3.14Å; I397-S400 WeakPolarHBondContact CA-OG 3.21Å; I397-S400 PolarHBondContact O-N 2.9Å; I397-S400 PolarHBondContact O-OG 2.9Å; I398-S400 VanDerWaalsContact C-N 3.29Å; I398-S400 PolarHBondContact O-N 3.02Å; S400-C403 PolarHBondContact O-N 3.03Å; S400-A404 WeakPolarHBondContact O-CB 3.37Å; S400-A404 PolarHBondContact O-N 2.98Å
401	I	93.2	Very high	91.3	Very high	78 Å²	78	42.1 Å²	42.1	40%	0.4	23%	0.23	S	C	.	.	H	α-helix	trans	-66.3	-44.7	174.5	-68.1	165.8	0	0	0	110.1	I366 I370 I397 I398 I399 C403 A404 A405	I366-I401 HydrophobicContact CG2-CG1 4.08Å; I370-I401 HydrophobicContact CD1-CD1 3.91Å; I370-I401 HydrophobicContact CD1-CG1 4.33Å; I397-I401 HydrophobicContact CG2-CD1 3.74Å; I397-I401 HydrophobicContact CG2-CG1 4.39Å; I397-I401 VanDerWaalsContact O-CG1 3.31Å; I397-I401 WeakPolarHBondContact O-CG1 3.43Å; I397-I401 PolarHBondContact O-N 3.29Å; I398-I401 PolarHBondContact O-N 3.49Å; I399-I401 PolarHBondContact O-N 3.49Å; I401-C403 VanDerWaalsContact C-N 3.34Å; I401-C403 PolarHBondContact O-N 2.88Å; I401-A404 PolarHBondContact O-N 3.47Å; I401-A405 WeakPolarHBondContact O-CB 3.31Å; I401-A405 PolarHBondContact O-N 3.45Å
402	V	92.9	Very high	91.3	Very high	79 Å²	79	44.9 Å²	44.9	48%	0.479	24%	0.24	S	C	.	.	H	α-helix	trans	-60.4	-45.1	176.5	173.3	0	0	0	0	110.6	I398 I399 A404 A405 F406	I398-V402 WeakPolarHBondContact O-CG2 3.41Å; I398-V402 PolarHBondContact O-N 3.28Å; I399-V402 PolarHBondContact O-N 2.88Å; V402-A404 PolarHBondContact O-N 2.95Å; V402-A405 PolarHBondContact O-N 3.48Å; V402-F406 WeakPolarHBondContact O-CB 3.49Å; V402-F406 PolarHBondContact O-N 3.37Å
403	C	92.2	Very high	91.3	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.041	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-43.1	175.5	-72.6	0	0	0	0	112.5	I399 S400 I401 N407 F441 A444	I399-C403 WeakPolarHBondContact O-CB 3.43Å; I399-C403 PolarHBondContact O-N 2.6Å; I399-C403 PolarHBondContact O-SG 3.31Å; S400-C403 PolarHBondContact O-N 3.03Å; I401-C403 VanDerWaalsContact C-N 3.34Å; I401-C403 PolarHBondContact O-N 2.88Å; C403-N407 WeakPolarHBondContact O-CB 3.4Å; C403-N407 PolarHBondContact O-N 2.99Å; C403-N407 PolarHBondContact O-ND2 3.39Å; C403-F441 HydrophobicContact CB-CD2 4.16Å; C403-F441 HydrophobicContact CB-CE2 3.93Å; C403-A444 WeakPolarHBondContact SG-CB 3.49Å
404	A	91.2	Very high	91.3	Very high	13 Å²	13	45.9 Å²	45.9	11%	0.107	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-48	177.4	0	0	0	0	0	111.9	L363 I366 S400 I401 V402 F406 N407 I408	L363-A404 HydrophobicContact CD2-CB 3.58Å; I366-A404 HydrophobicContact CD1-CB 4.39Å; S400-A404 WeakPolarHBondContact O-CB 3.37Å; S400-A404 PolarHBondContact O-N 2.98Å; I401-A404 PolarHBondContact O-N 3.47Å; V402-A404 PolarHBondContact O-N 2.95Å; A404-F406 VanDerWaalsContact C-N 3.34Å; A404-F406 PolarHBondContact O-N 2.87Å; A404-N407 PolarHBondContact O-N 3.14Å; A404-I408 WeakPolarHBondContact O-CG1 3.23Å; A404-I408 PolarHBondContact O-N 2.98Å
405	A	92	Very high	91.1	Very high	56 Å²	56	48.3 Å²	48.3	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-44	177.6	0	0	0	0	0	111.5	I401 V402 I408 Y409	I401-A405 WeakPolarHBondContact O-CB 3.31Å; I401-A405 PolarHBondContact O-N 3.45Å; V402-A405 PolarHBondContact O-N 3.48Å; A405-I408 PolarHBondContact O-N 3.19Å; A405-Y409 WeakPolarHBondContact O-CB 3.4Å; A405-Y409 PolarHBondContact O-N 3.37Å
406	F	91.8	Very high	90.9	Very high	13 Å²	13	48.7 Å²	48.7	6%	0.057	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-42.8	177	176.2	-103.6	0	0	0	112.6	V402 A404 I408 Y409 R410 W437 F441	V402-F406 WeakPolarHBondContact O-CB 3.49Å; V402-F406 PolarHBondContact O-N 3.37Å; A404-F406 VanDerWaalsContact C-N 3.34Å; A404-F406 PolarHBondContact O-N 2.87Å; F406-I408 VanDerWaalsContact C-N 3.28Å; F406-I408 PolarHBondContact O-N 3.46Å; F406-Y409 HydrophobicContact CD2-CD1 4.29Å; F406-Y409 HydrophobicContact CE2-CD1 4.36Å; F406-Y409 PolarHBondContact O-N 3.26Å; F406-R410 HydrophobicContact CE1-CB 4.29Å; F406-R410 HydrophobicContact CE2-CB 4.27Å; F406-R410 HydrophobicContact CZ-CB 4.03Å; F406-R410 HydrophobicContact CZ-CG 4.21Å; F406-R410 VanDerWaalsContact O-CB 3.31Å; F406-R410 WeakPolarHBondContact O-CB 3.22Å; F406-R410 PolarHBondContact O-N 3.28Å; F406-W437 HydrophobicContact CD2-CB 3.92Å; F406-W437 HydrophobicContact CD2-CD2 4.36Å; F406-W437 AromaticContact CD2-CE3 3.98Å; F406-W437 HydrophobicContact CD2-CE3 3.98Å; F406-W437 HydrophobicContact CD2-CG 4.37Å; F406-W437 HydrophobicContact CE2-CB 3.15Å; F406-W437 HydrophobicContact CE2-CD2 4.37Å; F406-W437 HydrophobicContact CE2-CE3 4.39Å; F406-W437 AromaticContact CE2-CG 3.91Å; F406-W437 HydrophobicContact CE2-CG 3.91Å; F406-W437 HydrophobicContact CZ-CB 3.5Å; F406-F441 HydrophobicContact CB-CD2 4.48Å; F406-F441 HydrophobicContact CD1-CB 3.43Å; F406-F441 VanDerWaalsContact CD1-CB 3.43Å; F406-F441 HydrophobicContact CD1-CD1 4.43Å; F406-F441 AromaticContact CD1-CD2 3.43Å; F406-F441 HydrophobicContact CD1-CD2 3.43Å; F406-F441 VanDerWaalsContact CD1-CD2 3.43Å; F406-F441 HydrophobicContact CD1-CE2 4.21Å; F406-F441 AromaticContact CD1-CG 3.51Å; F406-F441 HydrophobicContact CD1-CG 3.51Å; F406-F441 HydrophobicContact CE1-CB 3.46Å; F406-F441 VanDerWaalsContact CE1-CB 3.46Å; F406-F441 HydrophobicContact CE1-CD1 4.35Å; F406-F441 HydrophobicContact CE1-CD2 4.14Å; F406-F441 AromaticContact CE1-CG 3.74Å; F406-F441 HydrophobicContact CE1-CG 3.74Å; F406-F441 HydrophobicContact CG-CB 4.38Å; F406-F441 HydrophobicContact CG-CD2 4.36Å; F406-F441 HydrophobicContact CZ-CB 4.49Å
407	N	88.7	Confident	90.7	Very high	22 Å²	22	50.3 Å²	50.3	12%	0.118	27%	0.269	C	S	.	.	H	α-helix	trans	-57.8	-41.9	177.3	-89.6	-39.7	0	0	0	112.2	C403 A404 R410 T411 F441	C403-N407 WeakPolarHBondContact O-CB 3.4Å; C403-N407 PolarHBondContact O-N 2.99Å; C403-N407 PolarHBondContact O-ND2 3.39Å; A404-N407 PolarHBondContact O-N 3.14Å; N407-R410 PolarHBondContact OD1-NH1 3.43Å; N407-R410 PolarHBondContact OD1-NH2 3.39Å; N407-T411 PolarHBondContact O-N 2.87Å; N407-T411 PolarHBondContact O-OG1 2.97Å; N407-F441 VanDerWaalsContact CG-CE2 3.47Å; N407-F441 VanDerWaalsContact CG-CZ 3.46Å; N407-F441 WeakPolarHBondContact ND2-CE2 3.13Å; N407-F441 WeakPolarHBondContact ND2-CZ 3.25Å; N407-F441 WeakPolarHBondContact OD1-CE2 3.23Å; N407-F441 WeakPolarHBondContact OD1-CZ 3.24Å
408	I	89.6	Confident	90.5	Very high	96 Å²	96	51 Å²	51	49%	0.492	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-49.2	177.6	-63.9	167.4	0	0	0	110.2	A404 A405 F406 R410 T411 I412	A404-I408 WeakPolarHBondContact O-CG1 3.23Å; A404-I408 PolarHBondContact O-N 2.98Å; A405-I408 PolarHBondContact O-N 3.19Å; F406-I408 VanDerWaalsContact C-N 3.28Å; F406-I408 PolarHBondContact O-N 3.46Å; I408-R410 PolarHBondContact O-N 3.23Å; I408-T411 PolarHBondContact O-N 3.26Å; I408-I412 HydrophobicContact CG2-CD1 4.08Å; I408-I412 WeakPolarHBondContact O-CG1 3.16Å; I408-I412 PolarHBondContact O-N 2.98Å
409	Y	90.8	Very high	90.2	Very high	115 Å²	115	51.7 Å²	51.7	45%	0.451	27%	0.274	S	S	.	.	H	α-helix	trans	-56.5	-46.5	178.2	175.8	-102.4	0	0	0	112.5	A405 F406 T411 I412 I413	A405-Y409 WeakPolarHBondContact O-CB 3.4Å; A405-Y409 PolarHBondContact O-N 3.37Å; F406-Y409 HydrophobicContact CD2-CD1 4.29Å; F406-Y409 HydrophobicContact CE2-CD1 4.36Å; F406-Y409 PolarHBondContact O-N 3.26Å; Y409-T411 PolarHBondContact O-N 3.27Å; Y409-I412 PolarHBondContact O-N 3.29Å; Y409-I413 HydrophobicContact CD1-CD1 4Å; Y409-I413 HydrophobicContact CD2-CD1 3.87Å; Y409-I413 HydrophobicContact CE1-CD1 3.39Å; Y409-I413 HydrophobicContact CE2-CD1 3.25Å; Y409-I413 HydrophobicContact CE2-CG1 4.32Å; Y409-I413 HydrophobicContact CG-CD1 4.22Å; Y409-I413 PolarHBondContact O-N 2.83Å; Y409-I413 VanDerWaalsContact O-N 3.1Å; Y409-I413 WeakPolarHBondContact OH-CD1 3.44Å
410	R	89.6	Confident	89.9	Confident	3 Å²	3	53.8 Å²	53.8	1%	0.011	29%	0.286	C	S	.	.	H	α-helix	trans	-58.3	-47.3	178.3	-173.2	-167.5	62.1	-135.5	-23.4	111.4	F406 N407 I408 I412 I413 V414 L434	F406-R410 HydrophobicContact CE1-CB 4.29Å; F406-R410 HydrophobicContact CE2-CB 4.27Å; F406-R410 HydrophobicContact CZ-CB 4.03Å; F406-R410 HydrophobicContact CZ-CG 4.21Å; F406-R410 VanDerWaalsContact O-CB 3.31Å; F406-R410 WeakPolarHBondContact O-CB 3.22Å; F406-R410 PolarHBondContact O-N 3.28Å; N407-R410 PolarHBondContact OD1-NH1 3.43Å; N407-R410 PolarHBondContact OD1-NH2 3.39Å; I408-R410 PolarHBondContact O-N 3.23Å; R410-I412 VanDerWaalsContact C-N 3.31Å; R410-I412 PolarHBondContact O-N 3.33Å; R410-I413 PolarHBondContact O-N 3.47Å; R410-V414 HydrophobicContact CG-CG2 4.19Å; R410-V414 WeakPolarHBondContact O-CB 3.42Å; R410-V414 VanDerWaalsContact O-CG2 3.23Å; R410-V414 WeakPolarHBondContact O-CG2 3.5Å; R410-V414 PolarHBondContact O-N 3.14Å; R410-L434 HydrophobicContact CB-CD1 4.47Å; R410-L434 HydrophobicContact CG-CD1 3.75Å
411	T	87.6	Confident	89.6	Confident	43 Å²	43	54.5 Å²	54.5	26%	0.264	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-39.9	-178.1	-59.5	0	0	0	0	111.8	Y347 N407 I408 Y409 I415	Y347-T411 HydrophobicContact CE2-CG2 4.16Å; N407-T411 PolarHBondContact O-N 2.87Å; N407-T411 PolarHBondContact O-OG1 2.97Å; I408-T411 PolarHBondContact O-N 3.26Å; Y409-T411 PolarHBondContact O-N 3.27Å; T411-I415 HydrophobicContact CG2-CD1 4.49Å; T411-I415 WeakPolarHBondContact O-CD1 3.41Å; T411-I415 WeakPolarHBondContact O-CG1 3.49Å
412	I	89	Confident	89.2	Confident	97 Å²	97	56.7 Å²	56.7	50%	0.497	30%	0.301	S	S	.	.	H	α-helix	trans	-67.3	-46.3	178.6	-64	167.9	0	0	0	110.9	I408 Y409 R410 N416	I408-I412 HydrophobicContact CG2-CD1 4.08Å; I408-I412 WeakPolarHBondContact O-CG1 3.16Å; I408-I412 PolarHBondContact O-N 2.98Å; Y409-I412 PolarHBondContact O-N 3.29Å; R410-I412 VanDerWaalsContact C-N 3.31Å; R410-I412 PolarHBondContact O-N 3.33Å; I412-N416 PolarHBondContact O-N 2.89Å
413	I	89.3	Confident	88.9	Confident	46 Å²	46	59.9 Å²	59.9	24%	0.236	31%	0.311	C	S	.	.	H	α-helix	trans	-71.3	-39	-174.9	-74.1	179.8	0	0	0	113	Y409 R410 I415 N416 L417	Y409-I413 HydrophobicContact CD1-CD1 4Å; Y409-I413 HydrophobicContact CD2-CD1 3.87Å; Y409-I413 HydrophobicContact CE1-CD1 3.39Å; Y409-I413 HydrophobicContact CE2-CD1 3.25Å; Y409-I413 HydrophobicContact CE2-CG1 4.32Å; Y409-I413 HydrophobicContact CG-CD1 4.22Å; Y409-I413 PolarHBondContact O-N 2.83Å; Y409-I413 VanDerWaalsContact O-N 3.1Å; Y409-I413 WeakPolarHBondContact OH-CD1 3.44Å; R410-I413 PolarHBondContact O-N 3.47Å; I413-I415 PolarHBondContact O-N 3.42Å; I413-N416 PolarHBondContact O-N 3.49Å; I413-L417 VanDerWaalsContact O-CB 3.25Å; I413-L417 WeakPolarHBondContact O-CB 3.33Å; I413-L417 PolarHBondContact O-N 3.14Å
414	V	88.7	Confident	88.7	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-41.2	-179.9	167.6	0	0	0	0	111.2	L344 L345 R410 L418 L434	L344-V414 HydrophobicContact CB-CG1 4.08Å; L344-V414 HydrophobicContact CB-CG2 4.22Å; L344-V414 HydrophobicContact CD2-CG2 4.42Å; L345-V414 HydrophobicContact CD2-CG1 4.38Å; R410-V414 HydrophobicContact CG-CG2 4.19Å; R410-V414 WeakPolarHBondContact O-CB 3.42Å; R410-V414 VanDerWaalsContact O-CG2 3.23Å; R410-V414 WeakPolarHBondContact O-CG2 3.5Å; R410-V414 PolarHBondContact O-N 3.14Å; V414-L418 WeakPolarHBondContact O-CB 3.35Å; V414-L418 PolarHBondContact O-N 3.16Å; V414-L434 HydrophobicContact CG2-CD1 4.26Å; V414-L434 HydrophobicContact CG2-CD2 3.5Å; V414-L434 HydrophobicContact CG2-CG 4.48Å
415	I	87.9	Confident	88.4	Confident	88 Å²	88	64.9 Å²	64.9	45%	0.451	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-53.5	-179.8	-64.8	168.3	0	0	0	109.7	T411 I413 L417 L418 E419	T411-I415 HydrophobicContact CG2-CD1 4.49Å; T411-I415 WeakPolarHBondContact O-CD1 3.41Å; T411-I415 WeakPolarHBondContact O-CG1 3.49Å; I413-I415 PolarHBondContact O-N 3.42Å; I415-L417 VanDerWaalsContact C-N 3.34Å; I415-L417 PolarHBondContact O-N 3.43Å; I415-L418 PolarHBondContact O-N 2.89Å; I415-E419 WeakPolarHBondContact O-CG 3.38Å; I415-E419 PolarHBondContact O-N 3.22Å
416	N	89.3	Confident	88.2	Confident	96 Å²	96	67.8 Å²	67.8	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-59.9	-43.5	-178.6	-64.9	-12	0	0	0	112.5	I412 I413 D420	I412-N416 PolarHBondContact O-N 2.89Å; I413-N416 PolarHBondContact O-N 3.49Å; N416-D420 PolarHBondContact O-N 3.02Å
417	L	87.7	Confident	88.1	Confident	38 Å²	38	72.1 Å²	72.1	20%	0.199	37%	0.366	C	S	.	.	H	α-helix	trans	-72.9	-34.8	-177	-173.9	152	0	0	0	111.8	I413 I415 I421 N430 F431	I413-L417 VanDerWaalsContact O-CB 3.25Å; I413-L417 WeakPolarHBondContact O-CB 3.33Å; I413-L417 PolarHBondContact O-N 3.14Å; I415-L417 VanDerWaalsContact C-N 3.34Å; I415-L417 PolarHBondContact O-N 3.43Å; L417-I421 HydrophobicContact CD2-CD1 3.37Å; L417-I421 HydrophobicContact CD2-CG1 4.44Å; L417-I421 HydrophobicContact CG-CD1 4.17Å; L417-I421 WeakPolarHBondContact O-CD1 3.16Å; L417-I421 VanDerWaalsContact O-CG1 3.31Å; L417-I421 WeakPolarHBondContact O-CG1 3.38Å; L417-I421 PolarHBondContact O-N 3.4Å; L417-N430 WeakPolarHBondContact CD1-O 3.45Å; L417-F431 HydrophobicContact CD2-CD1 3.73Å; L417-F431 HydrophobicContact CD2-CD2 4.28Å; L417-F431 HydrophobicContact CD2-CE1 3.18Å; L417-F431 HydrophobicContact CD2-CE2 3.77Å; L417-F431 HydrophobicContact CD2-CG 4.27Å; L417-F431 HydrophobicContact CD2-CZ 3.19Å
418	L	87.2	Confident	88.3	Confident	35 Å²	35	71.8 Å²	71.8	18%	0.183	36%	0.363	C	S	.	.	H	α-helix	trans	-69.4	-39.9	175.2	-175.7	62.1	0	0	0	111.6	L345 V414 I415 D420 I421 L422	L345-L418 HydrophobicContact CD2-CD2 3.97Å; V414-L418 WeakPolarHBondContact O-CB 3.35Å; V414-L418 PolarHBondContact O-N 3.16Å; I415-L418 PolarHBondContact O-N 2.89Å; L418-D420 VanDerWaalsContact C-N 3.35Å; L418-D420 PolarHBondContact O-N 3.24Å; L418-I421 PolarHBondContact O-N 3.12Å; L418-L422 HydrophobicContact CD1-CD1 4.37Å; L418-L422 HydrophobicContact CD1-CG 4.27Å; L418-L422 HydrophobicContact CG-CD1 4.02Å; L418-L422 HydrophobicContact CG-CG 4.37Å; L418-L422 WeakPolarHBondContact O-CB 3.25Å; L418-L422 WeakPolarHBondContact O-CG 3.46Å; L418-L422 PolarHBondContact O-N 2.96Å
419	E	88	Confident	88.2	Confident	111 Å²	111	67.2 Å²	67.2	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-60.8	-42.7	175.8	-75.5	179.1	-170.5	0	0	112.1	I415 L422 Q423	I415-E419 WeakPolarHBondContact O-CG 3.38Å; I415-E419 PolarHBondContact O-N 3.22Å; E419-L422 PolarHBondContact O-N 3.37Å; E419-Q423 WeakPolarHBondContact O-CG 3.32Å; E419-Q423 PolarHBondContact O-N 3.49Å
420	D	88.1	Confident	88.2	Confident	82 Å²	82	63.4 Å²	63.4	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-46.8	178.4	-171.7	34.8	0	0	0	112.3	N416 L418 L422 Q423 N424	N416-D420 PolarHBondContact O-N 3.02Å; L418-D420 VanDerWaalsContact C-N 3.35Å; L418-D420 PolarHBondContact O-N 3.24Å; D420-L422 VanDerWaalsContact C-N 3.34Å; D420-L422 PolarHBondContact O-N 3.27Å; D420-Q423 WeakPolarHBondContact O-CB 3.44Å; D420-Q423 PolarHBondContact O-N 3.41Å; D420-Q423 VanDerWaalsContact O-N 3.14Å; D420-N424 PolarHBondContact O-N 2.95Å
421	I	86.7	Confident	88.3	Confident	20 Å²	20	63.3 Å²	63.3	10%	0.103	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-33	179.9	-62.6	165.1	0	0	0	112	I198 L417 L418 Q423 N424 A429 F431	I198-I421 HydrophobicContact CG2-CD1 4.42Å; I198-I421 HydrophobicContact CG2-CG2 3.67Å; L417-I421 HydrophobicContact CD2-CD1 3.37Å; L417-I421 HydrophobicContact CD2-CG1 4.44Å; L417-I421 HydrophobicContact CG-CD1 4.17Å; L417-I421 WeakPolarHBondContact O-CD1 3.16Å; L417-I421 VanDerWaalsContact O-CG1 3.31Å; L417-I421 WeakPolarHBondContact O-CG1 3.38Å; L417-I421 PolarHBondContact O-N 3.4Å; L418-I421 PolarHBondContact O-N 3.12Å; I421-Q423 PolarHBondContact O-N 2.96Å; I421-N424 CarbonylContact O-C 3.45Å; I421-N424 VanDerWaalsContact O-C 3.24Å; I421-N424 PolarHBondContact O-N 3.15Å; I421-A429 HydrophobicContact CD1-CB 3.6Å; I421-A429 HydrophobicContact CG1-CB 4.46Å; I421-F431 HydrophobicContact CD1-CE2 3.73Å; I421-F431 HydrophobicContact CD1-CZ 4Å
422	L	84.3	Confident	88.4	Confident	124 Å²	124	61.6 Å²	61.6	65%	0.649	32%	0.316	S	S	*	.	H	α-helix	trans	-66.3	-29	174.6	-74.3	174.8	0	0	0	111.9	L418 E419 D420	L418-L422 HydrophobicContact CD1-CD1 4.37Å; L418-L422 HydrophobicContact CD1-CG 4.27Å; L418-L422 HydrophobicContact CG-CD1 4.02Å; L418-L422 HydrophobicContact CG-CG 4.37Å; L418-L422 WeakPolarHBondContact O-CB 3.25Å; L418-L422 WeakPolarHBondContact O-CG 3.46Å; L418-L422 PolarHBondContact O-N 2.96Å; E419-L422 PolarHBondContact O-N 3.37Å; D420-L422 VanDerWaalsContact C-N 3.34Å; D420-L422 PolarHBondContact O-N 3.27Å
423	Q	87.6	Confident	88.4	Confident	147 Å²	147	58.7 Å²	58.7	69%	0.687	30%	0.301	S	S	*	.	H	α-helix	trans	-77.2	-39.9	172.7	-68.3	177.3	18.6	0	0	112	E419 D420 I421 P425	E419-Q423 WeakPolarHBondContact O-CG 3.32Å; E419-Q423 PolarHBondContact O-N 3.49Å; D420-Q423 WeakPolarHBondContact O-CB 3.44Å; D420-Q423 PolarHBondContact O-N 3.41Å; D420-Q423 VanDerWaalsContact O-N 3.14Å; I421-Q423 PolarHBondContact O-N 2.96Å; Q423-P425 VanDerWaalsContact C-CD 3.5Å; Q423-P425 WeakPolarHBondContact O-CD 3.41Å
424	N	88.4	Confident	88.5	Confident	77 Å²	77	57 Å²	57	41%	0.412	29%	0.293	S	S	.	.			trans	-117.4	75.7	-176.7	-64.3	-46.4	0	0	0	112.4	D420 I421 N426 E427	D420-N424 PolarHBondContact O-N 2.95Å; I421-N424 CarbonylContact O-C 3.45Å; I421-N424 VanDerWaalsContact O-C 3.24Å; I421-N424 PolarHBondContact O-N 3.15Å; N424-N426 PolarHBondContact O-N 3.36Å; N424-N426 VanDerWaalsContact O-N 3.17Å; N424-E427 HydrophobicContact CB-CB 4.4Å; N424-E427 PolarHBondContact O-N 3.3Å
425	P	85	Confident	88.6	Confident	47 Å²	47	56.8 Å²	56.8	31%	0.305	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.7	-173.6	28.5	-37	0	0	0	115	R279 Q423 E427	R279-P425 PolarHBondContact NE-O 3.4Å; R279-P425 PolarHBondContact NH2-O 3.28Å; Q423-P425 VanDerWaalsContact C-CD 3.5Å; Q423-P425 WeakPolarHBondContact O-CD 3.41Å; P425-E427 VanDerWaalsContact C-N 3.33Å
426	N	88	Confident	88.7	Confident	117 Å²	117	54.7 Å²	54.7	63%	0.626	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-2.7	178.6	-66.6	-19.1	0	0	0	112.9	R279 N424	R279-N426 WeakPolarHBondContact CD-OD1 3.38Å; N424-N426 PolarHBondContact O-N 3.36Å; N424-N426 VanDerWaalsContact O-N 3.17Å
427	E	89.6	Confident	88.8	Confident	103 Å²	103	55.2 Å²	55.2	48%	0.481	28%	0.275	S	S	.	.	S	Bend	trans	-94.7	153.1	178.8	-166.8	165.6	-171.7	0	0	111.6	G199 V200 N424 P425 A429	G199-E427 WeakPolarHBondContact CA-O 3.26Å; V200-E427 PolarHBondContact N-O 2.99Å; N424-E427 HydrophobicContact CB-CB 4.4Å; N424-E427 PolarHBondContact O-N 3.3Å; P425-E427 VanDerWaalsContact C-N 3.33Å; E427-A429 PolarHBondContact O-N 3.23Å
428	F	91	Very high	89	Confident	15 Å²	15	54.2 Å²	54.2	7%	0.066	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-68.4	129.9	175.9	169.2	-101.1	0	0	0	111.4	V200 R202 H307 N430	V200-F428 HydrophobicContact CG2-CB 4.39Å; V200-F428 VanDerWaalsContact O-CD2 3.3Å; V200-F428 WeakPolarHBondContact O-CD2 3.37Å; R202-F428 HydrophobicContact CB-CB 4.44Å; R202-F428 HydrophobicContact CB-CD2 3.35Å; R202-F428 HydrophobicContact CB-CE2 3.66Å; R202-F428 HydrophobicContact CB-CG 3.87Å; R202-F428 HydrophobicContact CB-CZ 4.36Å; R202-F428 HydrophobicContact CG-CD2 4.44Å; R202-F428 VanDerWaalsContact CZ-CD1 3.41Å; H307-F428 HydrophobicContact CB-CE2 3.66Å; H307-F428 HydrophobicContact CB-CZ 3.7Å; F428-N430 HydrophobicContact CD1-CB 4.06Å; F428-N430 HydrophobicContact CE1-CB 3.75Å; F428-N430 PolarHBondContact O-N 3.48Å
429	A	89.4	Confident	89.1	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.008	27%	0.272	C	S	.	.			trans	-81.6	96.9	178	0	0	0	0	0	112.1	I198 I421 E427 F431	I198-A429 HydrophobicContact CG2-CB 3.86Å; I198-A429 WeakPolarHBondContact O-CB 3.48Å; I421-A429 HydrophobicContact CD1-CB 3.6Å; I421-A429 HydrophobicContact CG1-CB 4.46Å; E427-A429 PolarHBondContact O-N 3.23Å; A429-F431 HydrophobicContact CB-CD2 3.85Å; A429-F431 HydrophobicContact CB-CE2 3.79Å; A429-F431 PolarHBondContact O-N 2.96Å
430	N	89.9	Confident	89.3	Confident	35 Å²	35	53 Å²	53	19%	0.187	27%	0.268	C	S	.	.			trans	-80	83.5	-178.8	-171.5	-0	0	0	0	113.3	L256 G257 L417 F428 Q432	L256-N430 PolarHBondContact O-ND2 3.18Å; G257-N430 PolarHBondContact O-ND2 3.28Å; L417-N430 WeakPolarHBondContact CD1-O 3.45Å; F428-N430 HydrophobicContact CD1-CB 4.06Å; F428-N430 HydrophobicContact CE1-CB 3.75Å; F428-N430 PolarHBondContact O-N 3.48Å; N430-Q432 PolarHBondContact OD1-N 3.35Å
431	F	91	Very high	89.5	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.25	C	C	.	.			trans	-97.7	7.1	172.5	-70.2	-82	0	0	0	114.1	I198 T309 F318 I320 L344 L417 I421 A429 M433 L434 S435	I198-F431 HydrophobicContact CG2-CE2 4.15Å; T309-F431 HydrophobicContact CG2-CD2 3.69Å; T309-F431 HydrophobicContact CG2-CE2 4.11Å; T309-F431 HydrophobicContact CG2-CG 4.36Å; F318-F431 HydrophobicContact CE1-CZ 4.36Å; I320-F431 HydrophobicContact CD1-CB 3.67Å; I320-F431 HydrophobicContact CD1-CG 4.49Å; I320-F431 HydrophobicContact CG1-CB 3.92Å; I320-F431 HydrophobicContact CG2-CB 4.4Å; L344-F431 HydrophobicContact CD1-CD1 3.71Å; L344-F431 HydrophobicContact CD1-CE1 3.62Å; L417-F431 HydrophobicContact CD2-CD1 3.73Å; L417-F431 HydrophobicContact CD2-CD2 4.28Å; L417-F431 HydrophobicContact CD2-CE1 3.18Å; L417-F431 HydrophobicContact CD2-CE2 3.77Å; L417-F431 HydrophobicContact CD2-CG 4.27Å; L417-F431 HydrophobicContact CD2-CZ 3.19Å; I421-F431 HydrophobicContact CD1-CE2 3.73Å; I421-F431 HydrophobicContact CD1-CZ 4Å; A429-F431 HydrophobicContact CB-CD2 3.85Å; A429-F431 HydrophobicContact CB-CE2 3.79Å; A429-F431 PolarHBondContact O-N 2.96Å; F431-M433 PolarHBondContact O-N 3.34Å; F431-L434 HydrophobicContact CD1-CD2 3.85Å; F431-L434 HydrophobicContact CE1-CD2 4.35Å; F431-L434 PolarHBondContact O-N 3.45Å; F431-S435 WeakPolarHBondContact O-CB 3.43Å; F431-S435 PolarHBondContact O-N 2.85Å
432	Q	90.6	Very high	89.7	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.028	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-53.6	-172.9	-171.4	-167.1	17.8	0	0	111.3	E322 N430 L434 S435 I436	E322-Q432 PolarHBondContact OE1-NE2 2.83Å; E322-Q432 PolarHBondContact OE2-NE2 3.3Å; N430-Q432 PolarHBondContact OD1-N 3.35Å; Q432-L434 VanDerWaalsContact C-N 3.34Å; Q432-L434 PolarHBondContact O-N 2.94Å; Q432-S435 WeakPolarHBondContact O-CB 3.42Å; Q432-S435 PolarHBondContact O-N 2.85Å; Q432-S435 VanDerWaalsContact O-N 3.13Å; Q432-S435 PolarHBondContact O-OG 3.19Å; Q432-I436 HydrophobicContact CG-CD1 4.22Å; Q432-I436 WeakPolarHBondContact O-CG1 3.34Å; Q432-I436 PolarHBondContact O-N 3.49Å
433	M	89.2	Confident	90.2	Very high	37 Å²	37	50.8 Å²	50.8	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-56.4	-49.5	179.1	177.7	59.1	160.1	0	0	111.3	Y259 F431 S435 I436 W437	Y259-M433 HydrophobicContact CD1-SD 4.36Å; Y259-M433 HydrophobicContact CD2-CB 3.91Å; Y259-M433 HydrophobicContact CD2-CE 4.35Å; Y259-M433 HydrophobicContact CD2-CG 4.01Å; Y259-M433 HydrophobicContact CD2-SD 3.47Å; Y259-M433 WeakPolarHBondContact CD2-SD 3.43Å; Y259-M433 HydrophobicContact CE1-CE 3.94Å; Y259-M433 HydrophobicContact CE1-SD 4.17Å; Y259-M433 HydrophobicContact CE2-CB 3.83Å; Y259-M433 HydrophobicContact CE2-CE 3.58Å; Y259-M433 HydrophobicContact CE2-CG 3.56Å; Y259-M433 HydrophobicContact CE2-SD 3.23Å; Y259-M433 WeakPolarHBondContact CE2-SD 3.4Å; Y259-M433 HydrophobicContact CG-SD 4.04Å; Y259-M433 VanDerWaalsContact OH-CE 3.31Å; Y259-M433 WeakPolarHBondContact OH-CE 3.43Å; F431-M433 PolarHBondContact O-N 3.34Å; M433-S435 VanDerWaalsContact C-N 3.26Å; M433-S435 PolarHBondContact O-N 3.21Å; M433-I436 PolarHBondContact O-N 2.88Å; M433-W437 HydrophobicContact CE-CZ2 4.45Å; M433-W437 VanDerWaalsContact O-CD1 3.26Å; M433-W437 PolarHBondContact O-N 3.46Å; M433-W437 VanDerWaalsContact O-N 3.1Å; M433-W437 PolarHBondContact SD-NE1 2.99Å
434	L	90.7	Very high	90.5	Very high	11 Å²	11	44.8 Å²	44.8	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-58	-40.5	178.9	-168.3	71.3	0	0	0	112	L344 R410 V414 F431 Q432 Q438	L344-L434 HydrophobicContact CD1-CD2 3.78Å; L344-L434 HydrophobicContact CD2-CD2 3.6Å; L344-L434 HydrophobicContact CD2-CG 4.28Å; L344-L434 HydrophobicContact CG-CD2 4.29Å; R410-L434 HydrophobicContact CB-CD1 4.47Å; R410-L434 HydrophobicContact CG-CD1 3.75Å; V414-L434 HydrophobicContact CG2-CD1 4.26Å; V414-L434 HydrophobicContact CG2-CD2 3.5Å; V414-L434 HydrophobicContact CG2-CG 4.48Å; F431-L434 HydrophobicContact CD1-CD2 3.85Å; F431-L434 HydrophobicContact CE1-CD2 4.35Å; F431-L434 PolarHBondContact O-N 3.45Å; Q432-L434 VanDerWaalsContact C-N 3.34Å; Q432-L434 PolarHBondContact O-N 2.94Å; L434-Q438 WeakPolarHBondContact O-CB 3.46Å; L434-Q438 PolarHBondContact O-N 3.35Å
435	S	90.3	Very high	90.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.007	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-44.3	178	84.2	0	0	0	0	112.4	R340 F431 Q432 M433 Q438 V439	R340-S435 PolarHBondContact NH1-OG 2.88Å; F431-S435 WeakPolarHBondContact O-CB 3.43Å; F431-S435 PolarHBondContact O-N 2.85Å; Q432-S435 WeakPolarHBondContact O-CB 3.42Å; Q432-S435 PolarHBondContact O-N 2.85Å; Q432-S435 VanDerWaalsContact O-N 3.13Å; Q432-S435 PolarHBondContact O-OG 3.19Å; M433-S435 VanDerWaalsContact C-N 3.26Å; M433-S435 PolarHBondContact O-N 3.21Å; S435-Q438 PolarHBondContact O-N 3.12Å; S435-V439 WeakPolarHBondContact O-CG2 3.48Å; S435-V439 PolarHBondContact O-N 2.93Å
436	I	90.6	Very high	91.1	Very high	44 Å²	44	42.6 Å²	42.6	23%	0.226	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-48.4	-179.3	-67.3	167.8	0	0	0	109.2	Q432 M433 Q438 V439 N440	Q432-I436 HydrophobicContact CG-CD1 4.22Å; Q432-I436 WeakPolarHBondContact O-CG1 3.34Å; Q432-I436 PolarHBondContact O-N 3.49Å; M433-I436 PolarHBondContact O-N 2.88Å; I436-Q438 VanDerWaalsContact C-N 3.31Å; I436-Q438 PolarHBondContact O-N 3.43Å; I436-V439 PolarHBondContact O-N 3.01Å; I436-N440 PolarHBondContact O-N 2.89Å; I436-N440 PolarHBondContact O-ND2 2.84Å
437	W	91	Very high	91.4	Very high	108 Å²	108	41.2 Å²	41.2	41%	0.409	21%	0.209	S	C	.	.	H	α-helix	trans	-65.4	-34.9	178.3	-77.4	92.7	0	0	0	113.1	F406 M433 V439 N440 F441	F406-W437 HydrophobicContact CD2-CB 3.92Å; F406-W437 HydrophobicContact CD2-CD2 4.36Å; F406-W437 AromaticContact CD2-CE3 3.98Å; F406-W437 HydrophobicContact CD2-CE3 3.98Å; F406-W437 HydrophobicContact CD2-CG 4.37Å; F406-W437 HydrophobicContact CE2-CB 3.15Å; F406-W437 HydrophobicContact CE2-CD2 4.37Å; F406-W437 HydrophobicContact CE2-CE3 4.39Å; F406-W437 AromaticContact CE2-CG 3.91Å; F406-W437 HydrophobicContact CE2-CG 3.91Å; F406-W437 HydrophobicContact CZ-CB 3.5Å; M433-W437 HydrophobicContact CE-CZ2 4.45Å; M433-W437 VanDerWaalsContact O-CD1 3.26Å; M433-W437 PolarHBondContact O-N 3.46Å; M433-W437 VanDerWaalsContact O-N 3.1Å; M433-W437 PolarHBondContact SD-NE1 2.99Å; W437-V439 VanDerWaalsContact C-N 3.34Å; W437-N440 PolarHBondContact O-N 3.41Å; W437-F441 VanDerWaalsContact O-CB 3.27Å; W437-F441 WeakPolarHBondContact O-CB 3.22Å; W437-F441 PolarHBondContact O-N 2.72Å
438	Q	91.4	Very high	91.6	Very high	16 Å²	16	36.5 Å²	36.5	8%	0.075	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-39.7	174.9	-178.1	58.5	57.9	0	0	111.9	V342 L434 S435 I436 F441 N442	V342-Q438 HydrophobicContact CB-CG 4.27Å; V342-Q438 HydrophobicContact CG1-CB 4.38Å; V342-Q438 HydrophobicContact CG1-CG 3.7Å; L434-Q438 WeakPolarHBondContact O-CB 3.46Å; L434-Q438 PolarHBondContact O-N 3.35Å; S435-Q438 PolarHBondContact O-N 3.12Å; I436-Q438 VanDerWaalsContact C-N 3.31Å; I436-Q438 PolarHBondContact O-N 3.43Å; Q438-F441 VanDerWaalsContact NE2-CD1 3.33Å; Q438-F441 PolarHBondContact O-N 2.93Å; Q438-N442 PolarHBondContact NE2-OD1 3.49Å; Q438-N442 PolarHBondContact O-N 3.3Å; Q438-N442 PolarHBondContact O-OD1 3.26Å
439	V	90.3	Very high	91.7	Very high	40 Å²	40	36.6 Å²	36.6	24%	0.242	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-46.6	174.3	171.3	0	0	0	0	110.7	R340 S435 I436 W437 F441 N442 F443	R340-V439 HydrophobicContact CG-CG2 4.38Å; S435-V439 WeakPolarHBondContact O-CG2 3.48Å; S435-V439 PolarHBondContact O-N 2.93Å; I436-V439 PolarHBondContact O-N 3.01Å; W437-V439 VanDerWaalsContact C-N 3.34Å; V439-F441 VanDerWaalsContact C-N 3.31Å; V439-F441 PolarHBondContact O-N 3.22Å; V439-N442 WeakPolarHBondContact O-CB 3.04Å; V439-N442 PolarHBondContact O-N 2.85Å; V439-N442 VanDerWaalsContact O-N 3.11Å; V439-F443 HydrophobicContact CG1-CD2 3.98Å; V439-F443 HydrophobicContact CG1-CE2 3.42Å; V439-F443 VanDerWaalsContact CG1-CE2 3.42Å; V439-F443 HydrophobicContact CG1-CZ 3.98Å; V439-F443 WeakPolarHBondContact O-CD2 3.05Å; V439-F443 PolarHBondContact O-N 3.43Å
440	N	92.3	Very high	91.9	Very high	81 Å²	81	42.9 Å²	42.9	43%	0.433	22%	0.216	S	C	.	.	H	α-helix	trans	-61.6	-38.6	176.8	-73.3	-27	0	0	0	112.6	I436 W437 F443 A444	I436-N440 PolarHBondContact O-N 2.89Å; I436-N440 PolarHBondContact O-ND2 2.84Å; W437-N440 PolarHBondContact O-N 3.41Å; N440-F443 PolarHBondContact O-N 3.18Å; N440-A444 WeakPolarHBondContact O-CB 3.09Å; N440-A444 PolarHBondContact O-N 3.47Å
441	F	92.4	Very high	92.1	Very high	13 Å²	13	42.8 Å²	42.8	6%	0.057	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-41.9	173.3	168.9	-95.9	0	0	0	112.2	C403 F406 N407 W437 Q438 V439 F443 A444 I445	C403-F441 HydrophobicContact CB-CD2 4.16Å; C403-F441 HydrophobicContact CB-CE2 3.93Å; F406-F441 HydrophobicContact CB-CD2 4.48Å; F406-F441 HydrophobicContact CD1-CB 3.43Å; F406-F441 VanDerWaalsContact CD1-CB 3.43Å; F406-F441 HydrophobicContact CD1-CD1 4.43Å; F406-F441 AromaticContact CD1-CD2 3.43Å; F406-F441 HydrophobicContact CD1-CD2 3.43Å; F406-F441 VanDerWaalsContact CD1-CD2 3.43Å; F406-F441 HydrophobicContact CD1-CE2 4.21Å; F406-F441 AromaticContact CD1-CG 3.51Å; F406-F441 HydrophobicContact CD1-CG 3.51Å; F406-F441 HydrophobicContact CE1-CB 3.46Å; F406-F441 VanDerWaalsContact CE1-CB 3.46Å; F406-F441 HydrophobicContact CE1-CD1 4.35Å; F406-F441 HydrophobicContact CE1-CD2 4.14Å; F406-F441 AromaticContact CE1-CG 3.74Å; F406-F441 HydrophobicContact CE1-CG 3.74Å; F406-F441 HydrophobicContact CG-CB 4.38Å; F406-F441 HydrophobicContact CG-CD2 4.36Å; F406-F441 HydrophobicContact CZ-CB 4.49Å; N407-F441 VanDerWaalsContact CG-CE2 3.47Å; N407-F441 VanDerWaalsContact CG-CZ 3.46Å; N407-F441 WeakPolarHBondContact ND2-CE2 3.13Å; N407-F441 WeakPolarHBondContact ND2-CZ 3.25Å; N407-F441 WeakPolarHBondContact OD1-CE2 3.23Å; N407-F441 WeakPolarHBondContact OD1-CZ 3.24Å; W437-F441 VanDerWaalsContact O-CB 3.27Å; W437-F441 WeakPolarHBondContact O-CB 3.22Å; W437-F441 PolarHBondContact O-N 2.72Å; Q438-F441 VanDerWaalsContact NE2-CD1 3.33Å; Q438-F441 PolarHBondContact O-N 2.93Å; V439-F441 VanDerWaalsContact C-N 3.31Å; V439-F441 PolarHBondContact O-N 3.22Å; F441-F443 VanDerWaalsContact C-N 3.32Å; F441-F443 PolarHBondContact O-N 3.38Å; F441-A444 PolarHBondContact O-N 2.95Å; F441-I445 HydrophobicContact CD1-CD1 4.19Å; F441-I445 HydrophobicContact CD2-CD1 4.34Å; F441-I445 HydrophobicContact CD2-CG1 4.37Å; F441-I445 HydrophobicContact CE1-CD1 3.4Å; F441-I445 HydrophobicContact CE1-CG1 4.22Å; F441-I445 HydrophobicContact CE2-CD1 3.58Å; F441-I445 HydrophobicContact CE2-CG1 3.98Å; F441-I445 HydrophobicContact CZ-CD1 3.07Å; F441-I445 HydrophobicContact CZ-CG1 3.94Å; F441-I445 PolarHBondContact O-N 2.69Å
442	N	91.1	Very high	92.1	Very high	41 Å²	41	42.9 Å²	42.9	22%	0.219	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-42	175.3	-68.6	-12.3	0	0	0	111.1	F124 Q438 V439 S446	F124-N442 HydrophobicContact CZ-CB 4.28Å; Q438-N442 PolarHBondContact NE2-OD1 3.49Å; Q438-N442 PolarHBondContact O-N 3.3Å; Q438-N442 PolarHBondContact O-OD1 3.26Å; V439-N442 WeakPolarHBondContact O-CB 3.04Å; V439-N442 PolarHBondContact O-N 2.85Å; V439-N442 VanDerWaalsContact O-N 3.11Å; N442-S446 WeakPolarHBondContact O-CB 2.9Å; N442-S446 PolarHBondContact O-N 3.11Å; N442-S446 PolarHBondContact O-OG 3.17Å
443	F	93.4	Very high	92.1	Very high	126 Å²	126	48.7 Å²	48.7	55%	0.553	24%	0.238	S	C	*	.	H	α-helix	trans	-62.3	-45.6	173.1	-67.5	-45.9	0	0	0	112.2	V439 N440 F441 I445 S446 I447	V439-F443 HydrophobicContact CG1-CD2 3.98Å; V439-F443 HydrophobicContact CG1-CE2 3.42Å; V439-F443 VanDerWaalsContact CG1-CE2 3.42Å; V439-F443 HydrophobicContact CG1-CZ 3.98Å; V439-F443 WeakPolarHBondContact O-CD2 3.05Å; V439-F443 PolarHBondContact O-N 3.43Å; N440-F443 PolarHBondContact O-N 3.18Å; F441-F443 VanDerWaalsContact C-N 3.32Å; F441-F443 PolarHBondContact O-N 3.38Å; F443-I445 PolarHBondContact O-N 3Å; F443-S446 WeakPolarHBondContact O-CB 3.4Å; F443-S446 PolarHBondContact O-N 3.38Å; F443-I447 WeakPolarHBondContact O-CG1 3.27Å; F443-I447 PolarHBondContact O-N 3.36Å
444	A	94	Very high	92.2	Very high	21 Å²	21	49 Å²	49	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-43.8	180	0	0	0	0	0	112.5	I399 C403 N440 F441 I447 T448	I399-A444 HydrophobicContact CG2-CB 3.97Å; C403-A444 WeakPolarHBondContact SG-CB 3.49Å; N440-A444 WeakPolarHBondContact O-CB 3.09Å; N440-A444 PolarHBondContact O-N 3.47Å; F441-A444 PolarHBondContact O-N 2.95Å; A444-I447 PolarHBondContact O-N 3.08Å; A444-T448 WeakPolarHBondContact O-CB 3.34Å; A444-T448 PolarHBondContact O-N 3.12Å; A444-T448 PolarHBondContact O-OG1 3.07Å
445	I	92.8	Very high	92	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-62.1	-44.2	173	-75.1	-166.7	0	0	0	111.2	I119 A120 F441 F443 I447 T448 V449	I119-I445 HydrophobicContact CG2-CD1 4.26Å; A120-I445 HydrophobicContact CB-CG2 3.6Å; F441-I445 HydrophobicContact CD1-CD1 4.19Å; F441-I445 HydrophobicContact CD2-CD1 4.34Å; F441-I445 HydrophobicContact CD2-CG1 4.37Å; F441-I445 HydrophobicContact CE1-CD1 3.4Å; F441-I445 HydrophobicContact CE1-CG1 4.22Å; F441-I445 HydrophobicContact CE2-CD1 3.58Å; F441-I445 HydrophobicContact CE2-CG1 3.98Å; F441-I445 HydrophobicContact CZ-CD1 3.07Å; F441-I445 HydrophobicContact CZ-CG1 3.94Å; F441-I445 PolarHBondContact O-N 2.69Å; F443-I445 PolarHBondContact O-N 3Å; I445-I447 VanDerWaalsContact C-N 3.34Å; I445-I447 PolarHBondContact O-N 3.07Å; I445-T448 WeakPolarHBondContact O-CB 3.31Å; I445-T448 PolarHBondContact O-N 3.28Å; I445-T448 VanDerWaalsContact O-N 3.12Å; I445-V449 HydrophobicContact CG2-CG2 4.3Å; I445-V449 WeakPolarHBondContact O-CG2 3.31Å; I445-V449 PolarHBondContact O-N 3.36Å
446	S	93.6	Very high	91.7	Very high	68 Å²	68	50.1 Å²	50.1	48%	0.476	25%	0.247	S	C	.	.	H	α-helix	trans	-60.6	-44.8	-179.5	-59.2	0	0	0	0	111.5	N442 F443 V449 F450	N442-S446 WeakPolarHBondContact O-CB 2.9Å; N442-S446 PolarHBondContact O-N 3.11Å; N442-S446 PolarHBondContact O-OG 3.17Å; F443-S446 WeakPolarHBondContact O-CB 3.4Å; F443-S446 PolarHBondContact O-N 3.38Å; S446-V449 PolarHBondContact O-N 2.85Å; S446-F450 PolarHBondContact O-N 3.42Å
447	I	94.6	Very high	91.4	Very high	87 Å²	87	53.5 Å²	53.5	45%	0.446	26%	0.261	S	S	.	.	H	α-helix	trans	-63.7	-41.8	174.5	-66.7	166.5	0	0	0	110.7	I399 F443 A444 I445 V449 F450 L451	I399-I447 HydrophobicContact CD1-CG2 4.18Å; F443-I447 WeakPolarHBondContact O-CG1 3.27Å; F443-I447 PolarHBondContact O-N 3.36Å; A444-I447 PolarHBondContact O-N 3.08Å; I445-I447 VanDerWaalsContact C-N 3.34Å; I445-I447 PolarHBondContact O-N 3.07Å; I447-V449 PolarHBondContact O-N 3.49Å; I447-F450 PolarHBondContact O-N 3.23Å; I447-L451 HydrophobicContact CG2-CD1 3.94Å; I447-L451 HydrophobicContact CG2-CG 4.24Å; I447-L451 WeakPolarHBondContact O-CG 3.47Å; I447-L451 PolarHBondContact O-N 2.86Å
448	T	93	Very high	90.8	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-43.6	178.5	-55.9	0	0	0	0	111.6	L116 I396 I399 A444 I445 L451 A452	L116-T448 HydrophobicContact CD1-CG2 4.29Å; L116-T448 HydrophobicContact CD2-CG2 4Å; I396-T448 HydrophobicContact CG2-CG2 4.4Å; I399-T448 WeakPolarHBondContact CG2-OG1 3.23Å; A444-T448 WeakPolarHBondContact O-CB 3.34Å; A444-T448 PolarHBondContact O-N 3.12Å; A444-T448 PolarHBondContact O-OG1 3.07Å; I445-T448 WeakPolarHBondContact O-CB 3.31Å; I445-T448 PolarHBondContact O-N 3.28Å; I445-T448 VanDerWaalsContact O-N 3.12Å; T448-L451 PolarHBondContact O-N 3.03Å; T448-A452 VanDerWaalsContact O-CB 3.3Å; T448-A452 WeakPolarHBondContact O-CB 3.5Å; T448-A452 PolarHBondContact O-N 3.43Å
449	V	93.4	Very high	90	Very high	18 Å²	18	52.6 Å²	52.6	11%	0.109	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-45.1	176	171.6	0	0	0	0	110.6	L116 L117 A120 I445 S446 I447 A452 W453	L116-V449 HydrophobicContact CD1-CG2 4.39Å; L116-V449 HydrophobicContact CD2-CB 4.38Å; L116-V449 HydrophobicContact CD2-CG2 3.79Å; L116-V449 HydrophobicContact CG-CG2 3.73Å; L117-V449 HydrophobicContact CD2-CG1 4.07Å; A120-V449 HydrophobicContact CB-CG2 3.85Å; I445-V449 HydrophobicContact CG2-CG2 4.3Å; I445-V449 WeakPolarHBondContact O-CG2 3.31Å; I445-V449 PolarHBondContact O-N 3.36Å; S446-V449 PolarHBondContact O-N 2.85Å; I447-V449 PolarHBondContact O-N 3.49Å; V449-A452 PolarHBondContact O-N 3.05Å; V449-W453 VanDerWaalsContact O-CD1 3.27Å; V449-W453 PolarHBondContact O-N 3.39Å
450	F	95.2	Very high	89.3	Confident	133 Å²	133	54 Å²	54	58%	0.583	26%	0.264	S	S	*	.	H	α-helix	trans	-59.4	-49.8	176.8	174.4	-99.7	0	0	0	112	S446 I447 A452 W453 V454	S446-F450 PolarHBondContact O-N 3.42Å; I447-F450 PolarHBondContact O-N 3.23Å; F450-A452 VanDerWaalsContact C-N 3.3Å; F450-A452 PolarHBondContact O-N 3.42Å; F450-W453 WeakPolarHBondContact O-CB 3.46Å; F450-W453 PolarHBondContact O-N 3.44Å; F450-W453 VanDerWaalsContact O-N 3.14Å; F450-V454 HydrophobicContact CD1-CG2 4.38Å; F450-V454 HydrophobicContact CE1-CG2 3.94Å; F450-V454 HydrophobicContact CE2-CG2 4.38Å; F450-V454 HydrophobicContact CZ-CG2 3.94Å; F450-V454 WeakPolarHBondContact O-CG2 3.32Å; F450-V454 PolarHBondContact O-N 2.95Å
451	L	93.4	Very high	88.1	Confident	32 Å²	32	52.3 Å²	52.3	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-34.9	178	-67.3	177.7	0	0	0	112.1	I395 I396 I399 I447 T448 W453 V454 K455	I395-L451 HydrophobicContact CG2-CD1 4.02Å; I396-L451 HydrophobicContact CD1-CB 3.87Å; I396-L451 HydrophobicContact CG1-CB 3.83Å; I396-L451 HydrophobicContact CG1-CD1 4.19Å; I399-L451 HydrophobicContact CD1-CD1 4.41Å; I447-L451 HydrophobicContact CG2-CD1 3.94Å; I447-L451 HydrophobicContact CG2-CG 4.24Å; I447-L451 WeakPolarHBondContact O-CG 3.47Å; I447-L451 PolarHBondContact O-N 2.86Å; T448-L451 PolarHBondContact O-N 3.03Å; L451-W453 VanDerWaalsContact C-N 3.33Å; L451-W453 PolarHBondContact O-N 3.3Å; L451-V454 PolarHBondContact O-N 3.34Å; L451-K455 WeakPolarHBondContact O-CB 3.21Å; L451-K455 PolarHBondContact O-N 3.09Å
452	A	90.5	Very high	86.9	Confident	3 Å²	3	55.4 Å²	55.4	3%	0.025	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-38.3	174.2	0	0	0	0	0	112	Y109 I113 L116 T448 V449 F450 K455 L456	Y109-A452 WeakPolarHBondContact OH-CA 3.42Å; Y109-A452 PolarHBondContact OH-O 3.36Å; I113-A452 HydrophobicContact CG1-CB 4.38Å; L116-A452 HydrophobicContact CD2-CB 3.95Å; T448-A452 VanDerWaalsContact O-CB 3.3Å; T448-A452 WeakPolarHBondContact O-CB 3.5Å; T448-A452 PolarHBondContact O-N 3.43Å; V449-A452 PolarHBondContact O-N 3.05Å; F450-A452 VanDerWaalsContact C-N 3.3Å; F450-A452 PolarHBondContact O-N 3.42Å; A452-K455 PolarHBondContact O-N 2.93Å; A452-L456 PolarHBondContact O-N 3.45Å
453	W	91.6	Very high	86	Confident	129 Å²	129	56.9 Å²	56.9	49%	0.489	28%	0.28	S	S	.	.	H	α-helix	trans	-67.1	-42.2	171.8	-81.9	110.1	0	0	0	112.5	I113 L117 V449 F450 L451 K455 L456	I113-W453 HydrophobicContact CG2-CZ2 4.27Å; L117-W453 HydrophobicContact CD1-CZ2 4.35Å; V449-W453 VanDerWaalsContact O-CD1 3.27Å; V449-W453 PolarHBondContact O-N 3.39Å; F450-W453 WeakPolarHBondContact O-CB 3.46Å; F450-W453 PolarHBondContact O-N 3.44Å; F450-W453 VanDerWaalsContact O-N 3.14Å; L451-W453 VanDerWaalsContact C-N 3.33Å; L451-W453 PolarHBondContact O-N 3.3Å; W453-K455 VanDerWaalsContact C-N 3.3Å; W453-K455 PolarHBondContact O-N 3.2Å; W453-L456 HydrophobicContact CE3-CD2 3.77Å; W453-L456 HydrophobicContact CZ3-CD2 3.61Å; W453-L456 WeakPolarHBondContact O-CB 3.44Å; W453-L456 PolarHBondContact O-N 3.41Å
454	V	90	Very high	84.9	Confident	43 Å²	43	54.1 Å²	54.1	26%	0.261	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-41	175.3	172.9	0	0	0	0	111.2	L392 F450 L451 L456 F457	L392-V454 HydrophobicContact CD1-CG1 4.16Å; F450-V454 HydrophobicContact CD1-CG2 4.38Å; F450-V454 HydrophobicContact CE1-CG2 3.94Å; F450-V454 HydrophobicContact CE2-CG2 4.38Å; F450-V454 HydrophobicContact CZ-CG2 3.94Å; F450-V454 WeakPolarHBondContact O-CG2 3.32Å; F450-V454 PolarHBondContact O-N 2.95Å; L451-V454 PolarHBondContact O-N 3.34Å; V454-L456 PolarHBondContact O-N 3.33Å; V454-F457 WeakPolarHBondContact O-CB 3.42Å; V454-F457 VanDerWaalsContact O-CD2 3.27Å; V454-F457 WeakPolarHBondContact O-CD2 3.25Å; V454-F457 PolarHBondContact O-N 3.45Å
455	K	86.4	Confident	84.2	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.03	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-22.6	175.8	174.1	175.6	-172.8	168.3	0	112.9	Y109 L392 D393 I396 L451 A452 W453 F457 K458 Y459	Y109-K455 HydrophobicContact CE1-CG 4.44Å; Y109-K455 HydrophobicContact CE2-CD 3.69Å; Y109-K455 HydrophobicContact CE2-CG 4.17Å; Y109-K455 VanDerWaalsContact OH-CB 3.29Å; Y109-K455 WeakPolarHBondContact OH-CB 3.37Å; Y109-K455 WeakPolarHBondContact OH-CD 3.46Å; Y109-K455 WeakPolarHBondContact OH-CG 3.48Å; L392-K455 HydrophobicContact CD2-CB 4.07Å; D393-K455 WeakPolarHBondContact OD1-CD 3.44Å; D393-K455 WeakPolarHBondContact OD1-CE 3.4Å; D393-K455 IonicContact OD1-NZ 3.86Å; D393-K455 PolarHBondContact OD1-NZ 3.1Å; D393-K455 IonicContact OD2-NZ 2.67Å; D393-K455 PolarHBondContact OD2-NZ 3.33Å; I396-K455 HydrophobicContact CD1-CD 4.49Å; L451-K455 WeakPolarHBondContact O-CB 3.21Å; L451-K455 PolarHBondContact O-N 3.09Å; A452-K455 PolarHBondContact O-N 2.93Å; W453-K455 VanDerWaalsContact C-N 3.3Å; W453-K455 PolarHBondContact O-N 3.2Å; K455-F457 PolarHBondContact O-N 3.46Å; K455-K458 VanDerWaalsContact O-CB 3.27Å; K455-K458 WeakPolarHBondContact O-CB 3.49Å; K455-K458 PolarHBondContact O-N 3.36Å; K455-Y459 HydrophobicContact CD-CE2 4.46Å; K455-Y459 WeakPolarHBondContact CE-OH 3.46Å; K455-Y459 HydrophobicContact CG-CE2 4.02Å
456	L	85.3	Confident	83.5	Confident	28 Å²	28	59.4 Å²	59.4	15%	0.147	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-31.4	172.8	-168.1	66.5	0	0	0	111.9	Y109 L110 I113 A452 W453 V454 K458 Y459 I460	Y109-L456 HydrophobicContact CD1-CD1 4.26Å; Y109-L456 HydrophobicContact CE1-CD1 4.22Å; L110-L456 HydrophobicContact CD2-CD1 4.12Å; I113-L456 HydrophobicContact CD1-CD1 4.4Å; A452-L456 PolarHBondContact O-N 3.45Å; W453-L456 HydrophobicContact CE3-CD2 3.77Å; W453-L456 HydrophobicContact CZ3-CD2 3.61Å; W453-L456 WeakPolarHBondContact O-CB 3.44Å; W453-L456 PolarHBondContact O-N 3.41Å; V454-L456 PolarHBondContact O-N 3.33Å; L456-K458 VanDerWaalsContact C-N 3.25Å; L456-K458 PolarHBondContact O-N 3.02Å; L456-Y459 PolarHBondContact O-N 2.64Å; L456-I460 HydrophobicContact CD2-CD1 4.08Å; L456-I460 HydrophobicContact CG-CD1 3.85Å; L456-I460 HydrophobicContact CG-CG1 4.37Å; L456-I460 WeakPolarHBondContact O-CG1 3.43Å; L456-I460 PolarHBondContact O-N 3.4Å; L456-I460 VanDerWaalsContact O-N 3.11Å
457	F	83.1	Confident	82.7	Confident	115 Å²	115	58.1 Å²	58.1	50%	0.504	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-32.9	175.9	-68.6	-57.5	0	0	0	113.3	W389 V454 K455 Y459 I460 S461	W389-F457 HydrophobicContact CH2-CB 4.14Å; V454-F457 WeakPolarHBondContact O-CB 3.42Å; V454-F457 VanDerWaalsContact O-CD2 3.27Å; V454-F457 WeakPolarHBondContact O-CD2 3.25Å; V454-F457 PolarHBondContact O-N 3.45Å; K455-F457 PolarHBondContact O-N 3.46Å; F457-Y459 PolarHBondContact O-N 2.69Å; F457-I460 PolarHBondContact O-N 2.79Å; F457-I460 VanDerWaalsContact O-N 3.1Å; F457-S461 PolarHBondContact O-N 3.22Å; F457-S461 VanDerWaalsContact O-N 3.09Å
458	K	78	Confident	82.1	Confident	63 Å²	63	55.3 Å²	55.3	27%	0.274	27%	0.269	S	S	.	.	H	α-helix	trans	-59.8	-34.5	173.8	-171.3	-177.1	-176.2	175.8	0	111.7	W389 D393 K455 L456 S461	W389-K458 HydrophobicContact CB-CD 3.93Å; W389-K458 HydrophobicContact CD2-CB 4.02Å; W389-K458 HydrophobicContact CD2-CD 4.06Å; W389-K458 HydrophobicContact CD2-CG 4.04Å; W389-K458 HydrophobicContact CE3-CB 3.81Å; W389-K458 HydrophobicContact CE3-CD 4.19Å; W389-K458 HydrophobicContact CE3-CG 4.26Å; W389-K458 HydrophobicContact CG-CD 3.96Å; W389-K458 HydrophobicContact CG-CG 4.25Å; W389-K458 HydrophobicContact CH2-CB 4.21Å; W389-K458 HydrophobicContact CZ2-CB 4.4Å; W389-K458 HydrophobicContact CZ3-CB 3.91Å; D393-K458 IonicContact OD2-NZ 3.6Å; K455-K458 VanDerWaalsContact O-CB 3.27Å; K455-K458 WeakPolarHBondContact O-CB 3.49Å; K455-K458 PolarHBondContact O-N 3.36Å; L456-K458 VanDerWaalsContact C-N 3.25Å; L456-K458 PolarHBondContact O-N 3.02Å; K458-S461 PolarHBondContact O-OG 3.28Å
459	Y	75.8	Confident	81.7	Confident	42 Å²	42	59.7 Å²	59.7	17%	0.165	29%	0.292	C	S	.	.	H	α-helix	trans	-86.9	-15.4	178.4	-59.1	-73.1	0	0	0	112.9	I106 Y109 K455 L456 F457 F462	I106-Y459 HydrophobicContact CG1-CD1 3.99Å; I106-Y459 HydrophobicContact CG1-CG 4.36Å; Y109-Y459 AromaticContact CD1-CD2 3.6Å; Y109-Y459 HydrophobicContact CD1-CD2 3.6Å; Y109-Y459 AromaticContact CD1-CE2 3.33Å; Y109-Y459 HydrophobicContact CD1-CE2 3.33Å; Y109-Y459 AromaticContact CD2-CE2 3.77Å; Y109-Y459 HydrophobicContact CD2-CE2 3.77Å; Y109-Y459 AromaticContact CE1-CD2 3.83Å; Y109-Y459 HydrophobicContact CE1-CD2 3.83Å; Y109-Y459 AromaticContact CE1-CE2 3.56Å; Y109-Y459 HydrophobicContact CE1-CE2 3.56Å; Y109-Y459 HydrophobicContact CE2-CE2 4.01Å; Y109-Y459 HydrophobicContact CG-CD2 4.13Å; Y109-Y459 AromaticContact CG-CE2 3.44Å; Y109-Y459 HydrophobicContact CG-CE2 3.44Å; Y109-Y459 VanDerWaalsContact CG-CE2 3.44Å; Y109-Y459 AromaticContact CG-CZ 3.91Å; Y109-Y459 AromaticContact CZ-CE2 3.93Å; K455-Y459 HydrophobicContact CD-CE2 4.46Å; K455-Y459 WeakPolarHBondContact CE-OH 3.46Å; K455-Y459 HydrophobicContact CG-CE2 4.02Å; L456-Y459 PolarHBondContact O-N 2.64Å; F457-Y459 PolarHBondContact O-N 2.69Å; Y459-F462 WeakPolarHBondContact O-CD2 3.28Å; Y459-F462 WeakPolarHBondContact O-CE2 3.49Å
460	I	75	Confident	81.1	Confident	70 Å²	70	61.6 Å²	61.6	36%	0.359	31%	0.306	S	S	.	.	H	α-helix	trans	-92.9	-10	177.4	-63.3	170.6	0	0	0	111.6	L456 F457 F462 N463 M466	L456-I460 HydrophobicContact CD2-CD1 4.08Å; L456-I460 HydrophobicContact CG-CD1 3.85Å; L456-I460 HydrophobicContact CG-CG1 4.37Å; L456-I460 WeakPolarHBondContact O-CG1 3.43Å; L456-I460 PolarHBondContact O-N 3.4Å; L456-I460 VanDerWaalsContact O-N 3.11Å; F457-I460 PolarHBondContact O-N 2.79Å; F457-I460 VanDerWaalsContact O-N 3.1Å; I460-F462 PolarHBondContact O-N 2.83Å; I460-N463 PolarHBondContact O-N 2.78Å; I460-N463 VanDerWaalsContact O-N 3.08Å; I460-M466 HydrophobicContact CG2-CG 4.17Å
461	S	68.5	Low	80.5	Confident	45 Å²	45	57.6 Å²	57.6	32%	0.315	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-6.6	178.7	66.9	0	0	0	0	114.7	F457 K458 N463 T467	F457-S461 PolarHBondContact O-N 3.22Å; F457-S461 VanDerWaalsContact O-N 3.09Å; K458-S461 PolarHBondContact O-OG 3.28Å; S461-N463 PolarHBondContact O-N 3.36Å; S461-T467 PolarHBondContact O-OG1 3.38Å
462	F	66.2	Low	80.3	Confident	79 Å²	79	56.5 Å²	56.5	35%	0.346	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-11.2	164.7	-59.9	-66.2	0	0	0	114.1	I102 I106 Y459 I460 F581 M583	I102-F462 HydrophobicContact CD1-CE1 4.2Å; I102-F462 HydrophobicContact CD1-CZ 4.27Å; I102-F462 HydrophobicContact CG2-CE1 4.2Å; I102-F462 HydrophobicContact CG2-CE2 3.9Å; I102-F462 HydrophobicContact CG2-CZ 3.38Å; I106-F462 HydrophobicContact CD1-CE2 3.87Å; Y459-F462 WeakPolarHBondContact O-CD2 3.28Å; Y459-F462 WeakPolarHBondContact O-CE2 3.49Å; I460-F462 PolarHBondContact O-N 2.83Å; F462-F581 VanDerWaalsContact C-CE1 3.47Å; F462-F581 WeakPolarHBondContact O-CD1 3.42Å; F462-F581 WeakPolarHBondContact O-CE1 3.35Å; F462-M583 HydrophobicContact CD1-SD 3.53Å; F462-M583 VanDerWaalsContact CD1-SD 3.53Å; F462-M583 HydrophobicContact CE1-CE 4.28Å; F462-M583 HydrophobicContact CE1-SD 3.77Å; F462-M583 HydrophobicContact CG-SD 4.11Å
463	N	71.1	Confident	80.1	Confident	71 Å²	71	62.1 Å²	62.1	38%	0.38	32%	0.318	S	S	.	.	S	Bend	trans	-91.6	131.5	170	-169.6	-17.1	0	0	0	111.8	I460 S461 T465 M466 T467	I460-N463 PolarHBondContact O-N 2.78Å; I460-N463 VanDerWaalsContact O-N 3.08Å; S461-N463 PolarHBondContact O-N 3.36Å; N463-T465 PolarHBondContact ND2-OG1 3.45Å; N463-T465 PolarHBondContact O-N 2.82Å; N463-T465 PolarHBondContact OD1-N 3.23Å; N463-T465 PolarHBondContact OD1-OG1 2.99Å; N463-T465 VanDerWaalsContact OD1-OG1 3.1Å; N463-M466 HydrophobicContact CB-CB 4.31Å; N463-M466 HydrophobicContact CB-CG 4.16Å; N463-M466 PolarHBondContact O-N 3.35Å; N463-M466 VanDerWaalsContact O-N 3.07Å; N463-T467 PolarHBondContact O-N 3.11Å
464	K	72.3	Confident	79.8	Confident	69 Å²	69	58.6 Å²	58.6	30%	0.3	32%	0.321	S	S	.	.	H	α-helix	trans	-50.7	-41.4	173.6	-173.3	169.6	-174.9	163.6	0	112.7	M466 T467 Q468 L574 F581	K464-M466 PolarHBondContact O-N 3.01Å; K464-T467 PolarHBondContact O-N 3.2Å; K464-Q468 WeakPolarHBondContact O-CB 3.46Å; K464-Q468 PolarHBondContact O-N 3.46Å; K464-L574 PolarHBondContact NZ-O 2.68Å; K464-F581 VanDerWaalsContact CA-CZ 3.45Å; K464-F581 HydrophobicContact CB-CD2 3.83Å; K464-F581 HydrophobicContact CB-CE2 3.73Å; K464-F581 HydrophobicContact CB-CG 4.29Å; K464-F581 HydrophobicContact CB-CZ 4.12Å; K464-F581 HydrophobicContact CD-CD2 4.43Å; K464-F581 HydrophobicContact CG-CD2 4.13Å; K464-F581 HydrophobicContact CG-CE2 3.91Å
465	T	78.5	Confident	79.6	Confident	73 Å²	73	59.5 Å²	59.5	45%	0.448	33%	0.33	S	S	.	.	H	α-helix	trans	-66.8	-38.3	-179.7	59.6	0	0	0	0	112.4	N463 Q468 L469	N463-T465 PolarHBondContact ND2-OG1 3.45Å; N463-T465 PolarHBondContact O-N 2.82Å; N463-T465 PolarHBondContact OD1-N 3.23Å; N463-T465 PolarHBondContact OD1-OG1 2.99Å; N463-T465 VanDerWaalsContact OD1-OG1 3.1Å; T465-Q468 WeakPolarHBondContact O-CB 3.45Å; T465-Q468 PolarHBondContact O-N 2.98Å; T465-L469 WeakPolarHBondContact O-CG 3.25Å; T465-L469 PolarHBondContact O-N 3.31Å
466	M	77.5	Confident	79.8	Confident	69 Å²	69	59.5 Å²	59.5	34%	0.34	33%	0.33	S	S	.	.	H	α-helix	trans	-73.4	-38.1	179.3	-67.9	-63	-179.6	0	0	111.7	I460 N463 K464 Q468 L469 S470	I460-M466 HydrophobicContact CG2-CG 4.17Å; N463-M466 HydrophobicContact CB-CB 4.31Å; N463-M466 HydrophobicContact CB-CG 4.16Å; N463-M466 PolarHBondContact O-N 3.35Å; N463-M466 VanDerWaalsContact O-N 3.07Å; K464-M466 PolarHBondContact O-N 3.01Å; M466-Q468 VanDerWaalsContact C-N 3.31Å; M466-L469 PolarHBondContact O-N 3.02Å; M466-L469 HydrophobicContact SD-CD1 4.12Å; M466-S470 WeakPolarHBondContact O-CB 3.31Å; M466-S470 PolarHBondContact O-N 3.09Å
467	T	77.6	Confident	80	Confident	41 Å²	41	60.6 Å²	60.6	25%	0.252	34%	0.343	S	S	.	.	H	α-helix	trans	-63	-39.7	171.5	-68.9	0	0	0	0	111.3	S461 N463 K464 S470 S471 F581	S461-T467 PolarHBondContact O-OG1 3.38Å; N463-T467 PolarHBondContact O-N 3.11Å; K464-T467 PolarHBondContact O-N 3.2Å; T467-S470 PolarHBondContact O-N 2.69Å; T467-S471 VanDerWaalsContact O-CB 3.26Å; T467-S471 WeakPolarHBondContact O-CB 3.36Å; T467-S471 PolarHBondContact O-N 3.15Å; T467-F581 HydrophobicContact CG2-CZ 4.26Å
468	Q	82	Confident	80.3	Confident	28 Å²	28	63.4 Å²	63.4	13%	0.131	36%	0.355	C	S	.	.	H	α-helix	trans	-59.5	-47	173.9	-176.2	174.2	-6.6	0	0	112.6	K464 T465 M466 S471 T472 Y567 V570 L574	K464-Q468 WeakPolarHBondContact O-CB 3.46Å; K464-Q468 PolarHBondContact O-N 3.46Å; T465-Q468 WeakPolarHBondContact O-CB 3.45Å; T465-Q468 PolarHBondContact O-N 2.98Å; M466-Q468 VanDerWaalsContact C-N 3.31Å; Q468-S471 PolarHBondContact O-N 3.44Å; Q468-T472 WeakPolarHBondContact O-CB 3.46Å; Q468-T472 PolarHBondContact O-N 3.35Å; Q468-T472 PolarHBondContact O-OG1 3.49Å; Q468-Y567 HydrophobicContact CG-CE2 4.4Å; Q468-Y567 PolarHBondContact NE2-OH 2.88Å; Q468-V570 HydrophobicContact CG-CG1 4.41Å; Q468-L574 HydrophobicContact CB-CD1 3.47Å; Q468-L574 VanDerWaalsContact CB-CD1 3.47Å; Q468-L574 HydrophobicContact CG-CD1 3.6Å
469	L	83.8	Confident	81	Confident	96 Å²	96	64.6 Å²	64.6	50%	0.503	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-47.9	175.8	-71.2	171	0	0	0	111.6	T465 M466 S471 T472 L473	T465-L469 WeakPolarHBondContact O-CG 3.25Å; T465-L469 PolarHBondContact O-N 3.31Å; M466-L469 PolarHBondContact O-N 3.02Å; M466-L469 HydrophobicContact SD-CD1 4.12Å; L469-S471 VanDerWaalsContact C-N 3.34Å; L469-S471 PolarHBondContact O-N 3.25Å; L469-T472 PolarHBondContact O-N 2.97Å; L469-L473 WeakPolarHBondContact O-CG 3.39Å; L469-L473 PolarHBondContact O-N 3.04Å
470	S	81.8	Confident	81.7	Confident	58 Å²	58	65.4 Å²	65.4	41%	0.406	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-40.5	-179.7	-172.8	0	0	0	0	112.4	M466 T467 G474	M466-S470 WeakPolarHBondContact O-CB 3.31Å; M466-S470 PolarHBondContact O-N 3.09Å; T467-S470 PolarHBondContact O-N 2.69Å; S470-G474 PolarHBondContact O-N 2.91Å
471	S	82.6	Confident	82.5	Confident	48 Å²	48	64.7 Å²	64.7	34%	0.336	38%	0.376	S	S	.	.	H	α-helix	trans	-68.6	-40.4	177	-176.6	0	0	0	0	111.5	T467 Q468 L469 L473 G474 S475	T467-S471 VanDerWaalsContact O-CB 3.26Å; T467-S471 WeakPolarHBondContact O-CB 3.36Å; T467-S471 PolarHBondContact O-N 3.15Å; Q468-S471 PolarHBondContact O-N 3.44Å; L469-S471 VanDerWaalsContact C-N 3.34Å; L469-S471 PolarHBondContact O-N 3.25Å; S471-L473 PolarHBondContact O-N 3.37Å; S471-G474 PolarHBondContact O-N 3.32Å; S471-S475 WeakPolarHBondContact O-CB 3.48Å; S471-S475 PolarHBondContact O-N 3.42Å; S471-S475 PolarHBondContact O-OG 3.05Å; S471-S475 VanDerWaalsContact O-OG 3.05Å
472	T	87.7	Confident	83.5	Confident	9 Å²	9	64.7 Å²	64.7	6%	0.055	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-47	176.2	-56.8	0	0	0	0	111.2	Q468 L469 S475 C476 Y567	Q468-T472 WeakPolarHBondContact O-CB 3.46Å; Q468-T472 PolarHBondContact O-N 3.35Å; Q468-T472 PolarHBondContact O-OG1 3.49Å; L469-T472 PolarHBondContact O-N 2.97Å; T472-S475 PolarHBondContact O-N 2.9Å; T472-C476 WeakPolarHBondContact O-CB 3.44Å; T472-C476 PolarHBondContact O-N 2.89Å; T472-C476 PolarHBondContact O-SG 2.95Å; T472-Y567 HydrophobicContact CG2-CD2 4.27Å
473	L	86.7	Confident	84.7	Confident	122 Å²	122	61.5 Å²	61.5	64%	0.639	37%	0.369	S	S	*	.	H	α-helix	trans	-63.9	-41.6	177	-71.1	171.3	0	0	0	112.4	L469 S471 A477	L469-L473 WeakPolarHBondContact O-CG 3.39Å; L469-L473 PolarHBondContact O-N 3.04Å; S471-L473 PolarHBondContact O-N 3.37Å; L473-A477 WeakPolarHBondContact O-CB 3.36Å; L473-A477 PolarHBondContact O-N 3.25Å; L473-A477 VanDerWaalsContact O-N 3.12Å
474	G	84.9	Confident	85.7	Confident	54 Å²	54	59.1 Å²	59.1	56%	0.557	36%	0.36	S	S	*	.	H	α-helix	trans	-64.7	-44.1	177.4	0	0	0	0	0	112.7	S470 S471	S470-G474 PolarHBondContact O-N 2.91Å; S471-G474 PolarHBondContact O-N 3.32Å
475	S	86.2	Confident	86.7	Confident	63 Å²	63	61.3 Å²	61.3	44%	0.441	37%	0.373	S	S	.	.	H	α-helix	trans	-69.5	-40.5	-179.9	-64.6	0	0	0	0	112.3	S471 T472	S471-S475 WeakPolarHBondContact O-CB 3.48Å; S471-S475 PolarHBondContact O-N 3.42Å; S471-S475 PolarHBondContact O-OG 3.05Å; S471-S475 VanDerWaalsContact O-OG 3.05Å; T472-S475 PolarHBondContact O-N 2.9Å
476	C	91.1	Very high	87.3	Confident	6 Å²	6	63 Å²	63	4%	0.041	38%	0.378	C	S	.	.	H	α-helix	trans	-79.1	-17.3	-179.6	79.4	0	0	0	0	113.9	T472 K478 D479 L480 T566	T472-C476 WeakPolarHBondContact O-CB 3.44Å; T472-C476 PolarHBondContact O-N 2.89Å; T472-C476 PolarHBondContact O-SG 2.95Å; C476-K478 PolarHBondContact O-N 3.18Å; C476-K478 VanDerWaalsContact O-N 3.17Å; C476-D479 PolarHBondContact O-N 3Å; C476-D479 VanDerWaalsContact O-N 3.16Å; C476-L480 VanDerWaalsContact O-CB 3.24Å; C476-L480 WeakPolarHBondContact O-CB 3.4Å; C476-L480 PolarHBondContact O-N 2.92Å; C476-T566 HydrophobicContact CB-CG2 3.72Å; C476-T566 WeakPolarHBondContact CB-OG1 3.44Å
477	A	88.9	Confident	87.9	Confident	51 Å²	51	60.6 Å²	60.6	42%	0.421	37%	0.365	S	S	.	.	H	α-helix	trans	-55.3	-37	-176	0	0	0	0	0	113.4	L473 A481	L473-A477 WeakPolarHBondContact O-CB 3.36Å; L473-A477 PolarHBondContact O-N 3.25Å; L473-A477 VanDerWaalsContact O-N 3.12Å; A477-A481 VanDerWaalsContact O-CB 3.24Å; A477-A481 WeakPolarHBondContact O-CB 2.96Å; A477-A481 PolarHBondContact O-N 2.87Å
478	K	90.2	Very high	88.6	Confident	174 Å²	174	62.6 Å²	62.6	76%	0.757	37%	0.371	S	S	*	.	H	α-helix	trans	-68.2	-46.9	179	-175.3	-177.4	175.8	-173.6	0	111.9	C476 L480 A481 G482	C476-K478 PolarHBondContact O-N 3.18Å; C476-K478 VanDerWaalsContact O-N 3.17Å; K478-L480 VanDerWaalsContact C-N 3.35Å; K478-A481 PolarHBondContact O-N 3.36Å; K478-G482 PolarHBondContact O-N 3.48Å; K478-G482 VanDerWaalsContact O-N 3.07Å
479	D	92	Very high	89.1	Confident	88 Å²	88	66.4 Å²	66.4	47%	0.471	39%	0.391	S	S	.	.	H	α-helix	trans	-69.3	-39	-179.6	-61.5	-21	0	0	0	110.6	C476 G482 F483 I562	C476-D479 PolarHBondContact O-N 3Å; C476-D479 VanDerWaalsContact O-N 3.16Å; D479-G482 PolarHBondContact O-N 2.98Å; D479-F483 PolarHBondContact O-N 3.08Å; D479-I562 HydrophobicContact CB-CG2 3.94Å
480	L	91.9	Very high	89.5	Confident	60 Å²	60	63.5 Å²	63.5	31%	0.314	38%	0.377	S	S	.	.	H	α-helix	trans	-61.1	-44.9	173.5	-170.6	71.5	0	0	0	111.7	C476 K478 G482 F483 A484 F559	C476-L480 VanDerWaalsContact O-CB 3.24Å; C476-L480 WeakPolarHBondContact O-CB 3.4Å; C476-L480 PolarHBondContact O-N 2.92Å; K478-L480 VanDerWaalsContact C-N 3.35Å; L480-G482 VanDerWaalsContact C-N 3.34Å; L480-G482 PolarHBondContact O-N 3.01Å; L480-F483 PolarHBondContact O-N 2.89Å; L480-A484 VanDerWaalsContact O-CB 3.24Å; L480-A484 WeakPolarHBondContact O-CB 3.19Å; L480-A484 PolarHBondContact O-N 3.45Å; L480-F559 HydrophobicContact CD1-CD1 3.23Å; L480-F559 HydrophobicContact CD1-CE1 3.33Å; L480-F559 HydrophobicContact CG-CE1 4.31Å
481	A	90.3	Very high	90.1	Very high	55 Å²	55	61 Å²	61	46%	0.455	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-41	177	0	0	0	0	0	111.8	A477 K478 A484 I485	A477-A481 VanDerWaalsContact O-CB 3.24Å; A477-A481 WeakPolarHBondContact O-CB 2.96Å; A477-A481 PolarHBondContact O-N 2.87Å; K478-A481 PolarHBondContact O-N 3.36Å; A481-A484 PolarHBondContact O-N 2.78Å; A481-I485 WeakPolarHBondContact O-CG1 3.47Å; A481-I485 PolarHBondContact O-N 3.21Å
482	G	90.4	Very high	90.7	Very high	45 Å²	45	63 Å²	63	46%	0.464	36%	0.361	S	S	.	.	H	α-helix	trans	-60.1	-46.2	174.5	0	0	0	0	0	112.5	K478 D479 L480	K478-G482 PolarHBondContact O-N 3.48Å; K478-G482 VanDerWaalsContact O-N 3.07Å; D479-G482 PolarHBondContact O-N 2.98Å; L480-G482 VanDerWaalsContact C-N 3.34Å; L480-G482 PolarHBondContact O-N 3.01Å
483	F	91.6	Very high	91	Very high	11 Å²	11	66 Å²	66	5%	0.048	38%	0.383	C	S	.	.	H	α-helix	trans	-70.9	-33.2	176.5	-178.6	-123.3	0	0	0	113.2	D479 L480 I485 M486 F487 L555 M558 F559 I562	D479-F483 PolarHBondContact O-N 3.08Å; L480-F483 PolarHBondContact O-N 2.89Å; F483-I485 PolarHBondContact O-N 3.23Å; F483-M486 HydrophobicContact CD2-CB 4.37Å; F483-M486 HydrophobicContact CD2-SD 4.25Å; F483-M486 HydrophobicContact CE2-SD 4.06Å; F483-M486 WeakPolarHBondContact O-CB 3.47Å; F483-M486 PolarHBondContact O-N 3.47Å; F483-F487 PolarHBondContact O-N 3.19Å; F483-L555 HydrophobicContact CE2-CD2 4.25Å; F483-L555 HydrophobicContact CZ-CD2 3.7Å; F483-M558 HydrophobicContact CD1-CG 4.45Å; F483-M558 HydrophobicContact CD2-CE 3.32Å; F483-M558 HydrophobicContact CD2-CG 4.32Å; F483-M558 HydrophobicContact CD2-SD 3.67Å; F483-M558 HydrophobicContact CE1-CB 4.09Å; F483-M558 HydrophobicContact CE1-CG 4Å; F483-M558 HydrophobicContact CE1-SD 4.33Å; F483-M558 HydrophobicContact CE2-CB 4.39Å; F483-M558 HydrophobicContact CE2-CE 3.5Å; F483-M558 VanDerWaalsContact CE2-CE 3.5Å; F483-M558 HydrophobicContact CE2-CG 3.87Å; F483-M558 HydrophobicContact CE2-SD 3.12Å; F483-M558 WeakPolarHBondContact CE2-SD 3.25Å; F483-M558 HydrophobicContact CG-CE 4Å; F483-M558 HydrophobicContact CG-SD 4.48Å; F483-M558 HydrophobicContact CZ-CB 3.77Å; F483-M558 HydrophobicContact CZ-CE 4.27Å; F483-M558 HydrophobicContact CZ-CG 3.69Å; F483-M558 HydrophobicContact CZ-SD 3.52Å; F483-M558 VanDerWaalsContact CZ-SD 3.52Å; F483-F559 AromaticContact CD1-CD1 3.52Å; F483-F559 HydrophobicContact CD1-CD1 3.52Å; F483-F559 HydrophobicContact CD1-CD2 4.16Å; F483-F559 AromaticContact CD1-CE1 3.3Å; F483-F559 HydrophobicContact CD1-CE1 3.3Å; F483-F559 AromaticContact CD1-CE2 3.95Å; F483-F559 HydrophobicContact CD1-CE2 3.95Å; F483-F559 AromaticContact CD1-CG 3.95Å; F483-F559 HydrophobicContact CD1-CG 3.95Å; F483-F559 AromaticContact CD1-CZ 3.51Å; F483-F559 HydrophobicContact CD1-CZ 3.51Å; F483-F559 AromaticContact CE1-CD1 3.73Å; F483-F559 HydrophobicContact CE1-CD1 3.73Å; F483-F559 AromaticContact CE1-CD2 3.52Å; F483-F559 HydrophobicContact CE1-CD2 3.52Å; F483-F559 AromaticContact CE1-CE1 3.69Å; F483-F559 HydrophobicContact CE1-CE1 3.69Å; F483-F559 AromaticContact CE1-CE2 3.43Å; F483-F559 HydrophobicContact CE1-CE2 3.43Å; F483-F559 VanDerWaalsContact CE1-CE2 3.43Å; F483-F559 AromaticContact CE1-CG 3.65Å; F483-F559 HydrophobicContact CE1-CG 3.65Å; F483-F559 AromaticContact CE1-CZ 3.52Å; F483-F559 HydrophobicContact CE1-CZ 3.52Å; F483-F559 HydrophobicContact CG-CE1 4.44Å; F483-F559 HydrophobicContact CZ-CE2 4.39Å; F483-I562 HydrophobicContact CB-CD1 3.99Å; F483-I562 HydrophobicContact CD1-CD1 4.11Å; F483-I562 HydrophobicContact CG-CD1 4.1Å
484	A	91.6	Very high	91.4	Very high	22 Å²	22	61.7 Å²	61.7	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-33	178.9	0	0	0	0	0	112.2	L480 A481 M486 F487 F488	L480-A484 VanDerWaalsContact O-CB 3.24Å; L480-A484 WeakPolarHBondContact O-CB 3.19Å; L480-A484 PolarHBondContact O-N 3.45Å; A481-A484 PolarHBondContact O-N 2.78Å; A484-M486 VanDerWaalsContact C-N 3.34Å; A484-M486 PolarHBondContact O-N 2.92Å; A484-F487 WeakPolarHBondContact O-CB 3.35Å; A484-F487 PolarHBondContact O-N 2.91Å; A484-F488 HydrophobicContact CB-CD2 4.43Å; A484-F488 HydrophobicContact CB-CE2 4.36Å; A484-F488 WeakPolarHBondContact O-CD2 3.43Å; A484-F488 PolarHBondContact O-N 3.31Å
485	I	93.1	Very high	92	Very high	114 Å²	114	59.1 Å²	59.1	59%	0.585	33%	0.333	S	S	*	.	H	α-helix	trans	-60.4	-46.1	174.2	-64.9	165.7	0	0	0	110.4	A481 F483 F488 I489	A481-I485 WeakPolarHBondContact O-CG1 3.47Å; A481-I485 PolarHBondContact O-N 3.21Å; F483-I485 PolarHBondContact O-N 3.23Å; I485-F488 PolarHBondContact O-N 3.12Å; I485-I489 HydrophobicContact CG2-CD1 4.22Å; I485-I489 WeakPolarHBondContact O-CG1 3.41Å; I485-I489 PolarHBondContact O-N 3.26Å; I485-I489 VanDerWaalsContact O-N 3.14Å
486	M	90.5	Very high	92.4	Very high	110 Å²	110	60 Å²	60	54%	0.542	33%	0.33	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.4	-173.8	-174.2	-61	0	0	111.5	F483 A484 I489 V490	F483-M486 HydrophobicContact CD2-CB 4.37Å; F483-M486 HydrophobicContact CD2-SD 4.25Å; F483-M486 HydrophobicContact CE2-SD 4.06Å; F483-M486 WeakPolarHBondContact O-CB 3.47Å; F483-M486 PolarHBondContact O-N 3.47Å; A484-M486 VanDerWaalsContact C-N 3.34Å; A484-M486 PolarHBondContact O-N 2.92Å; M486-I489 PolarHBondContact O-N 2.84Å; M486-V490 PolarHBondContact O-N 3.29Å
487	F	91.2	Very high	92.6	Very high	18 Å²	18	63.3 Å²	63.3	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-56.2	-51.2	174.4	167.9	-95	0	0	0	111.7	F483 A484 I489 V490 F491 F520 I523 L555 F559	F483-F487 PolarHBondContact O-N 3.19Å; A484-F487 WeakPolarHBondContact O-CB 3.35Å; A484-F487 PolarHBondContact O-N 2.91Å; F487-I489 VanDerWaalsContact C-N 3.33Å; F487-I489 PolarHBondContact O-N 3.33Å; F487-V490 PolarHBondContact O-N 2.83Å; F487-F491 HydrophobicContact CD1-CB 4.48Å; F487-F491 HydrophobicContact CE1-CB 4.11Å; F487-F491 HydrophobicContact CE1-CD2 4.24Å; F487-F491 HydrophobicContact CE1-CG 4.15Å; F487-F491 HydrophobicContact CE2-CD2 4.46Å; F487-F491 HydrophobicContact CZ-CB 4.15Å; F487-F491 AromaticContact CZ-CD2 3.75Å; F487-F491 HydrophobicContact CZ-CD2 3.75Å; F487-F491 HydrophobicContact CZ-CE2 4.41Å; F487-F491 HydrophobicContact CZ-CG 4.09Å; F487-F491 VanDerWaalsContact O-CB 3.25Å; F487-F491 WeakPolarHBondContact O-CB 3.06Å; F487-F491 PolarHBondContact O-N 2.98Å; F487-F520 HydrophobicContact CZ-CE1 4.49Å; F487-I523 HydrophobicContact CE2-CD1 4.36Å; F487-I523 HydrophobicContact CZ-CD1 4.07Å; F487-L555 HydrophobicContact CD2-CB 4.37Å; F487-L555 HydrophobicContact CD2-CD1 3.44Å; F487-L555 VanDerWaalsContact CD2-CD1 3.44Å; F487-L555 HydrophobicContact CD2-CD2 4.24Å; F487-L555 HydrophobicContact CD2-CG 4.23Å; F487-L555 HydrophobicContact CE2-CD1 3.77Å; F487-F559 HydrophobicContact CB-CE2 4.43Å; F487-F559 HydrophobicContact CB-CZ 4.17Å; F487-F559 HydrophobicContact CD2-CE2 4.04Å; F487-F559 HydrophobicContact CD2-CZ 4.48Å; F487-F559 HydrophobicContact CG-CE2 4.3Å; F487-F559 HydrophobicContact CG-CZ 4.28Å
488	F	92.8	Very high	92.9	Very high	83 Å²	83	60.9 Å²	60.9	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-66.4	-31.9	-176.3	-78.9	-60.5	0	0	0	113.3	A484 I485 F491 F492 F520	A484-F488 HydrophobicContact CB-CD2 4.43Å; A484-F488 HydrophobicContact CB-CE2 4.36Å; A484-F488 WeakPolarHBondContact O-CD2 3.43Å; A484-F488 PolarHBondContact O-N 3.31Å; I485-F488 PolarHBondContact O-N 3.12Å; F488-F491 HydrophobicContact CD1-CD1 4.33Å; F488-F492 HydrophobicContact CB-CD2 4.13Å; F488-F492 HydrophobicContact CB-CE2 3.98Å; F488-F492 AromaticContact CD1-CE2 3.88Å; F488-F492 HydrophobicContact CD1-CE2 3.88Å; F488-F492 HydrophobicContact CD1-CZ 4.02Å; F488-F492 HydrophobicContact CG-CE2 4.21Å; F488-F492 WeakPolarHBondContact O-CB 3.47Å; F488-F492 WeakPolarHBondContact O-CD2 3.15Å; F488-F492 WeakPolarHBondContact O-CG 3.44Å; F488-F492 PolarHBondContact O-N 2.63Å; F488-F520 HydrophobicContact CE1-CZ 4.34Å
489	I	92.8	Very high	93.1	Very high	108 Å²	108	57 Å²	57	55%	0.554	31%	0.308	S	S	*	.	H	α-helix	trans	-59.7	-48.1	173.9	-70	165.7	0	0	0	110.4	I485 M486 F487 S493	I485-I489 HydrophobicContact CG2-CD1 4.22Å; I485-I489 WeakPolarHBondContact O-CG1 3.41Å; I485-I489 PolarHBondContact O-N 3.26Å; I485-I489 VanDerWaalsContact O-N 3.14Å; M486-I489 PolarHBondContact O-N 2.84Å; F487-I489 VanDerWaalsContact C-N 3.33Å; F487-I489 PolarHBondContact O-N 3.33Å; I489-S493 WeakPolarHBondContact O-CB 3.13Å; I489-S493 PolarHBondContact O-N 3.36Å; I489-S493 PolarHBondContact O-OG 2.67Å
490	V	91.9	Very high	93.3	Very high	35 Å²	35	58.8 Å²	58.8	21%	0.212	32%	0.317	C	S	.	.	H	α-helix	trans	-72.9	-42.5	-179.7	-177	0	0	0	0	111.1	M486 F487 F492 S493 F494 F550	M486-V490 PolarHBondContact O-N 3.29Å; F487-V490 PolarHBondContact O-N 2.83Å; V490-F492 PolarHBondContact O-N 2.93Å; V490-S493 WeakPolarHBondContact O-CB 3.35Å; V490-S493 PolarHBondContact O-N 3.18Å; V490-F494 HydrophobicContact CG1-CD2 3.64Å; V490-F494 HydrophobicContact CG1-CE2 3.52Å; V490-F494 WeakPolarHBondContact O-CD2 3.34Å; V490-F494 PolarHBondContact O-N 3.29Å; V490-F550 HydrophobicContact CB-CD1 4.46Å; V490-F550 HydrophobicContact CB-CE1 3.62Å; V490-F550 HydrophobicContact CB-CZ 4.02Å; V490-F550 HydrophobicContact CG1-CD1 3.59Å; V490-F550 HydrophobicContact CG1-CE1 3.16Å; V490-F550 HydrophobicContact CG1-CE2 4.42Å; V490-F550 HydrophobicContact CG1-CG 4.41Å; V490-F550 HydrophobicContact CG1-CZ 3.65Å; V490-F550 HydrophobicContact CG2-CE1 3.91Å; V490-F550 HydrophobicContact CG2-CZ 3.77Å
491	F	93.8	Very high	93.4	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.018	32%	0.315	C	S	.	.	H	α-helix	trans	-57.7	-49.6	178.1	179.9	-94.2	0	0	0	112.4	F487 F488 S493 F494 A495 V516 L519 F520 I523	F487-F491 HydrophobicContact CD1-CB 4.48Å; F487-F491 HydrophobicContact CE1-CB 4.11Å; F487-F491 HydrophobicContact CE1-CD2 4.24Å; F487-F491 HydrophobicContact CE1-CG 4.15Å; F487-F491 HydrophobicContact CE2-CD2 4.46Å; F487-F491 HydrophobicContact CZ-CB 4.15Å; F487-F491 AromaticContact CZ-CD2 3.75Å; F487-F491 HydrophobicContact CZ-CD2 3.75Å; F487-F491 HydrophobicContact CZ-CE2 4.41Å; F487-F491 HydrophobicContact CZ-CG 4.09Å; F487-F491 VanDerWaalsContact O-CB 3.25Å; F487-F491 WeakPolarHBondContact O-CB 3.06Å; F487-F491 PolarHBondContact O-N 2.98Å; F488-F491 HydrophobicContact CD1-CD1 4.33Å; F491-S493 VanDerWaalsContact C-N 3.3Å; F491-S493 PolarHBondContact O-N 3.34Å; F491-F494 PolarHBondContact O-N 3.31Å; F491-A495 PolarHBondContact O-N 2.98Å; F491-V516 HydrophobicContact CE1-CB 4.35Å; F491-V516 HydrophobicContact CE1-CG1 3.86Å; F491-V516 HydrophobicContact CE1-CG2 4.16Å; F491-V516 HydrophobicContact CZ-CG1 4.09Å; F491-L519 HydrophobicContact CD2-CB 4.36Å; F491-L519 HydrophobicContact CD2-CD1 4.28Å; F491-L519 HydrophobicContact CE2-CB 3.43Å; F491-L519 VanDerWaalsContact CE2-CB 3.43Å; F491-L519 HydrophobicContact CE2-CD1 4.01Å; F491-L519 HydrophobicContact CE2-CG 4.4Å; F491-L519 HydrophobicContact CZ-CB 3.62Å; F491-L519 HydrophobicContact CZ-CD1 4.16Å; F491-F520 HydrophobicContact CE1-CD2 4.5Å; F491-F520 AromaticContact CE1-CE2 3.98Å; F491-F520 HydrophobicContact CE1-CE2 3.98Å; F491-F520 HydrophobicContact CE1-CZ 4.29Å; F491-F520 HydrophobicContact CE2-CD1 4.47Å; F491-F520 HydrophobicContact CE2-CD2 4.43Å; F491-F520 HydrophobicContact CE2-CE1 4.42Å; F491-F520 HydrophobicContact CE2-CE2 4.39Å; F491-F520 HydrophobicContact CE2-CG 4.46Å; F491-F520 HydrophobicContact CE2-CZ 4.38Å; F491-F520 AromaticContact CZ-CD2 3.73Å; F491-F520 HydrophobicContact CZ-CD2 3.73Å; F491-F520 HydrophobicContact CZ-CE1 4.39Å; F491-F520 AromaticContact CZ-CE2 3.6Å; F491-F520 HydrophobicContact CZ-CE2 3.6Å; F491-F520 HydrophobicContact CZ-CG 4.19Å; F491-F520 AromaticContact CZ-CZ 3.95Å; F491-F520 HydrophobicContact CZ-CZ 3.95Å; F491-I523 HydrophobicContact CE2-CD1 4.43Å
492	F	95.2	Very high	93.6	Very high	90 Å²	90	55 Å²	55	40%	0.395	29%	0.294	S	S	.	.	H	α-helix	trans	-69.4	-28.5	177.7	-69.3	-47.6	0	0	0	113	F488 V490 A495 Q496 F512 V516	F488-F492 HydrophobicContact CB-CD2 4.13Å; F488-F492 HydrophobicContact CB-CE2 3.98Å; F488-F492 AromaticContact CD1-CE2 3.88Å; F488-F492 HydrophobicContact CD1-CE2 3.88Å; F488-F492 HydrophobicContact CD1-CZ 4.02Å; F488-F492 HydrophobicContact CG-CE2 4.21Å; F488-F492 WeakPolarHBondContact O-CB 3.47Å; F488-F492 WeakPolarHBondContact O-CD2 3.15Å; F488-F492 WeakPolarHBondContact O-CG 3.44Å; F488-F492 PolarHBondContact O-N 2.63Å; V490-F492 PolarHBondContact O-N 2.93Å; F492-A495 PolarHBondContact O-N 3.01Å; F492-Q496 WeakPolarHBondContact O-CB 3.3Å; F492-Q496 PolarHBondContact O-N 3.2Å; F492-F512 AromaticContact CD1-CZ 3.99Å; F492-F512 HydrophobicContact CD1-CZ 3.99Å; F492-V516 HydrophobicContact CD1-CG2 4.33Å; F492-V516 HydrophobicContact CE1-CG2 4.09Å
493	S	95.1	Very high	93.6	Very high	74 Å²	74	53.6 Å²	53.6	52%	0.517	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-44.8	171.6	-59.9	0	0	0	0	111.2	I489 V490 F491 L497	I489-S493 WeakPolarHBondContact O-CB 3.13Å; I489-S493 PolarHBondContact O-N 3.36Å; I489-S493 PolarHBondContact O-OG 2.67Å; V490-S493 WeakPolarHBondContact O-CB 3.35Å; V490-S493 PolarHBondContact O-N 3.18Å; F491-S493 VanDerWaalsContact C-N 3.3Å; F491-S493 PolarHBondContact O-N 3.34Å; S493-L497 WeakPolarHBondContact O-CB 3.05Å; S493-L497 PolarHBondContact O-N 2.93Å
494	F	95	Very high	93.7	Very high	31 Å²	31	59.5 Å²	59.5	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-68.5	-33.2	174	-81.9	-74.8	0	0	0	113	V490 F491 L497 G498 L519 Y543 V546 Y547 F550	V490-F494 HydrophobicContact CG1-CD2 3.64Å; V490-F494 HydrophobicContact CG1-CE2 3.52Å; V490-F494 WeakPolarHBondContact O-CD2 3.34Å; V490-F494 PolarHBondContact O-N 3.29Å; F491-F494 PolarHBondContact O-N 3.31Å; F494-L497 PolarHBondContact O-N 3.3Å; F494-G498 PolarHBondContact O-N 3.02Å; F494-L519 HydrophobicContact CB-CD1 4.27Å; F494-Y543 HydrophobicContact CD1-CD2 4.29Å; F494-Y543 AromaticContact CD1-CE2 3.79Å; F494-Y543 HydrophobicContact CD1-CE2 3.79Å; F494-Y543 PolarHBondContact O-OH 3.33Å; F494-V546 HydrophobicContact CE1-CG1 4.17Å; F494-V546 HydrophobicContact CZ-CG1 3.98Å; F494-Y547 HydrophobicContact CB-CD2 3.98Å; F494-Y547 HydrophobicContact CB-CE2 4.29Å; F494-Y547 HydrophobicContact CD1-CD2 4.12Å; F494-Y547 HydrophobicContact CD2-CD2 4.01Å; F494-Y547 AromaticContact CG-CD2 3.78Å; F494-Y547 HydrophobicContact CG-CD2 3.78Å; F494-Y547 HydrophobicContact CG-CE2 4.47Å; F494-F550 HydrophobicContact CE2-CD1 4.44Å
495	A	95.8	Very high	93.6	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-46	175.8	0	0	0	0	0	111.2	F491 F492 G498 Y499 F512 V515 V516 L519	F491-A495 PolarHBondContact O-N 2.98Å; F492-A495 PolarHBondContact O-N 3.01Å; A495-G498 PolarHBondContact O-N 3.13Å; A495-Y499 WeakPolarHBondContact O-CB 3.42Å; A495-Y499 PolarHBondContact O-N 3.35Å; A495-F512 HydrophobicContact CB-CE2 3.99Å; A495-V515 HydrophobicContact CB-CG1 4.08Å; A495-V515 WeakPolarHBondContact O-CG1 3.49Å; A495-V516 HydrophobicContact CB-CG2 4.22Å; A495-L519 HydrophobicContact CB-CD1 3.71Å
496	Q	96.1	Very high	93.6	Very high	82 Å²	82	59.3 Å²	59.3	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-64.3	-42.2	176.9	-172	62.8	37.1	0	0	111.5	F492 Y499 L500	F492-Q496 WeakPolarHBondContact O-CB 3.3Å; F492-Q496 PolarHBondContact O-N 3.2Å; Q496-Y499 PolarHBondContact O-N 3.06Å; Q496-L500 HydrophobicContact CG-CD1 4.12Å; Q496-L500 WeakPolarHBondContact O-CB 3.47Å; Q496-L500 WeakPolarHBondContact O-CG 3.39Å; Q496-L500 PolarHBondContact O-N 3.23Å
497	L	95	Very high	93.6	Very high	74 Å²	74	62.7 Å²	62.7	39%	0.387	32%	0.323	S	S	.	.	H	α-helix	trans	-60	-47	175.1	-178.7	63.7	0	0	0	111.4	S493 F494 L500 A501 F539 Y543	S493-L497 WeakPolarHBondContact O-CB 3.05Å; S493-L497 PolarHBondContact O-N 2.93Å; F494-L497 PolarHBondContact O-N 3.3Å; L497-L500 PolarHBondContact O-N 3Å; L497-A501 WeakPolarHBondContact O-CB 3.35Å; L497-A501 PolarHBondContact O-N 2.92Å; L497-F539 HydrophobicContact CD1-CZ 4.26Å; L497-Y543 HydrophobicContact CB-CE2 4.39Å; L497-Y543 HydrophobicContact CD2-CD2 3.84Å; L497-Y543 HydrophobicContact CD2-CE2 4Å; L497-Y543 HydrophobicContact CG-CD2 4.26Å; L497-Y543 HydrophobicContact CG-CE2 4.18Å
498	G	94	Very high	93.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-42.8	179.4	0	0	0	0	0	112.7	F494 A495 F502	F494-G498 PolarHBondContact O-N 3.02Å; A495-G498 PolarHBondContact O-N 3.13Å; G498-F502 WeakPolarHBondContact O-CB 3.48Å; G498-F502 PolarHBondContact O-N 2.97Å
499	Y	95.7	Very high	93.7	Very high	92 Å²	92	60.2 Å²	60.2	36%	0.361	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-50.3	175.9	177.7	-114.8	0	0	0	111.9	A495 Q496 G503 F509 S510 V515	A495-Y499 WeakPolarHBondContact O-CB 3.42Å; A495-Y499 PolarHBondContact O-N 3.35Å; Q496-Y499 PolarHBondContact O-N 3.06Å; Y499-G503 VanDerWaalsContact O-CA 3.29Å; Y499-G503 WeakPolarHBondContact O-CA 3.45Å; Y499-G503 PolarHBondContact O-N 3.41Å; Y499-F509 WeakPolarHBondContact CD2-O 3.31Å; Y499-S510 WeakPolarHBondContact CE2-O 3.45Å; Y499-V515 HydrophobicContact CD2-CG2 4.36Å
500	L	95.3	Very high	93.6	Very high	126 Å²	126	57.9 Å²	57.9	66%	0.66	31%	0.307	S	S	*	.	H	α-helix	trans	-69.8	-34.4	-177.7	-67.7	176.4	0	0	0	112.8	Q496 L497	Q496-L500 HydrophobicContact CG-CD1 4.12Å; Q496-L500 WeakPolarHBondContact O-CB 3.47Å; Q496-L500 WeakPolarHBondContact O-CG 3.39Å; Q496-L500 PolarHBondContact O-N 3.23Å; L497-L500 PolarHBondContact O-N 3Å
501	A	93.8	Very high	93.7	Very high	34 Å²	34	58 Å²	58	28%	0.281	31%	0.31	S	S	.	.	H	α-helix	trans	-81.8	-39.4	-177.6	0	0	0	0	0	113.4	L497 F539	L497-A501 WeakPolarHBondContact O-CB 3.35Å; L497-A501 PolarHBondContact O-N 2.92Å; A501-F539 HydrophobicContact CB-CD1 4.27Å; A501-F539 HydrophobicContact CB-CE1 3.57Å; A501-F539 HydrophobicContact CB-CZ 4.45Å
502	F	94.3	Very high	93.7	Very high	1 Å²	1	61.7 Å²	61.7	0%	0.004	33%	0.326	C	S	.	.	H	α-helix	trans	-120	-5.2	-169.1	-52.6	-64.2	0	0	0	114.2	G498 T504 Q505 A506 F509 L532 A535 N536 F539 Y543	G498-F502 WeakPolarHBondContact O-CB 3.48Å; G498-F502 PolarHBondContact O-N 2.97Å; F502-T504 VanDerWaalsContact C-N 3.27Å; F502-T504 PolarHBondContact O-N 3.41Å; F502-T504 VanDerWaalsContact O-N 3.17Å; F502-Q505 PolarHBondContact O-N 3.46Å; F502-Q505 VanDerWaalsContact O-N 3.08Å; F502-A506 HydrophobicContact CB-CB 4.29Å; F502-A506 PolarHBondContact O-N 3.35Å; F502-F509 HydrophobicContact CB-CB 3.82Å; F502-F509 HydrophobicContact CB-CD1 4.31Å; F502-F509 HydrophobicContact CB-CD2 4.17Å; F502-F509 HydrophobicContact CB-CG 3.84Å; F502-F509 HydrophobicContact CD2-CD1 4.32Å; F502-F509 HydrophobicContact CD2-CE1 4.42Å; F502-L532 HydrophobicContact CD1-CD2 4.33Å; F502-L532 HydrophobicContact CD2-CD2 3.74Å; F502-L532 HydrophobicContact CE1-CD2 4.35Å; F502-L532 HydrophobicContact CE2-CD2 3.79Å; F502-L532 HydrophobicContact CG-CD2 4.04Å; F502-L532 HydrophobicContact CZ-CD2 4.09Å; F502-A535 HydrophobicContact CD1-CB 3.75Å; F502-A535 HydrophobicContact CE1-CB 4.34Å; F502-N536 HydrophobicContact CE1-CB 4.43Å; F502-F539 AromaticContact CE1-CD1 3.85Å; F502-F539 HydrophobicContact CE1-CD1 3.85Å; F502-F539 HydrophobicContact CE1-CE1 4.4Å; F502-F539 HydrophobicContact CE2-CD1 4.27Å; F502-F539 HydrophobicContact CE2-CE1 4.09Å; F502-F539 AromaticContact CZ-CD1 3.39Å; F502-F539 HydrophobicContact CZ-CD1 3.39Å; F502-F539 AromaticContact CZ-CE1 3.67Å; F502-F539 HydrophobicContact CZ-CE1 3.67Å; F502-Y543 AromaticContact CE2-CD1 3.77Å; F502-Y543 HydrophobicContact CE2-CD1 3.77Å; F502-Y543 HydrophobicContact CE2-CD2 4.37Å; F502-Y543 HydrophobicContact CE2-CE1 4.21Å; F502-Y543 AromaticContact CE2-CG 3.86Å; F502-Y543 HydrophobicContact CE2-CG 3.86Å; F502-Y543 HydrophobicContact CZ-CG 4.42Å
503	G	92.3	Very high	93.6	Very high	16 Å²	16	61.6 Å²	61.6	17%	0.165	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.8	-170.5	0	0	0	0	0	116.1	Y499 F509 S510	Y499-G503 VanDerWaalsContact O-CA 3.29Å; Y499-G503 WeakPolarHBondContact O-CA 3.45Å; Y499-G503 PolarHBondContact O-N 3.41Å; G503-F509 WeakPolarHBondContact CA-O 3.48Å; G503-S510 WeakPolarHBondContact O-CA 3.2Å
504	T	91.8	Very high	93.5	Very high	135 Å²	135	60.2 Å²	60.2	83%	0.828	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-19.3	175.2	56.1	0	0	0	0	113.6	F502	F502-T504 VanDerWaalsContact C-N 3.27Å; F502-T504 PolarHBondContact O-N 3.41Å; F502-T504 VanDerWaalsContact O-N 3.17Å
505	Q	91.2	Very high	93.5	Very high	125 Å²	125	58.7 Å²	58.7	58%	0.584	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-30.8	-171	-65.7	176.8	-3.3	0	0	112.9	F502 A535	F502-Q505 PolarHBondContact O-N 3.46Å; F502-Q505 VanDerWaalsContact O-N 3.08Å; Q505-A535 HydrophobicContact CB-CB 4Å; Q505-A535 VanDerWaalsContact OE1-C 3.29Å; Q505-A535 VanDerWaalsContact OE1-CB 3.29Å; Q505-A535 PolarHBondContact OE1-O 2.94Å
506	A	91.9	Very high	93.5	Very high	8 Å²	8	59.4 Å²	59.4	7%	0.066	32%	0.315	C	S	.	.			trans	-115.9	125.2	-177.6	0	0	0	0	0	111.2	F502 D508 F509 S510	F502-A506 HydrophobicContact CB-CB 4.29Å; F502-A506 PolarHBondContact O-N 3.35Å; A506-D508 VanDerWaalsContact C-N 3.29Å; A506-D508 PolarHBondContact O-N 3.24Å; A506-F509 HydrophobicContact CB-CB 4.35Å; A506-F509 HydrophobicContact CB-CD2 3.81Å; A506-F509 CarbonylContact O-C 2.97Å; A506-F509 PolarHBondContact O-N 3.36Å; A506-S510 PolarHBondContact O-N 3.44Å
507	K	90.6	Very high	93.4	Very high	180 Å²	180	62.6 Å²	62.6	78%	0.783	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-58.4	-40.1	-179	-175	-179.2	177.7	-178	0	112.5	F509 S510	K507-F509 PolarHBondContact O-N 3.26Å; K507-F509 VanDerWaalsContact O-N 3.15Å; K507-S510 VanDerWaalsContact O-CB 3.24Å; K507-S510 WeakPolarHBondContact O-CB 3.45Å; K507-S510 PolarHBondContact O-N 3.21Å; K507-S510 VanDerWaalsContact O-N 3.1Å; K507-S510 PolarHBondContact O-OG 3.44Å
508	D	92.6	Very high	93.3	Very high	44 Å²	44	59.6 Å²	59.6	24%	0.235	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-67.2	-12.8	179	-70.3	-18.9	0	0	0	113.5	A506 T518	A506-D508 VanDerWaalsContact C-N 3.29Å; A506-D508 PolarHBondContact O-N 3.24Å; D508-T518 HydrophobicContact CB-CG2 3.93Å; D508-T518 PolarHBondContact O-OG1 3.05Å
509	F	93.6	Very high	93.3	Very high	5 Å²	5	59.6 Å²	59.6	2%	0.022	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-111.1	4.8	176.6	-65.4	-93.9	0	0	0	113.4	Y499 F502 G503 A506 K507 S511 V515 T518 L532 Y543	Y499-F509 WeakPolarHBondContact CD2-O 3.31Å; F502-F509 HydrophobicContact CB-CB 3.82Å; F502-F509 HydrophobicContact CB-CD1 4.31Å; F502-F509 HydrophobicContact CB-CD2 4.17Å; F502-F509 HydrophobicContact CB-CG 3.84Å; F502-F509 HydrophobicContact CD2-CD1 4.32Å; F502-F509 HydrophobicContact CD2-CE1 4.42Å; G503-F509 WeakPolarHBondContact CA-O 3.48Å; A506-F509 HydrophobicContact CB-CB 4.35Å; A506-F509 HydrophobicContact CB-CD2 3.81Å; A506-F509 CarbonylContact O-C 2.97Å; A506-F509 PolarHBondContact O-N 3.36Å; K507-F509 PolarHBondContact O-N 3.26Å; K507-F509 VanDerWaalsContact O-N 3.15Å; F509-S511 VanDerWaalsContact C-N 3.33Å; F509-S511 PolarHBondContact O-N 2.93Å; F509-V515 VanDerWaalsContact CA-CG2 3.48Å; F509-V515 HydrophobicContact CB-CG2 4.02Å; F509-V515 HydrophobicContact CD1-CB 4.47Å; F509-V515 HydrophobicContact CD1-CG1 3.92Å; F509-V515 HydrophobicContact CD1-CG2 3.9Å; F509-V515 HydrophobicContact CE1-CG1 4.16Å; F509-V515 HydrophobicContact CG-CG2 4.33Å; F509-V515 WeakPolarHBondContact O-CG2 3.37Å; F509-T518 HydrophobicContact CE2-CG2 4.15Å; F509-T518 HydrophobicContact CZ-CG2 4.03Å; F509-L532 HydrophobicContact CD2-CD2 4.38Å; F509-L532 HydrophobicContact CE2-CD1 4.47Å; F509-L532 HydrophobicContact CE2-CD2 3.62Å; F509-L532 HydrophobicContact CE2-CG 4.07Å; F509-L532 HydrophobicContact CZ-CD1 4.4Å; F509-L532 HydrophobicContact CZ-CD2 3.75Å; F509-L532 HydrophobicContact CZ-CG 4.37Å; F509-Y543 HydrophobicContact CE1-CE1 4.21Å; F509-Y543 HydrophobicContact CZ-CE1 4.41Å
510	S	91.8	Very high	93.2	Very high	60 Å²	60	59.2 Å²	59.2	42%	0.42	31%	0.309	S	S	.	.	S	Bend	trans	-64.2	-28	-170.9	58	0	0	0	0	115.7	Y499 G503 A506 K507	Y499-S510 WeakPolarHBondContact CE2-O 3.45Å; G503-S510 WeakPolarHBondContact O-CA 3.2Å; A506-S510 PolarHBondContact O-N 3.44Å; K507-S510 VanDerWaalsContact O-CB 3.24Å; K507-S510 WeakPolarHBondContact O-CB 3.45Å; K507-S510 PolarHBondContact O-N 3.21Å; K507-S510 VanDerWaalsContact O-N 3.1Å; K507-S510 PolarHBondContact O-OG 3.44Å
511	S	92.1	Very high	93.1	Very high	37 Å²	37	58.2 Å²	58.2	26%	0.259	30%	0.297	S	S	.	.	S	Bend	trans	-134.4	149.7	176.9	90.3	0	0	0	0	110.1	F509 I513 T514 V515	F509-S511 VanDerWaalsContact C-N 3.33Å; F509-S511 PolarHBondContact O-N 2.93Å; S511-I513 VanDerWaalsContact C-N 3.26Å; S511-I513 PolarHBondContact O-N 3.07Å; S511-I513 WeakPolarHBondContact OG-CG2 3.29Å; S511-T514 PolarHBondContact O-N 2.71Å; S511-T514 VanDerWaalsContact O-N 3.11Å; S511-T514 WeakPolarHBondContact OG-CB 3.4Å; S511-T514 PolarHBondContact OG-N 3.48Å; S511-T514 PolarHBondContact OG-OG1 3.39Å; S511-V515 WeakPolarHBondContact O-CG2 3.44Å; S511-V515 PolarHBondContact O-N 3.34Å
512	F	94.3	Very high	93	Very high	81 Å²	81	56.8 Å²	56.8	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-55.8	-40.7	180	179.6	-101.4	0	0	0	112.7	F492 A495 V515 V516	F492-F512 AromaticContact CD1-CZ 3.99Å; F492-F512 HydrophobicContact CD1-CZ 3.99Å; A495-F512 HydrophobicContact CB-CE2 3.99Å; F512-V515 WeakPolarHBondContact O-CB 3.45Å; F512-V515 PolarHBondContact O-N 3.1Å; F512-V516 HydrophobicContact CE1-CG2 4.22Å; F512-V516 HydrophobicContact CZ-CG2 4.36Å; F512-V516 WeakPolarHBondContact O-CG2 3.33Å; F512-V516 PolarHBondContact O-N 3.2Å
513	I	93.6	Very high	92.7	Very high	89 Å²	89	58.4 Å²	58.4	46%	0.456	29%	0.293	S	S	.	.	H	α-helix	trans	-70.6	-38	178.4	-168.2	63.2	0	0	0	111.9	S511 V515 V516 Y517	S511-I513 VanDerWaalsContact C-N 3.26Å; S511-I513 PolarHBondContact O-N 3.07Å; S511-I513 WeakPolarHBondContact OG-CG2 3.29Å; I513-V515 VanDerWaalsContact C-N 3.3Å; I513-V515 PolarHBondContact O-N 2.69Å; I513-V516 WeakPolarHBondContact O-CB 3.3Å; I513-V516 PolarHBondContact O-N 3.33Å; I513-Y517 HydrophobicContact CD1-CE2 4.39Å; I513-Y517 HydrophobicContact CG1-CD2 4.34Å; I513-Y517 HydrophobicContact CG1-CE2 3.71Å; I513-Y517 VanDerWaalsContact O-CD2 3.3Å; I513-Y517 WeakPolarHBondContact O-CD2 3.42Å; I513-Y517 PolarHBondContact O-N 3.18Å
514	T	93.4	Very high	92.6	Very high	44 Å²	44	64.9 Å²	64.9	27%	0.27	32%	0.323	S	S	.	.	H	α-helix	trans	-61.6	-42	173.2	-50.5	0	0	0	0	110.2	S511 V516 Y517 T518	S511-T514 PolarHBondContact O-N 2.71Å; S511-T514 VanDerWaalsContact O-N 3.11Å; S511-T514 WeakPolarHBondContact OG-CB 3.4Å; S511-T514 PolarHBondContact OG-N 3.48Å; S511-T514 PolarHBondContact OG-OG1 3.39Å; T514-V516 VanDerWaalsContact C-N 3.32Å; T514-V516 PolarHBondContact O-N 3.04Å; T514-Y517 PolarHBondContact O-N 2.71Å; T514-Y517 VanDerWaalsContact O-N 3.15Å; T514-T518 WeakPolarHBondContact O-CB 3.34Å; T514-T518 PolarHBondContact O-N 2.84Å; T514-T518 PolarHBondContact O-OG1 3.48Å
515	V	94.9	Very high	92.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-43.4	176	179.7	0	0	0	0	110.7	A495 Y499 F509 S511 F512 I513 Y517 T518 L519	A495-V515 HydrophobicContact CB-CG1 4.08Å; A495-V515 WeakPolarHBondContact O-CG1 3.49Å; Y499-V515 HydrophobicContact CD2-CG2 4.36Å; F509-V515 VanDerWaalsContact CA-CG2 3.48Å; F509-V515 HydrophobicContact CB-CG2 4.02Å; F509-V515 HydrophobicContact CD1-CB 4.47Å; F509-V515 HydrophobicContact CD1-CG1 3.92Å; F509-V515 HydrophobicContact CD1-CG2 3.9Å; F509-V515 HydrophobicContact CE1-CG1 4.16Å; F509-V515 HydrophobicContact CG-CG2 4.33Å; F509-V515 WeakPolarHBondContact O-CG2 3.37Å; S511-V515 WeakPolarHBondContact O-CG2 3.44Å; S511-V515 PolarHBondContact O-N 3.34Å; F512-V515 WeakPolarHBondContact O-CB 3.45Å; F512-V515 PolarHBondContact O-N 3.1Å; I513-V515 VanDerWaalsContact C-N 3.3Å; I513-V515 PolarHBondContact O-N 2.69Å; V515-Y517 VanDerWaalsContact C-N 3.33Å; V515-Y517 PolarHBondContact O-N 3.07Å; V515-T518 PolarHBondContact O-N 3.25Å; V515-L519 HydrophobicContact CG1-CD1 4.44Å; V515-L519 HydrophobicContact CG1-CG 4.19Å; V515-L519 WeakPolarHBondContact O-CB 3.31Å; V515-L519 WeakPolarHBondContact O-CG 3.49Å; V515-L519 PolarHBondContact O-N 2.95Å
516	V	94.9	Very high	92.3	Very high	15 Å²	15	58.3 Å²	58.3	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-45.7	175.5	166.2	0	0	0	0	111.1	F491 F492 A495 F512 I513 T514 L519 F520	F491-V516 HydrophobicContact CE1-CB 4.35Å; F491-V516 HydrophobicContact CE1-CG1 3.86Å; F491-V516 HydrophobicContact CE1-CG2 4.16Å; F491-V516 HydrophobicContact CZ-CG1 4.09Å; F492-V516 HydrophobicContact CD1-CG2 4.33Å; F492-V516 HydrophobicContact CE1-CG2 4.09Å; A495-V516 HydrophobicContact CB-CG2 4.22Å; F512-V516 HydrophobicContact CE1-CG2 4.22Å; F512-V516 HydrophobicContact CZ-CG2 4.36Å; F512-V516 WeakPolarHBondContact O-CG2 3.33Å; F512-V516 PolarHBondContact O-N 3.2Å; I513-V516 WeakPolarHBondContact O-CB 3.3Å; I513-V516 PolarHBondContact O-N 3.33Å; T514-V516 VanDerWaalsContact C-N 3.32Å; T514-V516 PolarHBondContact O-N 3.04Å; V516-L519 PolarHBondContact O-N 3.11Å; V516-F520 HydrophobicContact CG1-CD2 3.98Å; V516-F520 HydrophobicContact CG1-CE2 3.84Å; V516-F520 VanDerWaalsContact O-CD2 3.25Å; V516-F520 WeakPolarHBondContact O-CD2 3.24Å; V516-F520 PolarHBondContact O-N 3.44Å; V516-F520 VanDerWaalsContact O-N 3.09Å
517	Y	94.7	Very high	92.1	Very high	148 Å²	148	62.5 Å²	62.5	58%	0.58	31%	0.314	S	S	*	.	H	α-helix	trans	-63	-43.7	175.1	-65.3	-46.1	0	0	0	112.4	I513 T514 V515 L519 F520 R521	I513-Y517 HydrophobicContact CD1-CE2 4.39Å; I513-Y517 HydrophobicContact CG1-CD2 4.34Å; I513-Y517 HydrophobicContact CG1-CE2 3.71Å; I513-Y517 VanDerWaalsContact O-CD2 3.3Å; I513-Y517 WeakPolarHBondContact O-CD2 3.42Å; I513-Y517 PolarHBondContact O-N 3.18Å; T514-Y517 PolarHBondContact O-N 2.71Å; T514-Y517 VanDerWaalsContact O-N 3.15Å; V515-Y517 VanDerWaalsContact C-N 3.33Å; V515-Y517 PolarHBondContact O-N 3.07Å; Y517-L519 VanDerWaalsContact C-N 3.33Å; Y517-L519 PolarHBondContact O-N 3.11Å; Y517-F520 PolarHBondContact O-N 2.93Å; Y517-R521 WeakPolarHBondContact O-CG 3.35Å; Y517-R521 PolarHBondContact O-N 2.82Å
518	T	93.7	Very high	92	Very high	12 Å²	12	57.7 Å²	57.7	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-43.7	176.3	-58.3	0	0	0	0	111.1	D508 F509 T514 V515 F520 R521 I522	D508-T518 HydrophobicContact CB-CG2 3.93Å; D508-T518 PolarHBondContact O-OG1 3.05Å; F509-T518 HydrophobicContact CE2-CG2 4.15Å; F509-T518 HydrophobicContact CZ-CG2 4.03Å; T514-T518 WeakPolarHBondContact O-CB 3.34Å; T514-T518 PolarHBondContact O-N 2.84Å; T514-T518 PolarHBondContact O-OG1 3.48Å; V515-T518 PolarHBondContact O-N 3.25Å; T518-F520 PolarHBondContact O-N 3.41Å; T518-R521 WeakPolarHBondContact O-CB 3.41Å; T518-R521 PolarHBondContact O-N 3.22Å; T518-R521 VanDerWaalsContact O-N 3.14Å; T518-I522 HydrophobicContact CG2-CD1 4.33Å; T518-I522 VanDerWaalsContact O-CG1 3.31Å; T518-I522 WeakPolarHBondContact O-CG1 3.2Å; T518-I522 PolarHBondContact O-N 3.15Å
519	L	93.7	Very high	91.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-41.1	177.1	-73.7	-168.5	0	0	0	112.1	F491 F494 A495 V515 V516 Y517 I522 I523 Y547	F491-L519 HydrophobicContact CD2-CB 4.36Å; F491-L519 HydrophobicContact CD2-CD1 4.28Å; F491-L519 HydrophobicContact CE2-CB 3.43Å; F491-L519 VanDerWaalsContact CE2-CB 3.43Å; F491-L519 HydrophobicContact CE2-CD1 4.01Å; F491-L519 HydrophobicContact CE2-CG 4.4Å; F491-L519 HydrophobicContact CZ-CB 3.62Å; F491-L519 HydrophobicContact CZ-CD1 4.16Å; F494-L519 HydrophobicContact CB-CD1 4.27Å; A495-L519 HydrophobicContact CB-CD1 3.71Å; V515-L519 HydrophobicContact CG1-CD1 4.44Å; V515-L519 HydrophobicContact CG1-CG 4.19Å; V515-L519 WeakPolarHBondContact O-CB 3.31Å; V515-L519 WeakPolarHBondContact O-CG 3.49Å; V515-L519 PolarHBondContact O-N 2.95Å; V516-L519 PolarHBondContact O-N 3.11Å; Y517-L519 VanDerWaalsContact C-N 3.33Å; Y517-L519 PolarHBondContact O-N 3.11Å; L519-I522 HydrophobicContact CD2-CD1 4.01Å; L519-I522 PolarHBondContact O-N 3.46Å; L519-I523 WeakPolarHBondContact O-CG1 3.39Å; L519-I523 PolarHBondContact O-N 3.37Å; L519-Y547 HydrophobicContact CD1-CE2 4.32Å; L519-Y547 HydrophobicContact CD2-CD1 4.46Å; L519-Y547 HydrophobicContact CD2-CD2 4.43Å; L519-Y547 HydrophobicContact CD2-CE1 4.06Å; L519-Y547 HydrophobicContact CD2-CE2 4.02Å; L519-Y547 PolarHBondContact O-OH 3.5Å
520	F	93	Very high	91.8	Very high	83 Å²	83	63.6 Å²	63.6	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-39.1	172	-81.1	-63.6	0	0	0	112.7	F487 F488 F491 V516 Y517 T518 I522 I523 L524	F487-F520 HydrophobicContact CZ-CE1 4.49Å; F488-F520 HydrophobicContact CE1-CZ 4.34Å; F491-F520 HydrophobicContact CE1-CD2 4.5Å; F491-F520 AromaticContact CE1-CE2 3.98Å; F491-F520 HydrophobicContact CE1-CE2 3.98Å; F491-F520 HydrophobicContact CE1-CZ 4.29Å; F491-F520 HydrophobicContact CE2-CD1 4.47Å; F491-F520 HydrophobicContact CE2-CD2 4.43Å; F491-F520 HydrophobicContact CE2-CE1 4.42Å; F491-F520 HydrophobicContact CE2-CE2 4.39Å; F491-F520 HydrophobicContact CE2-CG 4.46Å; F491-F520 HydrophobicContact CE2-CZ 4.38Å; F491-F520 AromaticContact CZ-CD2 3.73Å; F491-F520 HydrophobicContact CZ-CD2 3.73Å; F491-F520 HydrophobicContact CZ-CE1 4.39Å; F491-F520 AromaticContact CZ-CE2 3.6Å; F491-F520 HydrophobicContact CZ-CE2 3.6Å; F491-F520 HydrophobicContact CZ-CG 4.19Å; F491-F520 AromaticContact CZ-CZ 3.95Å; F491-F520 HydrophobicContact CZ-CZ 3.95Å; V516-F520 HydrophobicContact CG1-CD2 3.98Å; V516-F520 HydrophobicContact CG1-CE2 3.84Å; V516-F520 VanDerWaalsContact O-CD2 3.25Å; V516-F520 WeakPolarHBondContact O-CD2 3.24Å; V516-F520 PolarHBondContact O-N 3.44Å; V516-F520 VanDerWaalsContact O-N 3.09Å; Y517-F520 PolarHBondContact O-N 2.93Å; T518-F520 PolarHBondContact O-N 3.41Å; F520-I522 VanDerWaalsContact C-N 3.29Å; F520-I522 PolarHBondContact O-N 3.05Å; F520-I523 HydrophobicContact CD1-CD1 4Å; F520-I523 HydrophobicContact CE1-CD1 4.42Å; F520-I523 WeakPolarHBondContact O-CB 3.49Å; F520-I523 PolarHBondContact O-N 3.37Å; F520-I523 VanDerWaalsContact O-N 3.1Å; F520-L524 PolarHBondContact O-N 3.43Å
521	R	92.7	Very high	91.7	Very high	106 Å²	106	61.9 Å²	61.9	40%	0.4	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-39.4	174.2	-73.1	176.5	71.2	-162	-0	111.6	Y517 T518 I523 L524 G525 D526	Y517-R521 WeakPolarHBondContact O-CG 3.35Å; Y517-R521 PolarHBondContact O-N 2.82Å; T518-R521 WeakPolarHBondContact O-CB 3.41Å; T518-R521 PolarHBondContact O-N 3.22Å; T518-R521 VanDerWaalsContact O-N 3.14Å; R521-I523 VanDerWaalsContact C-N 3.3Å; R521-I523 PolarHBondContact O-N 3.1Å; R521-L524 CarbonylContact O-C 3.54Å; R521-L524 WeakPolarHBondContact O-CA 3.3Å; R521-L524 WeakPolarHBondContact O-CB 3.49Å; R521-L524 PolarHBondContact O-N 3.33Å; R521-G525 PolarHBondContact O-N 3.46Å; R521-G525 VanDerWaalsContact O-N 3.17Å; R521-D526 CarbonylContact C-O 3.13Å; R521-D526 HydrophobicContact CB-CB 4.34Å; R521-D526 WeakPolarHBondContact CB-O 3.41Å; R521-D526 IonicContact CZ-OD2 3.69Å; R521-D526 IonicContact NE-OD2 3.61Å; R521-D526 PolarHBondContact NE-OD2 2.89Å; R521-D526 VanDerWaalsContact NH2-CG 3.33Å; R521-D526 IonicContact NH2-OD1 2.71Å; R521-D526 PolarHBondContact NH2-OD1 2.92Å; R521-D526 IonicContact NH2-OD2 2.98Å; R521-D526 PolarHBondContact NH2-OD2 3.22Å; R521-D526 PolarHBondContact O-N 3.14Å
522	I	91.8	Very high	91.6	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-37.3	174.3	-63	164.1	0	0	0	111.3	T518 L519 F520 L524 G525 D526 F527 F544 Y547 V548	T518-I522 HydrophobicContact CG2-CD1 4.33Å; T518-I522 VanDerWaalsContact O-CG1 3.31Å; T518-I522 WeakPolarHBondContact O-CG1 3.2Å; T518-I522 PolarHBondContact O-N 3.15Å; L519-I522 HydrophobicContact CD2-CD1 4.01Å; L519-I522 PolarHBondContact O-N 3.46Å; F520-I522 VanDerWaalsContact C-N 3.29Å; F520-I522 PolarHBondContact O-N 3.05Å; I522-L524 PolarHBondContact O-N 3.36Å; I522-G525 PolarHBondContact O-N 2.96Å; I522-D526 PolarHBondContact N-O 3.24Å; I522-F527 HydrophobicContact CG1-CB 3.83Å; I522-F544 HydrophobicContact CG2-CE2 3.88Å; I522-Y547 HydrophobicContact CB-CD1 4.49Å; I522-Y547 HydrophobicContact CB-CE1 3.88Å; I522-Y547 HydrophobicContact CD1-CD1 4.49Å; I522-Y547 HydrophobicContact CD1-CE1 4.33Å; I522-Y547 HydrophobicContact CG2-CD1 3.79Å; I522-Y547 HydrophobicContact CG2-CE1 3.57Å; I522-V548 HydrophobicContact CG2-CG2 4.16Å
523	I	88.7	Confident	91.4	Very high	35 Å²	35	60 Å²	60	18%	0.179	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-36.1	175	-52.9	-173.2	0	0	0	111.1	F487 F491 L519 F520 R521 G525 V551 F552 I556	F487-I523 HydrophobicContact CE2-CD1 4.36Å; F487-I523 HydrophobicContact CZ-CD1 4.07Å; F491-I523 HydrophobicContact CE2-CD1 4.43Å; L519-I523 WeakPolarHBondContact O-CG1 3.39Å; L519-I523 PolarHBondContact O-N 3.37Å; F520-I523 HydrophobicContact CD1-CD1 4Å; F520-I523 HydrophobicContact CE1-CD1 4.42Å; F520-I523 WeakPolarHBondContact O-CB 3.49Å; F520-I523 PolarHBondContact O-N 3.37Å; F520-I523 VanDerWaalsContact O-N 3.1Å; R521-I523 VanDerWaalsContact C-N 3.3Å; R521-I523 PolarHBondContact O-N 3.1Å; I523-G525 PolarHBondContact O-N 3.25Å; I523-V551 HydrophobicContact CB-CG1 4.4Å; I523-V551 HydrophobicContact CD1-CG1 4.09Å; I523-V551 HydrophobicContact CG1-CG1 3.83Å; I523-V551 HydrophobicContact CG2-CG1 4.07Å; I523-F552 WeakPolarHBondContact O-CE1 3.26Å; I523-F552 WeakPolarHBondContact O-CZ 3.47Å; I523-I556 HydrophobicContact CG2-CD1 4.07Å
524	L	89.1	Confident	91.3	Very high	152 Å²	152	61.4 Å²	61.4	80%	0.796	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-5.1	176.1	-63	174.1	0	0	0	113.3	F520 R521 I522	F520-L524 PolarHBondContact O-N 3.43Å; R521-L524 CarbonylContact O-C 3.54Å; R521-L524 WeakPolarHBondContact O-CA 3.3Å; R521-L524 WeakPolarHBondContact O-CB 3.49Å; R521-L524 PolarHBondContact O-N 3.33Å; I522-L524 PolarHBondContact O-N 3.36Å
525	G	87.3	Confident	91.2	Very high	44 Å²	44	60.1 Å²	60.1	45%	0.454	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	7.6	-178.6	0	0	0	0	0	115	R521 I522 I523 F527	R521-G525 PolarHBondContact O-N 3.46Å; R521-G525 VanDerWaalsContact O-N 3.17Å; I522-G525 PolarHBondContact O-N 2.96Å; I523-G525 PolarHBondContact O-N 3.25Å; G525-F527 WeakPolarHBondContact O-CD1 3.31Å
526	D	89.7	Confident	91.1	Very high	77 Å²	77	63.7 Å²	63.7	41%	0.412	33%	0.329	S	S	.	.			trans	-98.4	109.6	177.2	176.6	20.5	0	0	0	110.2	R521 I522	R521-D526 CarbonylContact C-O 3.13Å; R521-D526 HydrophobicContact CB-CB 4.34Å; R521-D526 WeakPolarHBondContact CB-O 3.41Å; R521-D526 IonicContact CZ-OD2 3.69Å; R521-D526 IonicContact NE-OD2 3.61Å; R521-D526 PolarHBondContact NE-OD2 2.89Å; R521-D526 VanDerWaalsContact NH2-CG 3.33Å; R521-D526 IonicContact NH2-OD1 2.71Å; R521-D526 PolarHBondContact NH2-OD1 2.92Å; R521-D526 IonicContact NH2-OD2 2.98Å; R521-D526 PolarHBondContact NH2-OD2 3.22Å; R521-D526 PolarHBondContact O-N 3.14Å; I522-D526 PolarHBondContact N-O 3.24Å
527	F	87.2	Confident	90.9	Very high	96 Å²	96	72.4 Å²	72.4	42%	0.421	36%	0.361	S	S	.	.			trans	-150.7	142.7	-175.6	61.5	-91.1	0	0	0	112.7	I522 G525 F529 F544	I522-F527 HydrophobicContact CG1-CB 3.83Å; G525-F527 WeakPolarHBondContact O-CD1 3.31Å; F527-F529 HydrophobicContact CD2-CB 3.9Å; F527-F529 HydrophobicContact CE2-CB 3.91Å; F527-F544 HydrophobicContact CB-CE2 3.96Å; F527-F544 HydrophobicContact CB-CZ 4.46Å; F527-F544 HydrophobicContact CD1-CE2 4.11Å; F527-F544 AromaticContact CD1-CZ 3.83Å; F527-F544 HydrophobicContact CD1-CZ 3.83Å; F527-F544 HydrophobicContact CD2-CE1 4.27Å; F527-F544 AromaticContact CD2-CE2 3.61Å; F527-F544 HydrophobicContact CD2-CE2 3.61Å; F527-F544 AromaticContact CD2-CZ 3.4Å; F527-F544 HydrophobicContact CD2-CZ 3.4Å; F527-F544 VanDerWaalsContact CD2-CZ 3.4Å; F527-F544 AromaticContact CE1-CZ 3.83Å; F527-F544 HydrophobicContact CE1-CZ 3.83Å; F527-F544 AromaticContact CE2-CE1 3.95Å; F527-F544 HydrophobicContact CE2-CE1 3.95Å; F527-F544 HydrophobicContact CE2-CE2 4.11Å; F527-F544 AromaticContact CE2-CZ 3.4Å; F527-F544 HydrophobicContact CE2-CZ 3.4Å; F527-F544 VanDerWaalsContact CE2-CZ 3.4Å; F527-F544 AromaticContact CG-CE2 3.62Å; F527-F544 HydrophobicContact CG-CE2 3.62Å; F527-F544 AromaticContact CG-CZ 3.64Å; F527-F544 HydrophobicContact CG-CZ 3.64Å; F527-F544 HydrophobicContact CZ-CE1 4.22Å; F527-F544 AromaticContact CZ-CZ 3.63Å; F527-F544 HydrophobicContact CZ-CZ 3.63Å
528	D	89.4	Confident	90.9	Very high	80 Å²	80	70 Å²	70	43%	0.428	36%	0.361	S	S	.	.			trans	-96.4	89.5	169.6	-170.9	-9.6	0	0	0	110.2	N530 A531	D528-N530 VanDerWaalsContact C-N 3.27Å; D528-N530 PolarHBondContact O-N 3.17Å; D528-N530 WeakPolarHBondContact OD1-CB 3.46Å; D528-N530 PolarHBondContact OD1-N 3Å; D528-N530 VanDerWaalsContact OD1-N 3.09Å; D528-A531 HydrophobicContact CB-CB 4.07Å; D528-A531 PolarHBondContact O-N 3.05Å; D528-A531 PolarHBondContact OD1-N 2.88Å
529	F	90.3	Very high	90.9	Very high	62 Å²	62	73.3 Å²	73.3	27%	0.272	37%	0.374	S	S	.	.	H	α-helix	trans	-65.5	-32.4	177.5	-177.9	-97.5	0	0	0	112.3	F527 A531 L532 E533 P541 F544	F527-F529 HydrophobicContact CD2-CB 3.9Å; F527-F529 HydrophobicContact CE2-CB 3.91Å; F529-A531 VanDerWaalsContact C-N 3.32Å; F529-A531 PolarHBondContact O-N 2.78Å; F529-L532 PolarHBondContact O-N 3.45Å; F529-L532 VanDerWaalsContact O-N 3.17Å; F529-E533 HydrophobicContact CE1-CB 4.25Å; F529-E533 PolarHBondContact O-N 2.9Å; F529-P541 HydrophobicContact CE2-CB 4Å; F529-P541 HydrophobicContact CE2-CG 4.16Å; F529-P541 HydrophobicContact CZ-CB 3.83Å; F529-P541 HydrophobicContact CZ-CG 3.71Å; F529-F544 AromaticContact CD2-CD1 3.88Å; F529-F544 HydrophobicContact CD2-CD1 3.88Å; F529-F544 HydrophobicContact CD2-CE1 4.27Å; F529-F544 HydrophobicContact CD2-CG 4.21Å; F529-F544 HydrophobicContact CE2-CD1 4.08Å
530	N	91	Very high	90.9	Very high	111 Å²	111	73.3 Å²	73.3	59%	0.594	37%	0.374	S	S	*	.	H	α-helix	trans	-66.4	-38.4	-178.4	-65.2	-29.4	0	0	0	110.7	D528 L532 E533 T534	D528-N530 VanDerWaalsContact C-N 3.27Å; D528-N530 PolarHBondContact O-N 3.17Å; D528-N530 WeakPolarHBondContact OD1-CB 3.46Å; D528-N530 PolarHBondContact OD1-N 3Å; D528-N530 VanDerWaalsContact OD1-N 3.09Å; N530-L532 VanDerWaalsContact C-N 3.3Å; N530-L532 PolarHBondContact O-N 2.94Å; N530-E533 PolarHBondContact O-N 2.91Å; N530-T534 WeakPolarHBondContact O-CB 3.45Å; N530-T534 VanDerWaalsContact O-CG2 3.24Å; N530-T534 WeakPolarHBondContact O-CG2 3.5Å; N530-T534 PolarHBondContact O-N 3.33Å; N530-T534 PolarHBondContact O-OG1 2.89Å
531	A	89.7	Confident	90.9	Very high	23 Å²	23	70.3 Å²	70.3	19%	0.19	36%	0.364	C	S	.	.	H	α-helix	trans	-61	-37.8	174	0	0	0	0	0	112.6	D528 F529 T534 A535	D528-A531 HydrophobicContact CB-CB 4.07Å; D528-A531 PolarHBondContact O-N 3.05Å; D528-A531 PolarHBondContact OD1-N 2.88Å; F529-A531 VanDerWaalsContact C-N 3.32Å; F529-A531 PolarHBondContact O-N 2.78Å; A531-T534 WeakPolarHBondContact CA-OG1 3.47Å; A531-T534 PolarHBondContact O-OG1 3.04Å; A531-A535 WeakPolarHBondContact O-CB 3.17Å; A531-A535 PolarHBondContact O-N 3.3Å
532	L	89.8	Confident	91	Very high	3 Å²	3	69.8 Å²	69.8	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-72.4	-41.3	176.8	-76.8	165.5	0	0	0	112.5	F502 F509 F529 N530 A535 N536 Y543 F544	F502-L532 HydrophobicContact CD1-CD2 4.33Å; F502-L532 HydrophobicContact CD2-CD2 3.74Å; F502-L532 HydrophobicContact CE1-CD2 4.35Å; F502-L532 HydrophobicContact CE2-CD2 3.79Å; F502-L532 HydrophobicContact CG-CD2 4.04Å; F502-L532 HydrophobicContact CZ-CD2 4.09Å; F509-L532 HydrophobicContact CD2-CD2 4.38Å; F509-L532 HydrophobicContact CE2-CD1 4.47Å; F509-L532 HydrophobicContact CE2-CD2 3.62Å; F509-L532 HydrophobicContact CE2-CG 4.07Å; F509-L532 HydrophobicContact CZ-CD1 4.4Å; F509-L532 HydrophobicContact CZ-CD2 3.75Å; F509-L532 HydrophobicContact CZ-CG 4.37Å; F529-L532 PolarHBondContact O-N 3.45Å; F529-L532 VanDerWaalsContact O-N 3.17Å; N530-L532 VanDerWaalsContact C-N 3.3Å; N530-L532 PolarHBondContact O-N 2.94Å; L532-A535 PolarHBondContact O-N 2.97Å; L532-N536 PolarHBondContact O-N 3.47Å; L532-N536 VanDerWaalsContact O-N 3.14Å; L532-Y543 HydrophobicContact CD2-CD1 4.45Å; L532-F544 HydrophobicContact CD1-CB 4.3Å; L532-F544 HydrophobicContact CD1-CD2 4.12Å
533	E	91.8	Very high	91.1	Very high	75 Å²	75	70 Å²	70	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-67.3	-40.5	178.2	-172.5	-178.6	177.7	0	0	111.9	F529 N530 A535 N536 R537 P541	F529-E533 HydrophobicContact CE1-CB 4.25Å; F529-E533 PolarHBondContact O-N 2.9Å; N530-E533 PolarHBondContact O-N 2.91Å; E533-A535 VanDerWaalsContact C-N 3.32Å; E533-A535 PolarHBondContact O-N 3.43Å; E533-N536 CarbonylContact O-C 3.57Å; E533-N536 PolarHBondContact O-N 3.47Å; E533-R537 WeakPolarHBondContact O-CA 3.44Å; E533-R537 PolarHBondContact O-N 3.4Å; E533-P541 HydrophobicContact CG-CG 4.5Å
534	T	91.8	Very high	91.3	Very high	120 Å²	120	69.3 Å²	69.3	74%	0.736	36%	0.364	S	S	*	.	H	α-helix	trans	-66.7	-33.6	177.5	50.2	0	0	0	0	112.5	N530 A531	N530-T534 WeakPolarHBondContact O-CB 3.45Å; N530-T534 VanDerWaalsContact O-CG2 3.24Å; N530-T534 WeakPolarHBondContact O-CG2 3.5Å; N530-T534 PolarHBondContact O-N 3.33Å; N530-T534 PolarHBondContact O-OG1 2.89Å; A531-T534 WeakPolarHBondContact CA-OG1 3.47Å; A531-T534 PolarHBondContact O-OG1 3.04Å
535	A	90.9	Very high	91.5	Very high	17 Å²	17	67.2 Å²	67.2	14%	0.14	35%	0.353	C	S	.	.	H	α-helix	trans	-66.2	-50.7	172.9	0	0	0	0	0	111.5	F502 Q505 A531 L532 E533	F502-A535 HydrophobicContact CD1-CB 3.75Å; F502-A535 HydrophobicContact CE1-CB 4.34Å; Q505-A535 HydrophobicContact CB-CB 4Å; Q505-A535 VanDerWaalsContact OE1-C 3.29Å; Q505-A535 VanDerWaalsContact OE1-CB 3.29Å; Q505-A535 PolarHBondContact OE1-O 2.94Å; A531-A535 WeakPolarHBondContact O-CB 3.17Å; A531-A535 PolarHBondContact O-N 3.3Å; L532-A535 PolarHBondContact O-N 2.97Å; E533-A535 VanDerWaalsContact C-N 3.32Å; E533-A535 PolarHBondContact O-N 3.43Å
536	N	92.2	Very high	91.8	Very high	74 Å²	74	68.6 Å²	68.6	40%	0.396	35%	0.352	S	S	.	.			trans	-151	115.1	170.6	-170	-48.4	0	0	0	111.8	F502 L532 E533 V538 F539 G540 P541	F502-N536 HydrophobicContact CE1-CB 4.43Å; L532-N536 PolarHBondContact O-N 3.47Å; L532-N536 VanDerWaalsContact O-N 3.14Å; E533-N536 CarbonylContact O-C 3.57Å; E533-N536 PolarHBondContact O-N 3.47Å; N536-V538 PolarHBondContact O-N 2.97Å; N536-V538 PolarHBondContact OD1-N 2.9Å; N536-F539 HydrophobicContact CB-CB 4Å; N536-F539 PolarHBondContact OD1-N 3.42Å; N536-G540 WeakPolarHBondContact O-CA 3.27Å; N536-G540 PolarHBondContact O-N 3Å; N536-P541 WeakPolarHBondContact O-CD 3.46Å
537	R	91.6	Very high	91.9	Very high	199 Å²	199	65 Å²	65	75%	0.751	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-28.8	-176.6	-170.8	176.9	-177.7	-173.4	0.4	114.7	E533 P541	E533-R537 WeakPolarHBondContact O-CA 3.44Å; E533-R537 PolarHBondContact O-N 3.4Å; R537-P541 WeakPolarHBondContact O-CG 3.11Å
538	V	93.7	Very high	92.1	Very high	97 Å²	97	62.1 Å²	62.1	59%	0.588	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-51.2	-178.1	-179.6	0	0	0	0	110.8	N536 I542	N536-V538 PolarHBondContact O-N 2.97Å; N536-V538 PolarHBondContact OD1-N 2.9Å; V538-I542 HydrophobicContact CG1-CD1 3.74Å; V538-I542 WeakPolarHBondContact O-CD1 3.28Å; V538-I542 VanDerWaalsContact O-CG1 3.26Å; V538-I542 WeakPolarHBondContact O-CG1 3.21Å; V538-I542 PolarHBondContact O-N 3.34Å
539	F	93.6	Very high	92.2	Very high	81 Å²	81	64.1 Å²	64.1	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-70.3	-36.9	-174.3	-173.6	-101.4	0	0	0	112.7	L497 A501 F502 N536 I542 Y543	L497-F539 HydrophobicContact CD1-CZ 4.26Å; A501-F539 HydrophobicContact CB-CD1 4.27Å; A501-F539 HydrophobicContact CB-CE1 3.57Å; A501-F539 HydrophobicContact CB-CZ 4.45Å; F502-F539 AromaticContact CE1-CD1 3.85Å; F502-F539 HydrophobicContact CE1-CD1 3.85Å; F502-F539 HydrophobicContact CE1-CE1 4.4Å; F502-F539 HydrophobicContact CE2-CD1 4.27Å; F502-F539 HydrophobicContact CE2-CE1 4.09Å; F502-F539 AromaticContact CZ-CD1 3.39Å; F502-F539 HydrophobicContact CZ-CD1 3.39Å; F502-F539 AromaticContact CZ-CE1 3.67Å; F502-F539 HydrophobicContact CZ-CE1 3.67Å; N536-F539 HydrophobicContact CB-CB 4Å; N536-F539 PolarHBondContact OD1-N 3.42Å; F539-I542 PolarHBondContact O-N 3.38Å; F539-Y543 VanDerWaalsContact O-CB 3.31Å; F539-Y543 WeakPolarHBondContact O-CB 3.48Å; F539-Y543 PolarHBondContact O-N 3.41Å
540	G	93.5	Very high	92.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.5	-57	177.5	0	0	0	0	0	112.9	N536 I542 Y543 F544	N536-G540 WeakPolarHBondContact O-CA 3.27Å; N536-G540 PolarHBondContact O-N 3Å; G540-I542 PolarHBondContact O-N 2.92Å; G540-Y543 PolarHBondContact O-N 2.99Å; G540-F544 PolarHBondContact O-N 3.42Å
541	P	93.9	Very high	92.2	Very high	21 Å²	21	58.7 Å²	58.7	14%	0.136	30%	0.299	C	S	.	.	H	α-helix	trans	-60.6	-39.6	177	-28.5	37.1	0	0	0	114	F529 E533 N536 R537 F544 I545	F529-P541 HydrophobicContact CE2-CB 4Å; F529-P541 HydrophobicContact CE2-CG 4.16Å; F529-P541 HydrophobicContact CZ-CB 3.83Å; F529-P541 HydrophobicContact CZ-CG 3.71Å; E533-P541 HydrophobicContact CG-CG 4.5Å; N536-P541 WeakPolarHBondContact O-CD 3.46Å; R537-P541 WeakPolarHBondContact O-CG 3.11Å; P541-F544 PolarHBondContact O-N 3.29Å; P541-I545 WeakPolarHBondContact O-CB 3.39Å; P541-I545 VanDerWaalsContact O-CG1 3.22Å; P541-I545 WeakPolarHBondContact O-CG1 3.5Å; P541-I545 PolarHBondContact O-N 3.28Å
542	I	94.6	Very high	92.1	Very high	94 Å²	94	61 Å²	61	48%	0.482	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-48	177.8	-68.7	170.9	0	0	0	110.6	V538 F539 G540 F544 I545 V546	V538-I542 HydrophobicContact CG1-CD1 3.74Å; V538-I542 WeakPolarHBondContact O-CD1 3.28Å; V538-I542 VanDerWaalsContact O-CG1 3.26Å; V538-I542 WeakPolarHBondContact O-CG1 3.21Å; V538-I542 PolarHBondContact O-N 3.34Å; F539-I542 PolarHBondContact O-N 3.38Å; G540-I542 PolarHBondContact O-N 2.92Å; I542-F544 VanDerWaalsContact C-N 3.31Å; I542-F544 PolarHBondContact O-N 3.04Å; I542-I545 PolarHBondContact O-N 3.5Å; I542-V546 HydrophobicContact CG2-CG2 4.3Å; I542-V546 WeakPolarHBondContact O-CB 3.42Å; I542-V546 VanDerWaalsContact O-CG2 3.24Å; I542-V546 WeakPolarHBondContact O-CG2 2.92Å; I542-V546 PolarHBondContact O-N 2.97Å
543	Y	94.1	Very high	92	Very high	8 Å²	8	67.1 Å²	67.1	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-54.9	-49.1	175.8	168.2	-95.5	0	0	0	111.2	F494 L497 F502 F509 L532 F539 G540 V546 Y547	F494-Y543 HydrophobicContact CD1-CD2 4.29Å; F494-Y543 AromaticContact CD1-CE2 3.79Å; F494-Y543 HydrophobicContact CD1-CE2 3.79Å; F494-Y543 PolarHBondContact O-OH 3.33Å; L497-Y543 HydrophobicContact CB-CE2 4.39Å; L497-Y543 HydrophobicContact CD2-CD2 3.84Å; L497-Y543 HydrophobicContact CD2-CE2 4Å; L497-Y543 HydrophobicContact CG-CD2 4.26Å; L497-Y543 HydrophobicContact CG-CE2 4.18Å; F502-Y543 AromaticContact CE2-CD1 3.77Å; F502-Y543 HydrophobicContact CE2-CD1 3.77Å; F502-Y543 HydrophobicContact CE2-CD2 4.37Å; F502-Y543 HydrophobicContact CE2-CE1 4.21Å; F502-Y543 AromaticContact CE2-CG 3.86Å; F502-Y543 HydrophobicContact CE2-CG 3.86Å; F502-Y543 HydrophobicContact CZ-CG 4.42Å; F509-Y543 HydrophobicContact CE1-CE1 4.21Å; F509-Y543 HydrophobicContact CZ-CE1 4.41Å; L532-Y543 HydrophobicContact CD2-CD1 4.45Å; F539-Y543 VanDerWaalsContact O-CB 3.31Å; F539-Y543 WeakPolarHBondContact O-CB 3.48Å; F539-Y543 PolarHBondContact O-N 3.41Å; G540-Y543 PolarHBondContact O-N 2.99Å; Y543-V546 PolarHBondContact O-N 3.16Å; Y543-Y547 WeakPolarHBondContact O-CB 3.31Å; Y543-Y547 PolarHBondContact O-N 2.89Å
544	F	92.7	Very high	91.8	Very high	21 Å²	21	66.7 Å²	66.7	9%	0.092	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-49.7	-179.8	-179.7	-102	0	0	0	112.2	I522 F527 F529 L532 G540 P541 I542 V546 Y547 V548	I522-F544 HydrophobicContact CG2-CE2 3.88Å; F527-F544 HydrophobicContact CB-CE2 3.96Å; F527-F544 HydrophobicContact CB-CZ 4.46Å; F527-F544 HydrophobicContact CD1-CE2 4.11Å; F527-F544 AromaticContact CD1-CZ 3.83Å; F527-F544 HydrophobicContact CD1-CZ 3.83Å; F527-F544 HydrophobicContact CD2-CE1 4.27Å; F527-F544 AromaticContact CD2-CE2 3.61Å; F527-F544 HydrophobicContact CD2-CE2 3.61Å; F527-F544 AromaticContact CD2-CZ 3.4Å; F527-F544 HydrophobicContact CD2-CZ 3.4Å; F527-F544 VanDerWaalsContact CD2-CZ 3.4Å; F527-F544 AromaticContact CE1-CZ 3.83Å; F527-F544 HydrophobicContact CE1-CZ 3.83Å; F527-F544 AromaticContact CE2-CE1 3.95Å; F527-F544 HydrophobicContact CE2-CE1 3.95Å; F527-F544 HydrophobicContact CE2-CE2 4.11Å; F527-F544 AromaticContact CE2-CZ 3.4Å; F527-F544 HydrophobicContact CE2-CZ 3.4Å; F527-F544 VanDerWaalsContact CE2-CZ 3.4Å; F527-F544 AromaticContact CG-CE2 3.62Å; F527-F544 HydrophobicContact CG-CE2 3.62Å; F527-F544 AromaticContact CG-CZ 3.64Å; F527-F544 HydrophobicContact CG-CZ 3.64Å; F527-F544 HydrophobicContact CZ-CE1 4.22Å; F527-F544 AromaticContact CZ-CZ 3.63Å; F527-F544 HydrophobicContact CZ-CZ 3.63Å; F529-F544 AromaticContact CD2-CD1 3.88Å; F529-F544 HydrophobicContact CD2-CD1 3.88Å; F529-F544 HydrophobicContact CD2-CE1 4.27Å; F529-F544 HydrophobicContact CD2-CG 4.21Å; F529-F544 HydrophobicContact CE2-CD1 4.08Å; L532-F544 HydrophobicContact CD1-CB 4.3Å; L532-F544 HydrophobicContact CD1-CD2 4.12Å; G540-F544 PolarHBondContact O-N 3.42Å; P541-F544 PolarHBondContact O-N 3.29Å; I542-F544 VanDerWaalsContact C-N 3.31Å; I542-F544 PolarHBondContact O-N 3.04Å; F544-V546 PolarHBondContact O-N 3.32Å; F544-Y547 PolarHBondContact O-N 3.23Å; F544-V548 HydrophobicContact CD1-CG2 4.24Å; F544-V548 HydrophobicContact CD2-CG2 4.2Å; F544-V548 HydrophobicContact CE1-CG2 3.85Å; F544-V548 HydrophobicContact CE2-CG2 3.79Å; F544-V548 HydrophobicContact CG-CG2 4.41Å; F544-V548 HydrophobicContact CZ-CG2 3.6Å; F544-V548 WeakPolarHBondContact O-CB 3.22Å; F544-V548 VanDerWaalsContact O-CG2 3.3Å; F544-V548 WeakPolarHBondContact O-CG2 3.33Å; F544-V548 PolarHBondContact O-N 3.03Å
545	I	92.5	Very high	91.6	Very high	109 Å²	109	61.2 Å²	61.2	56%	0.559	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-44.8	-179.7	-70.2	167.2	0	0	0	111	P541 I542 F549	P541-I545 WeakPolarHBondContact O-CB 3.39Å; P541-I545 VanDerWaalsContact O-CG1 3.22Å; P541-I545 WeakPolarHBondContact O-CG1 3.5Å; P541-I545 PolarHBondContact O-N 3.28Å; I542-I545 PolarHBondContact O-N 3.5Å; I545-F549 VanDerWaalsContact O-CB 3.28Å; I545-F549 WeakPolarHBondContact O-CB 3.4Å; I545-F549 PolarHBondContact O-N 3.2Å
546	V	93.6	Very high	91.5	Very high	73 Å²	73	62.7 Å²	62.7	44%	0.442	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-42.8	179.7	172.1	0	0	0	0	111	F494 I542 Y543 F544 F549 F550	F494-V546 HydrophobicContact CE1-CG1 4.17Å; F494-V546 HydrophobicContact CZ-CG1 3.98Å; I542-V546 HydrophobicContact CG2-CG2 4.3Å; I542-V546 WeakPolarHBondContact O-CB 3.42Å; I542-V546 VanDerWaalsContact O-CG2 3.24Å; I542-V546 WeakPolarHBondContact O-CG2 2.92Å; I542-V546 PolarHBondContact O-N 2.97Å; Y543-V546 PolarHBondContact O-N 3.16Å; F544-V546 PolarHBondContact O-N 3.32Å; V546-F549 PolarHBondContact O-N 3.43Å; V546-F550 WeakPolarHBondContact O-CB 3.42Å; V546-F550 PolarHBondContact O-N 2.87Å
547	Y	93.2	Very high	91.4	Very high	1 Å²	1	63.3 Å²	63.3	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-50.3	177.2	176.8	-102.9	0	0	0	111.8	F494 L519 I522 Y543 F544 F549 F550 V551	F494-Y547 HydrophobicContact CB-CD2 3.98Å; F494-Y547 HydrophobicContact CB-CE2 4.29Å; F494-Y547 HydrophobicContact CD1-CD2 4.12Å; F494-Y547 HydrophobicContact CD2-CD2 4.01Å; F494-Y547 AromaticContact CG-CD2 3.78Å; F494-Y547 HydrophobicContact CG-CD2 3.78Å; F494-Y547 HydrophobicContact CG-CE2 4.47Å; L519-Y547 HydrophobicContact CD1-CE2 4.32Å; L519-Y547 HydrophobicContact CD2-CD1 4.46Å; L519-Y547 HydrophobicContact CD2-CD2 4.43Å; L519-Y547 HydrophobicContact CD2-CE1 4.06Å; L519-Y547 HydrophobicContact CD2-CE2 4.02Å; L519-Y547 PolarHBondContact O-OH 3.5Å; I522-Y547 HydrophobicContact CB-CD1 4.49Å; I522-Y547 HydrophobicContact CB-CE1 3.88Å; I522-Y547 HydrophobicContact CD1-CD1 4.49Å; I522-Y547 HydrophobicContact CD1-CE1 4.33Å; I522-Y547 HydrophobicContact CG2-CD1 3.79Å; I522-Y547 HydrophobicContact CG2-CE1 3.57Å; Y543-Y547 WeakPolarHBondContact O-CB 3.31Å; Y543-Y547 PolarHBondContact O-N 2.89Å; F544-Y547 PolarHBondContact O-N 3.23Å; Y547-F549 VanDerWaalsContact C-N 3.29Å; Y547-F549 PolarHBondContact O-N 3.16Å; Y547-F550 PolarHBondContact O-N 3.4Å; Y547-V551 HydrophobicContact CD1-CG2 4.3Å; Y547-V551 HydrophobicContact CD2-CG2 3.91Å; Y547-V551 HydrophobicContact CE1-CG2 3.89Å; Y547-V551 HydrophobicContact CE2-CG2 3.46Å; Y547-V551 VanDerWaalsContact CE2-CG2 3.46Å; Y547-V551 HydrophobicContact CG-CG2 4.32Å; Y547-V551 VanDerWaalsContact CZ-CG2 3.45Å; Y547-V551 WeakPolarHBondContact O-CG2 3.48Å; Y547-V551 PolarHBondContact O-N 3.26Å
548	V	91.3	Very high	91.3	Very high	35 Å²	35	57.7 Å²	57.7	21%	0.212	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-43.3	177.4	168.3	0	0	0	0	110.6	I522 F544 F550 F552	I522-V548 HydrophobicContact CG2-CG2 4.16Å; F544-V548 HydrophobicContact CD1-CG2 4.24Å; F544-V548 HydrophobicContact CD2-CG2 4.2Å; F544-V548 HydrophobicContact CE1-CG2 3.85Å; F544-V548 HydrophobicContact CE2-CG2 3.79Å; F544-V548 HydrophobicContact CG-CG2 4.41Å; F544-V548 HydrophobicContact CZ-CG2 3.6Å; F544-V548 WeakPolarHBondContact O-CB 3.22Å; F544-V548 VanDerWaalsContact O-CG2 3.3Å; F544-V548 WeakPolarHBondContact O-CG2 3.33Å; F544-V548 PolarHBondContact O-N 3.03Å; V548-F550 PolarHBondContact O-N 3.5Å; V548-F552 HydrophobicContact CB-CD2 4.35Å; V548-F552 HydrophobicContact CG1-CD2 3.69Å; V548-F552 HydrophobicContact CG1-CE2 4.17Å; V548-F552 WeakPolarHBondContact O-CB 3.1Å; V548-F552 WeakPolarHBondContact O-CD2 3.23Å; V548-F552 PolarHBondContact O-N 3.14Å
549	F	91.5	Very high	91.1	Very high	122 Å²	122	55.2 Å²	55.2	54%	0.535	27%	0.273	S	S	.	.	I	π-helix	trans	-58.9	-50	176.8	179.6	-98.5	0	0	0	111.5	I545 V546 Y547 F553	I545-F549 VanDerWaalsContact O-CB 3.28Å; I545-F549 WeakPolarHBondContact O-CB 3.4Å; I545-F549 PolarHBondContact O-N 3.2Å; V546-F549 PolarHBondContact O-N 3.43Å; Y547-F549 VanDerWaalsContact C-N 3.29Å; Y547-F549 PolarHBondContact O-N 3.16Å; F549-F553 HydrophobicContact CD2-CB 4.4Å; F549-F553 AromaticContact CD2-CD2 3.7Å; F549-F553 HydrophobicContact CD2-CD2 3.7Å; F549-F553 HydrophobicContact CD2-CE2 4.26Å; F549-F553 HydrophobicContact CD2-CG 4.23Å; F549-F553 HydrophobicContact CE2-CB 4.3Å; F549-F553 HydrophobicContact CE2-CD2 4.22Å; F549-F553 HydrophobicContact CE2-CG 4.31Å; F549-F553 HydrophobicContact CG-CD2 4.4Å; F549-F553 WeakPolarHBondContact O-CB 3.46Å; F549-F553 PolarHBondContact O-N 3.04Å; F549-F553 VanDerWaalsContact O-N 3.08Å
550	F	90.4	Very high	91.1	Very high	57 Å²	57	56 Å²	56	25%	0.25	28%	0.28	C	S	.	.	I	π-helix	trans	-64.7	-45.8	-178.3	-169.8	-95.1	0	0	0	112.3	V490 F494 V546 Y547 V548 V554 L555	V490-F550 HydrophobicContact CB-CD1 4.46Å; V490-F550 HydrophobicContact CB-CE1 3.62Å; V490-F550 HydrophobicContact CB-CZ 4.02Å; V490-F550 HydrophobicContact CG1-CD1 3.59Å; V490-F550 HydrophobicContact CG1-CE1 3.16Å; V490-F550 HydrophobicContact CG1-CE2 4.42Å; V490-F550 HydrophobicContact CG1-CG 4.41Å; V490-F550 HydrophobicContact CG1-CZ 3.65Å; V490-F550 HydrophobicContact CG2-CE1 3.91Å; V490-F550 HydrophobicContact CG2-CZ 3.77Å; F494-F550 HydrophobicContact CE2-CD1 4.44Å; V546-F550 WeakPolarHBondContact O-CB 3.42Å; V546-F550 PolarHBondContact O-N 2.87Å; Y547-F550 PolarHBondContact O-N 3.4Å; V548-F550 PolarHBondContact O-N 3.5Å; F550-V554 HydrophobicContact CD2-CG2 4.48Å; F550-V554 VanDerWaalsContact O-CB 3.26Å; F550-V554 WeakPolarHBondContact O-CB 3.39Å; F550-V554 PolarHBondContact O-N 3.43Å; F550-L555 HydrophobicContact CD1-CD1 3.52Å; F550-L555 HydrophobicContact CD1-CG 3.9Å; F550-L555 HydrophobicContact CE1-CD1 3.36Å; F550-L555 HydrophobicContact CE1-CD2 3.72Å; F550-L555 HydrophobicContact CE1-CG 3.54Å; F550-L555 HydrophobicContact CZ-CD1 4.5Å; F550-L555 HydrophobicContact CZ-CD2 4.13Å; F550-L555 HydrophobicContact CZ-CG 4.29Å; F550-L555 PolarHBondContact O-N 2.96Å; F550-L555 VanDerWaalsContact O-N 3.07Å
551	V	89.4	Confident	91	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	30%	0.302	C	S	.	.	I	π-helix	trans	-68.8	-55.2	-178.9	174.7	0	0	0	0	111.8	I523 Y547 L555 I556	I523-V551 HydrophobicContact CB-CG1 4.4Å; I523-V551 HydrophobicContact CD1-CG1 4.09Å; I523-V551 HydrophobicContact CG1-CG1 3.83Å; I523-V551 HydrophobicContact CG2-CG1 4.07Å; Y547-V551 HydrophobicContact CD1-CG2 4.3Å; Y547-V551 HydrophobicContact CD2-CG2 3.91Å; Y547-V551 HydrophobicContact CE1-CG2 3.89Å; Y547-V551 HydrophobicContact CE2-CG2 3.46Å; Y547-V551 VanDerWaalsContact CE2-CG2 3.46Å; Y547-V551 HydrophobicContact CG-CG2 4.32Å; Y547-V551 VanDerWaalsContact CZ-CG2 3.45Å; Y547-V551 WeakPolarHBondContact O-CG2 3.48Å; Y547-V551 PolarHBondContact O-N 3.26Å; V551-L555 HydrophobicContact CG2-CD1 4.18Å; V551-L555 WeakPolarHBondContact O-CB 3.18Å; V551-L555 PolarHBondContact O-N 3.2Å; V551-I556 HydrophobicContact CG1-CD1 4.2Å; V551-I556 HydrophobicContact CG1-CG1 4.37Å; V551-I556 WeakPolarHBondContact O-CG1 3.38Å; V551-I556 PolarHBondContact O-N 3.46Å
552	F	87.5	Confident	90.9	Very high	73 Å²	73	58.9 Å²	58.9	32%	0.32	30%	0.302	S	S	.	.	I	π-helix	trans	-75.1	-44.5	-171.3	-75.6	-80.1	0	0	0	112.5	I523 V548 I556	I523-F552 WeakPolarHBondContact O-CE1 3.26Å; I523-F552 WeakPolarHBondContact O-CZ 3.47Å; V548-F552 HydrophobicContact CB-CD2 4.35Å; V548-F552 HydrophobicContact CG1-CD2 3.69Å; V548-F552 HydrophobicContact CG1-CE2 4.17Å; V548-F552 WeakPolarHBondContact O-CB 3.1Å; V548-F552 WeakPolarHBondContact O-CD2 3.23Å; V548-F552 PolarHBondContact O-N 3.14Å; F552-I556 HydrophobicContact CD1-CD1 3.68Å; F552-I556 HydrophobicContact CE1-CD1 4Å; F552-I556 HydrophobicContact CG-CD1 4.36Å
553	F	88.4	Confident	90.8	Very high	130 Å²	130	58.3 Å²	58.3	57%	0.57	30%	0.299	S	S	*	.	I	π-helix	trans	-85.8	-32.8	-174.1	-66.4	-85	0	0	0	113.5	F549 N557	F549-F553 HydrophobicContact CD2-CB 4.4Å; F549-F553 AromaticContact CD2-CD2 3.7Å; F549-F553 HydrophobicContact CD2-CD2 3.7Å; F549-F553 HydrophobicContact CD2-CE2 4.26Å; F549-F553 HydrophobicContact CD2-CG 4.23Å; F549-F553 HydrophobicContact CE2-CB 4.3Å; F549-F553 HydrophobicContact CE2-CD2 4.22Å; F549-F553 HydrophobicContact CE2-CG 4.31Å; F549-F553 HydrophobicContact CG-CD2 4.4Å; F549-F553 WeakPolarHBondContact O-CB 3.46Å; F549-F553 PolarHBondContact O-N 3.04Å; F549-F553 VanDerWaalsContact O-N 3.08Å; F553-N557 PolarHBondContact O-ND2 3Å
554	V	87.3	Confident	90.7	Very high	66 Å²	66	62.7 Å²	62.7	40%	0.4	32%	0.323	S	S	.	.	I	π-helix	trans	-96.9	-59.6	-177.7	-171.5	0	0	0	0	110.6	F550 M558	F550-V554 HydrophobicContact CD2-CG2 4.48Å; F550-V554 VanDerWaalsContact O-CB 3.26Å; F550-V554 WeakPolarHBondContact O-CB 3.39Å; F550-V554 PolarHBondContact O-N 3.43Å; V554-M558 WeakPolarHBondContact O-CB 3.24Å; V554-M558 PolarHBondContact O-N 3.33Å
555	L	87.1	Confident	90.8	Very high	6 Å²	6	68.7 Å²	68.7	3%	0.031	35%	0.351	C	S	.	.	I	π-helix	trans	-72.5	-52.5	-169.2	-63.8	170	0	0	0	113.4	F483 F487 F550 V551 N557 M558 F559	F483-L555 HydrophobicContact CE2-CD2 4.25Å; F483-L555 HydrophobicContact CZ-CD2 3.7Å; F487-L555 HydrophobicContact CD2-CB 4.37Å; F487-L555 HydrophobicContact CD2-CD1 3.44Å; F487-L555 VanDerWaalsContact CD2-CD1 3.44Å; F487-L555 HydrophobicContact CD2-CD2 4.24Å; F487-L555 HydrophobicContact CD2-CG 4.23Å; F487-L555 HydrophobicContact CE2-CD1 3.77Å; F550-L555 HydrophobicContact CD1-CD1 3.52Å; F550-L555 HydrophobicContact CD1-CG 3.9Å; F550-L555 HydrophobicContact CE1-CD1 3.36Å; F550-L555 HydrophobicContact CE1-CD2 3.72Å; F550-L555 HydrophobicContact CE1-CG 3.54Å; F550-L555 HydrophobicContact CZ-CD1 4.5Å; F550-L555 HydrophobicContact CZ-CD2 4.13Å; F550-L555 HydrophobicContact CZ-CG 4.29Å; F550-L555 PolarHBondContact O-N 2.96Å; F550-L555 VanDerWaalsContact O-N 3.07Å; V551-L555 HydrophobicContact CG2-CD1 4.18Å; V551-L555 WeakPolarHBondContact O-CB 3.18Å; V551-L555 PolarHBondContact O-N 3.2Å; L555-N557 PolarHBondContact O-N 3.5Å; L555-M558 PolarHBondContact O-N 3.21Å; L555-F559 WeakPolarHBondContact O-CD2 3.06Å; L555-F559 PolarHBondContact O-N 2.78Å
556	I	89.3	Confident	90.7	Very high	47 Å²	47	64.2 Å²	64.2	24%	0.241	33%	0.329	C	S	.	.	I	π-helix	trans	-63.6	-42.9	-176.7	-68.1	177.5	0	0	0	111.3	I523 V551 F552 M558 F559 I560	I523-I556 HydrophobicContact CG2-CD1 4.07Å; V551-I556 HydrophobicContact CG1-CD1 4.2Å; V551-I556 HydrophobicContact CG1-CG1 4.37Å; V551-I556 WeakPolarHBondContact O-CG1 3.38Å; V551-I556 PolarHBondContact O-N 3.46Å; F552-I556 HydrophobicContact CD1-CD1 3.68Å; F552-I556 HydrophobicContact CE1-CD1 4Å; F552-I556 HydrophobicContact CG-CD1 4.36Å; I556-M558 VanDerWaalsContact C-N 3.28Å; I556-M558 PolarHBondContact O-N 2.88Å; I556-F559 WeakPolarHBondContact O-CB 3.42Å; I556-F559 PolarHBondContact O-N 2.78Å; I556-I560 HydrophobicContact CG2-CD1 3.82Å; I556-I560 HydrophobicContact CG2-CG1 4.39Å; I556-I560 WeakPolarHBondContact O-CG1 3.4Å; I556-I560 PolarHBondContact O-N 3.19Å
557	N	89.6	Confident	90.5	Very high	87 Å²	87	65.2 Å²	65.2	47%	0.465	33%	0.326	S	S	.	.	H	α-helix	trans	-62.1	-37.2	177.8	-73.2	-28.7	0	0	0	112.1	F553 L555 I560 A561	F553-N557 PolarHBondContact O-ND2 3Å; L555-N557 PolarHBondContact O-N 3.5Å; N557-I560 PolarHBondContact O-N 3.03Å; N557-A561 WeakPolarHBondContact O-CB 3.45Å; N557-A561 PolarHBondContact O-N 3.34Å
558	M	89.6	Confident	90.3	Very high	81 Å²	81	68.2 Å²	68.2	40%	0.399	35%	0.347	S	S	.	.	H	α-helix	trans	-67.9	-41.7	174.4	-176.4	167.4	171.3	0	0	112.1	F483 V554 L555 I556 I560 A561 I562	F483-M558 HydrophobicContact CD1-CG 4.45Å; F483-M558 HydrophobicContact CD2-CE 3.32Å; F483-M558 HydrophobicContact CD2-CG 4.32Å; F483-M558 HydrophobicContact CD2-SD 3.67Å; F483-M558 HydrophobicContact CE1-CB 4.09Å; F483-M558 HydrophobicContact CE1-CG 4Å; F483-M558 HydrophobicContact CE1-SD 4.33Å; F483-M558 HydrophobicContact CE2-CB 4.39Å; F483-M558 HydrophobicContact CE2-CE 3.5Å; F483-M558 VanDerWaalsContact CE2-CE 3.5Å; F483-M558 HydrophobicContact CE2-CG 3.87Å; F483-M558 HydrophobicContact CE2-SD 3.12Å; F483-M558 WeakPolarHBondContact CE2-SD 3.25Å; F483-M558 HydrophobicContact CG-CE 4Å; F483-M558 HydrophobicContact CG-SD 4.48Å; F483-M558 HydrophobicContact CZ-CB 3.77Å; F483-M558 HydrophobicContact CZ-CE 4.27Å; F483-M558 HydrophobicContact CZ-CG 3.69Å; F483-M558 HydrophobicContact CZ-SD 3.52Å; F483-M558 VanDerWaalsContact CZ-SD 3.52Å; V554-M558 WeakPolarHBondContact O-CB 3.24Å; V554-M558 PolarHBondContact O-N 3.33Å; L555-M558 PolarHBondContact O-N 3.21Å; I556-M558 VanDerWaalsContact C-N 3.28Å; I556-M558 PolarHBondContact O-N 2.88Å; M558-I560 VanDerWaalsContact C-N 3.35Å; M558-I560 PolarHBondContact O-N 2.83Å; M558-A561 PolarHBondContact O-N 2.99Å; M558-I562 HydrophobicContact CE-CD1 4.32Å; M558-I562 HydrophobicContact CG-CD1 4.26Å; M558-I562 WeakPolarHBondContact O-CG1 3.47Å; M558-I562 PolarHBondContact O-N 3.47Å; M558-I562 VanDerWaalsContact O-N 3.1Å
559	F	91	Very high	90.2	Very high	45 Å²	45	69.4 Å²	69.4	20%	0.197	36%	0.357	C	S	.	.	H	α-helix	trans	-56.8	-47.3	172.9	-82.5	-63.7	0	0	0	111.9	L480 F483 F487 L555 I556 A561 I562 I563	L480-F559 HydrophobicContact CD1-CD1 3.23Å; L480-F559 HydrophobicContact CD1-CE1 3.33Å; L480-F559 HydrophobicContact CG-CE1 4.31Å; F483-F559 AromaticContact CD1-CD1 3.52Å; F483-F559 HydrophobicContact CD1-CD1 3.52Å; F483-F559 HydrophobicContact CD1-CD2 4.16Å; F483-F559 AromaticContact CD1-CE1 3.3Å; F483-F559 HydrophobicContact CD1-CE1 3.3Å; F483-F559 AromaticContact CD1-CE2 3.95Å; F483-F559 HydrophobicContact CD1-CE2 3.95Å; F483-F559 AromaticContact CD1-CG 3.95Å; F483-F559 HydrophobicContact CD1-CG 3.95Å; F483-F559 AromaticContact CD1-CZ 3.51Å; F483-F559 HydrophobicContact CD1-CZ 3.51Å; F483-F559 AromaticContact CE1-CD1 3.73Å; F483-F559 HydrophobicContact CE1-CD1 3.73Å; F483-F559 AromaticContact CE1-CD2 3.52Å; F483-F559 HydrophobicContact CE1-CD2 3.52Å; F483-F559 AromaticContact CE1-CE1 3.69Å; F483-F559 HydrophobicContact CE1-CE1 3.69Å; F483-F559 AromaticContact CE1-CE2 3.43Å; F483-F559 HydrophobicContact CE1-CE2 3.43Å; F483-F559 VanDerWaalsContact CE1-CE2 3.43Å; F483-F559 AromaticContact CE1-CG 3.65Å; F483-F559 HydrophobicContact CE1-CG 3.65Å; F483-F559 AromaticContact CE1-CZ 3.52Å; F483-F559 HydrophobicContact CE1-CZ 3.52Å; F483-F559 HydrophobicContact CG-CE1 4.44Å; F483-F559 HydrophobicContact CZ-CE2 4.39Å; F487-F559 HydrophobicContact CB-CE2 4.43Å; F487-F559 HydrophobicContact CB-CZ 4.17Å; F487-F559 HydrophobicContact CD2-CE2 4.04Å; F487-F559 HydrophobicContact CD2-CZ 4.48Å; F487-F559 HydrophobicContact CG-CE2 4.3Å; F487-F559 HydrophobicContact CG-CZ 4.28Å; L555-F559 WeakPolarHBondContact O-CD2 3.06Å; L555-F559 PolarHBondContact O-N 2.78Å; I556-F559 WeakPolarHBondContact O-CB 3.42Å; I556-F559 PolarHBondContact O-N 2.78Å; F559-A561 VanDerWaalsContact C-N 3.34Å; F559-A561 PolarHBondContact O-N 2.95Å; F559-I562 PolarHBondContact O-N 2.92Å; F559-I563 WeakPolarHBondContact O-CG1 3.45Å; F559-I563 PolarHBondContact O-N 3.23Å; F559-I563 VanDerWaalsContact O-N 3.14Å
560	I	91.9	Very high	90.1	Very high	98 Å²	98	63.9 Å²	63.9	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-40.1	179	-66.5	169.3	0	0	0	111	I556 N557 M558 I563 N564	I556-I560 HydrophobicContact CG2-CD1 3.82Å; I556-I560 HydrophobicContact CG2-CG1 4.39Å; I556-I560 WeakPolarHBondContact O-CG1 3.4Å; I556-I560 PolarHBondContact O-N 3.19Å; N557-I560 PolarHBondContact O-N 3.03Å; M558-I560 VanDerWaalsContact C-N 3.35Å; M558-I560 PolarHBondContact O-N 2.83Å; I560-I563 PolarHBondContact O-N 2.92Å; I560-N564 WeakPolarHBondContact O-CB 3.26Å; I560-N564 PolarHBondContact O-N 2.96Å
561	A	92.8	Very high	89.9	Confident	56 Å²	56	65.6 Å²	65.6	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-46.9	178.1	0	0	0	0	0	112.1	N557 M558 F559 I563 N564 E565	N557-A561 WeakPolarHBondContact O-CB 3.45Å; N557-A561 PolarHBondContact O-N 3.34Å; M558-A561 PolarHBondContact O-N 2.99Å; F559-A561 VanDerWaalsContact C-N 3.34Å; F559-A561 PolarHBondContact O-N 2.95Å; A561-I563 VanDerWaalsContact C-N 3.33Å; A561-I563 PolarHBondContact O-N 3.47Å; A561-N564 PolarHBondContact O-N 2.88Å; A561-E565 PolarHBondContact O-N 3.22Å
562	I	92.2	Very high	89.8	Confident	26 Å²	26	67.5 Å²	67.5	13%	0.133	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-43.3	177.4	-64.7	166.2	0	0	0	110.9	D479 F483 M558 F559 T566	D479-I562 HydrophobicContact CB-CG2 3.94Å; F483-I562 HydrophobicContact CB-CD1 3.99Å; F483-I562 HydrophobicContact CD1-CD1 4.11Å; F483-I562 HydrophobicContact CG-CD1 4.1Å; M558-I562 HydrophobicContact CE-CD1 4.32Å; M558-I562 HydrophobicContact CG-CD1 4.26Å; M558-I562 WeakPolarHBondContact O-CG1 3.47Å; M558-I562 PolarHBondContact O-N 3.47Å; M558-I562 VanDerWaalsContact O-N 3.1Å; F559-I562 PolarHBondContact O-N 2.92Å; I562-T566 WeakPolarHBondContact O-CG2 3.44Å; I562-T566 PolarHBondContact O-N 2.77Å; I562-T566 VanDerWaalsContact O-N 3.12Å; I562-T566 PolarHBondContact O-OG1 2.88Å
563	I	92.2	Very high	89.7	Confident	81 Å²	81	67.4 Å²	67.4	42%	0.415	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-40.6	178.3	-65.5	169.3	0	0	0	111	F559 I560 A561 T566 Y567	F559-I563 WeakPolarHBondContact O-CG1 3.45Å; F559-I563 PolarHBondContact O-N 3.23Å; F559-I563 VanDerWaalsContact O-N 3.14Å; I560-I563 PolarHBondContact O-N 2.92Å; A561-I563 VanDerWaalsContact C-N 3.33Å; A561-I563 PolarHBondContact O-N 3.47Å; I563-T566 WeakPolarHBondContact CA-OG1 3.49Å; I563-T566 PolarHBondContact O-OG1 3.33Å; I563-Y567 WeakPolarHBondContact O-CB 3.22Å; I563-Y567 PolarHBondContact O-N 2.72Å
564	N	92.2	Very high	89.2	Confident	100 Å²	100	61.8 Å²	61.8	54%	0.535	33%	0.333	S	S	.	.	H	α-helix	trans	-69.3	-37.9	-178.6	-169.8	37	0	0	0	112.7	I560 A561 S568	I560-N564 WeakPolarHBondContact O-CB 3.26Å; I560-N564 PolarHBondContact O-N 2.96Å; A561-N564 PolarHBondContact O-N 2.88Å; N564-S568 WeakPolarHBondContact O-CB 3.43Å; N564-S568 PolarHBondContact O-N 2.83Å; N564-S568 PolarHBondContact O-OG 3.18Å
565	E	93.4	Very high	88.8	Confident	147 Å²	147	65 Å²	65	69%	0.687	34%	0.343	S	S	*	.	H	α-helix	trans	-64.2	-50.5	175.3	-176.7	173.2	-177.8	0	0	111.2	A561 Y567 S568 S569	A561-E565 PolarHBondContact O-N 3.22Å; E565-Y567 PolarHBondContact O-N 2.68Å; E565-S568 PolarHBondContact O-N 3.02Å; E565-S569 PolarHBondContact O-N 2.88Å
566	T	89.9	Confident	88.4	Confident	16 Å²	16	71.8 Å²	71.8	10%	0.098	37%	0.372	C	S	.	.	H	α-helix	trans	-64	-39.6	178.7	51.2	0	0	0	0	112.4	C476 I562 I563 S568 S569 V570	C476-T566 HydrophobicContact CB-CG2 3.72Å; C476-T566 WeakPolarHBondContact CB-OG1 3.44Å; I562-T566 WeakPolarHBondContact O-CG2 3.44Å; I562-T566 PolarHBondContact O-N 2.77Å; I562-T566 VanDerWaalsContact O-N 3.12Å; I562-T566 PolarHBondContact O-OG1 2.88Å; I563-T566 WeakPolarHBondContact CA-OG1 3.49Å; I563-T566 PolarHBondContact O-OG1 3.33Å; T566-S568 VanDerWaalsContact C-N 3.34Å; T566-S568 PolarHBondContact O-N 3.15Å; T566-S569 PolarHBondContact O-N 2.92Å; T566-V570 WeakPolarHBondContact O-CB 3.46Å; T566-V570 WeakPolarHBondContact O-CG2 3.4Å; T566-V570 PolarHBondContact O-N 3.19Å
567	Y	90	Very high	87.4	Confident	94 Å²	94	74.6 Å²	74.6	37%	0.369	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-43.5	173.4	175.9	-101.8	0	0	0	112.2	Q468 T472 I563 E565 K571	Q468-Y567 HydrophobicContact CG-CE2 4.4Å; Q468-Y567 PolarHBondContact NE2-OH 2.88Å; T472-Y567 HydrophobicContact CG2-CD2 4.27Å; I563-Y567 WeakPolarHBondContact O-CB 3.22Å; I563-Y567 PolarHBondContact O-N 2.72Å; E565-Y567 PolarHBondContact O-N 2.68Å; Y567-K571 VanDerWaalsContact O-CB 3.28Å; Y567-K571 WeakPolarHBondContact O-CB 3.38Å; Y567-K571 PolarHBondContact O-N 3.49Å
568	S	90.1	Very high	86.1	Confident	63 Å²	63	76 Å²	76	44%	0.441	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-41.7	178.7	-61.1	0	0	0	0	111.7	N564 E565 T566 S572	N564-S568 WeakPolarHBondContact O-CB 3.43Å; N564-S568 PolarHBondContact O-N 2.83Å; N564-S568 PolarHBondContact O-OG 3.18Å; E565-S568 PolarHBondContact O-N 3.02Å; T566-S568 VanDerWaalsContact C-N 3.34Å; T566-S568 PolarHBondContact O-N 3.15Å; S568-S572 PolarHBondContact O-N 3.31Å; S568-S572 VanDerWaalsContact O-N 3.13Å
569	S	89.5	Confident	84.5	Confident	61 Å²	61	77 Å²	77	43%	0.427	41%	0.405	S	S	.	.	H	α-helix	trans	-61.7	-52.4	174.6	169.7	0	0	0	0	111.8	E565 T566 K571 S572 D573	E565-S569 PolarHBondContact O-N 2.88Å; T566-S569 PolarHBondContact O-N 2.92Å; S569-K571 VanDerWaalsContact C-N 3.33Å; S569-K571 PolarHBondContact O-N 2.96Å; S569-S572 WeakPolarHBondContact O-CB 3.36Å; S569-S572 PolarHBondContact O-N 2.68Å; S569-S572 VanDerWaalsContact O-N 3.09Å; S569-S572 PolarHBondContact O-OG 2.79Å; S569-D573 PolarHBondContact O-N 3.07Å; S569-D573 VanDerWaalsContact O-N 3.09Å
570	V	88.1	Confident	82.6	Confident	6 Å²	6	82.6 Å²	82.6	4%	0.036	43%	0.432	C	S	.	.	H	α-helix	trans	-63.3	-38.8	-178.8	168.6	0	0	0	0	112	Q468 T566 S572 D573 L574	Q468-V570 HydrophobicContact CG-CG1 4.41Å; T566-V570 WeakPolarHBondContact O-CB 3.46Å; T566-V570 WeakPolarHBondContact O-CG2 3.4Å; T566-V570 PolarHBondContact O-N 3.19Å; V570-S572 VanDerWaalsContact C-N 3.32Å; V570-S572 PolarHBondContact O-N 2.62Å; V570-D573 PolarHBondContact O-N 3.09Å; V570-L574 HydrophobicContact CG1-CD1 3.79Å; V570-L574 HydrophobicContact CG1-CG 4.39Å; V570-L574 WeakPolarHBondContact O-CG 3.43Å; V570-L574 PolarHBondContact O-N 3.32Å
571	K	86.8	Confident	80.7	Confident	92 Å²	92	80.1 Å²	80.1	40%	0.4	42%	0.418	S	S	.	.	H	α-helix	trans	-59.1	-45.2	174	-174.4	-178.2	174.1	-170.2	0	111.2	Y567 S569 D573 L574 E575	Y567-K571 VanDerWaalsContact O-CB 3.28Å; Y567-K571 WeakPolarHBondContact O-CB 3.38Å; Y567-K571 PolarHBondContact O-N 3.49Å; S569-K571 VanDerWaalsContact C-N 3.33Å; S569-K571 PolarHBondContact O-N 2.96Å; K571-D573 VanDerWaalsContact C-N 3.27Å; K571-D573 PolarHBondContact O-N 3.21Å; K571-L574 PolarHBondContact O-N 3.28Å; K571-E575 VanDerWaalsContact CE-OE1 3.29Å; K571-E575 WeakPolarHBondContact CE-OE1 3.28Å; K571-E575 WeakPolarHBondContact O-CG 3.2Å; K571-E575 PolarHBondContact O-N 2.75Å; K571-E575 VanDerWaalsContact O-N 3.13Å
572	S	86.9	Confident	78.7	Confident	43 Å²	43	83.1 Å²	83.1	30%	0.301	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-32.4	179	81.8	0	0	0	0	112.9	S568 S569 V570 K576	S568-S572 PolarHBondContact O-N 3.31Å; S568-S572 VanDerWaalsContact O-N 3.13Å; S569-S572 WeakPolarHBondContact O-CB 3.36Å; S569-S572 PolarHBondContact O-N 2.68Å; S569-S572 VanDerWaalsContact O-N 3.09Å; S569-S572 PolarHBondContact O-OG 2.79Å; V570-S572 VanDerWaalsContact C-N 3.32Å; V570-S572 PolarHBondContact O-N 2.62Å; S572-K576 WeakPolarHBondContact O-CE 3.22Å; S572-K576 WeakPolarHBondContact O-CG 3.04Å; S572-K576 PolarHBondContact O-N 3.25Å
573	D	85.1	Confident	76.8	Confident	70 Å²	70	85.1 Å²	85.1	37%	0.374	43%	0.432	S	S	.	.	H	α-helix	trans	-77.8	-35.9	179.1	-68.5	-22.9	0	0	0	112.3	S569 V570 K571 E575 K576 Q577	S569-D573 PolarHBondContact O-N 3.07Å; S569-D573 VanDerWaalsContact O-N 3.09Å; V570-D573 PolarHBondContact O-N 3.09Å; K571-D573 VanDerWaalsContact C-N 3.27Å; K571-D573 PolarHBondContact O-N 3.21Å; D573-E575 VanDerWaalsContact C-N 3.26Å; D573-E575 PolarHBondContact O-N 2.85Å; D573-K576 PolarHBondContact O-N 3.1Å; D573-K576 VanDerWaalsContact O-N 3.15Å; D573-K576 IonicContact OD1-NZ 3.49Å; D573-K576 PolarHBondContact OD1-NZ 3.15Å; D573-Q577 PolarHBondContact O-N 3Å; D573-Q577 VanDerWaalsContact O-N 3.14Å
574	L	78.9	Confident	75	Confident	13 Å²	13	88.2 Å²	88.2	7%	0.068	44%	0.442	C	S	.	.	H	α-helix	trans	-71.6	-17.6	173.6	-71.5	167.8	0	0	0	114	K464 Q468 V570 K571	K464-L574 PolarHBondContact NZ-O 2.68Å; Q468-L574 HydrophobicContact CB-CD1 3.47Å; Q468-L574 VanDerWaalsContact CB-CD1 3.47Å; Q468-L574 HydrophobicContact CG-CD1 3.6Å; V570-L574 HydrophobicContact CG1-CD1 3.79Å; V570-L574 HydrophobicContact CG1-CG 4.39Å; V570-L574 WeakPolarHBondContact O-CG 3.43Å; V570-L574 PolarHBondContact O-N 3.32Å; K571-L574 PolarHBondContact O-N 3.28Å
575	E	78.9	Confident	73.4	Confident	134 Å²	134	87.9 Å²	87.9	63%	0.626	44%	0.44	S	S	*	.	H	α-helix	trans	-79.4	-29.3	169.5	-75.2	174.7	-174	0	0	111.8	K571 D573	K571-E575 VanDerWaalsContact CE-OE1 3.29Å; K571-E575 WeakPolarHBondContact CE-OE1 3.28Å; K571-E575 WeakPolarHBondContact O-CG 3.2Å; K571-E575 PolarHBondContact O-N 2.75Å; K571-E575 VanDerWaalsContact O-N 3.13Å; D573-E575 VanDerWaalsContact C-N 3.26Å; D573-E575 PolarHBondContact O-N 2.85Å
576	K	79	Confident	71.6	Confident	148 Å²	148	85.6 Å²	85.6	64%	0.643	43%	0.428	S	S	*	.	H	α-helix	trans	-80.5	-27.5	177.5	-65.4	167	-158.4	154.9	0	113.3	S572 D573	S572-K576 WeakPolarHBondContact O-CE 3.22Å; S572-K576 WeakPolarHBondContact O-CG 3.04Å; S572-K576 PolarHBondContact O-N 3.25Å; D573-K576 PolarHBondContact O-N 3.1Å; D573-K576 VanDerWaalsContact O-N 3.15Å; D573-K576 IonicContact OD1-NZ 3.49Å; D573-K576 PolarHBondContact OD1-NZ 3.15Å
577	Q	67.7	Low	70	Confident	106 Å²	106	90.1 Å²	90.1	50%	0.495	45%	0.451	S	S	.	.	S	Bend	trans	-68.8	133	178.3	-73.5	178.5	-8.2	0	0	110.5	D573	D573-Q577 PolarHBondContact O-N 3Å; D573-Q577 VanDerWaalsContact O-N 3.14Å
578	P	61.9	Low	68.7	Low	116 Å²	116	92 Å²	92	75%	0.753	46%	0.461	S	S	*	.			trans	-56.9	144.2	169.7	26.3	-32.7	0	0	0	108.4	E580	P578-E580 VanDerWaalsContact C-N 3.27Å; P578-E580 PolarHBondContact O-N 3.17Å
579	N	57.2	Low	67.7	Low	102 Å²	102	92.5 Å²	92.5	55%	0.545	46%	0.459	S	S	.	.			trans	-59.5	86.6	-177.1	-83	-20.3	0	0	0	111	F581	N579-F581 PolarHBondContact O-N 3.31Å; N579-F581 VanDerWaalsContact O-N 3.12Å
580	E	49.7	Very low	66.4	Low	162 Å²	162	95.2 Å²	95.2	76%	0.757	46%	0.46	S	S	*	.			trans	-66.3	-8.7	172	-148.6	-178.8	-176.3	0	0	111.2	P578 E582	P578-E580 VanDerWaalsContact C-N 3.27Å; P578-E580 PolarHBondContact O-N 3.17Å; E580-E582 PolarHBondContact O-N 3.08Å
581	F	52.2	Low	65.2	Low	46 Å²	46	98.6 Å²	98.6	20%	0.202	48%	0.476	C	S	.	.			trans	-77.7	37.7	178.1	-73.5	-74.7	0	0	0	114.1	F462 K464 T467 N579 M583 K584	F462-F581 VanDerWaalsContact C-CE1 3.47Å; F462-F581 WeakPolarHBondContact O-CD1 3.42Å; F462-F581 WeakPolarHBondContact O-CE1 3.35Å; K464-F581 VanDerWaalsContact CA-CZ 3.45Å; K464-F581 HydrophobicContact CB-CD2 3.83Å; K464-F581 HydrophobicContact CB-CE2 3.73Å; K464-F581 HydrophobicContact CB-CG 4.29Å; K464-F581 HydrophobicContact CB-CZ 4.12Å; K464-F581 HydrophobicContact CD-CD2 4.43Å; K464-F581 HydrophobicContact CG-CD2 4.13Å; K464-F581 HydrophobicContact CG-CE2 3.91Å; T467-F581 HydrophobicContact CG2-CZ 4.26Å; N579-F581 PolarHBondContact O-N 3.31Å; N579-F581 VanDerWaalsContact O-N 3.12Å; F581-M583 PolarHBondContact O-N 3.43Å; F581-K584 PolarHBondContact O-N 2.86Å; F581-K584 VanDerWaalsContact O-N 3.12Å
582	E	51.7	Low	64.6	Low	119 Å²	119	101.7 Å²	101.7	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-44.7	-30.6	172.4	-67.1	-179	164.9	0	0	112.1	H95 E580 F586	H95-E582 IonicContact CE1-OE2 3.68Å; H95-E582 PolarHBondContact CE1-OE2 3.43Å; E580-E582 PolarHBondContact O-N 3.08Å; E582-F586 WeakPolarHBondContact O-CA 3.34Å; E582-F586 WeakPolarHBondContact O-CB 3.45Å; E582-F586 PolarHBondContact O-N 2.94Å
583	M	52.1	Low	64.1	Low	68 Å²	68	102.7 Å²	102.7	34%	0.335	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-39.9	-178.9	-107.4	-173.3	-170.6	0	0	115.1	I102 F462 F581 L587	I102-M583 HydrophobicContact CD1-CE 3.78Å; I102-M583 HydrophobicContact CG2-CE 4.34Å; F462-M583 HydrophobicContact CD1-SD 3.53Å; F462-M583 VanDerWaalsContact CD1-SD 3.53Å; F462-M583 HydrophobicContact CE1-CE 4.28Å; F462-M583 HydrophobicContact CE1-SD 3.77Å; F462-M583 HydrophobicContact CG-SD 4.11Å; F581-M583 PolarHBondContact O-N 3.43Å; M583-L587 VanDerWaalsContact O-CB 3.28Å; M583-L587 WeakPolarHBondContact O-CB 3.24Å; M583-L587 PolarHBondContact O-N 3.42Å
584	K	53.7	Low	63.4	Low	147 Å²	147	103.7 Å²	103.7	64%	0.639	49%	0.491	S	S	*	.	H	α-helix	trans	-72.9	-44.5	-179.4	-177.9	-178.4	177.3	-178.7	0	110.2	F581 F586 L587 K588	F581-K584 PolarHBondContact O-N 2.86Å; F581-K584 VanDerWaalsContact O-N 3.12Å; K584-F586 VanDerWaalsContact C-N 3.28Å; K584-F586 PolarHBondContact O-N 3.31Å; K584-L587 PolarHBondContact O-N 3.13Å; K584-K588 WeakPolarHBondContact O-CB 3.49Å; K584-K588 PolarHBondContact O-N 3.03Å
585	D	58.7	Low	63.3	Low	92 Å²	92	103.7 Å²	103.7	49%	0.492	49%	0.491	S	S	.	.	H	α-helix	trans	-66.7	-34.2	177.1	-70.3	-24.8	0	0	0	110.7	D589	D585-D589 WeakPolarHBondContact O-CA 3.5Å; D585-D589 WeakPolarHBondContact O-CB 3.3Å; D585-D589 PolarHBondContact O-N 3.3Å
586	F	55.8	Low	63.3	Low	100 Å²	100	101.5 Å²	101.5	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-72	-39.4	172.3	-174.7	-92.2	0	0	0	113.2	E582 K584 K588 D589 R590	E582-F586 WeakPolarHBondContact O-CA 3.34Å; E582-F586 WeakPolarHBondContact O-CB 3.45Å; E582-F586 PolarHBondContact O-N 2.94Å; K584-F586 VanDerWaalsContact C-N 3.28Å; K584-F586 PolarHBondContact O-N 3.31Å; F586-K588 VanDerWaalsContact C-N 3.32Å; F586-D589 PolarHBondContact O-N 2.94Å; F586-R590 WeakPolarHBondContact O-CB 3.24Å; F586-R590 PolarHBondContact O-N 3.49Å
587	L	56.7	Low	63.2	Low	110 Å²	110	101.5 Å²	101.5	58%	0.576	48%	0.481	S	S	*	.	H	α-helix	trans	-62.9	-44.7	172.5	-112.2	157.2	0	0	0	109.7	M583 K584 R590 M591	M583-L587 VanDerWaalsContact O-CB 3.28Å; M583-L587 WeakPolarHBondContact O-CB 3.24Å; M583-L587 PolarHBondContact O-N 3.42Å; K584-L587 PolarHBondContact O-N 3.13Å; L587-R590 CarbonylContact O-C 3.59Å; L587-R590 PolarHBondContact O-N 2.96Å; L587-M591 HydrophobicContact CD2-CG 4.48Å; L587-M591 WeakPolarHBondContact O-CB 3.48Å; L587-M591 WeakPolarHBondContact O-CG 3.25Å; L587-M591 PolarHBondContact O-N 2.95Å
588	K	61.3	Low	63.8	Low	133 Å²	133	97.2 Å²	97.2	58%	0.578	46%	0.461	S	S	*	.	H	α-helix	trans	-63.3	-44.6	175.8	-170.7	175.4	-176.5	178.3	0	111	K584 F586 R590 M591 R592	K584-K588 WeakPolarHBondContact O-CB 3.49Å; K584-K588 PolarHBondContact O-N 3.03Å; F586-K588 VanDerWaalsContact C-N 3.32Å; K588-R590 VanDerWaalsContact C-N 3.3Å; K588-R590 PolarHBondContact O-N 3.45Å; K588-M591 PolarHBondContact O-N 3.16Å; K588-R592 WeakPolarHBondContact O-CB 3.3Å; K588-R592 PolarHBondContact O-N 3.01Å
589	D	69.2	Low	64.6	Low	74 Å²	74	96.4 Å²	96.4	40%	0.396	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-37.2	176	-170.4	64	0	0	0	110.9	D585 F586 R592 N593	D585-D589 WeakPolarHBondContact O-CA 3.5Å; D585-D589 WeakPolarHBondContact O-CB 3.3Å; D585-D589 PolarHBondContact O-N 3.3Å; F586-D589 PolarHBondContact O-N 2.94Å; D589-R592 CarbonylContact O-C 3.53Å; D589-R592 WeakPolarHBondContact O-CB 3.46Å; D589-R592 PolarHBondContact O-N 3.43Å; D589-N593 VanDerWaalsContact O-CB 3.23Å; D589-N593 WeakPolarHBondContact O-CB 3.31Å; D589-N593 PolarHBondContact O-N 3.35Å; D589-N593 PolarHBondContact O-ND2 3.45Å; D589-N593 PolarHBondContact OD2-ND2 3.08Å
590	R	63.3	Low	65.7	Low	119 Å²	119	96.2 Å²	96.2	45%	0.449	44%	0.444	S	S	.	.	H	α-helix	trans	-75.1	-38.9	176.9	-169.9	157	-176.7	-109.5	1.1	113.2	R99 F586 L587 K588 R592 N593 M594	R99-R590 VanDerWaalsContact NH1-NH1 3.19Å; F586-R590 WeakPolarHBondContact O-CB 3.24Å; F586-R590 PolarHBondContact O-N 3.49Å; L587-R590 CarbonylContact O-C 3.59Å; L587-R590 PolarHBondContact O-N 2.96Å; K588-R590 VanDerWaalsContact C-N 3.3Å; K588-R590 PolarHBondContact O-N 3.45Å; R590-R592 VanDerWaalsContact C-N 3.27Å; R590-N593 PolarHBondContact O-N 3.34Å; R590-M594 VanDerWaalsContact O-CB 3.3Å; R590-M594 WeakPolarHBondContact O-CB 3.33Å; R590-M594 PolarHBondContact O-N 2.67Å
591	M	63.1	Low	67.1	Low	76 Å²	76	94.6 Å²	94.6	37%	0.374	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-41	170.1	-69.8	-143	-52.8	0	0	109.4	L587 K588 M594 L595	L587-M591 HydrophobicContact CD2-CG 4.48Å; L587-M591 WeakPolarHBondContact O-CB 3.48Å; L587-M591 WeakPolarHBondContact O-CG 3.25Å; L587-M591 PolarHBondContact O-N 2.95Å; K588-M591 PolarHBondContact O-N 3.16Å; M591-M594 PolarHBondContact O-N 3.33Å; M591-L595 VanDerWaalsContact O-CB 3.28Å; M591-L595 WeakPolarHBondContact O-CB 3.44Å; M591-L595 PolarHBondContact O-N 3.01Å
592	R	73.2	Confident	68.5	Low	157 Å²	157	95.3 Å²	95.3	59%	0.592	44%	0.437	S	S	*	.	H	α-helix	trans	-62.9	-46.7	173.8	-166.2	-177.6	-153.4	179.7	4.8	111.7	K588 D589 R590 M594 L595 E596	K588-R592 WeakPolarHBondContact O-CB 3.3Å; K588-R592 PolarHBondContact O-N 3.01Å; D589-R592 CarbonylContact O-C 3.53Å; D589-R592 WeakPolarHBondContact O-CB 3.46Å; D589-R592 PolarHBondContact O-N 3.43Å; R590-R592 VanDerWaalsContact C-N 3.27Å; R592-M594 VanDerWaalsContact C-N 3.29Å; R592-M594 PolarHBondContact O-N 3.39Å; R592-L595 CarbonylContact O-C 3.48Å; R592-L595 WeakPolarHBondContact O-CB 3.34Å; R592-L595 PolarHBondContact O-N 3.25Å; R592-E596 VanDerWaalsContact O-CB 3.28Å; R592-E596 WeakPolarHBondContact O-CB 3.29Å; R592-E596 VanDerWaalsContact O-CG 3.28Å; R592-E596 WeakPolarHBondContact O-CG 3.45Å; R592-E596 PolarHBondContact O-N 3.42Å
593	N	76.6	Confident	70	Confident	65 Å²	65	96 Å²	96	35%	0.348	44%	0.438	S	S	.	.	H	α-helix	trans	-63.6	-34.8	175.8	-73.7	-34.5	0	0	0	111.6	D589 R590 K597	D589-N593 VanDerWaalsContact O-CB 3.23Å; D589-N593 WeakPolarHBondContact O-CB 3.31Å; D589-N593 PolarHBondContact O-N 3.35Å; D589-N593 PolarHBondContact O-ND2 3.45Å; D589-N593 PolarHBondContact OD2-ND2 3.08Å; R590-N593 PolarHBondContact O-N 3.34Å; N593-K597 WeakPolarHBondContact O-CB 3.13Å; N593-K597 VanDerWaalsContact O-CG 3.23Å; N593-K597 WeakPolarHBondContact O-CG 3.38Å; N593-K597 PolarHBondContact O-N 2.95Å
594	M	71.2	Confident	71.2	Confident	91 Å²	91	97.1 Å²	97.1	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-70.4	-47.5	174.1	-165.7	-134.7	-59.2	0	0	111.1	R590 M591 R592 E596 K597 L598	R590-M594 VanDerWaalsContact O-CB 3.3Å; R590-M594 WeakPolarHBondContact O-CB 3.33Å; R590-M594 PolarHBondContact O-N 2.67Å; M591-M594 PolarHBondContact O-N 3.33Å; R592-M594 VanDerWaalsContact C-N 3.29Å; R592-M594 PolarHBondContact O-N 3.39Å; M594-E596 VanDerWaalsContact C-N 3.29Å; M594-E596 PolarHBondContact O-N 3.04Å; M594-K597 WeakPolarHBondContact O-CB 3.29Å; M594-K597 PolarHBondContact O-N 3.37Å; M594-K597 VanDerWaalsContact O-N 3.17Å; M594-L598 WeakPolarHBondContact O-CG 3.38Å; M594-L598 PolarHBondContact O-N 2.95Å; M594-L598 HydrophobicContact SD-CD1 4.22Å
595	L	75.7	Confident	72.4	Confident	13 Å²	13	90.8 Å²	90.8	7%	0.068	41%	0.412	C	S	.	.	H	α-helix	trans	-57.5	-41.2	172.3	-92.5	155	0	0	0	111.3	M591 R592 L598 K599 L680 E683 E684	M591-L595 VanDerWaalsContact O-CB 3.28Å; M591-L595 WeakPolarHBondContact O-CB 3.44Å; M591-L595 PolarHBondContact O-N 3.01Å; R592-L595 CarbonylContact O-C 3.48Å; R592-L595 WeakPolarHBondContact O-CB 3.34Å; R592-L595 PolarHBondContact O-N 3.25Å; L595-L598 PolarHBondContact O-N 3.15Å; L595-K599 VanDerWaalsContact O-CB 3.29Å; L595-K599 WeakPolarHBondContact O-CB 3.41Å; L595-K599 WeakPolarHBondContact O-CG 3.44Å; L595-K599 PolarHBondContact O-N 3.41Å; L595-L680 HydrophobicContact CD2-CD2 3.79Å; L595-E683 HydrophobicContact CD2-CB 4.19Å; L595-E684 HydrophobicContact CD2-CG 4.4Å
596	E	79.1	Confident	73.5	Confident	87 Å²	87	89.2 Å²	89.2	41%	0.407	40%	0.402	S	S	.	.	H	α-helix	trans	-65.9	-44.6	175.1	-79.8	179.8	-166.6	0	0	110.8	R592 M594 L598 K599 I600	R592-E596 VanDerWaalsContact O-CB 3.28Å; R592-E596 WeakPolarHBondContact O-CB 3.29Å; R592-E596 VanDerWaalsContact O-CG 3.28Å; R592-E596 WeakPolarHBondContact O-CG 3.45Å; R592-E596 PolarHBondContact O-N 3.42Å; M594-E596 VanDerWaalsContact C-N 3.29Å; M594-E596 PolarHBondContact O-N 3.04Å; E596-L598 VanDerWaalsContact C-N 3.31Å; E596-L598 PolarHBondContact O-N 3.47Å; E596-K599 CarbonylContact O-C 3.48Å; E596-K599 PolarHBondContact O-N 3.15Å; E596-I600 WeakPolarHBondContact O-CB 3.22Å; E596-I600 WeakPolarHBondContact O-CD1 3.22Å; E596-I600 WeakPolarHBondContact O-CG1 3.3Å; E596-I600 PolarHBondContact O-N 3.36Å
597	K	78.2	Confident	74.7	Confident	148 Å²	148	86.6 Å²	86.6	64%	0.643	39%	0.392	S	S	*	.	H	α-helix	trans	-59.6	-40.8	173.1	-78.2	176	-178	-174	0	112	N593 M594 K601	N593-K597 WeakPolarHBondContact O-CB 3.13Å; N593-K597 VanDerWaalsContact O-CG 3.23Å; N593-K597 WeakPolarHBondContact O-CG 3.38Å; N593-K597 PolarHBondContact O-N 2.95Å; M594-K597 WeakPolarHBondContact O-CB 3.29Å; M594-K597 PolarHBondContact O-N 3.37Å; M594-K597 VanDerWaalsContact O-N 3.17Å; K597-K601 WeakPolarHBondContact O-CB 3.43Å; K597-K601 WeakPolarHBondContact O-CG 3.46Å; K597-K601 PolarHBondContact O-N 2.89Å
598	L	78.4	Confident	75.7	Confident	17 Å²	17	82 Å²	82	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-67	-45.4	174.6	-68.9	174.3	0	0	0	111	M594 L595 E596 I600 K601 K602 L676 L680	M594-L598 WeakPolarHBondContact O-CG 3.38Å; M594-L598 PolarHBondContact O-N 2.95Å; M594-L598 HydrophobicContact SD-CD1 4.22Å; L595-L598 PolarHBondContact O-N 3.15Å; E596-L598 VanDerWaalsContact C-N 3.31Å; E596-L598 PolarHBondContact O-N 3.47Å; L598-I600 VanDerWaalsContact C-N 3.33Å; L598-I600 PolarHBondContact O-N 3.44Å; L598-K601 WeakPolarHBondContact O-CB 3.46Å; L598-K601 PolarHBondContact O-N 3.17Å; L598-K602 PolarHBondContact O-N 3.22Å; L598-L676 HydrophobicContact CB-CD2 4.22Å; L598-L676 HydrophobicContact CD2-CD1 4.45Å; L598-L676 HydrophobicContact CD2-CG 4.34Å; L598-L676 WeakPolarHBondContact O-CD2 3.48Å; L598-L680 HydrophobicContact CB-CD2 3.76Å; L598-L680 HydrophobicContact CB-CG 4.33Å; L598-L680 HydrophobicContact CD1-CD2 4.41Å
599	K	80.1	Confident	76.5	Confident	99 Å²	99	77.1 Å²	77.1	43%	0.43	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-40	175.6	-76.3	174.7	-178.8	-173.4	0	112	L595 E596 K602 K603 L680 E684	L595-K599 VanDerWaalsContact O-CB 3.29Å; L595-K599 WeakPolarHBondContact O-CB 3.41Å; L595-K599 WeakPolarHBondContact O-CG 3.44Å; L595-K599 PolarHBondContact O-N 3.41Å; E596-K599 CarbonylContact O-C 3.48Å; E596-K599 PolarHBondContact O-N 3.15Å; K599-K602 WeakPolarHBondContact O-CB 3.42Å; K599-K602 PolarHBondContact O-N 3.3Å; K599-K603 WeakPolarHBondContact O-CB 3.5Å; K599-K603 PolarHBondContact O-N 3.48Å; K599-L680 HydrophobicContact CG-CD2 4.1Å; K599-E684 VanDerWaalsContact CE-OE1 3.22Å; K599-E684 WeakPolarHBondContact CE-OE1 3.28Å; K599-E684 IonicContact NZ-OE1 3.33Å; K599-E684 PolarHBondContact NZ-OE1 3.2Å
600	I	80.8	Confident	76.9	Confident	98 Å²	98	77 Å²	77	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-48.3	173.9	-68.7	162.9	0	0	0	109.7	E596 L598 K602 K603 R604	E596-I600 WeakPolarHBondContact O-CB 3.22Å; E596-I600 WeakPolarHBondContact O-CD1 3.22Å; E596-I600 WeakPolarHBondContact O-CG1 3.3Å; E596-I600 PolarHBondContact O-N 3.36Å; L598-I600 VanDerWaalsContact C-N 3.33Å; L598-I600 PolarHBondContact O-N 3.44Å; I600-K602 VanDerWaalsContact C-N 3.33Å; I600-K602 PolarHBondContact O-N 3.2Å; I600-K603 PolarHBondContact O-N 3.48Å; I600-R604 HydrophobicContact CG2-CG 4.31Å; I600-R604 WeakPolarHBondContact O-CG 3.47Å; I600-R604 PolarHBondContact O-N 2.87Å
601	K	79.1	Confident	77.4	Confident	127 Å²	127	71.4 Å²	71.4	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-56.2	-45.1	175	-79.5	-176.2	175.4	-172.9	0	111.9	K597 L598 R604 I605 L676	K597-K601 WeakPolarHBondContact O-CB 3.43Å; K597-K601 WeakPolarHBondContact O-CG 3.46Å; K597-K601 PolarHBondContact O-N 2.89Å; L598-K601 WeakPolarHBondContact O-CB 3.46Å; L598-K601 PolarHBondContact O-N 3.17Å; K601-R604 PolarHBondContact O-N 3.48Å; K601-I605 WeakPolarHBondContact O-CG1 3.31Å; K601-I605 PolarHBondContact O-N 3.03Å; K601-L676 HydrophobicContact CB-CD1 3.84Å; K601-L676 HydrophobicContact CD-CD1 4.32Å
602	K	81.2	Confident	77.9	Confident	62 Å²	62	67.8 Å²	67.8	27%	0.27	31%	0.308	S	S	.	.	H	α-helix	trans	-56.8	-51.1	174	-173.7	-179	172.3	-176	0	111.6	L598 K599 I600 R604 I605 E606 L676 V677 L680	L598-K602 PolarHBondContact O-N 3.22Å; K599-K602 WeakPolarHBondContact O-CB 3.42Å; K599-K602 PolarHBondContact O-N 3.3Å; I600-K602 VanDerWaalsContact C-N 3.33Å; I600-K602 PolarHBondContact O-N 3.2Å; K602-R604 VanDerWaalsContact C-N 3.32Å; K602-R604 PolarHBondContact O-N 2.79Å; K602-I605 PolarHBondContact O-N 3.28Å; K602-E606 WeakPolarHBondContact O-CG 3.39Å; K602-E606 PolarHBondContact O-N 2.96Å; K602-L676 HydrophobicContact CB-CD2 3.73Å; K602-V677 HydrophobicContact CD-CG2 4.21Å; K602-L680 HydrophobicContact CB-CD1 4.4Å; K602-L680 HydrophobicContact CD-CD1 3.73Å
603	K	82.1	Confident	77.7	Confident	133 Å²	133	66.6 Å²	66.6	58%	0.578	31%	0.309	S	S	*	.	H	α-helix	trans	-64.4	-35.5	-178.7	-167.8	174.9	-176.3	178.8	0	112.2	K599 I600 E606 N607	K599-K603 WeakPolarHBondContact O-CB 3.5Å; K599-K603 PolarHBondContact O-N 3.48Å; I600-K603 PolarHBondContact O-N 3.48Å; K603-E606 PolarHBondContact O-N 3.17Å; K603-N607 WeakPolarHBondContact O-CB 3.4Å; K603-N607 VanDerWaalsContact O-CG 3.26Å; K603-N607 PolarHBondContact O-N 2.79Å
604	R	78.1	Confident	77.4	Confident	91 Å²	91	68.4 Å²	68.4	34%	0.343	32%	0.318	S	S	.	.	H	α-helix	trans	-63.9	-45.3	173.1	-69.6	-168.8	82.4	174.3	9.6	111.4	I600 K601 K602 E606 N607 I608 F637 E641	I600-R604 HydrophobicContact CG2-CG 4.31Å; I600-R604 WeakPolarHBondContact O-CG 3.47Å; I600-R604 PolarHBondContact O-N 2.87Å; K601-R604 PolarHBondContact O-N 3.48Å; K602-R604 VanDerWaalsContact C-N 3.32Å; K602-R604 PolarHBondContact O-N 2.79Å; R604-E606 VanDerWaalsContact C-N 3.35Å; R604-E606 PolarHBondContact O-N 2.84Å; R604-N607 WeakPolarHBondContact O-CB 3.33Å; R604-N607 PolarHBondContact O-N 3.16Å; R604-I608 WeakPolarHBondContact O-CG1 3.19Å; R604-I608 PolarHBondContact O-N 2.93Å; R604-F637 HydrophobicContact CB-CE1 4.46Å; R604-F637 HydrophobicContact CB-CZ 4.18Å; R604-F637 VanDerWaalsContact NH2-CD1 3.27Å; R604-E641 IonicContact CZ-OE1 2.64Å; R604-E641 IonicContact CZ-OE2 2.66Å; R604-E641 IonicContact NH1-OE1 2.69Å; R604-E641 PolarHBondContact NH1-OE1 3.47Å; R604-E641 IonicContact NH2-OE1 3.09Å; R604-E641 PolarHBondContact NH2-OE1 3.04Å; R604-E641 IonicContact NH2-OE2 3.4Å; R604-E641 PolarHBondContact NH2-OE2 2.88Å
605	I	79.5	Confident	77	Confident	15 Å²	15	64.1 Å²	64.1	8%	0.077	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-43.7	175.5	-67.3	166.9	0	0	0	111.1	K601 K602 N607 I608 Q609 L669 Q672 K673	K601-I605 WeakPolarHBondContact O-CG1 3.31Å; K601-I605 PolarHBondContact O-N 3.03Å; K602-I605 PolarHBondContact O-N 3.28Å; I605-N607 VanDerWaalsContact C-N 3.33Å; I605-N607 PolarHBondContact O-N 3.44Å; I605-I608 PolarHBondContact O-N 3.23Å; I605-Q609 WeakPolarHBondContact O-CG 3.23Å; I605-Q609 PolarHBondContact O-N 2.84Å; I605-L669 HydrophobicContact CG2-CB 4.23Å; I605-L669 HydrophobicContact CG2-CD2 4.15Å; I605-Q672 HydrophobicContact CD1-CB 3.97Å; I605-K673 HydrophobicContact CG2-CB 4.07Å
606	E	80.3	Confident	76.5	Confident	59 Å²	59	66 Å²	66	28%	0.276	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-38.7	175.6	-73.8	-179.6	165.9	0	0	112.6	K602 K603 R604 I608 Q609 N610 K673	K602-E606 WeakPolarHBondContact O-CG 3.39Å; K602-E606 PolarHBondContact O-N 2.96Å; K603-E606 PolarHBondContact O-N 3.17Å; R604-E606 VanDerWaalsContact C-N 3.35Å; R604-E606 PolarHBondContact O-N 2.84Å; E606-I608 VanDerWaalsContact C-N 3.33Å; E606-I608 PolarHBondContact O-N 2.77Å; E606-Q609 PolarHBondContact O-N 3.29Å; E606-N610 WeakPolarHBondContact O-CB 3.29Å; E606-N610 VanDerWaalsContact O-CG 3.27Å; E606-N610 PolarHBondContact O-N 3.43Å; E606-N610 PolarHBondContact O-ND2 3.44Å; E606-K673 HydrophobicContact CG-CD 4.36Å; E606-K673 WeakPolarHBondContact OE1-CE 3.22Å; E606-K673 IonicContact OE1-NZ 3.83Å; E606-K673 PolarHBondContact OE1-NZ 3.09Å; E606-K673 VanDerWaalsContact OE1-NZ 3.1Å
607	N	81.2	Confident	75.5	Confident	45 Å²	45	70.1 Å²	70.1	24%	0.241	32%	0.324	C	S	.	.	H	α-helix	trans	-64.1	-38.4	175.7	-79.1	-16.4	0	0	0	112.3	K603 R604 I605 A611 K635 F637	K603-N607 WeakPolarHBondContact O-CB 3.4Å; K603-N607 VanDerWaalsContact O-CG 3.26Å; K603-N607 PolarHBondContact O-N 2.79Å; R604-N607 WeakPolarHBondContact O-CB 3.33Å; R604-N607 PolarHBondContact O-N 3.16Å; I605-N607 VanDerWaalsContact C-N 3.33Å; I605-N607 PolarHBondContact O-N 3.44Å; N607-A611 VanDerWaalsContact O-CB 3.25Å; N607-A611 WeakPolarHBondContact O-CB 2.9Å; N607-A611 PolarHBondContact O-N 3.32Å; N607-K635 HydrophobicContact CB-CD 3.81Å; N607-K635 WeakPolarHBondContact O-CD 3.31Å; N607-K635 PolarHBondContact O-NZ 3.07Å; N607-F637 HydrophobicContact CB-CE2 3.97Å; N607-F637 HydrophobicContact CB-CZ 4.32Å
608	I	77.8	Confident	74.8	Confident	14 Å²	14	66.2 Å²	66.2	7%	0.072	31%	0.311	C	S	.	.	H	α-helix	trans	-65.8	-49.2	174.8	-62.9	166.5	0	0	0	110	R604 I605 E606 N610 A611 I612 L632 F637 V645 L669	R604-I608 WeakPolarHBondContact O-CG1 3.19Å; R604-I608 PolarHBondContact O-N 2.93Å; I605-I608 PolarHBondContact O-N 3.23Å; E606-I608 VanDerWaalsContact C-N 3.33Å; E606-I608 PolarHBondContact O-N 2.77Å; I608-N610 PolarHBondContact O-N 2.99Å; I608-A611 WeakPolarHBondContact O-CB 3.42Å; I608-A611 PolarHBondContact O-N 3.11Å; I608-I612 HydrophobicContact CG2-CD1 3.75Å; I608-I612 HydrophobicContact CG2-CG1 4.4Å; I608-I612 VanDerWaalsContact O-CG1 3.32Å; I608-I612 WeakPolarHBondContact O-CG1 3.1Å; I608-I612 PolarHBondContact O-N 2.89Å; I608-L632 HydrophobicContact CB-CD2 4.42Å; I608-L632 HydrophobicContact CG1-CD2 4.04Å; I608-F637 HydrophobicContact CD1-CE1 3.84Å; I608-F637 HydrophobicContact CD1-CZ 3.95Å; I608-F637 HydrophobicContact CG1-CE1 3.83Å; I608-F637 HydrophobicContact CG1-CE2 4.16Å; I608-F637 HydrophobicContact CG1-CZ 3.49Å; I608-F637 VanDerWaalsContact CG1-CZ 3.49Å; I608-V645 HydrophobicContact CG2-CG1 4.49Å; I608-L669 HydrophobicContact CB-CD1 4.32Å; I608-L669 HydrophobicContact CG2-CD1 3.57Å; I608-L669 HydrophobicContact CG2-CD2 4.31Å
609	Q	78.2	Confident	74	Confident	30 Å²	30	74.3 Å²	74.3	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-54.6	-52.2	176.3	-73.8	-179.1	-22.7	0	0	111.7	I605 E606 A611 I612 E613 L669	I605-Q609 WeakPolarHBondContact O-CG 3.23Å; I605-Q609 PolarHBondContact O-N 2.84Å; E606-Q609 PolarHBondContact O-N 3.29Å; Q609-A611 PolarHBondContact O-N 2.68Å; Q609-I612 PolarHBondContact O-N 3.1Å; Q609-E613 PolarHBondContact O-N 3.19Å; Q609-L669 HydrophobicContact CG-CB 4.11Å; Q609-L669 HydrophobicContact CG-CD1 4.15Å
610	N	77.4	Confident	73.5	Confident	72 Å²	72	73.3 Å²	73.3	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-27.6	178.4	-72.7	-13.9	0	0	0	112.7	E606 I608 L614 K635	E606-N610 WeakPolarHBondContact O-CB 3.29Å; E606-N610 VanDerWaalsContact O-CG 3.27Å; E606-N610 PolarHBondContact O-N 3.43Å; E606-N610 PolarHBondContact O-ND2 3.44Å; I608-N610 PolarHBondContact O-N 2.99Å; N610-L614 WeakPolarHBondContact O-CB 3.3Å; N610-L614 WeakPolarHBondContact O-CD1 3.48Å; N610-L614 VanDerWaalsContact O-CG 3.23Å; N610-L614 WeakPolarHBondContact O-CG 3.45Å; N610-L614 PolarHBondContact O-N 3.32Å; N610-K635 VanDerWaalsContact C-NZ 3.29Å
611	A	74.8	Confident	72.8	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-74.3	-41	176.7	0	0	0	0	0	110.5	N607 I608 Q609 E613 L614 A615 H631 L632 K635	N607-A611 VanDerWaalsContact O-CB 3.25Å; N607-A611 WeakPolarHBondContact O-CB 2.9Å; N607-A611 PolarHBondContact O-N 3.32Å; I608-A611 WeakPolarHBondContact O-CB 3.42Å; I608-A611 PolarHBondContact O-N 3.11Å; Q609-A611 PolarHBondContact O-N 2.68Å; A611-E613 VanDerWaalsContact C-N 3.31Å; A611-E613 PolarHBondContact O-N 3.14Å; A611-L614 PolarHBondContact O-N 3.21Å; A611-A615 WeakPolarHBondContact O-CB 3.45Å; A611-A615 PolarHBondContact O-N 2.96Å; A611-H631 HydrophobicContact CB-CB 4.1Å; A611-L632 HydrophobicContact CB-CD2 3.59Å; A611-L632 HydrophobicContact CB-CG 4.17Å; A611-K635 HydrophobicContact CB-CD 4.35Å; A611-K635 VanDerWaalsContact N-NZ 3.14Å
612	I	72.3	Confident	72.4	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-37.5	175.2	-63.6	161.5	0	0	0	111	I608 Q609 L623 Q662 L665 L669	I608-I612 HydrophobicContact CG2-CD1 3.75Å; I608-I612 HydrophobicContact CG2-CG1 4.4Å; I608-I612 VanDerWaalsContact O-CG1 3.32Å; I608-I612 WeakPolarHBondContact O-CG1 3.1Å; I608-I612 PolarHBondContact O-N 2.89Å; Q609-I612 PolarHBondContact O-N 3.1Å; I612-L623 HydrophobicContact CG1-CD2 4.43Å; I612-L623 HydrophobicContact CG2-CD2 4.43Å; I612-Q662 HydrophobicContact CG2-CG 3.81Å; I612-L665 HydrophobicContact CD1-CD2 3.46Å; I612-L665 VanDerWaalsContact CD1-CD2 3.46Å; I612-L665 HydrophobicContact CD1-CG 3.79Å; I612-L665 HydrophobicContact CG1-CD2 4.24Å; I612-L669 HydrophobicContact CD1-CD1 3.76Å
613	E	70.6	Confident	72.1	Confident	132 Å²	132	66.4 Å²	66.4	62%	0.617	32%	0.317	S	S	*	.	H	α-helix	trans	-69.8	-34.6	175.8	-72.6	179.8	-176.7	0	0	113.4	Q609 A611	Q609-E613 PolarHBondContact O-N 3.19Å; A611-E613 VanDerWaalsContact C-N 3.31Å; A611-E613 PolarHBondContact O-N 3.14Å
614	L	68.9	Low	71.9	Confident	103 Å²	103	63.8 Å²	63.8	54%	0.539	31%	0.307	S	S	.	.	H	α-helix	trans	-87.7	-24.9	-178.4	-72.7	169.9	0	0	0	114	N610 A611 D616	N610-L614 WeakPolarHBondContact O-CB 3.3Å; N610-L614 WeakPolarHBondContact O-CD1 3.48Å; N610-L614 VanDerWaalsContact O-CG 3.23Å; N610-L614 WeakPolarHBondContact O-CG 3.45Å; N610-L614 PolarHBondContact O-N 3.32Å; A611-L614 PolarHBondContact O-N 3.21Å; L614-D616 VanDerWaalsContact C-N 3.3Å; L614-D616 PolarHBondContact O-N 2.79Å
615	A	63.5	Low	72	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-74.5	-19.4	-173.9	0	0	0	0	0	113.6	A611 F617 L623 H631	A611-A615 WeakPolarHBondContact O-CB 3.45Å; A611-A615 PolarHBondContact O-N 2.96Å; A615-F617 PolarHBondContact O-N 3.23Å; A615-L623 HydrophobicContact CB-CD1 3.39Å; A615-H631 HydrophobicContact CB-CB 4.27Å
616	D	64.9	Low	72.1	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.283	33%	0.331	S	S	.	.			trans	-74.6	62.6	172.4	-170.4	3.4	0	0	0	110.8	L614 N618 K619	L614-D616 VanDerWaalsContact C-N 3.3Å; L614-D616 PolarHBondContact O-N 2.79Å; D616-N618 VanDerWaalsContact C-N 3.33Å; D616-N618 PolarHBondContact OD1-OD1 2.81Å; D616-K619 WeakPolarHBondContact OD1-CA 3.49Å; D616-K619 PolarHBondContact OD1-N 2.67Å
617	F	58.2	Low	72	Confident	173 Å²	173	68.3 Å²	68.3	76%	0.759	33%	0.327	S	S	*	.			trans	-76	-25.2	-178.7	-129.6	-84.8	0	0	0	111.7	A615	A615-F617 PolarHBondContact O-N 3.23Å
618	N	63.8	Low	71.9	Confident	67 Å²	67	66.2 Å²	66.2	36%	0.358	32%	0.316	S	S	.	.	S	Bend	trans	-91.7	-10.4	-178.7	62.1	-2.2	0	0	0	113.3	D616 D620	D616-N618 VanDerWaalsContact C-N 3.33Å; D616-N618 PolarHBondContact OD1-OD1 2.81Å; N618-D620 VanDerWaalsContact CG-CG 3.49Å; N618-D620 PolarHBondContact ND2-OD1 2.73Å; N618-D620 PolarHBondContact ND2-OD2 2.8Å; N618-D620 PolarHBondContact O-N 2.98Å; N618-D620 PolarHBondContact OD1-N 2.81Å; N618-D620 PolarHBondContact OD1-OD1 3.37Å; N618-D620 VanDerWaalsContact OD1-OD1 3.07Å
619	K	61.6	Low	72	Confident	186 Å²	186	70.4 Å²	70.4	81%	0.809	33%	0.331	S	S	*	.			trans	54.7	27.1	-179.4	-63.4	-175.7	178	179.1	0	113.5	D616 G621	D616-K619 WeakPolarHBondContact OD1-CA 3.49Å; D616-K619 PolarHBondContact OD1-N 2.67Å; K619-G621 VanDerWaalsContact C-N 3.33Å
620	D	69.1	Low	72.2	Confident	79 Å²	79	76.1 Å²	76.1	42%	0.422	36%	0.355	S	S	.	.	S	Bend	trans	-88	-6.5	-179.5	75.3	-10.2	0	0	0	112.7	N618 K622	N618-D620 VanDerWaalsContact CG-CG 3.49Å; N618-D620 PolarHBondContact ND2-OD1 2.73Å; N618-D620 PolarHBondContact ND2-OD2 2.8Å; N618-D620 PolarHBondContact O-N 2.98Å; N618-D620 PolarHBondContact OD1-N 2.81Å; N618-D620 PolarHBondContact OD1-OD1 3.37Å; N618-D620 VanDerWaalsContact OD1-OD1 3.07Å; D620-K622 VanDerWaalsContact C-N 3.27Å; D620-K622 PolarHBondContact O-N 3.1Å; D620-K622 PolarHBondContact OD1-N 2.81Å
621	G	67	Low	72.4	Confident	22 Å²	22	74.9 Å²	74.9	23%	0.227	35%	0.347	C	S	.	.	S	Bend	trans	73.6	16.8	-178.7	0	0	0	0	0	113.9	K619	K619-G621 VanDerWaalsContact C-N 3.33Å
622	K	71	Confident	72.8	Confident	117 Å²	117	74.9 Å²	74.9	51%	0.509	35%	0.347	S	S	.	.			trans	-129.4	125	178.7	-65.3	-176.2	-179.7	-174	0	109.5	D620 I656	D620-K622 VanDerWaalsContact C-N 3.27Å; D620-K622 PolarHBondContact O-N 3.1Å; D620-K622 PolarHBondContact OD1-N 2.81Å; K622-I656 HydrophobicContact CB-CG2 3.72Å; K622-I656 HydrophobicContact CD-CG2 4.2Å; K622-I656 HydrophobicContact CG-CG2 4.32Å
623	L	74.5	Confident	73.2	Confident	3 Å²	3	78.9 Å²	78.9	2%	0.016	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	106.5	-179.9	177.6	68.7	0	0	0	109.7	I612 A615 E627 M628 L657	I612-L623 HydrophobicContact CG1-CD2 4.43Å; I612-L623 HydrophobicContact CG2-CD2 4.43Å; A615-L623 HydrophobicContact CB-CD1 3.39Å; L623-E627 HydrophobicContact CD1-CB 4.18Å; L623-M628 HydrophobicContact CD1-CB 4.24Å; L623-M628 HydrophobicContact CD2-CB 4.03Å; L623-M628 HydrophobicContact CD2-CG 4.01Å; L623-M628 HydrophobicContact CD2-SD 4.06Å; L623-M628 HydrophobicContact CG-CB 4.09Å; L623-L657 HydrophobicContact CB-CB 4.14Å; L623-L657 HydrophobicContact CD2-CD1 4.02Å; L623-L657 PolarHBondContact N-O 3.08Å; L623-L657 PolarHBondContact O-N 3.47Å
624	E	78	Confident	73.7	Confident	78 Å²	78	76.8 Å²	76.8	36%	0.364	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	146.8	176	-65.8	-169.7	173.9	0	0	111.4	K626 E627 M628 I656	E624-K626 PolarHBondContact O-N 3.47Å; E624-K626 VanDerWaalsContact O-N 3.15Å; E624-E627 HydrophobicContact CB-CG 4.17Å; E624-E627 PolarHBondContact N-OE2 3.02Å; E624-E627 PolarHBondContact O-N 2.99Å; E624-M628 PolarHBondContact O-N 2.87Å; E624-I656 HydrophobicContact CG-CG1 4.42Å
625	Y	79.3	Confident	74.3	Confident	60 Å²	60	74.8 Å²	74.8	24%	0.235	36%	0.357	C	S	.	.	H	α-helix	trans	-51.8	-39.6	173.7	177.7	-103.8	0	0	0	112.5	E627 W629 I642 F646 N655	Y625-E627 PolarHBondContact O-N 2.81Å; Y625-W629 WeakPolarHBondContact O-CB 3.36Å; Y625-W629 PolarHBondContact O-N 3.27Å; Y625-I642 HydrophobicContact CE2-CG2 4.1Å; Y625-F646 HydrophobicContact CD2-CB 3.87Å; Y625-F646 AromaticContact CD2-CD1 3.87Å; Y625-F646 HydrophobicContact CD2-CD1 3.87Å; Y625-F646 AromaticContact CD2-CD2 3.79Å; Y625-F646 HydrophobicContact CD2-CD2 3.79Å; Y625-F646 HydrophobicContact CD2-CE1 4.39Å; Y625-F646 HydrophobicContact CD2-CE2 4.28Å; Y625-F646 AromaticContact CD2-CG 3.55Å; Y625-F646 HydrophobicContact CD2-CG 3.55Å; Y625-F646 HydrophobicContact CE2-CB 4.08Å; Y625-F646 HydrophobicContact CE2-CG 4.26Å; Y625-N655 PolarHBondContact N-O 2.88Å
626	K	80.9	Confident	75.1	Confident	157 Å²	157	77.8 Å²	77.8	68%	0.683	39%	0.387	S	S	*	.	H	α-helix	trans	-64.8	-38.4	179.7	-72.3	179.7	-178	169.2	0	112.9	E624 K630	E624-K626 PolarHBondContact O-N 3.47Å; E624-K626 VanDerWaalsContact O-N 3.15Å; K626-K630 WeakPolarHBondContact O-CB 3.37Å; K626-K630 PolarHBondContact O-N 2.76Å
627	E	78.6	Confident	75.9	Confident	43 Å²	43	75.8 Å²	75.8	20%	0.201	38%	0.376	C	S	.	.	H	α-helix	trans	-71.4	-47.4	179.4	-66	178	150.4	0	0	110.3	L623 E624 Y625 W629 K630 H631	L623-E627 HydrophobicContact CD1-CB 4.18Å; E624-E627 HydrophobicContact CB-CG 4.17Å; E624-E627 PolarHBondContact N-OE2 3.02Å; E624-E627 PolarHBondContact O-N 2.99Å; Y625-E627 PolarHBondContact O-N 2.81Å; E627-W629 VanDerWaalsContact C-N 3.28Å; E627-W629 PolarHBondContact O-N 3.1Å; E627-K630 PolarHBondContact O-N 3.44Å; E627-H631 PolarHBondContact O-CD2 2.72Å; E627-H631 PolarHBondContact O-N 2.64Å; E627-H631 VanDerWaalsContact O-N 3.09Å
628	M	78.9	Confident	77.1	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.2	-43.3	174.3	-164	-178.5	81	0	0	111.1	L623 E624 H631 L632 I642 F646 L657	L623-M628 HydrophobicContact CD1-CB 4.24Å; L623-M628 HydrophobicContact CD2-CB 4.03Å; L623-M628 HydrophobicContact CD2-CG 4.01Å; L623-M628 HydrophobicContact CD2-SD 4.06Å; L623-M628 HydrophobicContact CG-CB 4.09Å; E624-M628 PolarHBondContact O-N 2.87Å; M628-H631 PolarHBondContact O-N 2.89Å; M628-L632 HydrophobicContact CE-CD1 3.84Å; M628-L632 HydrophobicContact CG-CD1 3.65Å; M628-L632 HydrophobicContact CG-CG 4.16Å; M628-L632 WeakPolarHBondContact O-CB 3.31Å; M628-L632 WeakPolarHBondContact O-CG 3.25Å; M628-L632 PolarHBondContact O-N 3.5Å; M628-L632 HydrophobicContact SD-CD1 4.05Å; M628-I642 HydrophobicContact CE-CG2 3.94Å; M628-I642 WeakPolarHBondContact CE-O 3.4Å; M628-F646 HydrophobicContact CE-CB 3.52Å; M628-F646 HydrophobicContact CE-CD2 3.46Å; M628-F646 VanDerWaalsContact CE-CD2 3.46Å; M628-F646 HydrophobicContact CE-CG 3.95Å; M628-F646 HydrophobicContact SD-CD2 3.85Å; M628-L657 HydrophobicContact SD-CD1 4.1Å
629	W	81.1	Confident	77.8	Confident	102 Å²	102	71.1 Å²	71.1	39%	0.386	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-48.3	176.2	179.5	86.3	0	0	0	111.4	Y625 E627 H631 L632 K633 D639 I642	Y625-W629 WeakPolarHBondContact O-CB 3.36Å; Y625-W629 PolarHBondContact O-N 3.27Å; E627-W629 VanDerWaalsContact C-N 3.28Å; E627-W629 PolarHBondContact O-N 3.1Å; W629-H631 VanDerWaalsContact C-N 3.35Å; W629-H631 PolarHBondContact O-N 2.9Å; W629-L632 PolarHBondContact O-N 3.37Å; W629-K633 HydrophobicContact CZ2-CD 4.37Å; W629-K633 HydrophobicContact CZ2-CG 4.22Å; W629-K633 WeakPolarHBondContact O-CB 3.5Å; W629-K633 PolarHBondContact O-N 2.03Å; W629-D639 PolarHBondContact NE1-OD1 2.75Å; W629-I642 HydrophobicContact CB-CG2 4.21Å
630	K	82.8	Confident	78.6	Confident	151 Å²	151	69.6 Å²	69.6	66%	0.657	36%	0.358	S	S	*	.	H	α-helix	trans	-59.2	-44.5	179.6	-169.6	179.2	-178.8	-176.5	0	112	K626 E627 A634	K626-K630 WeakPolarHBondContact O-CB 3.37Å; K626-K630 PolarHBondContact O-N 2.76Å; E627-K630 PolarHBondContact O-N 3.44Å; K630-A634 WeakPolarHBondContact O-CB 3.44Å; K630-A634 PolarHBondContact O-N 3.41Å; K630-A634 VanDerWaalsContact O-N 3.13Å
631	H	81.5	Confident	79.1	Confident	45 Å²	45	68.1 Å²	68.1	21%	0.208	35%	0.348	C	S	.	.	H	α-helix	trans	-74.5	-39.7	-178.5	-80.9	-90.6	0	0	0	113.4	A611 A615 E627 M628 W629 K635	A611-H631 HydrophobicContact CB-CB 4.1Å; A615-H631 HydrophobicContact CB-CB 4.27Å; E627-H631 PolarHBondContact O-CD2 2.72Å; E627-H631 PolarHBondContact O-N 2.64Å; E627-H631 VanDerWaalsContact O-N 3.09Å; M628-H631 PolarHBondContact O-N 2.89Å; W629-H631 VanDerWaalsContact C-N 3.35Å; W629-H631 PolarHBondContact O-N 2.9Å; H631-K635 PolarHBondContact O-N 3.45Å
632	L	82.4	Confident	79.7	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-73.9	-37	177.5	-70.9	178.2	0	0	0	111.9	I608 A611 M628 W629 A634 K635 G636 F637 I642	I608-L632 HydrophobicContact CB-CD2 4.42Å; I608-L632 HydrophobicContact CG1-CD2 4.04Å; A611-L632 HydrophobicContact CB-CD2 3.59Å; A611-L632 HydrophobicContact CB-CG 4.17Å; M628-L632 HydrophobicContact CE-CD1 3.84Å; M628-L632 HydrophobicContact CG-CD1 3.65Å; M628-L632 HydrophobicContact CG-CG 4.16Å; M628-L632 WeakPolarHBondContact O-CB 3.31Å; M628-L632 WeakPolarHBondContact O-CG 3.25Å; M628-L632 PolarHBondContact O-N 3.5Å; M628-L632 HydrophobicContact SD-CD1 4.05Å; W629-L632 PolarHBondContact O-N 3.37Å; L632-A634 VanDerWaalsContact C-N 3.32Å; L632-A634 PolarHBondContact O-N 3.06Å; L632-K635 CarbonylContact O-C 3.42Å; L632-K635 PolarHBondContact O-N 3.09Å; L632-K635 VanDerWaalsContact O-N 3.08Å; L632-G636 PolarHBondContact O-N 3.47Å; L632-F637 HydrophobicContact CB-CB 4.19Å; L632-F637 HydrophobicContact CB-CD2 4.19Å; L632-F637 HydrophobicContact CB-CG 4.37Å; L632-F637 HydrophobicContact CD2-CD2 3.9Å; L632-F637 HydrophobicContact CD2-CE2 4Å; L632-F637 HydrophobicContact CD2-CG 4.44Å; L632-F637 WeakPolarHBondContact O-CD2 3.36Å; L632-F637 PolarHBondContact O-N 3.48Å; L632-F637 VanDerWaalsContact O-N 3.1Å; L632-I642 HydrophobicContact CB-CD1 3.73Å; L632-I642 HydrophobicContact CB-CG1 3.67Å; L632-I642 HydrophobicContact CD1-CG1 4.04Å; L632-I642 HydrophobicContact CD1-CG2 4.23Å
633	K	81	Confident	80.2	Confident	83 Å²	83	66.4 Å²	66.4	36%	0.361	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-42.7	173.3	-166.3	71.8	171.4	-166.9	0	110.9	W629 K635 G636 D639 I642	W629-K633 HydrophobicContact CZ2-CD 4.37Å; W629-K633 HydrophobicContact CZ2-CG 4.22Å; W629-K633 WeakPolarHBondContact O-CB 3.5Å; W629-K633 PolarHBondContact O-N 2.03Å; K633-K635 PolarHBondContact O-N 3.48Å; K633-G636 PolarHBondContact O-N 3.25Å; K633-D639 IonicContact NZ-OD1 2.82Å; K633-D639 PolarHBondContact NZ-OD1 3.45Å; K633-D639 IonicContact NZ-OD2 2.87Å; K633-D639 PolarHBondContact NZ-OD2 3.42Å; K633-I642 HydrophobicContact CB-CD1 4.25Å; K633-I642 HydrophobicContact CD-CD1 4.47Å
634	A	81.1	Confident	80.6	Confident	89 Å²	89	71.6 Å²	71.6	74%	0.736	36%	0.36	S	S	*	.	H	α-helix	trans	-61.4	-26.6	174.6	0	0	0	0	0	113.5	K630 L632	K630-A634 WeakPolarHBondContact O-CB 3.44Å; K630-A634 PolarHBondContact O-N 3.41Å; K630-A634 VanDerWaalsContact O-N 3.13Å; L632-A634 VanDerWaalsContact C-N 3.32Å; L632-A634 PolarHBondContact O-N 3.06Å
635	K	80.9	Confident	80.6	Confident	61 Å²	61	69.3 Å²	69.3	27%	0.265	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	5.8	174.8	-68.1	-169.3	-172.6	179	0	114.4	N607 N610 A611 H631 L632 K633 F637	N607-K635 HydrophobicContact CB-CD 3.81Å; N607-K635 WeakPolarHBondContact O-CD 3.31Å; N607-K635 PolarHBondContact O-NZ 3.07Å; N610-K635 VanDerWaalsContact C-NZ 3.29Å; A611-K635 HydrophobicContact CB-CD 4.35Å; A611-K635 VanDerWaalsContact N-NZ 3.14Å; H631-K635 PolarHBondContact O-N 3.45Å; L632-K635 CarbonylContact O-C 3.42Å; L632-K635 PolarHBondContact O-N 3.09Å; L632-K635 VanDerWaalsContact O-N 3.08Å; K633-K635 PolarHBondContact O-N 3.48Å; K635-F637 HydrophobicContact CB-CD2 4.22Å; K635-F637 HydrophobicContact CB-CE2 4.29Å
636	G	80	Confident	80.7	Confident	63 Å²	63	66.6 Å²	66.6	65%	0.649	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	19.6	173.7	0	0	0	0	0	115.8	L632 K633	L632-G636 PolarHBondContact O-N 3.47Å; K633-G636 PolarHBondContact O-N 3.25Å
637	F	81.7	Confident	80.6	Confident	12 Å²	12	64.4 Å²	64.4	5%	0.053	33%	0.333	C	S	.	.			trans	-77.7	145.3	171.5	-71.9	-96.1	0	0	0	111.5	R604 N607 I608 L632 K635 E641 I642	R604-F637 HydrophobicContact CB-CE1 4.46Å; R604-F637 HydrophobicContact CB-CZ 4.18Å; R604-F637 VanDerWaalsContact NH2-CD1 3.27Å; N607-F637 HydrophobicContact CB-CE2 3.97Å; N607-F637 HydrophobicContact CB-CZ 4.32Å; I608-F637 HydrophobicContact CD1-CE1 3.84Å; I608-F637 HydrophobicContact CD1-CZ 3.95Å; I608-F637 HydrophobicContact CG1-CE1 3.83Å; I608-F637 HydrophobicContact CG1-CE2 4.16Å; I608-F637 HydrophobicContact CG1-CZ 3.49Å; I608-F637 VanDerWaalsContact CG1-CZ 3.49Å; L632-F637 HydrophobicContact CB-CB 4.19Å; L632-F637 HydrophobicContact CB-CD2 4.19Å; L632-F637 HydrophobicContact CB-CG 4.37Å; L632-F637 HydrophobicContact CD2-CD2 3.9Å; L632-F637 HydrophobicContact CD2-CE2 4Å; L632-F637 HydrophobicContact CD2-CG 4.44Å; L632-F637 WeakPolarHBondContact O-CD2 3.36Å; L632-F637 PolarHBondContact O-N 3.48Å; L632-F637 VanDerWaalsContact O-N 3.1Å; K635-F637 HydrophobicContact CB-CD2 4.22Å; K635-F637 HydrophobicContact CB-CE2 4.29Å; F637-E641 HydrophobicContact CD1-CB 4.47Å; F637-I642 HydrophobicContact CB-CD1 4.05Å; F637-I642 HydrophobicContact CB-CG1 3.75Å
638	T	83.3	Confident	80.7	Confident	67 Å²	67	68.3 Å²	68.3	41%	0.411	36%	0.355	S	S	.	.			trans	-75.8	157	174.5	61.1	0	0	0	0	111.1	E640 E641 I642	T638-E640 VanDerWaalsContact C-N 3.25Å; T638-E640 PolarHBondContact O-N 3.25Å; T638-E641 PolarHBondContact N-OE2 3.38Å; T638-E641 PolarHBondContact O-N 2.94Å; T638-E641 WeakPolarHBondContact OG1-CB 3.31Å; T638-E641 WeakPolarHBondContact OG1-CG 3.43Å; T638-E641 PolarHBondContact OG1-N 3.42Å; T638-E641 PolarHBondContact OG1-OE2 3.17Å; T638-I642 WeakPolarHBondContact O-CG1 3.33Å; T638-I642 PolarHBondContact O-N 3.14Å; T638-I642 VanDerWaalsContact O-N 3.08Å
639	D	79.1	Confident	80.7	Confident	74 Å²	74	70.3 Å²	70.3	40%	0.396	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-33.7	-177.3	-62.7	-40.9	0	0	0	112	W629 K633 K643	W629-D639 PolarHBondContact NE1-OD1 2.75Å; K633-D639 IonicContact NZ-OD1 2.82Å; K633-D639 PolarHBondContact NZ-OD1 3.45Å; K633-D639 IonicContact NZ-OD2 2.87Å; K633-D639 PolarHBondContact NZ-OD2 3.42Å; D639-K643 WeakPolarHBondContact O-CB 3.49Å; D639-K643 PolarHBondContact O-N 3.03Å
640	E	79.2	Confident	80.6	Confident	155 Å²	155	66.1 Å²	66.1	72%	0.724	35%	0.349	S	S	*	.	H	α-helix	trans	-65.5	-44	175.6	-65.7	171.5	-179.7	0	0	111.9	T638 K643 M644	T638-E640 VanDerWaalsContact C-N 3.25Å; T638-E640 PolarHBondContact O-N 3.25Å; E640-K643 PolarHBondContact O-N 3.03Å; E640-M644 WeakPolarHBondContact O-CG 3.32Å; E640-M644 PolarHBondContact O-N 3.46Å
641	E	78.8	Confident	80.4	Confident	48 Å²	48	65.5 Å²	65.5	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-66.1	-41.4	178.1	-71.6	166.7	143.5	0	0	112	R604 F637 T638 K643 M644 V645	R604-E641 IonicContact CZ-OE1 2.64Å; R604-E641 IonicContact CZ-OE2 2.66Å; R604-E641 IonicContact NH1-OE1 2.69Å; R604-E641 PolarHBondContact NH1-OE1 3.47Å; R604-E641 IonicContact NH2-OE1 3.09Å; R604-E641 PolarHBondContact NH2-OE1 3.04Å; R604-E641 IonicContact NH2-OE2 3.4Å; R604-E641 PolarHBondContact NH2-OE2 2.88Å; F637-E641 HydrophobicContact CD1-CB 4.47Å; T638-E641 PolarHBondContact N-OE2 3.38Å; T638-E641 PolarHBondContact O-N 2.94Å; T638-E641 WeakPolarHBondContact OG1-CB 3.31Å; T638-E641 WeakPolarHBondContact OG1-CG 3.43Å; T638-E641 PolarHBondContact OG1-N 3.42Å; T638-E641 PolarHBondContact OG1-OE2 3.17Å; E641-K643 VanDerWaalsContact C-N 3.32Å; E641-M644 PolarHBondContact O-N 3.44Å; E641-V645 WeakPolarHBondContact O-CB 3.45Å; E641-V645 VanDerWaalsContact O-CG2 3.26Å; E641-V645 WeakPolarHBondContact O-CG2 3.49Å; E641-V645 PolarHBondContact O-N 3.39Å
642	I	79.8	Confident	80.3	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-61.4	-45.6	177	-66.3	169.8	0	0	0	109.9	Y625 M628 W629 L632 K633 F637 T638 V645 F646	Y625-I642 HydrophobicContact CE2-CG2 4.1Å; M628-I642 HydrophobicContact CE-CG2 3.94Å; M628-I642 WeakPolarHBondContact CE-O 3.4Å; W629-I642 HydrophobicContact CB-CG2 4.21Å; L632-I642 HydrophobicContact CB-CD1 3.73Å; L632-I642 HydrophobicContact CB-CG1 3.67Å; L632-I642 HydrophobicContact CD1-CG1 4.04Å; L632-I642 HydrophobicContact CD1-CG2 4.23Å; K633-I642 HydrophobicContact CB-CD1 4.25Å; K633-I642 HydrophobicContact CD-CD1 4.47Å; F637-I642 HydrophobicContact CB-CD1 4.05Å; F637-I642 HydrophobicContact CB-CG1 3.75Å; T638-I642 WeakPolarHBondContact O-CG1 3.33Å; T638-I642 PolarHBondContact O-N 3.14Å; T638-I642 VanDerWaalsContact O-N 3.08Å; I642-V645 PolarHBondContact O-N 2.91Å; I642-F646 WeakPolarHBondContact O-CB 3.5Å; I642-F646 PolarHBondContact O-N 3.05Å
643	K	81.2	Confident	80.1	Confident	103 Å²	103	75.8 Å²	75.8	45%	0.448	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-46.8	177.3	-174.3	176.2	173.9	-178.5	0	111.7	D639 E640 E641 V645 F646 E647	D639-K643 WeakPolarHBondContact O-CB 3.49Å; D639-K643 PolarHBondContact O-N 3.03Å; E640-K643 PolarHBondContact O-N 3.03Å; E641-K643 VanDerWaalsContact C-N 3.32Å; K643-V645 PolarHBondContact O-N 3.4Å; K643-F646 PolarHBondContact O-N 3Å; K643-E647 VanDerWaalsContact CE-CD 3.45Å; K643-E647 WeakPolarHBondContact CE-OE1 3.4Å; K643-E647 HydrophobicContact CG-CG 4.17Å; K643-E647 IonicContact NZ-OE1 2.76Å; K643-E647 WeakPolarHBondContact O-CB 3.26Å; K643-E647 WeakPolarHBondContact O-CG 3.19Å; K643-E647 PolarHBondContact O-N 3.01Å
644	M	82	Confident	80.1	Confident	111 Å²	111	75.3 Å²	75.3	55%	0.547	40%	0.398	S	S	.	.	H	α-helix	trans	-62.1	-41.9	176.6	-74.1	-157.2	-60.8	0	0	112.7	E640 E641 F646 N648	E640-M644 WeakPolarHBondContact O-CG 3.32Å; E640-M644 PolarHBondContact O-N 3.46Å; E641-M644 PolarHBondContact O-N 3.44Å; M644-F646 VanDerWaalsContact C-N 3.29Å; M644-F646 PolarHBondContact O-N 3.09Å; M644-N648 VanDerWaalsContact O-CB 3.3Å; M644-N648 WeakPolarHBondContact O-CB 3.36Å; M644-N648 PolarHBondContact O-N 3.1Å; M644-N648 VanDerWaalsContact O-N 3.12Å; M644-N648 PolarHBondContact O-ND2 2.95Å; M644-N648 VanDerWaalsContact O-ND2 3.1Å
645	V	79	Confident	80	Confident	31 Å²	31	75.9 Å²	75.9	19%	0.188	39%	0.388	C	S	.	.	H	α-helix	trans	-64.9	-36	177.2	171.7	0	0	0	0	111	I608 E641 I642 K643 F649 L665	I608-V645 HydrophobicContact CG2-CG1 4.49Å; E641-V645 WeakPolarHBondContact O-CB 3.45Å; E641-V645 VanDerWaalsContact O-CG2 3.26Å; E641-V645 WeakPolarHBondContact O-CG2 3.49Å; E641-V645 PolarHBondContact O-N 3.39Å; I642-V645 PolarHBondContact O-N 2.91Å; K643-V645 PolarHBondContact O-N 3.4Å; V645-F649 WeakPolarHBondContact O-CD2 3.47Å; V645-L665 HydrophobicContact CG1-CD1 4.35Å
646	F	80.5	Confident	79.9	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.009	39%	0.388	C	S	.	.	H	α-helix	trans	-71	-54.7	176.9	-161.4	-92.3	0	0	0	111.9	Y625 M628 I642 K643 M644 N648 F649 D650 N655 L657	Y625-F646 HydrophobicContact CD2-CB 3.87Å; Y625-F646 AromaticContact CD2-CD1 3.87Å; Y625-F646 HydrophobicContact CD2-CD1 3.87Å; Y625-F646 AromaticContact CD2-CD2 3.79Å; Y625-F646 HydrophobicContact CD2-CD2 3.79Å; Y625-F646 HydrophobicContact CD2-CE1 4.39Å; Y625-F646 HydrophobicContact CD2-CE2 4.28Å; Y625-F646 AromaticContact CD2-CG 3.55Å; Y625-F646 HydrophobicContact CD2-CG 3.55Å; Y625-F646 HydrophobicContact CE2-CB 4.08Å; Y625-F646 HydrophobicContact CE2-CG 4.26Å; M628-F646 HydrophobicContact CE-CB 3.52Å; M628-F646 HydrophobicContact CE-CD2 3.46Å; M628-F646 VanDerWaalsContact CE-CD2 3.46Å; M628-F646 HydrophobicContact CE-CG 3.95Å; M628-F646 HydrophobicContact SD-CD2 3.85Å; I642-F646 WeakPolarHBondContact O-CB 3.5Å; I642-F646 PolarHBondContact O-N 3.05Å; K643-F646 PolarHBondContact O-N 3Å; M644-F646 VanDerWaalsContact C-N 3.29Å; M644-F646 PolarHBondContact O-N 3.09Å; F646-N648 PolarHBondContact O-N 3.03Å; F646-F649 PolarHBondContact O-N 3.41Å; F646-F649 VanDerWaalsContact O-N 3.08Å; F646-D650 HydrophobicContact CD1-CB 3.93Å; F646-D650 HydrophobicContact CE1-CB 3.76Å; F646-D650 WeakPolarHBondContact CE1-OD2 3.45Å; F646-D650 WeakPolarHBondContact O-CB 3.11Å; F646-D650 PolarHBondContact O-N 2.63Å; F646-N655 VanDerWaalsContact CZ-O 3.3Å; F646-N655 WeakPolarHBondContact CZ-O 3.37Å; F646-L657 HydrophobicContact CD2-CD1 3.52Å; F646-L657 HydrophobicContact CD2-CG 4.06Å; F646-L657 HydrophobicContact CE2-CB 4.36Å; F646-L657 HydrophobicContact CE2-CD1 3.4Å; F646-L657 HydrophobicContact CE2-CG 3.58Å; F646-L657 HydrophobicContact CG-CD1 4.44Å; F646-L657 HydrophobicContact CZ-CD1 4.19Å; F646-L657 HydrophobicContact CZ-CG 3.86Å
647	E	79.7	Confident	79.8	Confident	112 Å²	112	72.4 Å²	72.4	52%	0.523	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-28.3	-175.5	-72.6	-178.9	159.6	0	0	113.2	K643 F649	K643-E647 VanDerWaalsContact CE-CD 3.45Å; K643-E647 WeakPolarHBondContact CE-OE1 3.4Å; K643-E647 HydrophobicContact CG-CG 4.17Å; K643-E647 IonicContact NZ-OE1 2.76Å; K643-E647 WeakPolarHBondContact O-CB 3.26Å; K643-E647 WeakPolarHBondContact O-CG 3.19Å; K643-E647 PolarHBondContact O-N 3.01Å; E647-F649 PolarHBondContact O-N 2.89Å
648	N	80.5	Confident	79.6	Confident	124 Å²	124	73.6 Å²	73.6	66%	0.663	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.4	177.7	-76.2	-17.7	0	0	0	113.6	M644 F646	M644-N648 VanDerWaalsContact O-CB 3.3Å; M644-N648 WeakPolarHBondContact O-CB 3.36Å; M644-N648 PolarHBondContact O-N 3.1Å; M644-N648 VanDerWaalsContact O-N 3.12Å; M644-N648 PolarHBondContact O-ND2 2.95Å; M644-N648 VanDerWaalsContact O-ND2 3.1Å; F646-N648 PolarHBondContact O-N 3.03Å
649	F	78.6	Confident	79.3	Confident	43 Å²	43	75.6 Å²	75.6	19%	0.189	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-13.7	-177.2	-68.1	-89.3	0	0	0	113.5	V645 F646 E647 E651 L657 E661 K664 L665	V645-F649 WeakPolarHBondContact O-CD2 3.47Å; F646-F649 PolarHBondContact O-N 3.41Å; F646-F649 VanDerWaalsContact O-N 3.08Å; E647-F649 PolarHBondContact O-N 2.89Å; F649-E651 PolarHBondContact O-N 3.4Å; F649-L657 HydrophobicContact CB-CD2 3.87Å; F649-E661 WeakPolarHBondContact O-CB 3.33Å; F649-E661 VanDerWaalsContact O-CG 3.29Å; F649-E661 WeakPolarHBondContact O-CG 3.3Å; F649-K664 HydrophobicContact CD1-CB 4.31Å; F649-L665 HydrophobicContact CB-CB 4.36Å; F649-L665 HydrophobicContact CD1-CB 3.73Å; F649-L665 HydrophobicContact CD1-CD1 4.21Å; F649-L665 HydrophobicContact CD2-CB 4.35Å; F649-L665 HydrophobicContact CD2-CD1 3.42Å; F649-L665 VanDerWaalsContact CD2-CD1 3.42Å; F649-L665 HydrophobicContact CD2-CG 4.36Å; F649-L665 VanDerWaalsContact CE1-CA 3.43Å; F649-L665 HydrophobicContact CE1-CB 4.05Å; F649-L665 HydrophobicContact CE1-CD1 4.14Å; F649-L665 HydrophobicContact CE2-CD1 3.3Å; F649-L665 HydrophobicContact CG-CB 3.88Å; F649-L665 HydrophobicContact CG-CD1 3.86Å; F649-L665 HydrophobicContact CG-CG 4.36Å; F649-L665 HydrophobicContact CZ-CB 4.46Å; F649-L665 HydrophobicContact CZ-CD1 3.68Å
650	D	80.6	Confident	79.3	Confident	13 Å²	13	76.3 Å²	76.3	7%	0.07	38%	0.379	C	S	.	.			trans	-79	90.9	169.2	-179.6	3.9	0	0	0	109.8	F646 N652 K653 D654 N655	F646-D650 HydrophobicContact CD1-CB 3.93Å; F646-D650 HydrophobicContact CE1-CB 3.76Å; F646-D650 WeakPolarHBondContact CE1-OD2 3.45Å; F646-D650 WeakPolarHBondContact O-CB 3.11Å; F646-D650 PolarHBondContact O-N 2.63Å; D650-N652 VanDerWaalsContact C-N 3.31Å; D650-N652 PolarHBondContact OD1-N 3.36Å; D650-N652 PolarHBondContact OD1-OD1 2.96Å; D650-K653 VanDerWaalsContact OD1-CA 3.31Å; D650-K653 WeakPolarHBondContact OD1-CA 3.34Å; D650-K653 PolarHBondContact OD1-N 3.49Å; D650-K653 VanDerWaalsContact OD2-CA 3.29Å; D650-K653 WeakPolarHBondContact OD2-CA 3.45Å; D650-D654 PolarHBondContact OD1-N 3.14Å; D650-D654 PolarHBondContact OD2-N 3.01Å; D650-N655 PolarHBondContact OD2-N 3.48Å
651	E	76.6	Confident	79.4	Confident	138 Å²	138	69.4 Å²	69.4	65%	0.645	35%	0.347	S	S	*	.	S	Bend	trans	-73.4	-27.4	-177.4	-71.8	-179.8	167.7	0	0	111.8	F649 E661 K664	F649-E651 PolarHBondContact O-N 3.4Å; E651-E661 PolarHBondContact N-OE1 3.05Å; E651-E661 VanDerWaalsContact N-OE1 3.08Å; E651-K664 IonicContact OE1-NZ 2.75Å; E651-K664 PolarHBondContact OE1-NZ 3.42Å; E651-K664 IonicContact OE2-NZ 2.72Å; E651-K664 PolarHBondContact OE2-NZ 3.31Å
652	N	81	Confident	79.3	Confident	84 Å²	84	67.7 Å²	67.7	45%	0.449	34%	0.339	S	S	.	.	S	Bend	trans	-99.5	-9.2	-171.5	72.8	22.9	0	0	0	113.4	D650 D654	D650-N652 VanDerWaalsContact C-N 3.31Å; D650-N652 PolarHBondContact OD1-N 3.36Å; D650-N652 PolarHBondContact OD1-OD1 2.96Å; N652-D654 VanDerWaalsContact C-N 3.29Å; N652-D654 VanDerWaalsContact CG-CG 3.44Å; N652-D654 PolarHBondContact ND2-OD2 3.36Å; N652-D654 PolarHBondContact O-N 2.97Å; N652-D654 WeakPolarHBondContact OD1-CB 3.37Å; N652-D654 PolarHBondContact OD1-N 3.17Å; N652-D654 PolarHBondContact OD1-OD1 3.11Å; N652-D654 PolarHBondContact OD1-OD2 3.21Å
653	K	77.7	Confident	79.4	Confident	178 Å²	178	72 Å²	72	77%	0.774	36%	0.361	S	S	*	.			trans	60.8	28.6	-179.1	-59.9	-175.6	178.9	-179.7	0	114.5	D650 N655	D650-K653 VanDerWaalsContact OD1-CA 3.31Å; D650-K653 WeakPolarHBondContact OD1-CA 3.34Å; D650-K653 PolarHBondContact OD1-N 3.49Å; D650-K653 VanDerWaalsContact OD2-CA 3.29Å; D650-K653 WeakPolarHBondContact OD2-CA 3.45Å; K653-N655 VanDerWaalsContact C-N 3.33Å
654	D	81.3	Confident	79.4	Confident	74 Å²	74	71.3 Å²	71.3	40%	0.396	36%	0.358	S	S	.	.	S	Bend	trans	-86.6	0.7	-177.8	73	6.1	0	0	0	113.9	D650 N652 I656	D650-D654 PolarHBondContact OD1-N 3.14Å; D650-D654 PolarHBondContact OD2-N 3.01Å; N652-D654 VanDerWaalsContact C-N 3.29Å; N652-D654 VanDerWaalsContact CG-CG 3.44Å; N652-D654 PolarHBondContact ND2-OD2 3.36Å; N652-D654 PolarHBondContact O-N 2.97Å; N652-D654 WeakPolarHBondContact OD1-CB 3.37Å; N652-D654 PolarHBondContact OD1-N 3.17Å; N652-D654 PolarHBondContact OD1-OD1 3.11Å; N652-D654 PolarHBondContact OD1-OD2 3.21Å; D654-I656 PolarHBondContact O-N 2.95Å; D654-I656 WeakPolarHBondContact OD1-CA 3.5Å; D654-I656 WeakPolarHBondContact OD1-CB 3.32Å; D654-I656 PolarHBondContact OD1-N 3.22Å
655	N	79.3	Confident	79.4	Confident	100 Å²	100	66 Å²	66	54%	0.535	33%	0.332	S	S	.	.	S	Bend	trans	64.2	16.7	-174	-57.3	-72	0	0	0	114.6	Y625 F646 D650 K653	Y625-N655 PolarHBondContact N-O 2.88Å; F646-N655 VanDerWaalsContact CZ-O 3.3Å; F646-N655 WeakPolarHBondContact CZ-O 3.37Å; D650-N655 PolarHBondContact OD2-N 3.48Å; K653-N655 VanDerWaalsContact C-N 3.33Å
656	I	78.9	Confident	79.5	Confident	51 Å²	51	67.8 Å²	67.8	26%	0.262	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	112	179.8	-54.3	177.3	0	0	0	109.7	K622 E624 D654 S658	K622-I656 HydrophobicContact CB-CG2 3.72Å; K622-I656 HydrophobicContact CD-CG2 4.2Å; K622-I656 HydrophobicContact CG-CG2 4.32Å; E624-I656 HydrophobicContact CG-CG1 4.42Å; D654-I656 PolarHBondContact O-N 2.95Å; D654-I656 WeakPolarHBondContact OD1-CA 3.5Å; D654-I656 WeakPolarHBondContact OD1-CB 3.32Å; D654-I656 PolarHBondContact OD1-N 3.22Å; I656-S658 PolarHBondContact O-N 3.11Å; I656-S658 VanDerWaalsContact O-N 3.1Å
657	L	76.4	Confident	79.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	112.2	174.5	-78.5	157.6	0	0	0	109.7	L623 M628 F646 F649 E661 L665	L623-L657 HydrophobicContact CB-CB 4.14Å; L623-L657 HydrophobicContact CD2-CD1 4.02Å; L623-L657 PolarHBondContact N-O 3.08Å; L623-L657 PolarHBondContact O-N 3.47Å; M628-L657 HydrophobicContact SD-CD1 4.1Å; F646-L657 HydrophobicContact CD2-CD1 3.52Å; F646-L657 HydrophobicContact CD2-CG 4.06Å; F646-L657 HydrophobicContact CE2-CB 4.36Å; F646-L657 HydrophobicContact CE2-CD1 3.4Å; F646-L657 HydrophobicContact CE2-CG 3.58Å; F646-L657 HydrophobicContact CG-CD1 4.44Å; F646-L657 HydrophobicContact CZ-CD1 4.19Å; F646-L657 HydrophobicContact CZ-CG 3.86Å; F649-L657 HydrophobicContact CB-CD2 3.87Å; L657-E661 HydrophobicContact CD2-CB 3.7Å; L657-L665 HydrophobicContact CD1-CD2 4.29Å
658	S	77.6	Confident	79.7	Confident	38 Å²	38	66.7 Å²	66.7	27%	0.266	35%	0.346	S	S	.	.			trans	-64.9	161	171.9	68.3	0	0	0	0	111.3	I656 T660 E661 Q662	I656-S658 PolarHBondContact O-N 3.11Å; I656-S658 VanDerWaalsContact O-N 3.1Å; S658-T660 PolarHBondContact O-N 2.88Å; S658-T660 VanDerWaalsContact O-N 3.15Å; S658-E661 WeakPolarHBondContact CB-OE2 3.29Å; S658-E661 PolarHBondContact N-OE2 2.85Å; S658-E661 PolarHBondContact O-N 2.83Å; S658-E661 VanDerWaalsContact O-N 3.08Å; S658-E661 VanDerWaalsContact OG-CD 3.3Å; S658-E661 WeakPolarHBondContact OG-CG 3.35Å; S658-E661 PolarHBondContact OG-N 2.9Å; S658-E661 PolarHBondContact OG-OE2 3.46Å; S658-Q662 PolarHBondContact O-N 3.29Å
659	H	78.1	Confident	79.9	Confident	108 Å²	108	61.3 Å²	61.3	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-52.6	-37.7	176.5	-178.8	-93.1	0	0	0	113	Q662 L663	H659-Q662 PolarHBondContact O-N 3.37Å; H659-L663 WeakPolarHBondContact O-CG 3.45Å; H659-L663 PolarHBondContact O-N 3.08Å
660	T	78.8	Confident	80.1	Confident	90 Å²	90	64.7 Å²	64.7	55%	0.552	33%	0.334	S	S	*	.	H	α-helix	trans	-67.9	-41.1	178.7	-49.6	0	0	0	0	112.1	S658 L663 K664	S658-T660 PolarHBondContact O-N 2.88Å; S658-T660 VanDerWaalsContact O-N 3.15Å; T660-L663 PolarHBondContact O-N 3.4Å; T660-K664 PolarHBondContact O-N 2.8Å; T660-K664 VanDerWaalsContact O-N 3.08Å
661	E	80.6	Confident	80.2	Confident	9 Å²	9	70.9 Å²	70.9	4%	0.042	36%	0.362	C	S	.	.	H	α-helix	trans	-70.9	-37.4	177	-67.8	159.4	148.7	0	0	111.2	F649 E651 L657 S658 L663 K664 L665	F649-E661 WeakPolarHBondContact O-CB 3.33Å; F649-E661 VanDerWaalsContact O-CG 3.29Å; F649-E661 WeakPolarHBondContact O-CG 3.3Å; E651-E661 PolarHBondContact N-OE1 3.05Å; E651-E661 VanDerWaalsContact N-OE1 3.08Å; L657-E661 HydrophobicContact CD2-CB 3.7Å; S658-E661 WeakPolarHBondContact CB-OE2 3.29Å; S658-E661 PolarHBondContact N-OE2 2.85Å; S658-E661 PolarHBondContact O-N 2.83Å; S658-E661 VanDerWaalsContact O-N 3.08Å; S658-E661 VanDerWaalsContact OG-CD 3.3Å; S658-E661 WeakPolarHBondContact OG-CG 3.35Å; S658-E661 PolarHBondContact OG-N 2.9Å; S658-E661 PolarHBondContact OG-OE2 3.46Å; E661-L663 VanDerWaalsContact C-N 3.28Å; E661-L663 PolarHBondContact O-N 2.87Å; E661-K664 PolarHBondContact O-N 2.93Å; E661-L665 WeakPolarHBondContact O-CB 3.29Å; E661-L665 PolarHBondContact O-N 2.89Å
662	Q	77.3	Confident	80.5	Confident	13 Å²	13	69.1 Å²	69.1	6%	0.061	35%	0.354	C	S	.	.	H	α-helix	trans	-60.4	-38.6	172.3	-163.4	-164.8	27.1	0	0	111.5	I612 S658 H659 K666	I612-Q662 HydrophobicContact CG2-CG 3.81Å; S658-Q662 PolarHBondContact O-N 3.29Å; H659-Q662 PolarHBondContact O-N 3.37Å; Q662-K666 WeakPolarHBondContact O-CB 3.39Å; Q662-K666 WeakPolarHBondContact O-CG 3.08Å; Q662-K666 PolarHBondContact O-N 2.76Å
663	L	80.9	Confident	80.6	Confident	90 Å²	90	67.7 Å²	67.7	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-44.5	174.3	-74.7	175.5	0	0	0	112.1	H659 T660 E661 L665 K666 A667	H659-L663 WeakPolarHBondContact O-CG 3.45Å; H659-L663 PolarHBondContact O-N 3.08Å; T660-L663 PolarHBondContact O-N 3.4Å; E661-L663 VanDerWaalsContact C-N 3.28Å; E661-L663 PolarHBondContact O-N 2.87Å; L663-L665 VanDerWaalsContact C-N 3.33Å; L663-L665 PolarHBondContact O-N 3.47Å; L663-K666 PolarHBondContact O-N 3.45Å; L663-A667 WeakPolarHBondContact O-CB 3.37Å; L663-A667 PolarHBondContact O-N 2.92Å
664	K	82.3	Confident	80.8	Confident	89 Å²	89	64.1 Å²	64.1	39%	0.387	33%	0.332	S	S	.	.	H	α-helix	trans	-58.2	-45.7	174.4	-73.3	176.8	177.5	176.3	0	111.2	F649 E651 T660 E661 A667 S668	F649-K664 HydrophobicContact CD1-CB 4.31Å; E651-K664 IonicContact OE1-NZ 2.75Å; E651-K664 PolarHBondContact OE1-NZ 3.42Å; E651-K664 IonicContact OE2-NZ 2.72Å; E651-K664 PolarHBondContact OE2-NZ 3.31Å; T660-K664 PolarHBondContact O-N 2.8Å; T660-K664 VanDerWaalsContact O-N 3.08Å; E661-K664 PolarHBondContact O-N 2.93Å; K664-A667 PolarHBondContact O-N 3.44Å; K664-S668 WeakPolarHBondContact O-CB 3.39Å; K664-S668 PolarHBondContact O-N 3.46Å
665	L	82	Confident	80.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60.9	-48.6	176.7	175.7	61.7	0	0	0	112	I612 V645 F649 L657 E661 L663 A667 S668 L669	I612-L665 HydrophobicContact CD1-CD2 3.46Å; I612-L665 VanDerWaalsContact CD1-CD2 3.46Å; I612-L665 HydrophobicContact CD1-CG 3.79Å; I612-L665 HydrophobicContact CG1-CD2 4.24Å; V645-L665 HydrophobicContact CG1-CD1 4.35Å; F649-L665 HydrophobicContact CB-CB 4.36Å; F649-L665 HydrophobicContact CD1-CB 3.73Å; F649-L665 HydrophobicContact CD1-CD1 4.21Å; F649-L665 HydrophobicContact CD2-CB 4.35Å; F649-L665 HydrophobicContact CD2-CD1 3.42Å; F649-L665 VanDerWaalsContact CD2-CD1 3.42Å; F649-L665 HydrophobicContact CD2-CG 4.36Å; F649-L665 VanDerWaalsContact CE1-CA 3.43Å; F649-L665 HydrophobicContact CE1-CB 4.05Å; F649-L665 HydrophobicContact CE1-CD1 4.14Å; F649-L665 HydrophobicContact CE2-CD1 3.3Å; F649-L665 HydrophobicContact CG-CB 3.88Å; F649-L665 HydrophobicContact CG-CD1 3.86Å; F649-L665 HydrophobicContact CG-CG 4.36Å; F649-L665 HydrophobicContact CZ-CB 4.46Å; F649-L665 HydrophobicContact CZ-CD1 3.68Å; L657-L665 HydrophobicContact CD1-CD2 4.29Å; E661-L665 WeakPolarHBondContact O-CB 3.29Å; E661-L665 PolarHBondContact O-N 2.89Å; L663-L665 VanDerWaalsContact C-N 3.33Å; L663-L665 PolarHBondContact O-N 3.47Å; L665-A667 PolarHBondContact O-N 3.04Å; L665-S668 PolarHBondContact O-N 2.85Å; L665-L669 HydrophobicContact CD1-CD1 3.88Å; L665-L669 HydrophobicContact CD1-CG 4.15Å; L665-L669 HydrophobicContact CG-CD1 4.06Å; L665-L669 WeakPolarHBondContact O-CB 3.33Å; L665-L669 VanDerWaalsContact O-CG 3.27Å; L665-L669 WeakPolarHBondContact O-CG 3.42Å; L665-L669 PolarHBondContact O-N 2.88Å
666	K	81.2	Confident	81.1	Confident	67 Å²	67	59.5 Å²	59.5	29%	0.291	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-44.1	176.8	-77.7	175.1	-179.8	170.4	0	111.9	Q662 L663 L669 Q670	Q662-K666 WeakPolarHBondContact O-CB 3.39Å; Q662-K666 WeakPolarHBondContact O-CG 3.08Å; Q662-K666 PolarHBondContact O-N 2.76Å; L663-K666 PolarHBondContact O-N 3.45Å; K666-L669 PolarHBondContact O-N 2.95Å; K666-Q670 VanDerWaalsContact O-CB 3.29Å; K666-Q670 WeakPolarHBondContact O-CB 3.46Å; K666-Q670 PolarHBondContact O-N 3.42Å
667	A	81.5	Confident	81.3	Confident	59 Å²	59	59.9 Å²	59.9	49%	0.488	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-47.7	178.9	0	0	0	0	0	112	L663 K664 L665 L669 Q670 E671	L663-A667 WeakPolarHBondContact O-CB 3.37Å; L663-A667 PolarHBondContact O-N 2.92Å; K664-A667 PolarHBondContact O-N 3.44Å; L665-A667 PolarHBondContact O-N 3.04Å; A667-L669 PolarHBondContact O-N 3.26Å; A667-Q670 PolarHBondContact O-N 2.86Å; A667-E671 PolarHBondContact O-N 2.9Å
668	S	82.6	Confident	81.4	Confident	32 Å²	32	62.8 Å²	62.8	22%	0.224	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-44	178	-175.8	0	0	0	0	112.4	K664 L665 Q670 E671 Q672	K664-S668 WeakPolarHBondContact O-CB 3.39Å; K664-S668 PolarHBondContact O-N 3.46Å; L665-S668 PolarHBondContact O-N 2.85Å; S668-Q670 VanDerWaalsContact C-N 3.29Å; S668-Q670 PolarHBondContact O-N 3.45Å; S668-E671 PolarHBondContact O-N 3.03Å; S668-Q672 WeakPolarHBondContact O-CG 3.37Å; S668-Q672 PolarHBondContact O-N 2.73Å
669	L	84.3	Confident	81.5	Confident	11 Å²	11	65.6 Å²	65.6	6%	0.058	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-36.8	175.6	-70.5	170.9	0	0	0	111.9	I605 I608 Q609 I612 L665 K666 A667 K673	I605-L669 HydrophobicContact CG2-CB 4.23Å; I605-L669 HydrophobicContact CG2-CD2 4.15Å; I608-L669 HydrophobicContact CB-CD1 4.32Å; I608-L669 HydrophobicContact CG2-CD1 3.57Å; I608-L669 HydrophobicContact CG2-CD2 4.31Å; Q609-L669 HydrophobicContact CG-CB 4.11Å; Q609-L669 HydrophobicContact CG-CD1 4.15Å; I612-L669 HydrophobicContact CD1-CD1 3.76Å; L665-L669 HydrophobicContact CD1-CD1 3.88Å; L665-L669 HydrophobicContact CD1-CG 4.15Å; L665-L669 HydrophobicContact CG-CD1 4.06Å; L665-L669 WeakPolarHBondContact O-CB 3.33Å; L665-L669 VanDerWaalsContact O-CG 3.27Å; L665-L669 WeakPolarHBondContact O-CG 3.42Å; L665-L669 PolarHBondContact O-N 2.88Å; K666-L669 PolarHBondContact O-N 2.95Å; A667-L669 PolarHBondContact O-N 3.26Å; L669-K673 VanDerWaalsContact O-CB 3.23Å; L669-K673 WeakPolarHBondContact O-CB 2.98Å; L669-K673 PolarHBondContact O-N 2.93Å
670	Q	83.3	Confident	81.6	Confident	115 Å²	115	60.8 Å²	60.8	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-68.8	-40.8	177.5	-175.1	166.5	-20.1	0	0	111.9	K666 A667 S668 K673 I674	K666-Q670 VanDerWaalsContact O-CB 3.29Å; K666-Q670 WeakPolarHBondContact O-CB 3.46Å; K666-Q670 PolarHBondContact O-N 3.42Å; A667-Q670 PolarHBondContact O-N 2.86Å; S668-Q670 VanDerWaalsContact C-N 3.29Å; S668-Q670 PolarHBondContact O-N 3.45Å; Q670-K673 PolarHBondContact O-N 2.94Å; Q670-I674 HydrophobicContact CG-CD1 3.97Å; Q670-I674 VanDerWaalsContact O-CG1 3.24Å; Q670-I674 WeakPolarHBondContact O-CG1 3.24Å; Q670-I674 PolarHBondContact O-N 2.89Å
671	E	83	Confident	81.6	Confident	142 Å²	142	58.4 Å²	58.4	66%	0.664	32%	0.316	S	S	*	.	H	α-helix	trans	-61.1	-50.5	173.6	-175.8	179.8	-171.9	0	0	111.5	A667 S668 K673 I674 A675	A667-E671 PolarHBondContact O-N 2.9Å; S668-E671 PolarHBondContact O-N 3.03Å; E671-K673 VanDerWaalsContact C-N 3.29Å; E671-K673 PolarHBondContact O-N 3.22Å; E671-I674 PolarHBondContact O-N 2.99Å; E671-I674 VanDerWaalsContact O-N 3.14Å; E671-A675 PolarHBondContact O-N 2.8Å
672	Q	82.6	Confident	81.3	Confident	101 Å²	101	64.8 Å²	64.8	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-58.3	-41.9	175.9	-70.7	-179.3	12.5	0	0	111.7	I605 S668 L676	I605-Q672 HydrophobicContact CD1-CB 3.97Å; S668-Q672 WeakPolarHBondContact O-CG 3.37Å; S668-Q672 PolarHBondContact O-N 2.73Å; Q672-L676 VanDerWaalsContact O-CB 3.27Å; Q672-L676 WeakPolarHBondContact O-CB 3.31Å; Q672-L676 PolarHBondContact O-N 3.09Å
673	K	83.5	Confident	80.7	Confident	55 Å²	55	66.7 Å²	66.7	24%	0.239	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-43.9	176.1	-174.7	177.8	-177.1	172.3	0	111.7	I605 E606 L669 Q670 E671 L676 V677	I605-K673 HydrophobicContact CG2-CB 4.07Å; E606-K673 HydrophobicContact CG-CD 4.36Å; E606-K673 WeakPolarHBondContact OE1-CE 3.22Å; E606-K673 IonicContact OE1-NZ 3.83Å; E606-K673 PolarHBondContact OE1-NZ 3.09Å; E606-K673 VanDerWaalsContact OE1-NZ 3.1Å; L669-K673 VanDerWaalsContact O-CB 3.23Å; L669-K673 WeakPolarHBondContact O-CB 2.98Å; L669-K673 PolarHBondContact O-N 2.93Å; Q670-K673 PolarHBondContact O-N 2.94Å; E671-K673 VanDerWaalsContact C-N 3.29Å; E671-K673 PolarHBondContact O-N 3.22Å; K673-L676 PolarHBondContact O-N 3.2Å; K673-V677 HydrophobicContact CG-CG2 4.44Å; K673-V677 WeakPolarHBondContact O-CB 3.48Å; K673-V677 WeakPolarHBondContact O-CG2 3.22Å; K673-V677 PolarHBondContact O-N 2.84Å
674	I	81.5	Confident	80.2	Confident	102 Å²	102	66.2 Å²	66.2	52%	0.523	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-46	179.8	-70	164.3	0	0	0	110.8	Q670 E671 L676 V677 S678	Q670-I674 HydrophobicContact CG-CD1 3.97Å; Q670-I674 VanDerWaalsContact O-CG1 3.24Å; Q670-I674 WeakPolarHBondContact O-CG1 3.24Å; Q670-I674 PolarHBondContact O-N 2.89Å; E671-I674 PolarHBondContact O-N 2.99Å; E671-I674 VanDerWaalsContact O-N 3.14Å; I674-L676 VanDerWaalsContact C-N 3.29Å; I674-L676 PolarHBondContact O-N 3.41Å; I674-V677 PolarHBondContact O-N 2.84Å; I674-S678 PolarHBondContact O-N 3.31Å
675	A	82.6	Confident	79.2	Confident	59 Å²	59	71 Å²	71	49%	0.488	36%	0.364	S	S	.	.	H	α-helix	trans	-57.1	-45.3	176.3	0	0	0	0	0	111.2	E671 S678 E679	E671-A675 PolarHBondContact O-N 2.8Å; A675-S678 WeakPolarHBondContact O-CB 3.08Å; A675-S678 PolarHBondContact O-N 2.96Å; A675-E679 PolarHBondContact O-N 2.85Å
676	L	84.5	Confident	77.8	Confident	19 Å²	19	76.3 Å²	76.3	10%	0.099	39%	0.392	C	S	.	.	H	α-helix	trans	-72.1	-33.2	-178.6	-147.5	138.1	0	0	0	112.5	L598 K601 K602 Q672 K673 I674 L680	L598-L676 HydrophobicContact CB-CD2 4.22Å; L598-L676 HydrophobicContact CD2-CD1 4.45Å; L598-L676 HydrophobicContact CD2-CG 4.34Å; L598-L676 WeakPolarHBondContact O-CD2 3.48Å; K601-L676 HydrophobicContact CB-CD1 3.84Å; K601-L676 HydrophobicContact CD-CD1 4.32Å; K602-L676 HydrophobicContact CB-CD2 3.73Å; Q672-L676 VanDerWaalsContact O-CB 3.27Å; Q672-L676 WeakPolarHBondContact O-CB 3.31Å; Q672-L676 PolarHBondContact O-N 3.09Å; K673-L676 PolarHBondContact O-N 3.2Å; I674-L676 VanDerWaalsContact C-N 3.29Å; I674-L676 PolarHBondContact O-N 3.41Å; L676-L680 HydrophobicContact CD2-CD1 3.88Å; L676-L680 HydrophobicContact CD2-CG 4.29Å; L676-L680 WeakPolarHBondContact O-CB 3.32Å; L676-L680 WeakPolarHBondContact O-CG 3.46Å; L676-L680 PolarHBondContact O-N 3.47Å
677	V	82.8	Confident	76.2	Confident	59 Å²	59	76.1 Å²	76.1	36%	0.358	39%	0.394	S	S	.	.	H	α-helix	trans	-67.7	-38.7	171	167.8	0	0	0	0	111.3	K602 K673 I674 L680 A681	K602-V677 HydrophobicContact CD-CG2 4.21Å; K673-V677 HydrophobicContact CG-CG2 4.44Å; K673-V677 WeakPolarHBondContact O-CB 3.48Å; K673-V677 WeakPolarHBondContact O-CG2 3.22Å; K673-V677 PolarHBondContact O-N 2.84Å; I674-V677 PolarHBondContact O-N 2.84Å; V677-L680 PolarHBondContact O-N 2.88Å; V677-A681 VanDerWaalsContact O-CB 3.25Å; V677-A681 WeakPolarHBondContact O-CB 3.48Å; V677-A681 PolarHBondContact O-N 2.75Å
678	S	79.3	Confident	74.6	Confident	60 Å²	60	79.5 Å²	79.5	42%	0.42	40%	0.403	S	S	.	.	H	α-helix	trans	-63.6	-43.9	174.5	-176.5	0	0	0	0	111.5	I674 A675 A681 K682	I674-S678 PolarHBondContact O-N 3.31Å; A675-S678 WeakPolarHBondContact O-CB 3.08Å; A675-S678 PolarHBondContact O-N 2.96Å; S678-A681 PolarHBondContact O-N 3.23Å; S678-K682 WeakPolarHBondContact O-CG 3.49Å; S678-K682 PolarHBondContact O-N 2.75Å
679	E	78.8	Confident	72.5	Confident	98 Å²	98	85 Å²	85	46%	0.458	43%	0.43	S	S	.	.	H	α-helix	trans	-63.8	-46.7	176.3	-161.4	170.3	-155.8	0	0	111.2	A675 A681 K682 E683	A675-E679 PolarHBondContact O-N 2.85Å; E679-A681 VanDerWaalsContact C-N 3.32Å; E679-A681 PolarHBondContact O-N 2.8Å; E679-K682 PolarHBondContact O-N 2.69Å; E679-E683 WeakPolarHBondContact O-CG 3.45Å; E679-E683 PolarHBondContact O-N 3.18Å; E679-E683 VanDerWaalsContact O-N 3.09Å
680	L	80.8	Confident	70.6	Confident	7 Å²	7	88.4 Å²	88.4	4%	0.037	46%	0.455	C	S	.	.	H	α-helix	trans	-59.8	-39.2	172.9	-75.9	170.4	0	0	0	112.5	L595 L598 K599 K602 L676 V677 E683 E684	L595-L680 HydrophobicContact CD2-CD2 3.79Å; L598-L680 HydrophobicContact CB-CD2 3.76Å; L598-L680 HydrophobicContact CB-CG 4.33Å; L598-L680 HydrophobicContact CD1-CD2 4.41Å; K599-L680 HydrophobicContact CG-CD2 4.1Å; K602-L680 HydrophobicContact CB-CD1 4.4Å; K602-L680 HydrophobicContact CD-CD1 3.73Å; L676-L680 HydrophobicContact CD2-CD1 3.88Å; L676-L680 HydrophobicContact CD2-CG 4.29Å; L676-L680 WeakPolarHBondContact O-CB 3.32Å; L676-L680 WeakPolarHBondContact O-CG 3.46Å; L676-L680 PolarHBondContact O-N 3.47Å; V677-L680 PolarHBondContact O-N 2.88Å; L680-E683 PolarHBondContact O-N 3.2Å; L680-E684 VanDerWaalsContact O-CB 3.3Å; L680-E684 WeakPolarHBondContact O-CB 3.26Å; L680-E684 WeakPolarHBondContact O-CG 3.48Å; L680-E684 PolarHBondContact O-N 3.48Å
681	A	78.3	Confident	68.2	Low	40 Å²	40	87.8 Å²	87.8	33%	0.331	46%	0.459	S	S	.	.	H	α-helix	trans	-70.2	-33.7	178.8	0	0	0	0	0	112.6	V677 S678 E679 R685	V677-A681 VanDerWaalsContact O-CB 3.25Å; V677-A681 WeakPolarHBondContact O-CB 3.48Å; V677-A681 PolarHBondContact O-N 2.75Å; S678-A681 PolarHBondContact O-N 3.23Å; E679-A681 VanDerWaalsContact C-N 3.32Å; E679-A681 PolarHBondContact O-N 2.8Å; A681-R685 WeakPolarHBondContact O-CB 3.31Å; A681-R685 WeakPolarHBondContact O-CG 3.46Å; A681-R685 PolarHBondContact O-N 3.14Å; A681-R685 VanDerWaalsContact O-N 3.14Å
682	K	74.2	Confident	65.5	Low	143 Å²	143	89.4 Å²	89.4	62%	0.622	47%	0.467	S	S	*	.	H	α-helix	trans	-62.6	-45.1	171.4	-73.3	174.9	-176.9	179.1	0	110.8	S678 E679 L686	S678-K682 WeakPolarHBondContact O-CG 3.49Å; S678-K682 PolarHBondContact O-N 2.75Å; E679-K682 PolarHBondContact O-N 2.69Å; K682-L686 WeakPolarHBondContact O-CG 3.49Å; K682-L686 PolarHBondContact O-N 2.93Å
683	E	65.3	Low	63.2	Low	52 Å²	52	90.8 Å²	90.8	24%	0.243	48%	0.484	C	S	.	.	H	α-helix	trans	-73.4	-41.2	-179.7	-63.9	-63.5	155.4	0	0	112.8	L595 E679 L680 R685 L686 D687	L595-E683 HydrophobicContact CD2-CB 4.19Å; E679-E683 WeakPolarHBondContact O-CG 3.45Å; E679-E683 PolarHBondContact O-N 3.18Å; E679-E683 VanDerWaalsContact O-N 3.09Å; L680-E683 PolarHBondContact O-N 3.2Å; E683-R685 VanDerWaalsContact C-N 3.33Å; E683-R685 PolarHBondContact O-N 2.91Å; E683-L686 WeakPolarHBondContact O-CB 3.25Å; E683-L686 PolarHBondContact O-N 2.99Å; E683-L686 VanDerWaalsContact O-N 3.1Å; E683-D687 PolarHBondContact O-N 3.21Å; E683-D687 VanDerWaalsContact O-N 3.11Å
684	E	69.7	Low	60.6	Low	80 Å²	80	91.9 Å²	91.9	37%	0.374	51%	0.511	S	S	.	.	H	α-helix	trans	-69.4	-29.7	179.1	-75.4	-175.3	163.3	0	0	112.4	L595 K599 L680 L686 D687 L688	L595-E684 HydrophobicContact CD2-CG 4.4Å; K599-E684 VanDerWaalsContact CE-OE1 3.22Å; K599-E684 WeakPolarHBondContact CE-OE1 3.28Å; K599-E684 IonicContact NZ-OE1 3.33Å; K599-E684 PolarHBondContact NZ-OE1 3.2Å; L680-E684 VanDerWaalsContact O-CB 3.3Å; L680-E684 WeakPolarHBondContact O-CB 3.26Å; L680-E684 WeakPolarHBondContact O-CG 3.48Å; L680-E684 PolarHBondContact O-N 3.48Å; E684-L686 VanDerWaalsContact C-N 3.3Å; E684-D687 PolarHBondContact O-N 2.82Å; E684-L688 PolarHBondContact O-N 2.86Å
685	R	60.7	Low	57.9	Low	189 Å²	189	93.4 Å²	93.4	71%	0.713	53%	0.525	S	S	*	.	H	α-helix	trans	-63.3	-37	169.6	-78.1	178	-178.4	-161.6	1.1	111.8	A681 E683 L688 D689	A681-R685 WeakPolarHBondContact O-CB 3.31Å; A681-R685 WeakPolarHBondContact O-CG 3.46Å; A681-R685 PolarHBondContact O-N 3.14Å; A681-R685 VanDerWaalsContact O-N 3.14Å; E683-R685 VanDerWaalsContact C-N 3.33Å; E683-R685 PolarHBondContact O-N 2.91Å; R685-L688 PolarHBondContact O-N 2.9Å; R685-D689 PolarHBondContact O-N 2.85Å
686	L	52.8	Low	55.5	Low	113 Å²	113	96.6 Å²	96.6	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-67.1	-37.3	174.6	-66.1	166.1	0	0	0	111.8	K682 E683 E684 S690	K682-L686 WeakPolarHBondContact O-CG 3.49Å; K682-L686 PolarHBondContact O-N 2.93Å; E683-L686 WeakPolarHBondContact O-CB 3.25Å; E683-L686 PolarHBondContact O-N 2.99Å; E683-L686 VanDerWaalsContact O-N 3.1Å; E684-L686 VanDerWaalsContact C-N 3.3Å; L686-S690 PolarHBondContact O-N 3.19Å
687	D	48.6	Very low	52.6	Low	63 Å²	63	104.1 Å²	104.1	34%	0.337	58%	0.579	S	S	.	*	H	α-helix	trans	-67.6	-40.5	176.1	-100.6	-15.5	0	0	0	112.4	E683 E684 S690 T691	E683-D687 PolarHBondContact O-N 3.21Å; E683-D687 VanDerWaalsContact O-N 3.11Å; E684-D687 PolarHBondContact O-N 2.82Å; D687-S690 PolarHBondContact O-N 3.43Å; D687-S690 PolarHBondContact O-OG 3.25Å; D687-T691 PolarHBondContact O-N 3.46Å; D687-T691 PolarHBondContact O-OG1 2.79Å
688	L	46.6	Very low	50	Low	130 Å²	130	106.9 Å²	106.9	68%	0.681	60%	0.601	S	S	*	*	H	α-helix	trans	-68.1	-38.6	179.2	-77.3	161.7	0	0	0	112.9	E684 R685 S690 T691	E684-L688 PolarHBondContact O-N 2.86Å; R685-L688 PolarHBondContact O-N 2.9Å; L688-S690 PolarHBondContact O-N 2.91Å; L688-T691 PolarHBondContact O-N 3.25Å; L688-T691 PolarHBondContact O-OG1 3.22Å
689	D	39.2	Very low	47.7	Very low	147 Å²	147	113.6 Å²	113.6	79%	0.786	62%	0.622	S	S	*	*	H	α-helix	trans	-67.7	-24.2	173.8	-88.5	-13.3	0	0	0	112.4	R685 T691	R685-D689 PolarHBondContact O-N 2.85Å; D689-T691 VanDerWaalsContact C-N 3.34Å
690	S	44.9	Very low	45.2	Very low	83 Å²	83	115.7 Å²	115.7	58%	0.58	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-9.6	177.2	80.5	0	0	0	0	114.4	L686 D687 L688	L686-S690 PolarHBondContact O-N 3.19Å; D687-S690 PolarHBondContact O-N 3.43Å; D687-S690 PolarHBondContact O-OG 3.25Å; L688-S690 PolarHBondContact O-N 2.91Å
691	T	32.5	Very low	42.9	Very low	101 Å²	101	121.2 Å²	121.2	62%	0.62	68%	0.675	S	S	*	*			trans	-107.7	42.7	-173.8	25.1	0	0	0	0	114.6	D687 L688 D689	D687-T691 PolarHBondContact O-N 3.46Å; D687-T691 PolarHBondContact O-OG1 2.79Å; L688-T691 PolarHBondContact O-N 3.25Å; L688-T691 PolarHBondContact O-OG1 3.22Å; D689-T691 VanDerWaalsContact C-N 3.34Å
692	Q	25.7	Very low	40.7	Very low	177 Å²	177	124.7 Å²	124.7	83%	0.827	69%	0.694	S	S	*	*			trans	-151	147.1	155.3	-68.1	-163.3	0.7	0	0	110.8
693	P	35.7	Very low	38.6	Very low	130 Å²	130	124.1 Å²	124.1	84%	0.844	70%	0.703	S	S	*	*			cis	-125.6	165.2	-22.4	37.1	-21.2	0	0	0	112.8
694	G	29.2	Very low	36.9	Very low	78 Å²	78	127.3 Å²	127.3	80%	0.804	73%	0.726	S	S	*	*			trans	172.1	82.8	171.9	0	0	0	0	0	114.8
695	T	24.5	Very low	35.2	Very low	134 Å²	134	132.8 Å²	132.8	82%	0.822	75%	0.749	S	S	*	*			trans	-49	135.9	174.4	-15.3	0	0	0	0	114.1
696	S	31.1	Very low	33.9	Very low	125 Å²	125	133.9 Å²	133.9	87%	0.874	75%	0.754	S	S	*	*			trans	-164.6	130.8	139.1	-80.9	0	0	0	0	111.2
697	Q	24.7	Very low	33	Very low	178 Å²	178	136.8 Å²	136.8	83%	0.832	77%	0.765	S	S	*	*			trans	-74.6	134.7	-169.9	-60.7	157.4	-20.4	0	0	111.6
698	S	27.1	Very low	32.8	Very low	117 Å²	117	140.7 Å²	140.7	82%	0.818	78%	0.784	S	S	*	*				172.8	139.9	126.6	-85.6	0	0	0	0	113.6
699	K	30.7	Very low	32.5	Very low	200 Å²	200	143 Å²	143	87%	0.87	79%	0.792	S	S	*	*			trans	79.5	77.4	173.3	-62.5	-175.3	179.5	178.5	0	116.6	V701	K699-V701 PolarHBondContact O-N 3.17Å
700	V	27.6	Very low	33.3	Very low	142 Å²	142	141.1 Å²	141.1	86%	0.861	78%	0.78	S	S	*	*			trans	-59	113.2	160.5	179.2	0	0	0	0	109.8
701	V	33	Very low	34	Very low	124 Å²	124	144.6 Å²	144.6	75%	0.752	79%	0.785	S	S	*	*			trans	-111.6	135.5	155.2	176.3	0	0	0	0	105.6	K699 T703	K699-V701 PolarHBondContact O-N 3.17Å; V701-T703 PolarHBondContact O-N 2.63Å
702	P	31	Very low	35.7	Very low	113 Å²	113	147.8 Å²	147.8	73%	0.734	79%	0.793	S	S	*	*			trans	-74.6	122.4	-151.5	17.6	-15.5	0	0	0	113.1	T704	P702-T704 PolarHBondContact O-N 3.01Å
703	T	30.1	Very low	37.9	Very low	131 Å²	131	142.7 Å²	142.7	80%	0.804	78%	0.781	S	S	*	*			trans	-74.2	110.4	172.4	-28.1	0	0	0	0	109.7	V701 K705	V701-T703 PolarHBondContact O-N 2.63Å; T703-K705 PolarHBondContact O-N 3.44Å; T703-K705 VanDerWaalsContact O-N 3.11Å
704	T	30.4	Very low	39.7	Very low	118 Å²	118	141.5 Å²	141.5	72%	0.724	77%	0.765	S	S	*	*			trans	-62.3	108.7	164.3	0	0	0	0	0	108.3	P702 Y706	P702-T704 PolarHBondContact O-N 3.01Å; T704-Y706 PolarHBondContact O-N 3.27Å
705	K	33.1	Very low	42	Very low	195 Å²	195	144 Å²	144	85%	0.848	75%	0.754	S	S	*	*			trans	-60.6	105.7	170.2	-82.7	177.7	174.1	176.8	0	108.9	T703 Q707	T703-K705 PolarHBondContact O-N 3.44Å; T703-K705 VanDerWaalsContact O-N 3.11Å; K705-Q707 PolarHBondContact O-N 2.89Å; K705-Q707 VanDerWaalsContact O-N 3.1Å
706	Y	34.7	Very low	44.3	Very low	212 Å²	212	142 Å²	142	83%	0.831	74%	0.737	S	S	*	*			trans	-69.8	97.9	160.8	-77.3	-88	0	0	0	108.1	T704 I708	T704-Y706 PolarHBondContact O-N 3.27Å; Y706-I708 PolarHBondContact O-N 3.38Å
707	Q	33.4	Very low	46.5	Very low	175 Å²	175	142.9 Å²	142.9	82%	0.818	73%	0.727	S	S	*	*			trans	-74.2	109.5	162	-78.8	-179.1	-39.2	0	0	107.5	K705 E709	K705-Q707 PolarHBondContact O-N 2.89Å; K705-Q707 VanDerWaalsContact O-N 3.1Å; Q707-E709 PolarHBondContact O-N 3.18Å; Q707-E709 VanDerWaalsContact O-N 3.17Å
708	I	43.8	Very low	49.1	Very low	144 Å²	144	139 Å²	139	74%	0.738	71%	0.712	S	S	*	*			trans	-79.4	92.8	175.4	-55.5	172.8	0	0	0	106.9	Y706 I710	Y706-I708 PolarHBondContact O-N 3.38Å; I708-I710 HydrophobicContact CG2-CD1 4.45Å; I708-I710 HydrophobicContact CG2-CG1 3.74Å; I708-I710 PolarHBondContact O-N 3.28Å
709	E	40.4	Very low	51.6	Low	179 Å²	179	140 Å²	140	84%	0.836	70%	0.698	S	S	*	*			trans	-76.3	95.6	165.5	-80.3	-172.8	157.8	0	0	109	Q707 K711	Q707-E709 PolarHBondContact O-N 3.18Å; Q707-E709 VanDerWaalsContact O-N 3.17Å; E709-K711 PolarHBondContact O-N 3.44Å
710	I	56.2	Low	53.9	Low	108 Å²	108	137 Å²	137	55%	0.554	69%	0.685	S	S	*	*			trans	-72.7	117	171.6	-57.6	175.9	0	0	0	107.7	I708 Q712 E714	I708-I710 HydrophobicContact CG2-CD1 4.45Å; I708-I710 HydrophobicContact CG2-CG1 3.74Å; I708-I710 PolarHBondContact O-N 3.28Å; I710-Q712 PolarHBondContact O-N 2.83Å; I710-E714 HydrophobicContact CG2-CB 4.21Å
711	K	59.4	Low	56.5	Low	155 Å²	155	138.8 Å²	138.8	67%	0.674	68%	0.676	S	S	*	*			trans	-66.6	135.3	178.7	-69.3	-179.6	179.2	177.7	0	109.6	E709 A713 E714 F715	E709-K711 PolarHBondContact O-N 3.44Å; K711-A713 PolarHBondContact O-N 3.06Å; K711-E714 WeakPolarHBondContact O-CB 3.28Å; K711-E714 PolarHBondContact O-N 2.97Å; K711-F715 PolarHBondContact O-N 3.11Å
712	Q	67.4	Low	58.8	Low	168 Å²	168	136.7 Å²	136.7	79%	0.785	66%	0.664	S	S	*	*	H	α-helix	trans	-52	-28.9	-176.3	-154.1	174.6	9.2	0	0	113.8	I710 F715 I716	I710-Q712 PolarHBondContact O-N 2.83Å; Q712-F715 PolarHBondContact O-N 3.04Å; Q712-I716 WeakPolarHBondContact O-CG1 3.43Å; Q712-I716 PolarHBondContact O-N 3.42Å
713	A	72.3	Confident	61.1	Low	71 Å²	71	134 Å²	134	59%	0.587	64%	0.644	S	S	*	*	H	α-helix	trans	-66	-39.4	173.9	0	0	0	0	0	113.5	K711 F715 I716 Q717	K711-A713 PolarHBondContact O-N 3.06Å; A713-F715 VanDerWaalsContact C-N 3.33Å; A713-I716 PolarHBondContact O-N 3Å; A713-Q717 PolarHBondContact O-N 3.36Å; A713-Q717 VanDerWaalsContact O-N 3.09Å
714	E	74.7	Confident	63.5	Low	105 Å²	105	137.2 Å²	137.2	49%	0.491	64%	0.641	S	S	.	*	H	α-helix	trans	-66.6	-37.4	176.7	-66.9	-179.8	166	0	0	110.8	I710 K711 Q717 L718	I710-E714 HydrophobicContact CG2-CB 4.21Å; K711-E714 WeakPolarHBondContact O-CB 3.28Å; K711-E714 PolarHBondContact O-N 2.97Å; E714-Q717 PolarHBondContact O-N 3.3Å; E714-L718 WeakPolarHBondContact O-CB 3.4Å; E714-L718 PolarHBondContact O-N 2.82Å
715	F	75.4	Confident	65.9	Low	131 Å²	131	136.7 Å²	136.7	58%	0.575	63%	0.632	S	S	*	*	H	α-helix	trans	-63.5	-44.2	175.7	-175.2	-97.1	0	0	0	112.2	K711 Q712 A713 Q717 L718 Y719	K711-F715 PolarHBondContact O-N 3.11Å; Q712-F715 PolarHBondContact O-N 3.04Å; A713-F715 VanDerWaalsContact C-N 3.33Å; F715-Q717 VanDerWaalsContact C-N 3.31Å; F715-Q717 PolarHBondContact O-N 3.03Å; F715-L718 PolarHBondContact O-N 3.45Å; F715-Y719 WeakPolarHBondContact O-CB 3.36Å; F715-Y719 PolarHBondContact O-N 3.36Å
716	I	74.6	Confident	68.1	Low	92 Å²	92	133.3 Å²	133.3	47%	0.472	62%	0.62	S	S	.	*	H	α-helix	trans	-64.9	-37.6	177.4	-66	167.7	0	0	0	111	Q712 A713 Y719 K720	Q712-I716 WeakPolarHBondContact O-CG1 3.43Å; Q712-I716 PolarHBondContact O-N 3.42Å; A713-I716 PolarHBondContact O-N 3Å; I716-Y719 PolarHBondContact O-N 3.48Å; I716-K720 WeakPolarHBondContact O-CG 3.28Å; I716-K720 PolarHBondContact O-N 3.19Å
717	Q	77.6	Confident	70.3	Confident	142 Å²	142	129.1 Å²	129.1	66%	0.664	61%	0.612	S	S	*	*	H	α-helix	trans	-69.1	-40.1	177.7	-163.3	174.6	7.8	0	0	111.8	A713 E714 F715 R721	A713-Q717 PolarHBondContact O-N 3.36Å; A713-Q717 VanDerWaalsContact O-N 3.09Å; E714-Q717 PolarHBondContact O-N 3.3Å; F715-Q717 VanDerWaalsContact C-N 3.31Å; F715-Q717 PolarHBondContact O-N 3.03Å; Q717-R721 WeakPolarHBondContact O-CB 3.4Å; Q717-R721 PolarHBondContact O-N 2.84Å; Q717-R721 VanDerWaalsContact O-N 3.07Å
718	L	78.3	Confident	72.5	Confident	98 Å²	98	122.2 Å²	122.2	51%	0.513	59%	0.588	S	S	.	*	H	α-helix	trans	-62.4	-46.3	172.1	-85.8	158.9	0	0	0	111.5	E714 F715 K720 R721 V722	E714-L718 WeakPolarHBondContact O-CB 3.4Å; E714-L718 PolarHBondContact O-N 2.82Å; F715-L718 PolarHBondContact O-N 3.45Å; L718-K720 PolarHBondContact O-N 2.86Å; L718-R721 CarbonylContact O-C 3.55Å; L718-R721 WeakPolarHBondContact O-CA 3.47Å; L718-R721 WeakPolarHBondContact O-CB 3.25Å; L718-R721 PolarHBondContact O-N 3.06Å; L718-V722 WeakPolarHBondContact O-CG2 3.36Å; L718-V722 PolarHBondContact O-N 3.44Å
719	Y	78.9	Confident	74.2	Confident	137 Å²	137	120.8 Å²	120.8	54%	0.537	58%	0.579	S	S	.	*	H	α-helix	trans	-59.2	-44.8	178.2	-172.2	-96.5	0	0	0	112	F715 I716 R721 V722 N723	F715-Y719 WeakPolarHBondContact O-CB 3.36Å; F715-Y719 PolarHBondContact O-N 3.36Å; I716-Y719 PolarHBondContact O-N 3.48Å; Y719-R721 VanDerWaalsContact C-N 3.28Å; Y719-R721 PolarHBondContact O-N 3.16Å; Y719-V722 PolarHBondContact O-N 3.43Å; Y719-N723 PolarHBondContact O-N 2.73Å
720	K	80.5	Confident	76.1	Confident	136 Å²	136	114.4 Å²	114.4	59%	0.591	56%	0.561	S	S	*	*	H	α-helix	trans	-62.2	-34.9	173.8	-75.3	-178.4	179.5	-179.7	0	112.7	I716 L718 R724	I716-K720 WeakPolarHBondContact O-CG 3.28Å; I716-K720 PolarHBondContact O-N 3.19Å; L718-K720 PolarHBondContact O-N 2.86Å; K720-R724 WeakPolarHBondContact O-CG 3.38Å; K720-R724 PolarHBondContact O-N 3.1Å
721	R	80.9	Confident	77.3	Confident	180 Å²	180	116 Å²	116	68%	0.679	57%	0.567	S	S	*	*	H	α-helix	trans	-72.4	-38.8	178.7	-158.5	175.9	-177.6	178.4	1.5	111.3	Q717 L718 Y719 R724 I725	Q717-R721 WeakPolarHBondContact O-CB 3.4Å; Q717-R721 PolarHBondContact O-N 2.84Å; Q717-R721 VanDerWaalsContact O-N 3.07Å; L718-R721 CarbonylContact O-C 3.55Å; L718-R721 WeakPolarHBondContact O-CA 3.47Å; L718-R721 WeakPolarHBondContact O-CB 3.25Å; L718-R721 PolarHBondContact O-N 3.06Å; Y719-R721 VanDerWaalsContact C-N 3.28Å; Y719-R721 PolarHBondContact O-N 3.16Å; R721-R724 PolarHBondContact O-N 2.93Å; R721-I725 WeakPolarHBondContact O-CG1 3.41Å; R721-I725 PolarHBondContact O-N 3.41Å; R721-I725 VanDerWaalsContact O-N 3.11Å
722	V	81.4	Confident	78.3	Confident	81 Å²	81	112.5 Å²	112.5	49%	0.491	56%	0.558	S	S	.	*	H	α-helix	trans	-64.9	-46.7	174.7	173.4	0	0	0	0	110.9	L718 Y719 R724 I725 E726	L718-V722 WeakPolarHBondContact O-CG2 3.36Å; L718-V722 PolarHBondContact O-N 3.44Å; Y719-V722 PolarHBondContact O-N 3.43Å; V722-R724 PolarHBondContact O-N 3.1Å; V722-I725 CarbonylContact O-C 3.55Å; V722-I725 WeakPolarHBondContact O-CA 3.44Å; V722-I725 WeakPolarHBondContact O-CB 3.49Å; V722-I725 PolarHBondContact O-N 3.21Å; V722-E726 PolarHBondContact O-N 2.96Å
723	N	78.9	Confident	79	Confident	57 Å²	57	108.4 Å²	108.4	31%	0.305	54%	0.541	S	S	.	.	H	α-helix	trans	-60.9	-32.4	176.8	-79.1	15.9	0	0	0	113.1	Y719 N727	Y719-N723 PolarHBondContact O-N 2.73Å; N723-N727 WeakPolarHBondContact O-CB 3.2Å; N723-N727 PolarHBondContact O-N 3.05Å
724	R	81	Confident	79.6	Confident	198 Å²	198	106.3 Å²	106.3	75%	0.747	53%	0.526	S	S	*	.	H	α-helix	trans	-68.6	-39.1	172.7	-75.4	-179	-174.5	173.2	0.9	112.2	K720 R721 V722 G728	K720-R724 WeakPolarHBondContact O-CG 3.38Å; K720-R724 PolarHBondContact O-N 3.1Å; R721-R724 PolarHBondContact O-N 2.93Å; V722-R724 PolarHBondContact O-N 3.1Å; R724-G728 PolarHBondContact O-N 2.82Å
725	I	81.6	Confident	80	Confident	106 Å²	106	107.3 Å²	107.3	54%	0.544	53%	0.531	S	S	.	.	H	α-helix	trans	-65.7	-43.8	175.5	-68.3	167.5	0	0	0	109.6	R721 V722 G728 M729	R721-I725 WeakPolarHBondContact O-CG1 3.41Å; R721-I725 PolarHBondContact O-N 3.41Å; R721-I725 VanDerWaalsContact O-N 3.11Å; V722-I725 CarbonylContact O-C 3.55Å; V722-I725 WeakPolarHBondContact O-CA 3.44Å; V722-I725 WeakPolarHBondContact O-CB 3.49Å; V722-I725 PolarHBondContact O-N 3.21Å; I725-G728 CarbonylContact O-C 3.56Å; I725-G728 PolarHBondContact O-N 3.41Å; I725-M729 WeakPolarHBondContact O-CB 3.28Å; I725-M729 PolarHBondContact O-N 3.34Å
726	E	79.1	Confident	80.3	Confident	124 Å²	124	105.5 Å²	105.5	58%	0.579	53%	0.526	S	S	*	.	H	α-helix	trans	-61.7	-46.2	179.1	-165.2	175.3	-164.8	0	0	111.8	V722 G728 M729 G730	V722-E726 PolarHBondContact O-N 2.96Å; E726-G728 VanDerWaalsContact C-N 3.35Å; E726-G728 PolarHBondContact O-N 3.47Å; E726-M729 PolarHBondContact O-N 2.93Å; E726-G730 PolarHBondContact O-N 2.97Å
727	N	80	Confident	80.7	Confident	124 Å²	124	106.3 Å²	106.3	66%	0.663	53%	0.528	S	S	*	.	H	α-helix	trans	-63	-38.4	174.1	-73.5	-8.1	0	0	0	112.8	N723 G730	N723-N727 WeakPolarHBondContact O-CB 3.2Å; N723-N727 PolarHBondContact O-N 3.05Å; N727-G730 PolarHBondContact O-N 3.11Å
728	G	80.9	Confident	81	Confident	31 Å²	31	104 Å²	104	32%	0.32	52%	0.52	S	S	.	.	H	α-helix	trans	-68.2	-35.1	174.7	0	0	0	0	0	112.7	R724 I725 E726 G730 Q731 V732	R724-G728 PolarHBondContact O-N 2.82Å; I725-G728 CarbonylContact O-C 3.56Å; I725-G728 PolarHBondContact O-N 3.41Å; E726-G728 VanDerWaalsContact C-N 3.35Å; E726-G728 PolarHBondContact O-N 3.47Å; G728-G730 VanDerWaalsContact C-N 3.34Å; G728-Q731 PolarHBondContact O-N 3.26Å; G728-V732 WeakPolarHBondContact O-CG2 3.48Å; G728-V732 PolarHBondContact O-N 2.85Å; G728-V732 VanDerWaalsContact O-N 3.16Å
729	M	79	Confident	81.2	Confident	113 Å²	113	103.2 Å²	103.2	56%	0.557	52%	0.519	S	S	*	.	H	α-helix	trans	-69.3	-33.8	177.9	-148.7	160	95.4	0	0	111.3	I725 E726 Q731 V732 I733	I725-M729 WeakPolarHBondContact O-CB 3.28Å; I725-M729 PolarHBondContact O-N 3.34Å; E726-M729 PolarHBondContact O-N 2.93Å; M729-Q731 VanDerWaalsContact C-N 3.3Å; M729-Q731 PolarHBondContact O-N 2.92Å; M729-V732 PolarHBondContact O-N 2.92Å; M729-I733 HydrophobicContact CG-CD1 4.43Å; M729-I733 WeakPolarHBondContact O-CB 3.41Å; M729-I733 VanDerWaalsContact O-CG1 3.26Å; M729-I733 WeakPolarHBondContact O-CG1 3.15Å; M729-I733 PolarHBondContact O-N 3.47Å
730	G	79.6	Confident	81.2	Confident	45 Å²	45	101.8 Å²	101.8	46%	0.464	52%	0.52	S	S	.	.	H	α-helix	trans	-57.4	-40.1	170.7	0	0	0	0	0	113.3	E726 N727 G728 G734	E726-G730 PolarHBondContact O-N 2.97Å; N727-G730 PolarHBondContact O-N 3.11Å; G728-G730 VanDerWaalsContact C-N 3.34Å; G730-G734 PolarHBondContact O-N 2.86Å; G730-G734 VanDerWaalsContact O-N 3.15Å
731	Q	82.3	Confident	81.3	Confident	143 Å²	143	101.3 Å²	101.3	67%	0.668	52%	0.518	S	S	*	.	H	α-helix	trans	-69.6	-41.2	175.2	-68.3	-179.1	-11.2	0	0	112.5	G728 M729 I733 G734 H735	G728-Q731 PolarHBondContact O-N 3.26Å; M729-Q731 VanDerWaalsContact C-N 3.3Å; M729-Q731 PolarHBondContact O-N 2.92Å; Q731-I733 VanDerWaalsContact C-N 3.34Å; Q731-I733 PolarHBondContact O-N 2.7Å; Q731-G734 PolarHBondContact O-N 2.93Å; Q731-H735 PolarHBondContact O-CD2 3.2Å; Q731-H735 PolarHBondContact O-N 2.82Å
732	V	80.6	Confident	81.2	Confident	81 Å²	81	95 Å²	95	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-40.4	177.6	175	0	0	0	0	111.2	G728 M729 G734 H735 I736	G728-V732 WeakPolarHBondContact O-CG2 3.48Å; G728-V732 PolarHBondContact O-N 2.85Å; G728-V732 VanDerWaalsContact O-N 3.16Å; M729-V732 PolarHBondContact O-N 2.92Å; V732-G734 VanDerWaalsContact C-N 3.34Å; V732-H735 PolarHBondContact O-N 3.43Å; V732-I736 HydrophobicContact CG1-CD1 3.96Å; V732-I736 HydrophobicContact CG1-CG1 4.49Å; V732-I736 WeakPolarHBondContact O-CG1 3.1Å; V732-I736 PolarHBondContact O-N 3.18Å
733	I	82	Confident	81	Confident	82 Å²	82	95.9 Å²	95.9	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-43.5	175.8	-69	165.8	0	0	0	110.3	M729 Q731 H735 I736 E737	M729-I733 HydrophobicContact CG-CD1 4.43Å; M729-I733 WeakPolarHBondContact O-CB 3.41Å; M729-I733 VanDerWaalsContact O-CG1 3.26Å; M729-I733 WeakPolarHBondContact O-CG1 3.15Å; M729-I733 PolarHBondContact O-N 3.47Å; Q731-I733 VanDerWaalsContact C-N 3.34Å; Q731-I733 PolarHBondContact O-N 2.7Å; I733-H735 PolarHBondContact O-N 2.67Å; I733-I736 PolarHBondContact O-N 2.82Å; I733-I736 VanDerWaalsContact O-N 3.16Å; I733-E737 PolarHBondContact O-N 2.98Å
734	G	83.1	Confident	81.1	Confident	27 Å²	27	95.4 Å²	95.4	28%	0.278	51%	0.507	S	S	.	.	H	α-helix	trans	-56.5	-46.1	173.6	0	0	0	0	0	112.9	G730 Q731 V732 I736 E737 D738	G730-G734 PolarHBondContact O-N 2.86Å; G730-G734 VanDerWaalsContact O-N 3.15Å; Q731-G734 PolarHBondContact O-N 2.93Å; V732-G734 VanDerWaalsContact C-N 3.34Å; G734-I736 PolarHBondContact O-N 3.19Å; G734-E737 PolarHBondContact O-N 2.92Å; G734-D738 PolarHBondContact O-N 3.12Å
735	H	84.4	Confident	81.1	Confident	126 Å²	126	87.4 Å²	87.4	58%	0.583	48%	0.48	S	S	*	.	H	α-helix	trans	-63.8	-36.7	175.9	-77.3	-55.4	0	0	0	113.6	Q731 V732 I733 D738 V739	Q731-H735 PolarHBondContact O-CD2 3.2Å; Q731-H735 PolarHBondContact O-N 2.82Å; V732-H735 PolarHBondContact O-N 3.43Å; I733-H735 PolarHBondContact O-N 2.67Å; H735-D738 PolarHBondContact O-N 3.48Å; H735-V739 VanDerWaalsContact O-CG2 3.3Å; H735-V739 WeakPolarHBondContact O-CG2 3.35Å; H735-V739 PolarHBondContact O-N 2.71Å
736	I	81.1	Confident	81	Confident	93 Å²	93	87 Å²	87	48%	0.477	48%	0.478	S	S	.	.	H	α-helix	trans	-66.9	-40.1	176.2	-69.8	169	0	0	0	110.5	V732 I733 G734 D738 V739 L740	V732-I736 HydrophobicContact CG1-CD1 3.96Å; V732-I736 HydrophobicContact CG1-CG1 4.49Å; V732-I736 WeakPolarHBondContact O-CG1 3.1Å; V732-I736 PolarHBondContact O-N 3.18Å; I733-I736 PolarHBondContact O-N 2.82Å; I733-I736 VanDerWaalsContact O-N 3.16Å; G734-I736 PolarHBondContact O-N 3.19Å; I736-D738 VanDerWaalsContact C-N 3.35Å; I736-V739 PolarHBondContact O-N 3.29Å; I736-L740 HydrophobicContact CG2-CD1 3.95Å; I736-L740 HydrophobicContact CG2-CG 4.39Å; I736-L740 WeakPolarHBondContact O-CB 3.45Å; I736-L740 WeakPolarHBondContact O-CG 3.38Å; I736-L740 PolarHBondContact O-N 3.38Å
737	E	83.8	Confident	81.1	Confident	109 Å²	109	87.8 Å²	87.8	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-41.6	174.5	-74.8	-176.6	179	0	0	111.9	I733 G734 L740 K741	I733-E737 PolarHBondContact O-N 2.98Å; G734-E737 PolarHBondContact O-N 2.92Å; E737-L740 PolarHBondContact O-N 3.32Å; E737-K741 WeakPolarHBondContact O-CG 3.37Å; E737-K741 PolarHBondContact O-N 3.12Å
738	D	84.3	Confident	81.3	Confident	93 Å²	93	88.2 Å²	88.2	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-62.7	-42.6	175.3	-67.8	-23.6	0	0	0	111.8	G734 H735 I736 K741 S742	G734-D738 PolarHBondContact O-N 3.12Å; H735-D738 PolarHBondContact O-N 3.48Å; I736-D738 VanDerWaalsContact C-N 3.35Å; D738-K741 PolarHBondContact O-N 3.41Å; D738-S742 PolarHBondContact O-N 3.4Å
739	V	80.8	Confident	81.3	Confident	82 Å²	82	88.3 Å²	88.3	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-65	-44	176.5	170.9	0	0	0	0	111.3	H735 I736 K741 S742 L743	H735-V739 VanDerWaalsContact O-CG2 3.3Å; H735-V739 WeakPolarHBondContact O-CG2 3.35Å; H735-V739 PolarHBondContact O-N 2.71Å; I736-V739 PolarHBondContact O-N 3.29Å; V739-K741 VanDerWaalsContact C-N 3.33Å; V739-K741 PolarHBondContact O-N 2.9Å; V739-S742 PolarHBondContact O-N 3.11Å; V739-S742 VanDerWaalsContact O-N 3.16Å; V739-S742 PolarHBondContact O-OG 2.94Å; V739-L743 HydrophobicContact CG1-CD1 4.12Å; V739-L743 PolarHBondContact O-N 3.36Å
740	L	80.4	Confident	81.4	Confident	107 Å²	107	89.8 Å²	89.8	56%	0.56	47%	0.474	S	S	*	.	H	α-helix	trans	-62.6	-39.4	177.2	-75.9	169.8	0	0	0	111.9	I736 E737 L743 A744	I736-L740 HydrophobicContact CG2-CD1 3.95Å; I736-L740 HydrophobicContact CG2-CG 4.39Å; I736-L740 WeakPolarHBondContact O-CB 3.45Å; I736-L740 WeakPolarHBondContact O-CG 3.38Å; I736-L740 PolarHBondContact O-N 3.38Å; E737-L740 PolarHBondContact O-N 3.32Å; L740-L743 PolarHBondContact O-N 3.29Å; L740-A744 PolarHBondContact O-N 3.49Å
741	K	80.9	Confident	81.7	Confident	126 Å²	126	91.1 Å²	91.1	55%	0.548	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-43.5	172.3	-76.2	175.4	-177.1	171.6	0	111.7	E737 D738 V739 L743 A744 T745	E737-K741 WeakPolarHBondContact O-CG 3.37Å; E737-K741 PolarHBondContact O-N 3.12Å; D738-K741 PolarHBondContact O-N 3.41Å; V739-K741 VanDerWaalsContact C-N 3.33Å; V739-K741 PolarHBondContact O-N 2.9Å; K741-L743 VanDerWaalsContact C-N 3.34Å; K741-L743 PolarHBondContact O-N 3.16Å; K741-A744 PolarHBondContact O-N 2.84Å; K741-T745 PolarHBondContact O-N 3.14Å; K741-T745 VanDerWaalsContact O-N 3.08Å; K741-T745 PolarHBondContact O-OG1 3.3Å
742	S	79.5	Confident	81.8	Confident	46 Å²	46	85.5 Å²	85.5	32%	0.322	45%	0.447	S	S	.	.	H	α-helix	trans	-65.1	-34.2	177.3	77.5	0	0	0	0	113.7	D738 V739 T745 L746	D738-S742 PolarHBondContact O-N 3.4Å; V739-S742 PolarHBondContact O-N 3.11Å; V739-S742 VanDerWaalsContact O-N 3.16Å; V739-S742 PolarHBondContact O-OG 2.94Å; S742-T745 PolarHBondContact O-OG1 3.37Å; S742-L746 WeakPolarHBondContact O-CG 3.25Å; S742-L746 PolarHBondContact O-N 2.88Å; S742-L746 VanDerWaalsContact O-N 3.08Å
743	L	78.4	Confident	81.9	Confident	100 Å²	100	89.4 Å²	89.4	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-68.3	-41.2	174.7	-93.1	154.8	0	0	0	111.5	V739 L740 K741 T745 L746 E747	V739-L743 HydrophobicContact CG1-CD1 4.12Å; V739-L743 PolarHBondContact O-N 3.36Å; L740-L743 PolarHBondContact O-N 3.29Å; K741-L743 VanDerWaalsContact C-N 3.34Å; K741-L743 PolarHBondContact O-N 3.16Å; L743-T745 VanDerWaalsContact C-N 3.35Å; L743-T745 PolarHBondContact O-N 3.29Å; L743-L746 PolarHBondContact O-N 3.2Å; L743-E747 PolarHBondContact O-N 3.16Å
744	A	81.1	Confident	81.9	Confident	48 Å²	48	94.4 Å²	94.4	40%	0.397	47%	0.467	S	S	.	.	H	α-helix	trans	-64.7	-36.9	176.7	0	0	0	0	0	112.3	L740 K741 E747 K748	L740-A744 PolarHBondContact O-N 3.49Å; K741-A744 PolarHBondContact O-N 2.84Å; A744-E747 PolarHBondContact O-N 3.07Å; A744-K748 PolarHBondContact O-N 3.01Å; A744-K748 VanDerWaalsContact O-N 3.11Å
745	T	79.8	Confident	82.1	Confident	30 Å²	30	98.5 Å²	98.5	18%	0.184	48%	0.479	C	S	.	.	H	α-helix	trans	-69.5	-41.3	174.5	54.7	0	0	0	0	112	K741 S742 L743 E747 K748 I749 Q794	K741-T745 PolarHBondContact O-N 3.14Å; K741-T745 VanDerWaalsContact O-N 3.08Å; K741-T745 PolarHBondContact O-OG1 3.3Å; S742-T745 PolarHBondContact O-OG1 3.37Å; L743-T745 VanDerWaalsContact C-N 3.35Å; L743-T745 PolarHBondContact O-N 3.29Å; T745-E747 VanDerWaalsContact C-N 3.26Å; T745-E747 PolarHBondContact O-N 3.29Å; T745-K748 PolarHBondContact O-N 3.25Å; T745-I749 VanDerWaalsContact O-CG1 3.31Å; T745-I749 WeakPolarHBondContact O-CG1 3.33Å; T745-I749 PolarHBondContact O-N 3.48Å; T745-Q794 PolarHBondContact OG1-OE1 3.18Å
746	L	79.4	Confident	82	Confident	97 Å²	97	93.7 Å²	93.7	51%	0.508	46%	0.458	S	S	.	.	H	α-helix	trans	-57.9	-37.4	172.7	-80.1	170	0	0	0	113	S742 L743 K750	S742-L746 WeakPolarHBondContact O-CG 3.25Å; S742-L746 PolarHBondContact O-N 2.88Å; S742-L746 VanDerWaalsContact O-N 3.08Å; L743-L746 PolarHBondContact O-N 3.2Å; L746-K750 WeakPolarHBondContact O-CG 3.44Å; L746-K750 PolarHBondContact O-N 2.84Å; L746-K750 VanDerWaalsContact O-N 3.13Å
747	E	81.6	Confident	82	Confident	140 Å²	140	94.3 Å²	94.3	65%	0.654	46%	0.46	S	S	*	.	H	α-helix	trans	-69.8	-42.5	177.7	-160.7	167.5	-157.5	0	0	111.8	L743 A744 T745 I749 K750 V751	L743-E747 PolarHBondContact O-N 3.16Å; A744-E747 PolarHBondContact O-N 3.07Å; T745-E747 VanDerWaalsContact C-N 3.26Å; T745-E747 PolarHBondContact O-N 3.29Å; E747-I749 PolarHBondContact O-N 3.02Å; E747-K750 WeakPolarHBondContact O-CB 3.28Å; E747-K750 PolarHBondContact O-N 3.15Å; E747-V751 WeakPolarHBondContact O-CG2 3.49Å; E747-V751 PolarHBondContact O-N 2.95Å; E747-V751 VanDerWaalsContact O-N 3.11Å
748	K	83.3	Confident	81.9	Confident	134 Å²	134	93.1 Å²	93.1	58%	0.583	46%	0.461	S	S	*	.	H	α-helix	trans	-59.5	-44.6	172.6	-73.8	-178.2	178.6	-179	0	112.3	A744 T745 K750 V751 I752	A744-K748 PolarHBondContact O-N 3.01Å; A744-K748 VanDerWaalsContact O-N 3.11Å; T745-K748 PolarHBondContact O-N 3.25Å; K748-K750 VanDerWaalsContact C-N 3.29Å; K748-K750 PolarHBondContact O-N 3.3Å; K748-V751 PolarHBondContact O-N 3.39Å; K748-I752 WeakPolarHBondContact O-CG1 3.47Å; K748-I752 PolarHBondContact O-N 3.4Å
749	I	82	Confident	81.8	Confident	33 Å²	33	93.4 Å²	93.4	17%	0.169	46%	0.459	C	S	.	.	H	α-helix	trans	-60.5	-39.1	177	-66.1	168.6	0	0	0	111.1	T745 E747 I752 R753 M787 V791	T745-I749 VanDerWaalsContact O-CG1 3.31Å; T745-I749 WeakPolarHBondContact O-CG1 3.33Å; T745-I749 PolarHBondContact O-N 3.48Å; E747-I749 PolarHBondContact O-N 3.02Å; I749-I752 PolarHBondContact O-N 2.86Å; I749-R753 WeakPolarHBondContact O-CB 3.29Å; I749-R753 PolarHBondContact O-N 3.44Å; I749-M787 HydrophobicContact CG2-CG 4.32Å; I749-M787 HydrophobicContact CG2-SD 4.13Å; I749-V791 HydrophobicContact CD1-CG2 4.15Å
750	K	80.9	Confident	81.8	Confident	144 Å²	144	92.2 Å²	92.2	63%	0.626	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-38	176.5	-78.8	178	-179	174.7	0	112.8	L746 E747 K748 R754	L746-K750 WeakPolarHBondContact O-CG 3.44Å; L746-K750 PolarHBondContact O-N 2.84Å; L746-K750 VanDerWaalsContact O-N 3.13Å; E747-K750 WeakPolarHBondContact O-CB 3.28Å; E747-K750 PolarHBondContact O-N 3.15Å; K748-K750 VanDerWaalsContact C-N 3.29Å; K748-K750 PolarHBondContact O-N 3.3Å; K750-R754 WeakPolarHBondContact O-CG 3.25Å; K750-R754 PolarHBondContact O-N 2.84Å; K750-R754 VanDerWaalsContact O-N 3.14Å
751	V	85.9	Confident	81.8	Confident	72 Å²	72	91.2 Å²	91.2	44%	0.436	44%	0.442	S	S	.	.	H	α-helix	trans	-66.7	-48.3	176.4	175.2	0	0	0	0	110.3	E747 K748 R753 R754 E755	E747-V751 WeakPolarHBondContact O-CG2 3.49Å; E747-V751 PolarHBondContact O-N 2.95Å; E747-V751 VanDerWaalsContact O-N 3.11Å; K748-V751 PolarHBondContact O-N 3.39Å; V751-R753 VanDerWaalsContact C-N 3.28Å; V751-R753 PolarHBondContact O-N 2.85Å; V751-R754 WeakPolarHBondContact O-CA 3.09Å; V751-R754 WeakPolarHBondContact O-CB 3.39Å; V751-R754 PolarHBondContact O-N 3.38Å; V751-E755 HydrophobicContact CG1-CG 4.49Å; V751-E755 PolarHBondContact O-N 3.02Å
752	I	84.2	Confident	81.8	Confident	25 Å²	25	91.2 Å²	91.2	13%	0.128	44%	0.444	C	S	.	.	H	α-helix	trans	-57.9	-41.8	176.8	-65	166.6	0	0	0	110.8	K748 I749 R754 E755 T756 N786 M787 T790	K748-I752 WeakPolarHBondContact O-CG1 3.47Å; K748-I752 PolarHBondContact O-N 3.4Å; I749-I752 PolarHBondContact O-N 2.86Å; I752-R754 VanDerWaalsContact C-N 3.32Å; I752-R754 PolarHBondContact O-N 3.22Å; I752-E755 PolarHBondContact O-N 3.43Å; I752-T756 HydrophobicContact CG2-CG2 4.21Å; I752-T756 WeakPolarHBondContact O-CB 3.31Å; I752-T756 VanDerWaalsContact O-CG2 3.28Å; I752-T756 WeakPolarHBondContact O-CG2 3.45Å; I752-T756 PolarHBondContact O-N 2.95Å; I752-T756 PolarHBondContact O-OG1 3.39Å; I752-N786 HydrophobicContact CD1-CB 4.49Å; I752-N786 HydrophobicContact CG2-CB 4.06Å; I752-M787 HydrophobicContact CG2-CE 4.14Å; I752-M787 HydrophobicContact CG2-CG 4.02Å; I752-T790 HydrophobicContact CD1-CG2 3.78Å
753	R	82.2	Confident	81.9	Confident	163 Å²	163	90 Å²	90	62%	0.615	43%	0.434	S	S	*	.	H	α-helix	trans	-59.8	-38.1	173.4	-87.2	-173.4	177.6	177.7	0.2	113.6	I749 V751 T756 M757 M787	I749-R753 WeakPolarHBondContact O-CB 3.29Å; I749-R753 PolarHBondContact O-N 3.44Å; V751-R753 VanDerWaalsContact C-N 3.28Å; V751-R753 PolarHBondContact O-N 2.85Å; R753-T756 VanDerWaalsContact CA-OG1 3.31Å; R753-T756 WeakPolarHBondContact CA-OG1 3.45Å; R753-T756 PolarHBondContact O-OG1 3.35Å; R753-M757 VanDerWaalsContact O-CB 3.25Å; R753-M757 WeakPolarHBondContact O-CB 3.34Å; R753-M757 PolarHBondContact O-N 3.39Å; R753-M757 VanDerWaalsContact O-N 3.09Å; R753-M787 HydrophobicContact CB-CE 4.37Å; R753-M787 HydrophobicContact CG-CE 3.38Å; R753-M787 HydrophobicContact CG-SD 3.96Å
754	R	83.3	Confident	81.8	Confident	188 Å²	188	87.7 Å²	87.7	71%	0.709	42%	0.422	S	S	*	.	H	α-helix	trans	-70.6	-44.7	177.6	-75.7	178.8	177.1	179.3	-0.1	110.9	K750 V751 I752 M757 T758	K750-R754 WeakPolarHBondContact O-CG 3.25Å; K750-R754 PolarHBondContact O-N 2.84Å; K750-R754 VanDerWaalsContact O-N 3.14Å; V751-R754 WeakPolarHBondContact O-CA 3.09Å; V751-R754 WeakPolarHBondContact O-CB 3.39Å; V751-R754 PolarHBondContact O-N 3.38Å; I752-R754 VanDerWaalsContact C-N 3.32Å; I752-R754 PolarHBondContact O-N 3.22Å; R754-M757 PolarHBondContact O-N 3.49Å; R754-T758 WeakPolarHBondContact O-CB 3.23Å; R754-T758 PolarHBondContact O-N 2.87Å; R754-T758 PolarHBondContact O-OG1 3.21Å
755	E	86	Confident	81.8	Confident	112 Å²	112	92.3 Å²	92.3	52%	0.523	44%	0.439	S	S	.	.	H	α-helix	trans	-62.5	-48.1	179.2	-71.6	178.9	170.6	0	0	111.6	V751 I752 M757 T758 Q759	V751-E755 HydrophobicContact CG1-CG 4.49Å; V751-E755 PolarHBondContact O-N 3.02Å; I752-E755 PolarHBondContact O-N 3.43Å; E755-M757 PolarHBondContact O-N 3.15Å; E755-T758 WeakPolarHBondContact O-CB 3.07Å; E755-T758 PolarHBondContact O-N 2.83Å; E755-T758 VanDerWaalsContact O-N 3.1Å; E755-Q759 WeakPolarHBondContact O-CG 3.37Å; E755-Q759 PolarHBondContact O-N 3.48Å
756	T	83.9	Confident	81.7	Confident	26 Å²	26	95.1 Å²	95.1	16%	0.16	46%	0.46	C	S	.	.	H	α-helix	trans	-59.9	-43.3	175.8	49	0	0	0	0	112.1	I752 R753 T758 Q759 F760	I752-T756 HydrophobicContact CG2-CG2 4.21Å; I752-T756 WeakPolarHBondContact O-CB 3.31Å; I752-T756 VanDerWaalsContact O-CG2 3.28Å; I752-T756 WeakPolarHBondContact O-CG2 3.45Å; I752-T756 PolarHBondContact O-N 2.95Å; I752-T756 PolarHBondContact O-OG1 3.39Å; R753-T756 VanDerWaalsContact CA-OG1 3.31Å; R753-T756 WeakPolarHBondContact CA-OG1 3.45Å; R753-T756 PolarHBondContact O-OG1 3.35Å; T756-T758 VanDerWaalsContact C-N 3.32Å; T756-T758 PolarHBondContact O-N 2.97Å; T756-Q759 PolarHBondContact O-N 2.83Å; T756-F760 VanDerWaalsContact O-CB 3.25Å; T756-F760 WeakPolarHBondContact O-CB 3.32Å; T756-F760 PolarHBondContact O-N 3.24Å
757	M	79.5	Confident	81.2	Confident	105 Å²	105	91.3 Å²	91.3	52%	0.517	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-37.4	174.4	-171.1	68.4	-175.7	0	0	112.2	R753 R754 E755 F760 L761	R753-M757 VanDerWaalsContact O-CB 3.25Å; R753-M757 WeakPolarHBondContact O-CB 3.34Å; R753-M757 PolarHBondContact O-N 3.39Å; R753-M757 VanDerWaalsContact O-N 3.09Å; R754-M757 PolarHBondContact O-N 3.49Å; E755-M757 PolarHBondContact O-N 3.15Å; M757-F760 PolarHBondContact O-N 3.18Å; M757-L761 HydrophobicContact CE-CD1 4.5Å; M757-L761 HydrophobicContact CE-CD2 4.5Å; M757-L761 HydrophobicContact CE-CG 4.46Å; M757-L761 VanDerWaalsContact O-CG 3.31Å; M757-L761 WeakPolarHBondContact O-CG 3.38Å; M757-L761 PolarHBondContact O-N 3.48Å
758	T	83	Confident	80.8	Confident	85 Å²	85	87.5 Å²	87.5	52%	0.521	43%	0.429	S	S	.	.	H	α-helix	trans	-68.6	-44.7	178.8	-47.9	0	0	0	0	110.5	R754 E755 T756 L761 Q762	R754-T758 WeakPolarHBondContact O-CB 3.23Å; R754-T758 PolarHBondContact O-N 2.87Å; R754-T758 PolarHBondContact O-OG1 3.21Å; E755-T758 WeakPolarHBondContact O-CB 3.07Å; E755-T758 PolarHBondContact O-N 2.83Å; E755-T758 VanDerWaalsContact O-N 3.1Å; T756-T758 VanDerWaalsContact C-N 3.32Å; T756-T758 PolarHBondContact O-N 2.97Å; T758-L761 PolarHBondContact O-N 3.15Å; T758-Q762 WeakPolarHBondContact O-CB 3.22Å; T758-Q762 PolarHBondContact O-N 3.15Å
759	Q	82.6	Confident	80.3	Confident	99 Å²	99	86.7 Å²	86.7	46%	0.463	44%	0.438	S	S	.	.	H	α-helix	trans	-61.5	-43.1	173.5	-72.7	178.1	-6	0	0	111.6	E755 T756 L761 Q762 T763 I779	E755-Q759 WeakPolarHBondContact O-CG 3.37Å; E755-Q759 PolarHBondContact O-N 3.48Å; T756-Q759 PolarHBondContact O-N 2.83Å; Q759-L761 PolarHBondContact O-N 3.26Å; Q759-Q762 PolarHBondContact O-N 3.19Å; Q759-Q762 VanDerWaalsContact O-N 3.16Å; Q759-T763 WeakPolarHBondContact O-CB 3.38Å; Q759-T763 PolarHBondContact O-N 2.98Å; Q759-T763 PolarHBondContact O-OG1 2.86Å; Q759-T763 VanDerWaalsContact O-OG1 3.06Å; Q759-I779 HydrophobicContact CB-CG2 4.14Å
760	F	80.2	Confident	79.8	Confident	57 Å²	57	93.7 Å²	93.7	25%	0.25	47%	0.47	C	S	.	.	H	α-helix	trans	-57.1	-48.2	176.2	-171	-92	0	0	0	111.5	T756 M757 Q762 T763 I764 L776 I780	T756-F760 VanDerWaalsContact O-CB 3.25Å; T756-F760 WeakPolarHBondContact O-CB 3.32Å; T756-F760 PolarHBondContact O-N 3.24Å; M757-F760 PolarHBondContact O-N 3.18Å; F760-Q762 PolarHBondContact O-N 3.15Å; F760-T763 PolarHBondContact O-N 3.27Å; F760-I764 HydrophobicContact CD1-CD1 3.64Å; F760-I764 HydrophobicContact CE1-CD1 3.45Å; F760-I764 VanDerWaalsContact CE1-CD1 3.45Å; F760-I764 HydrophobicContact CE1-CG1 4.46Å; F760-I764 HydrophobicContact CZ-CD1 4.31Å; F760-I764 VanDerWaalsContact O-CG1 3.31Å; F760-I764 WeakPolarHBondContact O-CG1 3.34Å; F760-I764 PolarHBondContact O-N 3Å; F760-L776 HydrophobicContact CD1-CD2 4.21Å; F760-L776 HydrophobicContact CD2-CD2 3.33Å; F760-L776 HydrophobicContact CE1-CD2 4.12Å; F760-L776 HydrophobicContact CE2-CB 4.03Å; F760-L776 HydrophobicContact CE2-CD2 3.19Å; F760-L776 HydrophobicContact CE2-CG 4.11Å; F760-L776 HydrophobicContact CG-CD2 3.85Å; F760-L776 HydrophobicContact CZ-CD2 3.63Å; F760-I780 HydrophobicContact CD2-CD1 4.35Å; F760-I780 HydrophobicContact CD2-CG1 4.21Å; F760-I780 HydrophobicContact CE2-CD1 3.74Å; F760-I780 HydrophobicContact CE2-CG1 4.1Å
761	L	79.8	Confident	79.6	Confident	86 Å²	86	90.8 Å²	90.8	45%	0.45	46%	0.461	S	S	.	.	H	α-helix	trans	-63.9	-39.6	176	-70.5	172.9	0	0	0	112.2	M757 T758 Q759 I764 I765	M757-L761 HydrophobicContact CE-CD1 4.5Å; M757-L761 HydrophobicContact CE-CD2 4.5Å; M757-L761 HydrophobicContact CE-CG 4.46Å; M757-L761 VanDerWaalsContact O-CG 3.31Å; M757-L761 WeakPolarHBondContact O-CG 3.38Å; M757-L761 PolarHBondContact O-N 3.48Å; T758-L761 PolarHBondContact O-N 3.15Å; Q759-L761 PolarHBondContact O-N 3.26Å; L761-I764 WeakPolarHBondContact O-CB 3.46Å; L761-I764 PolarHBondContact O-N 3.46Å; L761-I765 WeakPolarHBondContact O-CD1 3.16Å; L761-I765 VanDerWaalsContact O-CG1 3.28Å; L761-I765 WeakPolarHBondContact O-CG1 3.35Å; L761-I765 PolarHBondContact O-N 3.32Å
762	Q	80.8	Confident	79.1	Confident	126 Å²	126	91.8 Å²	91.8	59%	0.589	46%	0.457	S	S	*	.	H	α-helix	trans	-68.5	-38.1	-179.5	-156.9	175.1	10.3	0	0	112	T758 Q759 F760 I765 S766	T758-Q762 WeakPolarHBondContact O-CB 3.22Å; T758-Q762 PolarHBondContact O-N 3.15Å; Q759-Q762 PolarHBondContact O-N 3.19Å; Q759-Q762 VanDerWaalsContact O-N 3.16Å; F760-Q762 PolarHBondContact O-N 3.15Å; Q762-I765 PolarHBondContact O-N 2.98Å; Q762-S766 WeakPolarHBondContact O-CB 3.4Å; Q762-S766 PolarHBondContact O-N 3.14Å; Q762-S766 PolarHBondContact O-OG 3.31Å
763	T	81.4	Confident	78.8	Confident	19 Å²	19	92.5 Å²	92.5	12%	0.117	47%	0.47	C	S	.	.	H	α-helix	trans	-67.8	-37.9	174.5	-60.4	0	0	0	0	111.5	Q759 F760 I765 S766 T767 R775 I779	Q759-T763 WeakPolarHBondContact O-CB 3.38Å; Q759-T763 PolarHBondContact O-N 2.98Å; Q759-T763 PolarHBondContact O-OG1 2.86Å; Q759-T763 VanDerWaalsContact O-OG1 3.06Å; F760-T763 PolarHBondContact O-N 3.27Å; T763-I765 VanDerWaalsContact C-N 3.29Å; T763-I765 PolarHBondContact O-N 2.89Å; T763-S766 PolarHBondContact O-N 3.38Å; T763-T767 WeakPolarHBondContact O-CB 3.39Å; T763-T767 PolarHBondContact O-N 2.93Å; T763-T767 PolarHBondContact O-OG1 3.32Å; T763-R775 HydrophobicContact CG2-CB 3.93Å; T763-I779 HydrophobicContact CG2-CD1 4.05Å; T763-I779 WeakPolarHBondContact OG1-CD1 3.3Å
764	I	77.8	Confident	78.8	Confident	53 Å²	53	90.3 Å²	90.3	27%	0.272	47%	0.471	S	S	.	.	H	α-helix	trans	-56.6	-46.6	169.5	-71.6	170	0	0	0	109.6	F760 L761 R772 L776	F760-I764 HydrophobicContact CD1-CD1 3.64Å; F760-I764 HydrophobicContact CE1-CD1 3.45Å; F760-I764 VanDerWaalsContact CE1-CD1 3.45Å; F760-I764 HydrophobicContact CE1-CG1 4.46Å; F760-I764 HydrophobicContact CZ-CD1 4.31Å; F760-I764 VanDerWaalsContact O-CG1 3.31Å; F760-I764 WeakPolarHBondContact O-CG1 3.34Å; F760-I764 PolarHBondContact O-N 3Å; L761-I764 WeakPolarHBondContact O-CB 3.46Å; L761-I764 PolarHBondContact O-N 3.46Å; I764-R772 PolarHBondContact O-NE 3.17Å; I764-R772 PolarHBondContact O-NH2 3.02Å; I764-L776 HydrophobicContact CD1-CD2 4.47Å; I764-L776 HydrophobicContact CG1-CD2 3.98Å
765	I	79.6	Confident	78.6	Confident	145 Å²	145	87.6 Å²	87.6	74%	0.744	46%	0.461	S	S	*	.	H	α-helix	trans	-71.4	-35.8	-175.8	-64.7	161.4	0	0	0	112.5	L761 Q762 T763	L761-I765 WeakPolarHBondContact O-CD1 3.16Å; L761-I765 VanDerWaalsContact O-CG1 3.28Å; L761-I765 WeakPolarHBondContact O-CG1 3.35Å; L761-I765 PolarHBondContact O-N 3.32Å; Q762-I765 PolarHBondContact O-N 2.98Å; T763-I765 VanDerWaalsContact C-N 3.29Å; T763-I765 PolarHBondContact O-N 2.89Å
766	S	78.7	Confident	78.5	Confident	89 Å²	89	83.6 Å²	83.6	62%	0.622	44%	0.442	S	S	*	.	H	α-helix	trans	-102.8	-20.8	-165.8	58.9	0	0	0	0	116.1	Q762 T763	Q762-S766 WeakPolarHBondContact O-CB 3.4Å; Q762-S766 PolarHBondContact O-N 3.14Å; Q762-S766 PolarHBondContact O-OG 3.31Å; T763-S766 PolarHBondContact O-N 3.38Å
767	T	69.5	Low	78.4	Confident	16 Å²	16	87.1 Å²	87.1	10%	0.098	46%	0.461	C	S	.	.	S	Bend	trans	-101	140.9	-171.8	-54.5	0	0	0	0	112.4	T763 D771 R775	T763-T767 WeakPolarHBondContact O-CB 3.39Å; T763-T767 PolarHBondContact O-N 2.93Å; T763-T767 PolarHBondContact O-OG1 3.32Å; T767-D771 HydrophobicContact CG2-CB 3.92Å; T767-R775 PolarHBondContact OG1-NH1 3.16Å
768	S	71.7	Confident	78.7	Confident	60 Å²	60	87.1 Å²	87.1	42%	0.42	46%	0.463	S	S	.	.			trans	-61.6	153.1	176.8	61.3	0	0	0	0	112.2	Q770 D771 R772	S768-Q770 VanDerWaalsContact C-N 3.25Å; S768-Q770 PolarHBondContact O-N 3.28Å; S768-Q770 VanDerWaalsContact O-N 3.16Å; S768-D771 PolarHBondContact O-N 3.4Å; S768-R772 PolarHBondContact O-N 3.2Å
769	P	72.6	Confident	78.8	Confident	117 Å²	117	84.4 Å²	84.4	76%	0.76	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.7	-172.6	-22.8	32.2	0	0	0	115.1
770	Q	73.1	Confident	78.8	Confident	180 Å²	180	83.4 Å²	83.4	84%	0.841	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-38.3	-177.1	-73	177.2	-17.5	0	0	112.3	S768	S768-Q770 VanDerWaalsContact C-N 3.25Å; S768-Q770 PolarHBondContact O-N 3.28Å; S768-Q770 VanDerWaalsContact O-N 3.16Å
771	D	75.4	Confident	79	Confident	83 Å²	83	86.3 Å²	86.3	44%	0.444	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-2.3	-179.5	-58.3	-31.4	0	0	0	112.8	T767 S768 R775	T767-D771 HydrophobicContact CG2-CB 3.92Å; S768-D771 PolarHBondContact O-N 3.4Å; D771-R775 WeakPolarHBondContact O-CG 3.24Å; D771-R775 PolarHBondContact O-N 3.23Å
772	R	75.2	Confident	79.2	Confident	94 Å²	94	84.5 Å²	84.5	36%	0.355	45%	0.454	S	S	.	.	H	α-helix	trans	-68.1	-39.8	-171.7	-151.2	-165.4	-130.8	168.8	3.9	112.3	I764 S768 L776	I764-R772 PolarHBondContact O-NE 3.17Å; I764-R772 PolarHBondContact O-NH2 3.02Å; S768-R772 PolarHBondContact O-N 3.2Å; R772-L776 HydrophobicContact CG-CD1 3.72Å; R772-L776 HydrophobicContact CG-CG 4.35Å; R772-L776 VanDerWaalsContact O-CB 3.31Å; R772-L776 WeakPolarHBondContact O-CB 3.18Å; R772-L776 WeakPolarHBondContact O-CD1 3.43Å; R772-L776 WeakPolarHBondContact O-CG 3.31Å; R772-L776 PolarHBondContact O-N 2.88Å
773	G	79.2	Confident	79.3	Confident	39 Å²	39	78.7 Å²	78.7	40%	0.402	43%	0.427	S	S	.	.	H	α-helix	trans	-61.2	-60.1	-177.9	0	0	0	0	0	111.3	R775 L776 D777	G773-R775 VanDerWaalsContact C-N 3.32Å; G773-R775 PolarHBondContact O-N 3.3Å; G773-L776 PolarHBondContact O-N 2.78Å; G773-L776 VanDerWaalsContact O-N 3.07Å; G773-D777 PolarHBondContact O-N 3.47Å
774	D	80.7	Confident	79.3	Confident	118 Å²	118	82.4 Å²	82.4	63%	0.631	45%	0.446	S	S	*	.	H	α-helix	trans	-57.2	-43.1	-178.5	-61.2	-10.3	0	0	0	111.9	L776 D777 D778	D774-L776 PolarHBondContact O-N 3.26Å; D774-D777 PolarHBondContact O-N 3.36Å; D774-D778 PolarHBondContact O-N 2.86Å
775	R	79.8	Confident	79.5	Confident	131 Å²	131	84 Å²	84	49%	0.494	46%	0.455	S	S	.	.	H	α-helix	trans	-68.7	-33.1	177.5	-74.9	-165.2	-179.9	167.8	-2.7	114.3	T763 T767 D771 G773 I779	T763-R775 HydrophobicContact CG2-CB 3.93Å; T767-R775 PolarHBondContact OG1-NH1 3.16Å; D771-R775 WeakPolarHBondContact O-CG 3.24Å; D771-R775 PolarHBondContact O-N 3.23Å; G773-R775 VanDerWaalsContact C-N 3.32Å; G773-R775 PolarHBondContact O-N 3.3Å; R775-I779 WeakPolarHBondContact O-CD1 3.25Å; R775-I779 VanDerWaalsContact O-CG1 3.23Å; R775-I779 WeakPolarHBondContact O-CG1 3.34Å; R775-I779 PolarHBondContact O-N 2.89Å; R775-I779 VanDerWaalsContact O-N 3.15Å
776	L	83	Confident	79.7	Confident	27 Å²	27	81.4 Å²	81.4	14%	0.141	44%	0.443	C	S	.	.	H	α-helix	trans	-69.8	-40.7	176.8	-75	163.4	0	0	0	110.1	F760 I764 R772 G773 D774 I779 I780	F760-L776 HydrophobicContact CD1-CD2 4.21Å; F760-L776 HydrophobicContact CD2-CD2 3.33Å; F760-L776 HydrophobicContact CE1-CD2 4.12Å; F760-L776 HydrophobicContact CE2-CB 4.03Å; F760-L776 HydrophobicContact CE2-CD2 3.19Å; F760-L776 HydrophobicContact CE2-CG 4.11Å; F760-L776 HydrophobicContact CG-CD2 3.85Å; F760-L776 HydrophobicContact CZ-CD2 3.63Å; I764-L776 HydrophobicContact CD1-CD2 4.47Å; I764-L776 HydrophobicContact CG1-CD2 3.98Å; R772-L776 HydrophobicContact CG-CD1 3.72Å; R772-L776 HydrophobicContact CG-CG 4.35Å; R772-L776 VanDerWaalsContact O-CB 3.31Å; R772-L776 WeakPolarHBondContact O-CB 3.18Å; R772-L776 WeakPolarHBondContact O-CD1 3.43Å; R772-L776 WeakPolarHBondContact O-CG 3.31Å; R772-L776 PolarHBondContact O-N 2.88Å; G773-L776 PolarHBondContact O-N 2.78Å; G773-L776 VanDerWaalsContact O-N 3.07Å; D774-L776 PolarHBondContact O-N 3.26Å; L776-I779 PolarHBondContact O-N 2.91Å; L776-I780 VanDerWaalsContact O-CG1 3.32Å; L776-I780 WeakPolarHBondContact O-CG1 3.46Å; L776-I780 PolarHBondContact O-N 3.36Å
777	D	82.9	Confident	79.7	Confident	101 Å²	101	78.9 Å²	78.9	54%	0.54	42%	0.421	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.8	-73.4	-18.4	0	0	0	111.1	G773 D774 I779 I780 Q781	G773-D777 PolarHBondContact O-N 3.47Å; D774-D777 PolarHBondContact O-N 3.36Å; D777-I779 PolarHBondContact O-N 3.4Å; D777-I780 PolarHBondContact O-N 3.2Å; D777-Q781 VanDerWaalsContact O-CB 3.31Å; D777-Q781 WeakPolarHBondContact O-CB 3.39Å; D777-Q781 PolarHBondContact O-N 3.43Å
778	D	85.8	Confident	80.1	Confident	105 Å²	105	81.3 Å²	81.3	56%	0.561	44%	0.436	S	S	*	.	H	α-helix	trans	-58.6	-43.1	174.4	-77.5	-17	0	0	0	112.6	D774 Q781 A782	D774-D778 PolarHBondContact O-N 2.86Å; D778-Q781 PolarHBondContact O-N 3.04Å; D778-A782 VanDerWaalsContact O-CB 3.25Å; D778-A782 WeakPolarHBondContact O-CB 3.42Å; D778-A782 PolarHBondContact O-N 3.34Å
779	I	84.5	Confident	80.4	Confident	27 Å²	27	80.8 Å²	80.8	14%	0.138	43%	0.433	C	S	.	.	H	α-helix	trans	-68.2	-40.3	179.3	-69.3	165.3	0	0	0	111.1	Q759 T763 R775 L776 D777 G783	Q759-I779 HydrophobicContact CB-CG2 4.14Å; T763-I779 HydrophobicContact CG2-CD1 4.05Å; T763-I779 WeakPolarHBondContact OG1-CD1 3.3Å; R775-I779 WeakPolarHBondContact O-CD1 3.25Å; R775-I779 VanDerWaalsContact O-CG1 3.23Å; R775-I779 WeakPolarHBondContact O-CG1 3.34Å; R775-I779 PolarHBondContact O-N 2.89Å; R775-I779 VanDerWaalsContact O-N 3.15Å; L776-I779 PolarHBondContact O-N 2.91Å; D777-I779 PolarHBondContact O-N 3.4Å; I779-G783 PolarHBondContact O-N 3.12Å
780	I	83.5	Confident	80.4	Confident	78 Å²	78	76.8 Å²	76.8	40%	0.4	41%	0.406	S	S	.	.	H	α-helix	trans	-64.4	-45.5	176.2	-72	168.3	0	0	0	109.7	F760 L776 D777 G783 L784	F760-I780 HydrophobicContact CD2-CD1 4.35Å; F760-I780 HydrophobicContact CD2-CG1 4.21Å; F760-I780 HydrophobicContact CE2-CD1 3.74Å; F760-I780 HydrophobicContact CE2-CG1 4.1Å; L776-I780 VanDerWaalsContact O-CG1 3.32Å; L776-I780 WeakPolarHBondContact O-CG1 3.46Å; L776-I780 PolarHBondContact O-N 3.36Å; D777-I780 PolarHBondContact O-N 3.2Å; I780-G783 PolarHBondContact O-N 3.13Å; I780-L784 HydrophobicContact CG2-CD1 3.74Å; I780-L784 WeakPolarHBondContact O-CB 3.42Å; I780-L784 PolarHBondContact O-N 3.46Å
781	Q	83.9	Confident	80.4	Confident	118 Å²	118	71.2 Å²	71.2	55%	0.551	38%	0.384	S	S	*	.	H	α-helix	trans	-66.4	-46.1	-178.7	-165.7	166.6	-5.3	0	0	111.4	D777 D778 G783 L784 D785	D777-Q781 VanDerWaalsContact O-CB 3.31Å; D777-Q781 WeakPolarHBondContact O-CB 3.39Å; D777-Q781 PolarHBondContact O-N 3.43Å; D778-Q781 PolarHBondContact O-N 3.04Å; Q781-G783 VanDerWaalsContact C-N 3.29Å; Q781-G783 PolarHBondContact O-N 3.37Å; Q781-L784 PolarHBondContact O-N 3.01Å; Q781-D785 WeakPolarHBondContact O-CB 3.43Å; Q781-D785 VanDerWaalsContact O-CG 3.27Å; Q781-D785 PolarHBondContact O-N 3.36Å
782	A	84.7	Confident	79.9	Confident	49 Å²	49	71.6 Å²	71.6	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-61.2	-36.9	173.3	0	0	0	0	0	112.6	D778 N786	D778-A782 VanDerWaalsContact O-CB 3.25Å; D778-A782 WeakPolarHBondContact O-CB 3.42Å; D778-A782 PolarHBondContact O-N 3.34Å; A782-N786 WeakPolarHBondContact O-CB 3.39Å; A782-N786 PolarHBondContact O-N 2.97Å
783	G	83	Confident	79.1	Confident	3 Å²	3	73.2 Å²	73.2	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-65.3	-41.3	174.7	0	0	0	0	0	113.3	I779 I780 Q781 M787	I779-G783 PolarHBondContact O-N 3.12Å; I780-G783 PolarHBondContact O-N 3.13Å; Q781-G783 VanDerWaalsContact C-N 3.29Å; Q781-G783 PolarHBondContact O-N 3.37Å; G783-M787 WeakPolarHBondContact O-CG 3.42Å; G783-M787 PolarHBondContact O-N 3.35Å; G783-M787 VanDerWaalsContact O-N 3.1Å
784	L	81.5	Confident	77.9	Confident	97 Å²	97	75.7 Å²	75.7	51%	0.508	40%	0.402	S	S	.	.	H	α-helix	trans	-66.5	-44.2	174	-86.6	152.3	0	0	0	111.4	I780 Q781 N786 M787 T788	I780-L784 HydrophobicContact CG2-CD1 3.74Å; I780-L784 WeakPolarHBondContact O-CB 3.42Å; I780-L784 PolarHBondContact O-N 3.46Å; Q781-L784 PolarHBondContact O-N 3.01Å; L784-N786 VanDerWaalsContact C-N 3.33Å; L784-N786 PolarHBondContact O-N 3.33Å; L784-M787 CarbonylContact O-C 3.52Å; L784-M787 WeakPolarHBondContact O-CA 3.14Å; L784-M787 WeakPolarHBondContact O-CB 3.28Å; L784-M787 PolarHBondContact O-N 2.88Å; L784-T788 PolarHBondContact O-N 3.21Å; L784-T788 PolarHBondContact O-OG1 3.08Å; L784-T788 VanDerWaalsContact O-OG1 3.11Å
785	D	82.3	Confident	76.5	Confident	88 Å²	88	76.6 Å²	76.6	47%	0.471	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-36.3	178.4	-70.2	-17.4	0	0	0	112.2	Q781 T788 S789	Q781-D785 WeakPolarHBondContact O-CB 3.43Å; Q781-D785 VanDerWaalsContact O-CG 3.27Å; Q781-D785 PolarHBondContact O-N 3.36Å; D785-T788 VanDerWaalsContact CA-OG1 3.26Å; D785-T788 WeakPolarHBondContact CA-OG1 3.48Å; D785-T788 PolarHBondContact O-OG1 2.85Å; D785-S789 WeakPolarHBondContact O-CB 3.47Å; D785-S789 PolarHBondContact O-N 3Å; D785-S789 PolarHBondContact O-OG 3.02Å
786	N	82.2	Confident	74.8	Confident	90 Å²	90	81 Å²	81	48%	0.481	43%	0.433	S	S	.	.	H	α-helix	trans	-68.9	-34.3	171.7	-81.2	-16	0	0	0	112.3	I752 A782 L784 S789 T790	I752-N786 HydrophobicContact CD1-CB 4.49Å; I752-N786 HydrophobicContact CG2-CB 4.06Å; A782-N786 WeakPolarHBondContact O-CB 3.39Å; A782-N786 PolarHBondContact O-N 2.97Å; L784-N786 VanDerWaalsContact C-N 3.33Å; L784-N786 PolarHBondContact O-N 3.33Å; N786-S789 WeakPolarHBondContact CA-OG 3.25Å; N786-S789 PolarHBondContact O-OG 3.49Å; N786-S789 VanDerWaalsContact O-OG 3.1Å; N786-T790 WeakPolarHBondContact O-CG2 3.34Å; N786-T790 PolarHBondContact O-N 3.4Å; N786-T790 PolarHBondContact O-OG1 3.4Å
787	M	79	Confident	74.4	Confident	35 Å²	35	83.7 Å²	83.7	17%	0.172	45%	0.448	C	S	.	.	H	α-helix	trans	-71.9	-38.2	174.5	-74.2	-176.5	-135.5	0	0	112.2	I749 I752 R753 G783 L784 T790 V791	I749-M787 HydrophobicContact CG2-CG 4.32Å; I749-M787 HydrophobicContact CG2-SD 4.13Å; I752-M787 HydrophobicContact CG2-CE 4.14Å; I752-M787 HydrophobicContact CG2-CG 4.02Å; R753-M787 HydrophobicContact CB-CE 4.37Å; R753-M787 HydrophobicContact CG-CE 3.38Å; R753-M787 HydrophobicContact CG-SD 3.96Å; G783-M787 WeakPolarHBondContact O-CG 3.42Å; G783-M787 PolarHBondContact O-N 3.35Å; G783-M787 VanDerWaalsContact O-N 3.1Å; L784-M787 CarbonylContact O-C 3.52Å; L784-M787 WeakPolarHBondContact O-CA 3.14Å; L784-M787 WeakPolarHBondContact O-CB 3.28Å; L784-M787 PolarHBondContact O-N 2.88Å; M787-T790 WeakPolarHBondContact CA-OG1 3.5Å; M787-T790 PolarHBondContact O-OG1 2.92Å; M787-V791 WeakPolarHBondContact O-CG2 3.31Å; M787-V791 PolarHBondContact O-N 2.94Å
788	T	79.1	Confident	73.9	Confident	68 Å²	68	82.8 Å²	82.8	42%	0.417	44%	0.443	S	S	.	.	H	α-helix	trans	-70.9	-45.1	177.2	46.9	0	0	0	0	111.4	L784 D785 T790 V791 D792	L784-T788 PolarHBondContact O-N 3.21Å; L784-T788 PolarHBondContact O-OG1 3.08Å; L784-T788 VanDerWaalsContact O-OG1 3.11Å; D785-T788 VanDerWaalsContact CA-OG1 3.26Å; D785-T788 WeakPolarHBondContact CA-OG1 3.48Å; D785-T788 PolarHBondContact O-OG1 2.85Å; T788-T790 VanDerWaalsContact C-N 3.29Å; T788-T790 PolarHBondContact O-N 3.05Å; T788-V791 CarbonylContact O-C 3.59Å; T788-V791 WeakPolarHBondContact O-CA 3.34Å; T788-V791 WeakPolarHBondContact O-CB 3.42Å; T788-V791 PolarHBondContact O-N 2.78Å; T788-D792 PolarHBondContact O-N 3.37Å
789	S	76.8	Confident	73.3	Confident	49 Å²	49	81.6 Å²	81.6	34%	0.343	44%	0.437	S	S	.	.	H	α-helix	trans	-60.2	-35.7	175.5	56.5	0	0	0	0	113.4	D785 N786 V791 D792 L793	D785-S789 WeakPolarHBondContact O-CB 3.47Å; D785-S789 PolarHBondContact O-N 3Å; D785-S789 PolarHBondContact O-OG 3.02Å; N786-S789 WeakPolarHBondContact CA-OG 3.25Å; N786-S789 PolarHBondContact O-OG 3.49Å; N786-S789 VanDerWaalsContact O-OG 3.1Å; S789-V791 VanDerWaalsContact C-N 3.26Å; S789-V791 PolarHBondContact O-N 3.05Å; S789-D792 PolarHBondContact O-N 3Å; S789-L793 WeakPolarHBondContact O-CB 3.09Å; S789-L793 WeakPolarHBondContact O-CD1 3.48Å; S789-L793 VanDerWaalsContact O-CG 3.28Å; S789-L793 WeakPolarHBondContact O-CG 3.35Å; S789-L793 PolarHBondContact O-N 2.77Å
790	T	73.8	Confident	72.6	Confident	33 Å²	33	84.8 Å²	84.8	20%	0.202	45%	0.454	C	S	.	.	H	α-helix	trans	-70.1	-21.5	174.5	45.9	0	0	0	0	113.8	I752 N786 M787 T788	I752-T790 HydrophobicContact CD1-CG2 3.78Å; N786-T790 WeakPolarHBondContact O-CG2 3.34Å; N786-T790 PolarHBondContact O-N 3.4Å; N786-T790 PolarHBondContact O-OG1 3.4Å; M787-T790 WeakPolarHBondContact CA-OG1 3.5Å; M787-T790 PolarHBondContact O-OG1 2.92Å; T788-T790 VanDerWaalsContact C-N 3.29Å; T788-T790 PolarHBondContact O-N 3.05Å
791	V	71.4	Confident	71.9	Confident	62 Å²	62	85.2 Å²	85.2	38%	0.376	46%	0.457	S	S	.	.	H	α-helix	trans	-86.6	-40.1	172.8	174	0	0	0	0	111.1	I749 M787 T788 S789 Q794	I749-V791 HydrophobicContact CD1-CG2 4.15Å; M787-V791 WeakPolarHBondContact O-CG2 3.31Å; M787-V791 PolarHBondContact O-N 2.94Å; T788-V791 CarbonylContact O-C 3.59Å; T788-V791 WeakPolarHBondContact O-CA 3.34Å; T788-V791 WeakPolarHBondContact O-CB 3.42Å; T788-V791 PolarHBondContact O-N 2.78Å; S789-V791 VanDerWaalsContact C-N 3.26Å; S789-V791 PolarHBondContact O-N 3.05Å; V791-Q794 VanDerWaalsContact O-CB 3.25Å; V791-Q794 WeakPolarHBondContact O-CB 3.38Å; V791-Q794 PolarHBondContact O-N 3.06Å; V791-Q794 VanDerWaalsContact O-N 3.11Å
792	D	65.8	Low	71.1	Confident	91 Å²	91	83 Å²	83	49%	0.487	45%	0.451	S	S	.	.	H	α-helix	trans	-70.8	-34.1	-178.5	-71.7	-26.5	0	0	0	112.8	T788 S789 Q794 N795 E796	T788-D792 PolarHBondContact O-N 3.37Å; S789-D792 PolarHBondContact O-N 3Å; D792-Q794 PolarHBondContact O-N 3.17Å; D792-N795 PolarHBondContact O-N 3.19Å; D792-E796 PolarHBondContact O-N 3Å
793	L	59.2	Low	70.2	Confident	128 Å²	128	85.4 Å²	85.4	67%	0.67	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-9.4	169.3	-77.8	167.2	0	0	0	113.8	S789	S789-L793 WeakPolarHBondContact O-CB 3.09Å; S789-L793 WeakPolarHBondContact O-CD1 3.48Å; S789-L793 VanDerWaalsContact O-CG 3.28Å; S789-L793 WeakPolarHBondContact O-CG 3.35Å; S789-L793 PolarHBondContact O-N 2.77Å
794	Q	53.2	Low	69.2	Low	91 Å²	91	91.8 Å²	91.8	43%	0.425	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-18.5	174.8	-154.8	-178.7	-10.9	0	0	112.7	T745 V791 D792	T745-Q794 PolarHBondContact OG1-OE1 3.18Å; V791-Q794 VanDerWaalsContact O-CB 3.25Å; V791-Q794 WeakPolarHBondContact O-CB 3.38Å; V791-Q794 PolarHBondContact O-N 3.06Å; V791-Q794 VanDerWaalsContact O-N 3.11Å; D792-Q794 PolarHBondContact O-N 3.17Å
795	N	52.2	Low	68.1	Low	138 Å²	138	91.3 Å²	91.3	74%	0.738	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-22.4	179.2	-78.8	-22	0	0	0	113.4	D792	D792-N795 PolarHBondContact O-N 3.19Å
796	E	42.7	Very low	66.8	Low	223 Å²	223	91.6 Å²	91.6	100%	1.042	49%	0.487	S	S	*	.			trans	-80	0	162.3	-71.3	-172.1	158.6	0	0	111.3	D792	D792-E796 PolarHBondContact O-N 3Å

Retrieved 796 of 796 residues in 1708.8 ms (Link to these results)

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