A0A2K6D5F1_MACNE Loading...

O-acyltransferase

AlphaFold DB , UniProt , Accession A0A2K6D5F1, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene SOAT1, Length 550 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36.8	Very low	31.6	Very low	235 Å²	235	145.2 Å²	145.2	100%	1.158	75%	0.746	S	S	*	*				0	98.3	0	-67.4	162.7	171.1	0	0	105.3
2	V	28	Very low	31.4	Very low	135 Å²	135	151.1 Å²	151.1	82%	0.818	75%	0.752	S	S	*	*			cis	66.2	131.8	47.1	-171.2	0	0	0	0	110.3
3	G	30.5	Very low	31.2	Very low	59 Å²	59	151.4 Å²	151.4	61%	0.608	76%	0.757	S	S	*	*			cis	-129.5	169.9	9.7	0	0	0	0	0	114.3
4	E	34	Very low	31	Very low	156 Å²	156	146.6 Å²	146.6	73%	0.729	75%	0.745	S	S	*	*				95.2	142.5	70.6	-79.3	-174.6	137.3	0	0	111.3
5	E	30.9	Very low	30.7	Very low	135 Å²	135	150.3 Å²	150.3	63%	0.631	75%	0.754	S	S	*	*			cis	-152	142.3	12.2	-123.1	-173.1	152.3	0	0	110.2
6	K	33.1	Very low	30.5	Very low	151 Å²	151	147.8 Å²	147.8	66%	0.657	75%	0.754	S	S	*	*				63.3	144.2	105.6	-81	-175.4	-146.6	146.8	0	117.4
7	M	32.4	Very low	30.4	Very low	159 Å²	159	152.2 Å²	152.2	78%	0.783	76%	0.76	S	S	*	*			cis	-172.5	164	-5	-169	169.2	54.6	0	0	111.9
8	S	30	Very low	30.2	Very low	92 Å²	92	153.2 Å²	153.2	64%	0.643	76%	0.762	S	S	*	*			trans	83.4	143.8	141.9	143.6	0	0	0	0	119.3
9	L	32.9	Very low	30.3	Very low	137 Å²	137	153.2 Å²	153.2	72%	0.717	77%	0.765	S	S	*	*			cis	-165	163.9	-11.5	-97.2	163.8	0	0	0	104.3
10	R	29.7	Very low	30.7	Very low	217 Å²	217	152.1 Å²	152.1	82%	0.819	77%	0.769	S	S	*	*			cis	-165.9	136.3	32.6	-149.1	170.5	-168.1	171.7	1.7	110.8
11	N	29.6	Very low	30.8	Very low	121 Å²	121	153.6 Å²	153.6	65%	0.647	77%	0.773	S	S	*	*			trans	9.2	153.7	144.6	-61.2	-18.1	0	0	0	122.2
12	R	29.2	Very low	30.5	Very low	216 Å²	216	151.7 Å²	151.7	82%	0.815	76%	0.761	S	S	*	*			cis	-168.5	155.1	-12.4	-113.4	177.3	-180	-180	-2	110.1
13	L	28.5	Very low	30.5	Very low	155 Å²	155	152.4 Å²	152.4	81%	0.812	76%	0.761	S	S	*	*			trans	-18.3	161.3	143.8	-83.7	83.2	0	0	0	117.9
14	S	27.8	Very low	30.4	Very low	85 Å²	85	158.2 Å²	158.2	59%	0.594	77%	0.772	S	S	*	*			cis	170.6	154.3	-7.3	54.2	0	0	0	0	110
15	K	27.8	Very low	30.2	Very low	202 Å²	202	156.5 Å²	156.5	88%	0.878	77%	0.768	S	S	*	*				156.1	145.7	122.9	-94.7	-177.5	174.3	-177	0	112.8
16	S	27.1	Very low	30.1	Very low	109 Å²	109	156 Å²	156	76%	0.762	77%	0.766	S	S	*	*			trans	-90.4	155.1	159	53.4	0	0	0	0	110.4
17	R	28.1	Very low	29.9	Very low	224 Å²	224	159.2 Å²	159.2	85%	0.845	77%	0.773	S	S	*	*				171.6	168.6	101.2	-150.7	175.6	-170	-178.4	1.6	110.3
18	E	27.7	Very low	29.9	Very low	170 Å²	170	160.9 Å²	160.9	79%	0.794	78%	0.777	S	S	*	*			trans	95.3	117.6	160.7	-66.3	163.6	-165.3	0	0	118.4
19	N	30.6	Very low	30.7	Very low	153 Å²	153	162.5 Å²	162.5	82%	0.818	79%	0.785	S	S	*	*			trans	-89.6	164.9	152.7	-62.9	-2.7	0	0	0	107.7
20	P	40.2	Very low	30.7	Very low	130 Å²	130	160 Å²	160	84%	0.844	78%	0.784	S	S	*	*				-141	-172.2	92.5	32.5	-13.5	0	0	0	114.6
21	E	32	Very low	30.8	Very low	184 Å²	184	159.4 Å²	159.4	86%	0.86	79%	0.787	S	S	*	*			trans	-88.9	-171	-172.3	-60.8	168.5	130	0	0	113.8
22	E	29.8	Very low	30.7	Very low	195 Å²	195	163.1 Å²	163.1	91%	0.911	80%	0.801	S	S	*	*			trans	103.2	154.8	172.4	-61.5	-180	175.4	0	0	116.8
23	D	29.1	Very low	30.7	Very low	151 Å²	151	157.6 Å²	157.6	81%	0.807	80%	0.795	S	S	*	*				-160.7	175.8	-61.2	-150.7	-18.5	0	0	0	107.9
24	E	28.8	Very low	31	Very low	180 Å²	180	157.6 Å²	157.6	84%	0.841	80%	0.795	S	S	*	*			trans	62	167.1	168	-59.5	-167.9	144.9	0	0	119.5
25	D	29.4	Very low	31.2	Very low	121 Å²	121	162.2 Å²	162.2	65%	0.647	81%	0.808	S	S	*	*				-165.1	167	-53.8	-175.9	23.4	0	0	0	108
26	Q	28.6	Very low	31.5	Very low	125 Å²	125	157 Å²	157	58%	0.584	80%	0.802	S	S	*	*			trans	71.8	131.1	162	-47	-162.6	12.1	0	0	117.9
27	R	28	Very low	32.7	Very low	217 Å²	217	157.9 Å²	157.9	82%	0.819	81%	0.805	S	S	*	*			cis	-170.8	139.7	37.3	-127.4	157.2	-140.4	-162	6	112
28	K	33.3	Very low	33	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	80%	0.799	S	S	*	*			trans	-87.6	172.3	156.4	-86	179.7	-178.8	175.7	0	109
29	P	47.1	Very low	33.6	Very low	126 Å²	126	150.8 Å²	150.8	82%	0.818	80%	0.797	S	S	*	*			cis	-136.9	-157.5	34.1	39.2	-14.5	0	0	0	113.1
30	A	31.6	Very low	34.5	Very low	85 Å²	85	147.8 Å²	147.8	70%	0.702	80%	0.803	S	S	*	*			cis	-155.2	155.5	10.5	0	0	0	0	0	116.2
31	K	31.6	Very low	34.9	Very low	204 Å²	204	151.9 Å²	151.9	89%	0.887	80%	0.801	S	S	*	*			trans	25.1	126.5	139.6	-65.2	-177.4	173.8	-176.9	0	122.1
32	E	28.8	Very low	35.9	Very low	198 Å²	198	150 Å²	150	93%	0.925	80%	0.796	S	S	*	*				-153.6	159.6	100.8	-118.5	172	-167.6	0	0	112.1
33	S	28.6	Very low	37.3	Very low	101 Å²	101	145.8 Å²	145.8	71%	0.706	78%	0.779	S	S	*	*			trans	-112.4	160.6	179.8	51.7	0	0	0	0	109.1
34	L	35.4	Very low	38.8	Very low	154 Å²	154	144 Å²	144	81%	0.806	77%	0.769	S	S	*	*			cis	-174	-180	46.9	-138.7	148.9	0	0	0	109
35	E	30.7	Very low	40.5	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	77%	0.765	S	S	*	*			trans	84.9	146.2	165.3	-58.6	-171.8	178.1	0	0	121.2
36	A	34.8	Very low	42.2	Very low	92 Å²	92	144.6 Å²	144.6	76%	0.76	77%	0.765	S	S	*	*			trans	-160.4	173.9	175.8	0	0	0	0	0	107.6
37	P	52.7	Low	43.8	Very low	127 Å²	127	143.7 Å²	143.7	83%	0.825	76%	0.764	S	S	*	*			cis	-131.5	167.9	-6.6	40.5	-25.7	0	0	0	114.4
38	S	33.4	Very low	46	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	75%	0.748	S	S	*	*			trans	-165.8	136	163.3	173.2	0	0	0	0	116.1
39	N	41	Very low	47.9	Very low	141 Å²	141	131.5 Å²	131.5	75%	0.754	73%	0.732	S	S	*	*			trans	68.1	81.9	152.5	-72.2	-23.4	0	0	0	122.9	R41	N39-R41 PolarHBondContact O-N 3.1Å
40	G	50.6	Low	49.1	Very low	90 Å²	90	132.5 Å²	132.5	93%	0.928	72%	0.723	S	S	*	*			trans	-80.6	91.5	151.9	0	0	0	0	0	112.9
41	R	48.4	Very low	50.9	Low	216 Å²	216	135.7 Å²	135.7	82%	0.815	72%	0.721	S	S	*	*			trans	-134.4	4.9	175.8	-150.5	175.7	-176	178.3	2.4	115.8	N39	N39-R41 PolarHBondContact O-N 3.1Å
42	I	52.2	Low	53.1	Low	144 Å²	144	131.2 Å²	131.2	74%	0.738	71%	0.706	S	S	*	*	S	Bend	trans	-94.6	-28	-171.6	-64.8	176.3	0	0	0	113.2
43	D	59	Low	55.3	Low	107 Å²	107	128.1 Å²	128.1	57%	0.572	69%	0.689	S	S	*	*	H	α-helix	trans	-76.7	-35.2	-168.4	-159.2	8.5	0	0	0	114.7	K45 Q46 L47	D43-K45 VanDerWaalsContact C-N 3.31Å; D43-K45 PolarHBondContact O-N 2.95Å; D43-Q46 PolarHBondContact O-N 3.21Å; D43-Q46 VanDerWaalsContact O-N 3.15Å; D43-L47 PolarHBondContact O-N 3.02Å; D43-L47 VanDerWaalsContact O-N 3.17Å
44	I	60.9	Low	57.3	Low	113 Å²	113	128.1 Å²	128.1	58%	0.579	68%	0.681	S	S	*	*	H	α-helix	trans	-61.8	-34.8	-172.8	-63.2	174.4	0	0	0	112.7	L47 I48	I44-L47 PolarHBondContact O-N 2.97Å; I44-I48 HydrophobicContact CG2-CD1 3.78Å; I44-I48 HydrophobicContact CG2-CG1 4.39Å; I44-I48 WeakPolarHBondContact O-CG1 3.15Å; I44-I48 PolarHBondContact O-N 3Å
45	K	64.6	Low	59	Low	176 Å²	176	124.2 Å²	124.2	77%	0.765	66%	0.663	S	S	*	*	H	α-helix	trans	-68.8	-36.7	179.6	-74.4	-171.5	175.7	-175.6	0	112.5	D43 A49	D43-K45 VanDerWaalsContact C-N 3.31Å; D43-K45 PolarHBondContact O-N 2.95Å; K45-A49 PolarHBondContact O-N 2.91Å; K45-A49 VanDerWaalsContact O-N 3.13Å
46	Q	64.8	Low	61.2	Low	139 Å²	139	118 Å²	118	65%	0.65	64%	0.644	S	S	*	*	H	α-helix	trans	-70.3	-40.6	176.6	-69.9	-172.3	-15.1	0	0	111.2	D43 I48 A49 K50	D43-Q46 PolarHBondContact O-N 3.21Å; D43-Q46 VanDerWaalsContact O-N 3.15Å; Q46-I48 PolarHBondContact O-N 3.2Å; Q46-A49 PolarHBondContact O-N 2.99Å; Q46-K50 WeakPolarHBondContact O-CB 3.42Å; Q46-K50 PolarHBondContact O-N 3.14Å
47	L	62.8	Low	63	Low	106 Å²	106	117.3 Å²	117.3	56%	0.555	62%	0.624	S	S	*	*	H	α-helix	trans	-60	-43.4	173.8	-89.7	161.7	0	0	0	113	D43 I44 K50 K51	D43-L47 PolarHBondContact O-N 3.02Å; D43-L47 VanDerWaalsContact O-N 3.17Å; I44-L47 PolarHBondContact O-N 2.97Å; L47-K50 PolarHBondContact O-N 3.06Å; L47-K51 WeakPolarHBondContact O-CB 3.08Å; L47-K51 PolarHBondContact O-N 2.05Å
48	I	73.1	Confident	63.7	Low	94 Å²	94	114 Å²	114	48%	0.482	61%	0.608	S	S	.	*	H	α-helix	trans	-65.3	-45.8	177.4	-68.6	168.2	0	0	0	111.1	I44 Q46 K50 K51 I52	I44-I48 HydrophobicContact CG2-CD1 3.78Å; I44-I48 HydrophobicContact CG2-CG1 4.39Å; I44-I48 WeakPolarHBondContact O-CG1 3.15Å; I44-I48 PolarHBondContact O-N 3Å; Q46-I48 PolarHBondContact O-N 3.2Å; I48-K50 VanDerWaalsContact C-N 3.35Å; I48-K50 PolarHBondContact O-N 2.85Å; I48-K51 PolarHBondContact O-N 3.14Å; I48-I52 HydrophobicContact CG2-CD1 3.84Å; I48-I52 HydrophobicContact CG2-CG1 4.5Å; I48-I52 WeakPolarHBondContact O-CG1 3.28Å; I48-I52 PolarHBondContact O-N 3.08Å
49	A	73.9	Confident	65.6	Low	62 Å²	62	115.9 Å²	115.9	51%	0.512	61%	0.605	S	S	.	*	H	α-helix	trans	-61	-42.7	177.3	0	0	0	0	0	112.2	K45 Q46 I52 K53	K45-A49 PolarHBondContact O-N 2.91Å; K45-A49 VanDerWaalsContact O-N 3.13Å; Q46-A49 PolarHBondContact O-N 2.99Å; A49-I52 PolarHBondContact O-N 2.84Å; A49-K53 PolarHBondContact O-N 3.05Å; A49-K53 VanDerWaalsContact O-N 3.09Å
50	K	72.2	Confident	67.2	Low	146 Å²	146	116.4 Å²	116.4	64%	0.635	60%	0.603	S	S	*	*	H	α-helix	trans	-65.9	-38.5	176.9	-166	173.7	-175.1	178.3	0	112.2	Q46 L47 I48 L54	Q46-K50 WeakPolarHBondContact O-CB 3.42Å; Q46-K50 PolarHBondContact O-N 3.14Å; L47-K50 PolarHBondContact O-N 3.06Å; I48-K50 VanDerWaalsContact C-N 3.35Å; I48-K50 PolarHBondContact O-N 2.85Å; K50-L54 HydrophobicContact CG-CD1 4.36Å; K50-L54 WeakPolarHBondContact O-CG 3.11Å; K50-L54 PolarHBondContact O-N 3.5Å; K50-L54 VanDerWaalsContact O-N 3.11Å
51	K	69.7	Low	68.1	Low	153 Å²	153	117.9 Å²	117.9	67%	0.665	59%	0.589	S	S	*	*	H	α-helix	trans	-62.6	-48.3	174.3	-175.1	179.1	178.7	-178.1	0	111.5	L47 I48 K53 L54 T55	L47-K51 WeakPolarHBondContact O-CB 3.08Å; L47-K51 PolarHBondContact O-N 2.05Å; I48-K51 PolarHBondContact O-N 3.14Å; K51-K53 VanDerWaalsContact C-N 3.33Å; K51-K53 PolarHBondContact O-N 3.31Å; K51-L54 PolarHBondContact O-N 2.87Å; K51-T55 PolarHBondContact O-N 2.79Å; K51-T55 PolarHBondContact O-OG1 3.45Å
52	I	77.1	Confident	69.1	Low	110 Å²	110	113.7 Å²	113.7	56%	0.564	58%	0.577	S	S	*	*	H	α-helix	trans	-58.7	-44.8	179.3	-69.4	167.3	0	0	0	110.7	I48 A49 T55 A56	I48-I52 HydrophobicContact CG2-CD1 3.84Å; I48-I52 HydrophobicContact CG2-CG1 4.5Å; I48-I52 WeakPolarHBondContact O-CG1 3.28Å; I48-I52 PolarHBondContact O-N 3.08Å; A49-I52 PolarHBondContact O-N 2.84Å; I52-T55 WeakPolarHBondContact CA-OG1 3.15Å; I52-T55 PolarHBondContact O-N 2.71Å; I52-T55 PolarHBondContact O-OG1 2.74Å; I52-A56 PolarHBondContact O-N 3.05Å
53	K	76.6	Confident	70	Confident	133 Å²	133	110.8 Å²	110.8	58%	0.578	57%	0.568	S	S	*	*	H	α-helix	trans	-60.4	-46.3	177.1	-164.8	-175.6	-172.4	-114.2	0	112.4	A49 K51 T55 A56 E57	A49-K53 PolarHBondContact O-N 3.05Å; A49-K53 VanDerWaalsContact O-N 3.09Å; K51-K53 VanDerWaalsContact C-N 3.33Å; K51-K53 PolarHBondContact O-N 3.31Å; K53-T55 VanDerWaalsContact C-N 3.34Å; K53-T55 PolarHBondContact O-N 2.93Å; K53-A56 PolarHBondContact O-N 3.11Å; K53-E57 VanDerWaalsContact CE-OE1 3.28Å; K53-E57 WeakPolarHBondContact CE-OE1 3.1Å; K53-E57 IonicContact NZ-OE1 2.72Å; K53-E57 PolarHBondContact NZ-OE1 3.3Å; K53-E57 PolarHBondContact O-N 3.37Å
54	L	68.9	Low	70.6	Confident	100 Å²	100	112.9 Å²	112.9	52%	0.524	57%	0.572	S	S	.	*	H	α-helix	trans	-65.1	-34.8	178.8	-73.5	167.6	0	0	0	112.8	K50 K51 A58	K50-L54 HydrophobicContact CG-CD1 4.36Å; K50-L54 WeakPolarHBondContact O-CG 3.11Å; K50-L54 PolarHBondContact O-N 3.5Å; K50-L54 VanDerWaalsContact O-N 3.11Å; K51-L54 PolarHBondContact O-N 2.87Å; L54-A58 VanDerWaalsContact O-CB 3.31Å; L54-A58 WeakPolarHBondContact O-CB 3.06Å; L54-A58 PolarHBondContact O-N 3.38Å; L54-A58 VanDerWaalsContact O-N 3.08Å
55	T	72.7	Confident	70.9	Confident	72 Å²	72	114.5 Å²	114.5	44%	0.442	58%	0.575	S	S	.	*	H	α-helix	trans	-68.2	-37.1	172.2	35.3	0	0	0	0	112.8	K51 I52 K53 A58 E59	K51-T55 PolarHBondContact O-N 2.79Å; K51-T55 PolarHBondContact O-OG1 3.45Å; I52-T55 WeakPolarHBondContact CA-OG1 3.15Å; I52-T55 PolarHBondContact O-N 2.71Å; I52-T55 PolarHBondContact O-OG1 2.74Å; K53-T55 VanDerWaalsContact C-N 3.34Å; K53-T55 PolarHBondContact O-N 2.93Å; T55-A58 PolarHBondContact O-N 3.08Å; T55-E59 WeakPolarHBondContact O-CG 2.94Å; T55-E59 PolarHBondContact O-N 3.23Å
56	A	76.8	Confident	71.1	Confident	54 Å²	54	112.1 Å²	112.1	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-66.2	-46.6	176.5	0	0	0	0	0	111.8	I52 K53 A58 E59 E60	I52-A56 PolarHBondContact O-N 3.05Å; K53-A56 PolarHBondContact O-N 3.11Å; A56-A58 VanDerWaalsContact C-N 3.27Å; A56-A58 PolarHBondContact O-N 3.42Å; A56-E59 PolarHBondContact O-N 3.08Å; A56-E60 PolarHBondContact O-N 2.82Å
57	E	72.9	Confident	71.6	Confident	76 Å²	76	113.3 Å²	113.3	36%	0.355	57%	0.571	S	S	.	*	H	α-helix	trans	-58.6	-38.8	174.4	-71.6	171	-177.4	0	0	111.4	K53 L61	K53-E57 VanDerWaalsContact CE-OE1 3.28Å; K53-E57 WeakPolarHBondContact CE-OE1 3.1Å; K53-E57 IonicContact NZ-OE1 2.72Å; K53-E57 PolarHBondContact NZ-OE1 3.3Å; K53-E57 PolarHBondContact O-N 3.37Å; E57-L61 WeakPolarHBondContact O-CB 3.41Å; E57-L61 PolarHBondContact O-N 3.4Å; E57-L61 VanDerWaalsContact O-N 3.11Å
58	A	66.7	Low	72.1	Confident	58 Å²	58	113.1 Å²	113.1	48%	0.479	57%	0.567	S	S	.	*	H	α-helix	trans	-71.1	-34.3	177.1	0	0	0	0	0	113.7	L54 T55 A56 K62	L54-A58 VanDerWaalsContact O-CB 3.31Å; L54-A58 WeakPolarHBondContact O-CB 3.06Å; L54-A58 PolarHBondContact O-N 3.38Å; L54-A58 VanDerWaalsContact O-N 3.08Å; T55-A58 PolarHBondContact O-N 3.08Å; A56-A58 VanDerWaalsContact C-N 3.27Å; A56-A58 PolarHBondContact O-N 3.42Å; A58-K62 WeakPolarHBondContact O-CB 3.16Å; A58-K62 PolarHBondContact O-N 2.74Å
59	E	73.3	Confident	72.1	Confident	143 Å²	143	112 Å²	112	67%	0.668	57%	0.565	S	S	*	*	H	α-helix	trans	-72.8	-32.3	175	-75.4	-170.9	148	0	0	112.6	T55 A56 P63	T55-E59 WeakPolarHBondContact O-CG 2.94Å; T55-E59 PolarHBondContact O-N 3.23Å; A56-E59 PolarHBondContact O-N 3.08Å; E59-P63 WeakPolarHBondContact O-CD 3.33Å
60	E	74.8	Confident	72.1	Confident	153 Å²	153	110.6 Å²	110.6	72%	0.715	56%	0.556	S	S	*	*	H	α-helix	trans	-72.3	-37	175.1	-170	173	-167.2	0	0	112.7	A56 P63	A56-E60 PolarHBondContact O-N 2.82Å; E60-P63 VanDerWaalsContact O-CD 3.31Å; E60-P63 WeakPolarHBondContact O-CD 3.46Å; E60-P63 WeakPolarHBondContact O-CG 3.12Å
61	L	69.7	Low	72.2	Confident	120 Å²	120	106.5 Å²	106.5	63%	0.628	55%	0.545	S	S	*	.	H	α-helix	trans	-71.2	-27.4	174.8	-86.3	159	0	0	0	113.6	E57 F64 F65	E57-L61 WeakPolarHBondContact O-CB 3.41Å; E57-L61 PolarHBondContact O-N 3.4Å; E57-L61 VanDerWaalsContact O-N 3.11Å; L61-F64 PolarHBondContact O-N 2.96Å; L61-F65 PolarHBondContact O-N 2.85Å
62	K	68.4	Low	72.2	Confident	128 Å²	128	105.4 Å²	105.4	56%	0.557	54%	0.542	S	S	*	.	H	α-helix	trans	-56.9	-50	-176.5	-172.9	179.1	179.9	-176.7	0	114.8	A58 F64 M66	A58-K62 WeakPolarHBondContact O-CB 3.16Å; A58-K62 PolarHBondContact O-N 2.74Å; K62-F64 VanDerWaalsContact C-N 3.33Å; K62-F64 PolarHBondContact O-N 3.24Å; K62-M66 WeakPolarHBondContact O-CB 3.39Å; K62-M66 VanDerWaalsContact O-CG 3.28Å; K62-M66 WeakPolarHBondContact O-CG 3.22Å; K62-M66 PolarHBondContact O-N 2.85Å
63	P	71.6	Confident	72	Confident	84 Å²	84	106.4 Å²	106.4	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-33.1	177.4	25.8	-35.5	0	0	0	112.8	E59 E60 K67	E59-P63 WeakPolarHBondContact O-CD 3.33Å; E60-P63 VanDerWaalsContact O-CD 3.31Å; E60-P63 WeakPolarHBondContact O-CD 3.46Å; E60-P63 WeakPolarHBondContact O-CG 3.12Å; P63-K67 WeakPolarHBondContact O-CB 3.29Å; P63-K67 PolarHBondContact O-N 2.97Å
64	F	71.1	Confident	72	Confident	150 Å²	150	105 Å²	105	66%	0.658	54%	0.542	S	S	*	.	H	α-helix	trans	-66.2	-49.5	177	-132.4	-77.7	0	0	0	110.7	L61 K62 M66 K67 E68	L61-F64 PolarHBondContact O-N 2.96Å; K62-F64 VanDerWaalsContact C-N 3.33Å; K62-F64 PolarHBondContact O-N 3.24Å; F64-M66 PolarHBondContact O-N 3.44Å; F64-K67 PolarHBondContact O-N 3Å; F64-E68 PolarHBondContact O-N 2.79Å
65	F	67.3	Low	72.4	Confident	148 Å²	148	105.1 Å²	105.1	65%	0.649	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-40.4	178.4	-161	-92.9	0	0	0	112.6	L61 K67 E68 V69	L61-F65 PolarHBondContact O-N 2.85Å; F65-K67 VanDerWaalsContact C-N 3.3Å; F65-K67 PolarHBondContact O-N 2.67Å; F65-E68 PolarHBondContact O-N 2.9Å; F65-V69 HydrophobicContact CD1-CG2 3.84Å; F65-V69 HydrophobicContact CE1-CG2 3.61Å; F65-V69 HydrophobicContact CZ-CG2 4.19Å; F65-V69 WeakPolarHBondContact O-CB 3.25Å; F65-V69 VanDerWaalsContact O-CG2 3.3Å; F65-V69 WeakPolarHBondContact O-CG2 3.18Å; F65-V69 PolarHBondContact O-N 3.42Å
66	M	69.6	Low	72.3	Confident	125 Å²	125	108 Å²	108	62%	0.616	55%	0.55	S	S	*	.	H	α-helix	trans	-64.5	-33.5	175.2	-75.8	-68.1	-170.7	0	0	112.8	K62 F64 G70	K62-M66 WeakPolarHBondContact O-CB 3.39Å; K62-M66 VanDerWaalsContact O-CG 3.28Å; K62-M66 WeakPolarHBondContact O-CG 3.22Å; K62-M66 PolarHBondContact O-N 2.85Å; F64-M66 PolarHBondContact O-N 3.44Å; M66-G70 PolarHBondContact O-N 2.96Å
67	K	74.8	Confident	72.3	Confident	165 Å²	165	107.9 Å²	107.9	72%	0.717	54%	0.543	S	S	*	.	H	α-helix	trans	-71	-45.7	176	-170.6	-179.1	178.5	-172.5	0	111.6	P63 F64 F65 G70 S71	P63-K67 WeakPolarHBondContact O-CB 3.29Å; P63-K67 PolarHBondContact O-N 2.97Å; F64-K67 PolarHBondContact O-N 3Å; F65-K67 VanDerWaalsContact C-N 3.3Å; F65-K67 PolarHBondContact O-N 2.67Å; K67-G70 PolarHBondContact O-N 3.11Å; K67-S71 PolarHBondContact O-N 3.33Å; K67-S71 PolarHBondContact O-OG 3.18Å
68	E	72.3	Confident	72.5	Confident	102 Å²	102	108 Å²	108	48%	0.477	55%	0.549	S	S	.	.	H	α-helix	trans	-61.1	-46.5	177.9	-151.6	81.7	-159.5	0	0	111.6	F64 F65 G70 S71 H72	F64-E68 PolarHBondContact O-N 2.79Å; F65-E68 PolarHBondContact O-N 2.9Å; E68-G70 VanDerWaalsContact C-N 3.35Å; E68-S71 PolarHBondContact O-N 3.19Å; E68-S71 PolarHBondContact O-OG 2.91Å; E68-H72 WeakPolarHBondContact O-CB 3.49Å; E68-H72 PolarHBondContact O-CD2 3.43Å; E68-H72 PolarHBondContact O-N 2.95Å
69	V	73.5	Confident	72.8	Confident	71 Å²	71	110.2 Å²	110.2	43%	0.43	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-36.9	176.2	172.6	0	0	0	0	111.2	F65 H72 F73	F65-V69 HydrophobicContact CD1-CG2 3.84Å; F65-V69 HydrophobicContact CE1-CG2 3.61Å; F65-V69 HydrophobicContact CZ-CG2 4.19Å; F65-V69 WeakPolarHBondContact O-CB 3.25Å; F65-V69 VanDerWaalsContact O-CG2 3.3Å; F65-V69 WeakPolarHBondContact O-CG2 3.18Å; F65-V69 PolarHBondContact O-N 3.42Å; V69-H72 PolarHBondContact O-N 3.01Å; V69-F73 VanDerWaalsContact O-CB 3.23Å; V69-F73 WeakPolarHBondContact O-CB 3.48Å; V69-F73 PolarHBondContact O-N 3.48Å
70	G	75.1	Confident	72.3	Confident	31 Å²	31	108.1 Å²	108.1	32%	0.32	55%	0.546	S	S	.	.	H	α-helix	trans	-59.6	-51.3	174.2	0	0	0	0	0	112.4	M66 K67 E68 H72 F73 D74	M66-G70 PolarHBondContact O-N 2.96Å; K67-G70 PolarHBondContact O-N 3.11Å; E68-G70 VanDerWaalsContact C-N 3.35Å; G70-H72 PolarHBondContact O-N 3.27Å; G70-F73 PolarHBondContact O-N 3.31Å; G70-D74 PolarHBondContact O-N 3.12Å
71	S	73.1	Confident	72.4	Confident	60 Å²	60	105.8 Å²	105.8	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-63.9	-41.5	177.4	46.4	0	0	0	0	112.8	K67 E68 F73 D74 D75	K67-S71 PolarHBondContact O-N 3.33Å; K67-S71 PolarHBondContact O-OG 3.18Å; E68-S71 PolarHBondContact O-N 3.19Å; E68-S71 PolarHBondContact O-OG 2.91Å; S71-F73 VanDerWaalsContact C-N 3.29Å; S71-F73 PolarHBondContact O-N 3.24Å; S71-D74 PolarHBondContact O-N 3.47Å; S71-D75 WeakPolarHBondContact O-CB 3.34Å; S71-D75 PolarHBondContact O-N 2.89Å
72	H	70.8	Confident	72.5	Confident	130 Å²	130	106.4 Å²	106.4	60%	0.602	54%	0.537	S	S	*	.	H	α-helix	trans	-65.2	-32.1	175.6	-91.1	-72	0	0	0	113.1	E68 V69 G70 F76	E68-H72 WeakPolarHBondContact O-CB 3.49Å; E68-H72 PolarHBondContact O-CD2 3.43Å; E68-H72 PolarHBondContact O-N 2.95Å; V69-H72 PolarHBondContact O-N 3.01Å; G70-H72 PolarHBondContact O-N 3.27Å; H72-F76 VanDerWaalsContact O-CB 3.26Å; H72-F76 WeakPolarHBondContact O-CB 3.22Å; H72-F76 PolarHBondContact O-N 3.37Å; H72-F76 VanDerWaalsContact O-N 3.09Å
73	F	71.7	Confident	72.2	Confident	132 Å²	132	107.3 Å²	107.3	58%	0.579	54%	0.541	S	S	*	.	H	α-helix	trans	-73.6	-43.9	176.3	-172.4	-96.8	0	0	0	111.7	V69 G70 S71 F76 V77	V69-F73 VanDerWaalsContact O-CB 3.23Å; V69-F73 WeakPolarHBondContact O-CB 3.48Å; V69-F73 PolarHBondContact O-N 3.48Å; G70-F73 PolarHBondContact O-N 3.31Å; S71-F73 VanDerWaalsContact C-N 3.29Å; S71-F73 PolarHBondContact O-N 3.24Å; F73-F76 PolarHBondContact O-N 3.38Å; F73-V77 HydrophobicContact CD1-CG2 4.04Å; F73-V77 HydrophobicContact CE1-CG2 3.69Å; F73-V77 HydrophobicContact CE2-CG2 4.5Å; F73-V77 HydrophobicContact CZ-CG2 3.94Å; F73-V77 WeakPolarHBondContact O-CB 3.31Å; F73-V77 WeakPolarHBondContact O-CG2 3.34Å; F73-V77 PolarHBondContact O-N 3.19Å
74	D	77.9	Confident	71.5	Confident	102 Å²	102	106.2 Å²	106.2	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-40.5	176.2	-79.8	-10.9	0	0	0	111.9	G70 S71 F76 V77 T78	G70-D74 PolarHBondContact O-N 3.12Å; S71-D74 PolarHBondContact O-N 3.47Å; D74-F76 VanDerWaalsContact C-N 3.33Å; D74-F76 PolarHBondContact O-N 2.93Å; D74-V77 PolarHBondContact O-N 3.04Å; D74-T78 VanDerWaalsContact O-CB 3.26Å; D74-T78 WeakPolarHBondContact O-CB 3.46Å; D74-T78 PolarHBondContact O-N 3.34Å; D74-T78 PolarHBondContact O-OG1 3.44Å
75	D	77.2	Confident	71	Confident	103 Å²	103	101.8 Å²	101.8	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-62.9	-39.5	172.6	-89.3	-7.6	0	0	0	111.8	S71 N79	S71-D75 WeakPolarHBondContact O-CB 3.34Å; S71-D75 PolarHBondContact O-N 2.89Å; D75-N79 WeakPolarHBondContact O-CB 3.23Å; D75-N79 PolarHBondContact O-N 3.21Å; D75-N79 PolarHBondContact O-ND2 2.84Å
76	F	70.9	Confident	70.5	Confident	133 Å²	133	98.2 Å²	98.2	58%	0.583	52%	0.52	S	S	*	.	H	α-helix	trans	-65.9	-46.2	176.3	-178.9	-98.5	0	0	0	111.6	H72 F73 D74 N79 L80	H72-F76 VanDerWaalsContact O-CB 3.26Å; H72-F76 WeakPolarHBondContact O-CB 3.22Å; H72-F76 PolarHBondContact O-N 3.37Å; H72-F76 VanDerWaalsContact O-N 3.09Å; F73-F76 PolarHBondContact O-N 3.38Å; D74-F76 VanDerWaalsContact C-N 3.33Å; D74-F76 PolarHBondContact O-N 2.93Å; F76-N79 PolarHBondContact O-N 2.71Å; F76-L80 HydrophobicContact CD1-CD1 4.27Å; F76-L80 HydrophobicContact CE1-CD1 3.55Å; F76-L80 HydrophobicContact CE2-CD1 4.47Å; F76-L80 HydrophobicContact CZ-CD1 3.67Å; F76-L80 WeakPolarHBondContact O-CB 3.37Å; F76-L80 PolarHBondContact O-N 2.92Å
77	V	74.9	Confident	69.5	Low	51 Å²	51	98.4 Å²	98.4	31%	0.309	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-42	177	169.4	0	0	0	0	111	F73 D74 L80 I81	F73-V77 HydrophobicContact CD1-CG2 4.04Å; F73-V77 HydrophobicContact CE1-CG2 3.69Å; F73-V77 HydrophobicContact CE2-CG2 4.5Å; F73-V77 HydrophobicContact CZ-CG2 3.94Å; F73-V77 WeakPolarHBondContact O-CB 3.31Å; F73-V77 WeakPolarHBondContact O-CG2 3.34Å; F73-V77 PolarHBondContact O-N 3.19Å; D74-V77 PolarHBondContact O-N 3.04Å; V77-L80 WeakPolarHBondContact O-CB 3.36Å; V77-L80 PolarHBondContact O-N 3.42Å; V77-L80 VanDerWaalsContact O-N 3.14Å; V77-I81 HydrophobicContact CG1-CD1 3.77Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 VanDerWaalsContact O-CG1 3.32Å; V77-I81 WeakPolarHBondContact O-CG1 3.41Å; V77-I81 PolarHBondContact O-N 2.83Å
78	T	77.9	Confident	68.2	Low	80 Å²	80	97.8 Å²	97.8	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-44.5	179	-54.7	0	0	0	0	111.2	D74 L80 I81 E82	D74-T78 VanDerWaalsContact O-CB 3.26Å; D74-T78 WeakPolarHBondContact O-CB 3.46Å; D74-T78 PolarHBondContact O-N 3.34Å; D74-T78 PolarHBondContact O-OG1 3.44Å; T78-L80 VanDerWaalsContact C-N 3.27Å; T78-L80 PolarHBondContact O-N 2.87Å; T78-I81 PolarHBondContact O-N 3.02Å; T78-E82 WeakPolarHBondContact O-CB 3.47Å; T78-E82 PolarHBondContact O-N 3.36Å
79	N	72.5	Confident	67	Low	103 Å²	103	100.4 Å²	100.4	55%	0.551	55%	0.545	S	S	*	.	H	α-helix	trans	-58.4	-38.1	170.8	-89.6	-87.2	0	0	0	112.3	D75 F76 K83	D75-N79 WeakPolarHBondContact O-CB 3.23Å; D75-N79 PolarHBondContact O-N 3.21Å; D75-N79 PolarHBondContact O-ND2 2.84Å; F76-N79 PolarHBondContact O-N 2.71Å; N79-K83 WeakPolarHBondContact O-CB 3.4Å; N79-K83 PolarHBondContact O-N 3.37Å
80	L	64.3	Low	65.2	Low	100 Å²	100	99.5 Å²	99.5	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-71.2	-36.7	-179.8	-139	136.8	0	0	0	111.8	F76 V77 T78 S84	F76-L80 HydrophobicContact CD1-CD1 4.27Å; F76-L80 HydrophobicContact CE1-CD1 3.55Å; F76-L80 HydrophobicContact CE2-CD1 4.47Å; F76-L80 HydrophobicContact CZ-CD1 3.67Å; F76-L80 WeakPolarHBondContact O-CB 3.37Å; F76-L80 PolarHBondContact O-N 2.92Å; V77-L80 WeakPolarHBondContact O-CB 3.36Å; V77-L80 PolarHBondContact O-N 3.42Å; V77-L80 VanDerWaalsContact O-N 3.14Å; T78-L80 VanDerWaalsContact C-N 3.27Å; T78-L80 PolarHBondContact O-N 2.87Å; L80-S84 PolarHBondContact O-N 3.25Å
81	I	75.4	Confident	63.3	Low	104 Å²	104	101.7 Å²	101.7	53%	0.533	57%	0.572	S	S	.	*	H	α-helix	trans	-66.4	-48.2	172.9	-68.8	166.8	0	0	0	110.4	V77 T78 K83 S84 A85	V77-I81 HydrophobicContact CG1-CD1 3.77Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 VanDerWaalsContact O-CG1 3.32Å; V77-I81 WeakPolarHBondContact O-CG1 3.41Å; V77-I81 PolarHBondContact O-N 2.83Å; T78-I81 PolarHBondContact O-N 3.02Å; I81-K83 VanDerWaalsContact C-N 3.31Å; I81-K83 PolarHBondContact O-N 3.29Å; I81-S84 PolarHBondContact O-N 2.97Å; I81-S84 PolarHBondContact O-OG 3.29Å; I81-A85 PolarHBondContact O-N 3.44Å
82	E	73.5	Confident	61.5	Low	132 Å²	132	105.1 Å²	105.1	62%	0.617	60%	0.595	S	S	*	*	H	α-helix	trans	-62	-38.5	177.4	-171.4	172.8	-162.2	0	0	112	T78 S84 A85 S86	T78-E82 WeakPolarHBondContact O-CB 3.47Å; T78-E82 PolarHBondContact O-N 3.36Å; E82-S84 VanDerWaalsContact C-N 3.31Å; E82-S84 PolarHBondContact O-N 2.79Å; E82-A85 PolarHBondContact O-N 3.25Å; E82-S86 PolarHBondContact O-N 3.28Å; E82-S86 PolarHBondContact O-OG 2.88Å
83	K	60.4	Low	59.6	Low	147 Å²	147	103.5 Å²	103.5	64%	0.639	60%	0.604	S	S	*	*	H	α-helix	trans	-68.2	-27.3	173.3	-162.8	168.8	-171.2	173.1	0	113.3	N79 I81 S86 L87	N79-K83 WeakPolarHBondContact O-CB 3.4Å; N79-K83 PolarHBondContact O-N 3.37Å; I81-K83 VanDerWaalsContact C-N 3.31Å; I81-K83 PolarHBondContact O-N 3.29Å; K83-S86 WeakPolarHBondContact CA-OG 3.15Å; K83-S86 PolarHBondContact O-OG 3.04Å; K83-L87 WeakPolarHBondContact O-CD1 3.22Å; K83-L87 WeakPolarHBondContact O-CG 3.25Å; K83-L87 PolarHBondContact O-N 2.8Å
84	S	57.6	Low	57.5	Low	61 Å²	61	105.4 Å²	105.4	43%	0.427	62%	0.619	S	S	.	*	H	α-helix	trans	-76.6	-42.4	172	75.6	0	0	0	0	112.2	L80 I81 E82 S86 L87 D88	L80-S84 PolarHBondContact O-N 3.25Å; I81-S84 PolarHBondContact O-N 2.97Å; I81-S84 PolarHBondContact O-OG 3.29Å; E82-S84 VanDerWaalsContact C-N 3.31Å; E82-S84 PolarHBondContact O-N 2.79Å; S84-S86 VanDerWaalsContact C-N 3.3Å; S84-S86 PolarHBondContact O-N 3.41Å; S84-L87 WeakPolarHBondContact O-CB 3.41Å; S84-L87 PolarHBondContact O-N 3.32Å; S84-L87 VanDerWaalsContact O-N 3.07Å; S84-D88 PolarHBondContact O-N 3.5Å
85	A	61.2	Low	55.3	Low	58 Å²	58	106.6 Å²	106.6	48%	0.479	63%	0.63	S	S	.	*	H	α-helix	trans	-65.4	-32.5	178	0	0	0	0	0	112.7	I81 E82	I81-A85 PolarHBondContact O-N 3.44Å; E82-A85 PolarHBondContact O-N 3.25Å
86	S	56.8	Low	53	Low	73 Å²	73	107.7 Å²	107.7	51%	0.51	64%	0.641	S	S	.	*	H	α-helix	trans	-75.6	-20.3	173.2	48.1	0	0	0	0	113.9	E82 K83 S84	E82-S86 PolarHBondContact O-N 3.28Å; E82-S86 PolarHBondContact O-OG 2.88Å; K83-S86 WeakPolarHBondContact CA-OG 3.15Å; K83-S86 PolarHBondContact O-OG 3.04Å; S84-S86 VanDerWaalsContact C-N 3.3Å; S84-S86 PolarHBondContact O-N 3.41Å
87	L	48.9	Very low	51	Low	128 Å²	128	111.7 Å²	111.7	67%	0.67	66%	0.658	S	S	*	*	H	α-helix	trans	-78.8	-33.6	173.1	-79.3	165.8	0	0	0	112.8	K83 S84 N89 G90	K83-L87 WeakPolarHBondContact O-CD1 3.22Å; K83-L87 WeakPolarHBondContact O-CG 3.25Å; K83-L87 PolarHBondContact O-N 2.8Å; S84-L87 WeakPolarHBondContact O-CB 3.41Å; S84-L87 PolarHBondContact O-N 3.32Å; S84-L87 VanDerWaalsContact O-N 3.07Å; L87-N89 VanDerWaalsContact C-N 3.34Å; L87-N89 PolarHBondContact O-N 2.92Å; L87-G90 PolarHBondContact O-N 3.34Å
88	D	45.8	Very low	48.7	Very low	152 Å²	152	114.6 Å²	114.6	81%	0.813	68%	0.681	S	S	*	*	H	α-helix	trans	-70.9	-25.5	178.3	-87.9	-17.9	0	0	0	113.8	S84	S84-D88 PolarHBondContact O-N 3.5Å
89	N	47.3	Very low	46.4	Very low	158 Å²	158	118.5 Å²	118.5	85%	0.845	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-4.5	172.3	-85.6	-23.3	0	0	0	113.7	L87	L87-N89 VanDerWaalsContact C-N 3.34Å; L87-N89 PolarHBondContact O-N 2.92Å
90	G	36.3	Very low	44.4	Very low	51 Å²	51	121.7 Å²	121.7	53%	0.526	71%	0.713	S	S	.	*	S	Bend	trans	-98.6	88.7	-176.4	0	0	0	0	0	113.1	L87 C92	L87-G90 PolarHBondContact O-N 3.34Å; G90-C92 PolarHBondContact O-N 3.28Å
91	G	35.8	Very low	42.7	Very low	77 Å²	77	126.5 Å²	126.5	79%	0.794	73%	0.733	S	S	*	*			trans	-60.8	120.7	178.4	0	0	0	0	0	114.2
92	C	33.6	Very low	40.3	Very low	133 Å²	133	125 Å²	125	90%	0.899	74%	0.744	S	S	*	*			trans	73.1	91	159.8	-155.7	0	0	0	0	118.9	G90	G90-C92 PolarHBondContact O-N 3.28Å
93	A	32.2	Very low	38.5	Very low	96 Å²	96	127.8 Å²	127.8	79%	0.793	76%	0.757	S	S	*	*			trans	-166.8	100.1	140.2	0	0	0	0	0	111.2
94	L	27.8	Very low	37.1	Very low	172 Å²	172	130.1 Å²	130.1	90%	0.901	77%	0.767	S	S	*	*			trans	-121.9	95.2	174.3	-162.4	91.4	0	0	0	111.6
95	T	30.2	Very low	35.6	Very low	127 Å²	127	133 Å²	133	78%	0.779	78%	0.778	S	S	*	*			trans	-136.5	118.9	164.1	45.5	0	0	0	0	111.1
96	T	29.8	Very low	34	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	79%	0.79	S	S	*	*	S	Bend	trans	69.8	72.9	145.9	-39.1	0	0	0	0	117.8
97	F	28.5	Very low	32.6	Very low	216 Å²	216	140.7 Å²	140.7	95%	0.947	80%	0.799	S	S	*	*			trans	-168.8	66.9	142.5	-118.4	-75.6	0	0	0	112.5
98	S	26.7	Very low	31.7	Very low	112 Å²	112	143.7 Å²	143.7	78%	0.783	80%	0.802	S	S	*	*			trans	-157.9	26	177.3	57.5	0	0	0	0	115.7
99	I	29.6	Very low	31	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	80%	0.797	S	S	*	*			trans	-119.8	69.7	173.4	-50.3	178.6	0	0	0	109.1
100	L	31.6	Very low	30.2	Very low	169 Å²	169	140.7 Å²	140.7	89%	0.885	79%	0.79	S	S	*	*	S	Bend	trans	-168.6	49.8	164.9	-113.1	166.6	0	0	0	113.6
101	E	27.8	Very low	29.9	Very low	201 Å²	201	144.1 Å²	144.1	94%	0.939	80%	0.796	S	S	*	*	S	Bend	trans	-161.8	145.5	160.4	-121.8	169	-159.3	0	0	113.7
102	G	25.8	Very low	29.8	Very low	74 Å²	74	147.7 Å²	147.7	76%	0.763	80%	0.796	S	S	*	*			trans	78.3	98.9	151.5	0	0	0	0	0	119.5	K104	G102-K104 PolarHBondContact O-N 3.43Å
103	E	34.5	Very low	29.8	Very low	190 Å²	190	150.8 Å²	150.8	89%	0.888	79%	0.789	S	S	*	*			trans	-53.9	127	168.6	-60.4	179.1	107.6	0	0	114.8
104	K	30.8	Very low	29.6	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	76%	0.762	S	S	*	*			trans	173.9	73.6	134.5	-98.2	168	-176.7	173	0	112	G102	G102-K104 PolarHBondContact O-N 3.43Å
105	N	25.8	Very low	29.7	Very low	122 Å²	122	143.1 Å²	143.1	65%	0.652	74%	0.744	S	S	*	*			trans	-157.2	49.1	167.9	-106.5	-40.6	0	0	0	114.8	H107	N105-H107 PolarHBondContact O-N 2.97Å
106	N	28.2	Very low	30.3	Very low	138 Å²	138	141.9 Å²	141.9	74%	0.738	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	12.4	-179.3	-113.6	-35.3	0	0	0	115.3
107	H	28.7	Very low	31	Very low	154 Å²	154	144.3 Å²	144.3	71%	0.713	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-32	179.6	-75.2	-79.2	0	0	0	114.5	N105	N105-H107 PolarHBondContact O-N 2.97Å
108	R	29.1	Very low	32.3	Very low	190 Å²	190	139.6 Å²	139.6	72%	0.717	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-79.4	-18.2	-177.3	-81.3	-178	170.2	173.3	-2	115.3	K110 D111	R108-K110 PolarHBondContact O-N 2.77Å; R108-D111 PolarHBondContact O-N 3.43Å
109	A	30.6	Very low	34.5	Very low	86 Å²	86	135.3 Å²	135.3	71%	0.711	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-70.4	-7	176.8	0	0	0	0	0	114
110	K	30.2	Very low	37.2	Very low	161 Å²	161	128.7 Å²	128.7	70%	0.7	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-81.1	-23.7	171.8	-82.1	-178.3	174.4	176.6	0	113.3	R108 L112 R113	R108-K110 PolarHBondContact O-N 2.77Å; K110-L112 PolarHBondContact O-N 2.89Å; K110-R113 PolarHBondContact O-N 3.08Å
111	D	30.7	Very low	40	Very low	124 Å²	124	125.3 Å²	125.3	66%	0.663	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-9.5	-164.5	-56.3	-34.2	0	0	0	114.1	R108 R113	R108-D111 PolarHBondContact O-N 3.43Å; D111-R113 VanDerWaalsContact C-N 3.31Å
112	L	34.5	Very low	43.1	Very low	151 Å²	151	117 Å²	117	79%	0.791	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-3.4	168.7	-86.4	165.1	0	0	0	113.7	K110 I123	K110-L112 PolarHBondContact O-N 2.89Å; L112-I123 HydrophobicContact CD2-CD1 4.4Å
113	R	32.6	Very low	46.3	Very low	198 Å²	198	117 Å²	117	75%	0.747	59%	0.585	S	S	*	*	S	Bend	trans	-91.5	101.5	168.2	-175.9	174.7	-91.7	177.1	-7.4	107.8	K110 D111	K110-R113 PolarHBondContact O-N 3.08Å; D111-R113 VanDerWaalsContact C-N 3.31Å
114	A	27.5	Very low	49.1	Very low	28 Å²	28	111.1 Å²	111.1	23%	0.231	57%	0.568	C	S	.	*			trans	-47.8	150.6	175.3	0	0	0	0	0	111.9	Q118 I121	A114-Q118 HydrophobicContact CB-CB 4.17Å; A114-I121 HydrophobicContact CB-CD1 3.77Å; A114-I121 HydrophobicContact CB-CG1 4.43Å
115	P	30.5	Very low	52.1	Low	79 Å²	79	105.5 Å²	105.5	51%	0.513	54%	0.542	S	S	.	.			trans	-49.8	146.9	177.5	-27	34.7	0	0	0	111.4	E117 Q118	P115-E117 PolarHBondContact O-N 3.09Å; P115-Q118 PolarHBondContact O-N 3.12Å
116	P	42.6	Very low	55.3	Low	102 Å²	102	106 Å²	106	66%	0.662	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-4.7	-170.6	23.6	-34.6	0	0	0	115.6	K434	P116-K434 PolarHBondContact O-NZ 2.91Å
117	E	45	Very low	58.4	Low	176 Å²	176	99.4 Å²	99.4	82%	0.822	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-25.4	176.1	-57.2	-173.5	157	0	0	112.7	P115	P115-E117 PolarHBondContact O-N 3.09Å
118	Q	55.8	Low	61.5	Low	117 Å²	117	94.7 Å²	94.7	55%	0.547	48%	0.479	S	S	.	.	S	Bend	trans	-92.2	133	174.5	-65.3	178.9	-0.7	0	0	110.1	A114 P115	A114-Q118 HydrophobicContact CB-CB 4.17Å; P115-Q118 PolarHBondContact O-N 3.12Å
119	G	73.4	Confident	64.5	Low	22 Å²	22	86.6 Å²	86.6	23%	0.227	45%	0.45	C	S	.	.			trans	-70.5	-176.1	179.7	0	0	0	0	0	113.1	I121 R309	G119-I121 PolarHBondContact O-N 3.18Å; G119-R309 VanDerWaalsContact C-NH2 3.28Å
120	K	86.6	Confident	67.4	Low	24 Å²	24	83.7 Å²	83.7	10%	0.104	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-54	127.4	178.3	-175.3	173.2	-178.4	165.8	0	111.2	F122 I307 R309 D426 Y430	K120-F122 HydrophobicContact CD-CE1 4.14Å; K120-F122 HydrophobicContact CD-CE2 4.45Å; K120-F122 HydrophobicContact CD-CZ 4.03Å; K120-F122 HydrophobicContact CG-CE2 4.38Å; K120-F122 HydrophobicContact CG-CZ 4.44Å; K120-I307 HydrophobicContact CB-CD1 4.02Å; K120-I307 HydrophobicContact CD-CD1 3.87Å; K120-R309 PolarHBondContact O-NE 3.49Å; K120-R309 PolarHBondContact O-NH2 3Å; K120-D426 WeakPolarHBondContact CD-OD2 3.04Å; K120-D426 WeakPolarHBondContact CE-OD2 3.15Å; K120-D426 IonicContact NZ-OD2 3.96Å; K120-D426 PolarHBondContact NZ-OD2 3.18Å; K120-Y430 HydrophobicContact CB-CE2 3.85Å; K120-Y430 PolarHBondContact N-OH 2.9Å
121	I	89.3	Confident	70.4	Confident	98 Å²	98	81.5 Å²	81.5	50%	0.503	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-94	127.7	168.8	-56.8	-179.8	0	0	0	107.2	A114 G119 I123	A114-I121 HydrophobicContact CB-CD1 3.77Å; A114-I121 HydrophobicContact CB-CG1 4.43Å; G119-I121 PolarHBondContact O-N 3.18Å; I121-I123 HydrophobicContact CG2-CG1 4.27Å
122	F	92.6	Very high	73.3	Confident	26 Å²	26	78.2 Å²	78.2	11%	0.114	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-93	127.8	176.4	-68.3	-91.4	0	0	0	109.1	K120 T305 I307 R309 Y312 P313 F398 D400	K120-F122 HydrophobicContact CD-CE1 4.14Å; K120-F122 HydrophobicContact CD-CE2 4.45Å; K120-F122 HydrophobicContact CD-CZ 4.03Å; K120-F122 HydrophobicContact CG-CE2 4.38Å; K120-F122 HydrophobicContact CG-CZ 4.44Å; F122-T305 HydrophobicContact CE1-CG2 4.46Å; F122-I307 HydrophobicContact CE2-CG2 4.07Å; F122-I307 HydrophobicContact CZ-CB 4.09Å; F122-I307 HydrophobicContact CZ-CG2 4.08Å; F122-R309 HydrophobicContact CD2-CG 4.01Å; F122-R309 HydrophobicContact CE2-CG 3.6Å; F122-Y312 HydrophobicContact CD1-CD1 4.43Å; F122-Y312 HydrophobicContact CD2-CD1 4.23Å; F122-Y312 HydrophobicContact CD2-CE1 4.49Å; F122-Y312 HydrophobicContact CE1-CD1 4.46Å; F122-Y312 HydrophobicContact CE1-CE1 4.49Å; F122-Y312 HydrophobicContact CE2-CD1 4.28Å; F122-Y312 HydrophobicContact CE2-CE1 4.1Å; F122-Y312 HydrophobicContact CG-CD1 4.31Å; F122-Y312 HydrophobicContact CZ-CD1 4.38Å; F122-Y312 HydrophobicContact CZ-CE1 4.08Å; F122-P313 VanDerWaalsContact CB-CD 3.41Å; F122-P313 HydrophobicContact CB-CG 3.8Å; F122-F398 HydrophobicContact CD1-CE2 4.48Å; F122-F398 AromaticContact CD1-CZ 3.98Å; F122-F398 HydrophobicContact CD1-CZ 3.98Å; F122-F398 HydrophobicContact CE1-CZ 4.03Å; F122-D400 HydrophobicContact CB-CB 4.32Å; F122-D400 HydrophobicContact CD1-CB 3.96Å; F122-D400 WeakPolarHBondContact CD1-OD2 3.34Å
123	I	93.4	Very high	76.1	Confident	75 Å²	75	72.7 Å²	72.7	39%	0.385	37%	0.368	S	S	.	.			trans	-121.1	138.5	-177.8	-57.6	174.5	0	0	0	107.7	L112 I121 R125 D400	L112-I123 HydrophobicContact CD2-CD1 4.4Å; I121-I123 HydrophobicContact CG2-CG1 4.27Å; I123-R125 PolarHBondContact O-N 3.05Å; I123-D400 WeakPolarHBondContact O-CA 3.4Å; I123-D400 VanDerWaalsContact O-CB 3.29Å; I123-D400 WeakPolarHBondContact O-CB 3.44Å
124	A	93.6	Very high	78.9	Confident	66 Å²	66	68.9 Å²	68.9	55%	0.545	36%	0.359	S	S	.	.			trans	-66.7	118	174	0	0	0	0	0	110	P313 G399	A124-P313 HydrophobicContact CB-CB 4.17Å; A124-G399 WeakPolarHBondContact CA-O 3.09Å
125	R	93.6	Very high	82.1	Confident	79 Å²	79	70.8 Å²	70.8	30%	0.298	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-159.7	150.6	-178.9	60.8	-170.6	162.6	-165.5	-8.1	111.5	I123 G399 D400 R401 M402	I123-R125 PolarHBondContact O-N 3.05Å; R125-G399 PolarHBondContact N-O 3.29Å; R125-D400 IonicContact CZ-OD1 3.55Å; R125-D400 IonicContact CZ-OD2 3.24Å; R125-D400 IonicContact NE-OD1 3.58Å; R125-D400 PolarHBondContact NE-OD1 2.88Å; R125-D400 VanDerWaalsContact NH2-CG 3.3Å; R125-D400 IonicContact NH2-OD1 2.72Å; R125-D400 PolarHBondContact NH2-OD1 3Å; R125-D400 IonicContact NH2-OD2 2.73Å; R125-D400 PolarHBondContact NH2-OD2 2.91Å; R125-R401 WeakPolarHBondContact O-CB 3.38Å; R125-R401 PolarHBondContact O-N 2.82Å; R125-R401 VanDerWaalsContact O-N 3.12Å; R125-M402 VanDerWaalsContact CZ-SD 3.59Å; R125-M402 VanDerWaalsContact NE-CB 3.27Å; R125-M402 PolarHBondContact NH1-SD 2.79Å
126	R	92.7	Very high	85.1	Confident	131 Å²	131	71.8 Å²	71.8	49%	0.494	37%	0.369	S	S	.	.			trans	-70.2	166.3	174.5	-73.6	-179.9	164.5	-155.4	-2	111.8	E134	R126-E134 IonicContact CZ-OE1 2.71Å; R126-E134 IonicContact NH1-OE1 2.69Å; R126-E134 PolarHBondContact NH1-OE1 3.2Å; R126-E134 IonicContact NH1-OE2 3.35Å
127	S	93.6	Very high	87.5	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.37	C	S	.	.			trans	-77.4	138.6	171.6	-149.8	0	0	0	0	109.1	L129 D130 E131 N390 R401 Y404	S127-L129 PolarHBondContact O-N 2.83Å; S127-L129 VanDerWaalsContact O-N 3.13Å; S127-D130 WeakPolarHBondContact CB-OD2 3.16Å; S127-D130 PolarHBondContact N-OD2 3.02Å; S127-D130 WeakPolarHBondContact O-CB 3.39Å; S127-D130 PolarHBondContact O-N 3.1Å; S127-E131 PolarHBondContact O-N 3.15Å; S127-N390 VanDerWaalsContact CB-ND2 3.34Å; S127-N390 WeakPolarHBondContact CB-ND2 3.12Å; S127-N390 PolarHBondContact OG-ND2 3.38Å; S127-N390 VanDerWaalsContact OG-ND2 3.15Å; S127-R401 PolarHBondContact OG-O 2.85Å; S127-Y404 PolarHBondContact OG-OH 2.87Å
128	L	93.4	Very high	89.8	Confident	55 Å²	55	68 Å²	68	29%	0.288	34%	0.343	S	S	.	.	H	α-helix	trans	-56	-36.3	-174.8	178.3	65.9	0	0	0	112.6	L132 Y404 D406 W408	L128-L132 WeakPolarHBondContact O-CB 3.34Å; L128-L132 PolarHBondContact O-N 2.83Å; L128-Y404 HydrophobicContact CB-CE2 4.23Å; L128-D406 HydrophobicContact CD2-CB 3.98Å; L128-D406 VanDerWaalsContact CD2-N 3.32Å; L128-W408 HydrophobicContact CD2-CH2 3.82Å; L128-W408 HydrophobicContact CD2-CZ2 3.97Å; L128-W408 HydrophobicContact CG-CH2 4.41Å
129	L	92.6	Very high	91.7	Very high	21 Å²	21	66.7 Å²	66.7	11%	0.11	33%	0.333	C	S	.	.	H	α-helix	trans	-79.8	-22.3	179.9	-161.5	70.1	0	0	0	113	S127 E131 L132 L133 F382 H386 Y404	S127-L129 PolarHBondContact O-N 2.83Å; S127-L129 VanDerWaalsContact O-N 3.13Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-L132 HydrophobicContact CD1-CB 4.4Å; L129-L132 HydrophobicContact CD1-CD2 4.35Å; L129-L133 WeakPolarHBondContact O-CB 3.39Å; L129-L133 PolarHBondContact O-N 2.83Å; L129-F382 HydrophobicContact CD2-CD2 3.54Å; L129-F382 HydrophobicContact CD2-CE2 3.7Å; L129-H386 HydrophobicContact CD2-CB 4.48Å; L129-Y404 HydrophobicContact CB-CE2 4.12Å; L129-Y404 WeakPolarHBondContact CB-OH 3.26Å; L129-Y404 PolarHBondContact N-OH 3.3Å
130	D	91.4	Very high	92.7	Very high	24 Å²	24	69.2 Å²	69.2	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-48.5	170.4	-69.3	-55.3	0	0	0	108.9	S127 L133 Y322 H386	S127-D130 WeakPolarHBondContact CB-OD2 3.16Å; S127-D130 PolarHBondContact N-OD2 3.02Å; S127-D130 WeakPolarHBondContact O-CB 3.39Å; S127-D130 PolarHBondContact O-N 3.1Å; D130-L133 PolarHBondContact O-N 3Å; D130-Y322 VanDerWaalsContact CG-OH 3.28Å; D130-Y322 PolarHBondContact OD1-OH 2.87Å; D130-Y322 PolarHBondContact OD2-OH 2.98Å; D130-H386 IonicContact OD1-CE1 2.77Å; D130-H386 PolarHBondContact OD1-CE1 3.18Å; D130-H386 IonicContact OD1-NE2 3.23Å
131	E	92.9	Very high	93.1	Very high	115 Å²	115	72 Å²	72	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-67.1	-42.8	179.3	-174.9	175.8	179.3	0	0	111.7	S127 L129 L133 E134	S127-E131 PolarHBondContact O-N 3.15Å; L129-E131 VanDerWaalsContact C-N 3.31Å; E131-L133 VanDerWaalsContact C-N 3.32Å; E131-L133 PolarHBondContact O-N 3.4Å; E131-E134 WeakPolarHBondContact O-CB 3.15Å; E131-E134 PolarHBondContact O-N 2.93Å
132	L	92.4	Very high	93.3	Very high	56 Å²	56	70 Å²	70	29%	0.293	35%	0.346	S	S	.	.	H	α-helix	trans	-69.5	-27.7	179.2	-151.8	80.9	0	0	0	113.2	L128 L129 E134 V135 I138 W408	L128-L132 WeakPolarHBondContact O-CB 3.34Å; L128-L132 PolarHBondContact O-N 2.83Å; L129-L132 HydrophobicContact CD1-CB 4.4Å; L129-L132 HydrophobicContact CD1-CD2 4.35Å; L132-E134 VanDerWaalsContact C-N 3.28Å; L132-V135 WeakPolarHBondContact O-CB 3.33Å; L132-V135 PolarHBondContact O-N 2.83Å; L132-V135 VanDerWaalsContact O-N 3.14Å; L132-I138 HydrophobicContact CD2-CD1 4.43Å; L132-I138 HydrophobicContact CD2-CG1 4Å; L132-I138 HydrophobicContact CD2-CG2 4.34Å; L132-I138 HydrophobicContact CG-CG1 4Å; L132-I138 WeakPolarHBondContact O-CB 3.42Å; L132-W408 HydrophobicContact CD2-CZ2 4Å
133	L	91.8	Very high	93.4	Very high	35 Å²	35	73.7 Å²	73.7	18%	0.183	36%	0.363	C	S	.	.	H	α-helix	trans	-77	-14.7	177.6	-163.4	69	0	0	0	112.7	L129 D130 E131 V135 I138 R139 Y142	L129-L133 WeakPolarHBondContact O-CB 3.39Å; L129-L133 PolarHBondContact O-N 2.83Å; D130-L133 PolarHBondContact O-N 3Å; E131-L133 VanDerWaalsContact C-N 3.32Å; E131-L133 PolarHBondContact O-N 3.4Å; L133-V135 PolarHBondContact O-N 2.89Å; L133-I138 HydrophobicContact CD1-CG2 4.19Å; L133-R139 PolarHBondContact O-NE 3.36Å; L133-Y142 HydrophobicContact CD1-CD1 4.44Å; L133-Y142 HydrophobicContact CD1-CG 4.01Å
134	E	91.9	Very high	93.5	Very high	117 Å²	117	76.1 Å²	76.1	55%	0.547	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-19.6	165.5	-64.9	177.8	-178	0	0	111.2	R126 E131 L132 R139	R126-E134 IonicContact CZ-OE1 2.71Å; R126-E134 IonicContact NH1-OE1 2.69Å; R126-E134 PolarHBondContact NH1-OE1 3.2Å; R126-E134 IonicContact NH1-OE2 3.35Å; E131-E134 WeakPolarHBondContact O-CB 3.15Å; E131-E134 PolarHBondContact O-N 2.93Å; L132-E134 VanDerWaalsContact C-N 3.28Å; E134-R139 PolarHBondContact O-NH2 3.02Å
135	V	95.1	Very high	93.6	Very high	69 Å²	69	76.1 Å²	76.1	42%	0.418	36%	0.362	S	S	.	.	S	Bend	trans	-79.9	125.5	173.3	-174.2	0	0	0	0	111.5	L132 L133 H137 I138 R139	L132-V135 WeakPolarHBondContact O-CB 3.33Å; L132-V135 PolarHBondContact O-N 2.83Å; L132-V135 VanDerWaalsContact O-N 3.14Å; L133-V135 PolarHBondContact O-N 2.89Å; V135-H137 VanDerWaalsContact C-N 3.28Å; V135-H137 HydrophobicContact CG1-CB 4.49Å; V135-H137 PolarHBondContact O-N 2.93Å; V135-H137 VanDerWaalsContact O-N 3.15Å; V135-I138 PolarHBondContact O-N 3Å; V135-R139 PolarHBondContact O-N 2.65Å
136	D	93.1	Very high	93.6	Very high	100 Å²	100	75.5 Å²	75.5	54%	0.535	36%	0.364	S	S	.	.	H	α-helix	trans	-56.8	-35.1	-172.9	-63.5	-46	0	0	0	114	I138 R139 T140	D136-I138 PolarHBondContact O-N 2.96Å; D136-R139 PolarHBondContact O-N 3.44Å; D136-R139 IonicContact OD1-CZ 3.66Å; D136-R139 IonicContact OD1-NH1 3.79Å; D136-R139 PolarHBondContact OD1-NH1 3.01Å; D136-R139 IonicContact OD1-NH2 2.73Å; D136-R139 PolarHBondContact OD1-NH2 2.92Å; D136-T140 WeakPolarHBondContact O-CB 3.11Å; D136-T140 PolarHBondContact O-N 3.26Å; D136-T140 PolarHBondContact O-OG1 3.35Å
137	H	94.3	Very high	93.7	Very high	150 Å²	150	72 Å²	72	69%	0.694	36%	0.363	S	S	*	.	H	α-helix	trans	-62.4	-42.9	177	-58	-51.7	0	0	0	112.5	V135 T140 I141	V135-H137 VanDerWaalsContact C-N 3.28Å; V135-H137 HydrophobicContact CG1-CB 4.49Å; V135-H137 PolarHBondContact O-N 2.93Å; V135-H137 VanDerWaalsContact O-N 3.15Å; H137-T140 WeakPolarHBondContact O-CB 3.41Å; H137-T140 PolarHBondContact O-N 3.22Å; H137-I141 PolarHBondContact O-N 3.37Å
138	I	93.1	Very high	93.7	Very high	48 Å²	48	75 Å²	75	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-77.5	-34.3	-180	-54.7	-53.5	0	0	0	110.4	L132 L133 V135 D136 T140 I141 Y142	L132-I138 HydrophobicContact CD2-CD1 4.43Å; L132-I138 HydrophobicContact CD2-CG1 4Å; L132-I138 HydrophobicContact CD2-CG2 4.34Å; L132-I138 HydrophobicContact CG-CG1 4Å; L132-I138 WeakPolarHBondContact O-CB 3.42Å; L133-I138 HydrophobicContact CD1-CG2 4.19Å; V135-I138 PolarHBondContact O-N 3Å; D136-I138 PolarHBondContact O-N 2.96Å; I138-T140 PolarHBondContact O-N 3.04Å; I138-I141 HydrophobicContact CD1-CD1 3.96Å; I138-I141 WeakPolarHBondContact O-CB 3.21Å; I138-I141 PolarHBondContact O-N 3.26Å; I138-I141 VanDerWaalsContact O-N 3.15Å; I138-Y142 PolarHBondContact O-N 3.05Å
139	R	93.9	Very high	93.7	Very high	89 Å²	89	73.7 Å²	73.7	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-58.9	-37.3	169.9	-149.2	-174.1	-52.3	133.7	11.3	111.8	L133 E134 V135 D136 Y142 H143	L133-R139 PolarHBondContact O-NE 3.36Å; E134-R139 PolarHBondContact O-NH2 3.02Å; V135-R139 PolarHBondContact O-N 2.65Å; D136-R139 PolarHBondContact O-N 3.44Å; D136-R139 IonicContact OD1-CZ 3.66Å; D136-R139 IonicContact OD1-NH1 3.79Å; D136-R139 PolarHBondContact OD1-NH1 3.01Å; D136-R139 IonicContact OD1-NH2 2.73Å; D136-R139 PolarHBondContact OD1-NH2 2.92Å; R139-Y142 WeakPolarHBondContact O-CB 3.24Å; R139-Y142 PolarHBondContact O-N 3.23Å; R139-H143 PolarHBondContact O-CD2 3.35Å; R139-H143 VanDerWaalsContact O-CG 3.26Å; R139-H143 PolarHBondContact O-N 3.08Å
140	T	95.4	Very high	93.7	Very high	75 Å²	75	77.6 Å²	77.6	46%	0.46	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-44.9	173.4	-56.2	0	0	0	0	111.6	D136 H137 I138 Y142 H143 M144	D136-T140 WeakPolarHBondContact O-CB 3.11Å; D136-T140 PolarHBondContact O-N 3.26Å; D136-T140 PolarHBondContact O-OG1 3.35Å; H137-T140 WeakPolarHBondContact O-CB 3.41Å; H137-T140 PolarHBondContact O-N 3.22Å; I138-T140 PolarHBondContact O-N 3.04Å; T140-Y142 VanDerWaalsContact C-N 3.32Å; T140-Y142 PolarHBondContact O-N 3.3Å; T140-H143 PolarHBondContact O-N 3.26Å; T140-M144 WeakPolarHBondContact O-CG 3.31Å; T140-M144 PolarHBondContact O-N 3.39Å
141	I	94.4	Very high	93.8	Very high	82 Å²	82	81.4 Å²	81.4	42%	0.421	41%	0.411	S	S	.	.	H	α-helix	trans	-59.1	-44.6	174.8	-63.4	169.8	0	0	0	110.5	H137 I138 H143 M144 F145	H137-I141 PolarHBondContact O-N 3.37Å; I138-I141 HydrophobicContact CD1-CD1 3.96Å; I138-I141 WeakPolarHBondContact O-CB 3.21Å; I138-I141 PolarHBondContact O-N 3.26Å; I138-I141 VanDerWaalsContact O-N 3.15Å; I141-H143 PolarHBondContact O-N 3.12Å; I141-M144 WeakPolarHBondContact O-CB 3.23Å; I141-M144 PolarHBondContact O-N 3.04Å; I141-M144 VanDerWaalsContact O-N 3.13Å; I141-F145 HydrophobicContact CG2-CD2 4.01Å; I141-F145 HydrophobicContact CG2-CE2 3.98Å; I141-F145 WeakPolarHBondContact O-CD2 3.39Å; I141-F145 PolarHBondContact O-N 2.95Å
142	Y	94.2	Very high	93.7	Very high	57 Å²	57	77.1 Å²	77.1	22%	0.224	39%	0.391	C	S	.	.	H	α-helix	trans	-59.4	-43	175.5	173.4	-105.6	0	0	0	112.4	L133 I138 R139 T140 M144 F145 I146 Q329 F382	L133-Y142 HydrophobicContact CD1-CD1 4.44Å; L133-Y142 HydrophobicContact CD1-CG 4.01Å; I138-Y142 PolarHBondContact O-N 3.05Å; R139-Y142 WeakPolarHBondContact O-CB 3.24Å; R139-Y142 PolarHBondContact O-N 3.23Å; T140-Y142 VanDerWaalsContact C-N 3.32Å; T140-Y142 PolarHBondContact O-N 3.3Å; Y142-M144 PolarHBondContact O-N 3.05Å; Y142-F145 PolarHBondContact O-N 3.3Å; Y142-I146 HydrophobicContact CD1-CD1 3.96Å; Y142-I146 HydrophobicContact CE1-CD1 3.44Å; Y142-I146 VanDerWaalsContact CE1-CD1 3.44Å; Y142-I146 HydrophobicContact CE2-CD1 4.23Å; Y142-I146 PolarHBondContact O-N 2.99Å; Y142-I146 VanDerWaalsContact O-N 3.1Å; Y142-Q329 PolarHBondContact OH-NE2 2.84Å; Y142-F382 HydrophobicContact CD2-CZ 4.2Å; Y142-F382 HydrophobicContact CE2-CE1 4.15Å; Y142-F382 AromaticContact CE2-CZ 3.82Å; Y142-F382 HydrophobicContact CE2-CZ 3.82Å
143	H	94.8	Very high	93.6	Very high	104 Å²	104	77 Å²	77	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-36.3	173.1	-63.2	170.9	0	0	0	112.8	R139 T140 I141 I146 A147	R139-H143 PolarHBondContact O-CD2 3.35Å; R139-H143 VanDerWaalsContact O-CG 3.26Å; R139-H143 PolarHBondContact O-N 3.08Å; T140-H143 PolarHBondContact O-N 3.26Å; I141-H143 PolarHBondContact O-N 3.12Å; H143-I146 PolarHBondContact O-N 3.48Å; H143-A147 WeakPolarHBondContact O-CB 3.18Å; H143-A147 PolarHBondContact O-N 3.45Å
144	M	95.8	Very high	93.5	Very high	125 Å²	125	80.3 Å²	80.3	62%	0.616	41%	0.408	S	S	*	.	H	α-helix	trans	-63.2	-40.5	173.9	-68.6	170.1	66.1	0	0	112	T140 I141 Y142 A147 L148	T140-M144 WeakPolarHBondContact O-CG 3.31Å; T140-M144 PolarHBondContact O-N 3.39Å; I141-M144 WeakPolarHBondContact O-CB 3.23Å; I141-M144 PolarHBondContact O-N 3.04Å; I141-M144 VanDerWaalsContact O-N 3.13Å; Y142-M144 PolarHBondContact O-N 3.05Å; M144-A147 PolarHBondContact O-N 3.14Å; M144-L148 WeakPolarHBondContact O-CB 3.4Å; M144-L148 PolarHBondContact O-N 3.36Å
145	F	94.4	Very high	93.4	Very high	67 Å²	67	77.3 Å²	77.3	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-64.1	-38.7	174.1	-89.1	-90.1	0	0	0	112.1	I141 Y142 L148 L149 Y336 L375	I141-F145 HydrophobicContact CG2-CD2 4.01Å; I141-F145 HydrophobicContact CG2-CE2 3.98Å; I141-F145 WeakPolarHBondContact O-CD2 3.39Å; I141-F145 PolarHBondContact O-N 2.95Å; Y142-F145 PolarHBondContact O-N 3.3Å; F145-L148 PolarHBondContact O-N 3.06Å; F145-L149 PolarHBondContact O-N 2.82Å; F145-Y336 HydrophobicContact CB-CE1 4.44Å; F145-Y336 HydrophobicContact CD1-CE1 4.03Å; F145-Y336 VanDerWaalsContact O-CE1 3.27Å; F145-Y336 WeakPolarHBondContact O-CE1 3.27Å; F145-Y336 PolarHBondContact O-OH 3.39Å; F145-L375 HydrophobicContact CE1-CD2 3.93Å; F145-L375 HydrophobicContact CZ-CD2 4.49Å
146	I	94.1	Very high	93	Very high	65 Å²	65	74 Å²	74	33%	0.333	38%	0.38	S	S	.	.	H	α-helix	trans	-65.5	-45.3	173.7	-67.6	166.5	0	0	0	111.2	Y142 H143 L148 L149 I150	Y142-I146 HydrophobicContact CD1-CD1 3.96Å; Y142-I146 HydrophobicContact CE1-CD1 3.44Å; Y142-I146 VanDerWaalsContact CE1-CD1 3.44Å; Y142-I146 HydrophobicContact CE2-CD1 4.23Å; Y142-I146 PolarHBondContact O-N 2.99Å; Y142-I146 VanDerWaalsContact O-N 3.1Å; H143-I146 PolarHBondContact O-N 3.48Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 3.5Å; I146-L149 WeakPolarHBondContact O-CB 3.49Å; I146-L149 PolarHBondContact O-N 3.35Å; I146-L149 VanDerWaalsContact O-N 3.17Å; I146-I150 HydrophobicContact CG2-CD1 3.94Å; I146-I150 HydrophobicContact CG2-CG1 4.49Å; I146-I150 WeakPolarHBondContact O-CG1 3.48Å; I146-I150 PolarHBondContact O-N 3.46Å
147	A	95.4	Very high	92.8	Very high	57 Å²	57	71.6 Å²	71.6	47%	0.471	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-40	177.8	0	0	0	0	0	111.7	H143 M144 I150 L151	H143-A147 WeakPolarHBondContact O-CB 3.18Å; H143-A147 PolarHBondContact O-N 3.45Å; M144-A147 PolarHBondContact O-N 3.14Å; A147-I150 PolarHBondContact O-N 2.94Å; A147-L151 WeakPolarHBondContact O-CB 3.22Å; A147-L151 PolarHBondContact O-N 3.48Å
148	L	94.2	Very high	92.5	Very high	65 Å²	65	67.9 Å²	67.9	34%	0.34	35%	0.354	S	S	.	.	H	α-helix	trans	-67.5	-36.3	175.2	-176.5	58.1	0	0	0	112.3	M144 F145 I146 L151 F152 Y336	M144-L148 WeakPolarHBondContact O-CB 3.4Å; M144-L148 PolarHBondContact O-N 3.36Å; F145-L148 PolarHBondContact O-N 3.06Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 3.5Å; L148-L151 PolarHBondContact O-N 3.36Å; L148-F152 HydrophobicContact CD1-CD2 4.21Å; L148-F152 HydrophobicContact CD1-CE2 3.82Å; L148-F152 HydrophobicContact CD1-CZ 4.4Å; L148-F152 HydrophobicContact CD2-CE2 4.2Å; L148-F152 HydrophobicContact CG-CD2 4.02Å; L148-F152 HydrophobicContact CG-CE2 3.68Å; L148-F152 WeakPolarHBondContact O-CD2 3.33Å; L148-F152 PolarHBondContact O-N 3.33Å; L148-Y336 WeakPolarHBondContact CB-OH 3.36Å; L148-Y336 VanDerWaalsContact CD2-OH 3.31Å; L148-Y336 WeakPolarHBondContact CD2-OH 3.45Å; L148-Y336 VanDerWaalsContact CG-OH 3.24Å; L148-Y336 WeakPolarHBondContact CG-OH 3.16Å
149	L	93	Very high	92.2	Very high	26 Å²	26	67.8 Å²	67.8	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-62.1	-45.4	170.3	173.2	57.7	0	0	0	111.9	F145 I146 L151 F152 I153 Y336 Y339	F145-L149 PolarHBondContact O-N 2.82Å; I146-L149 WeakPolarHBondContact O-CB 3.49Å; I146-L149 PolarHBondContact O-N 3.35Å; I146-L149 VanDerWaalsContact O-N 3.17Å; L149-L151 VanDerWaalsContact C-N 3.28Å; L149-L151 PolarHBondContact O-N 3.04Å; L149-F152 PolarHBondContact O-N 2.86Å; L149-I153 HydrophobicContact CD1-CD1 3.92Å; L149-I153 HydrophobicContact CD1-CG1 4.18Å; L149-I153 HydrophobicContact CG-CD1 3.93Å; L149-I153 WeakPolarHBondContact O-CG1 3.25Å; L149-I153 PolarHBondContact O-N 3.08Å; L149-Y336 HydrophobicContact CB-CD1 3.82Å; L149-Y336 HydrophobicContact CB-CE1 3.79Å; L149-Y336 HydrophobicContact CB-CG 4.21Å; L149-Y336 HydrophobicContact CD1-CD1 4.19Å; L149-Y336 HydrophobicContact CD1-CD2 4.06Å; L149-Y336 HydrophobicContact CD1-CG 3.77Å; L149-Y336 HydrophobicContact CD2-CD1 4.13Å; L149-Y336 HydrophobicContact CD2-CG 4.41Å; L149-Y336 HydrophobicContact CG-CD1 4.27Å; L149-Y336 HydrophobicContact CG-CG 4.35Å; L149-Y339 HydrophobicContact CD1-CD2 4.07Å
150	I	92.9	Very high	91.8	Very high	104 Å²	104	65.4 Å²	65.4	53%	0.533	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-40.8	176.3	-67.1	166.3	0	0	0	110.4	I146 A147 I153 L154	I146-I150 HydrophobicContact CG2-CD1 3.94Å; I146-I150 HydrophobicContact CG2-CG1 4.49Å; I146-I150 WeakPolarHBondContact O-CG1 3.48Å; I146-I150 PolarHBondContact O-N 3.46Å; A147-I150 PolarHBondContact O-N 2.94Å; I150-I153 PolarHBondContact O-N 2.8Å; I150-L154 WeakPolarHBondContact O-CB 3.03Å; I150-L154 PolarHBondContact O-N 2.92Å
151	L	93.6	Very high	91.4	Very high	103 Å²	103	68.2 Å²	68.2	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-42.3	175.4	-168.9	155.9	0	0	0	111.9	A147 L148 L149 L154 S155	A147-L151 WeakPolarHBondContact O-CB 3.22Å; A147-L151 PolarHBondContact O-N 3.48Å; L148-L151 PolarHBondContact O-N 3.36Å; L149-L151 VanDerWaalsContact C-N 3.28Å; L149-L151 PolarHBondContact O-N 3.04Å; L151-L154 PolarHBondContact O-N 3.22Å; L151-S155 VanDerWaalsContact O-CB 3.25Å; L151-S155 WeakPolarHBondContact O-CB 3.4Å; L151-S155 PolarHBondContact O-N 3.28Å
152	F	90.1	Very high	91.2	Very high	25 Å²	25	70 Å²	70	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-42.8	174	-81.5	-60.1	0	0	0	112.6	L148 L149 T156 Y336 R343 L344	L148-F152 HydrophobicContact CD1-CD2 4.21Å; L148-F152 HydrophobicContact CD1-CE2 3.82Å; L148-F152 HydrophobicContact CD1-CZ 4.4Å; L148-F152 HydrophobicContact CD2-CE2 4.2Å; L148-F152 HydrophobicContact CG-CD2 4.02Å; L148-F152 HydrophobicContact CG-CE2 3.68Å; L148-F152 WeakPolarHBondContact O-CD2 3.33Å; L148-F152 PolarHBondContact O-N 3.33Å; L149-F152 PolarHBondContact O-N 2.86Å; F152-T156 WeakPolarHBondContact O-CB 3.25Å; F152-T156 PolarHBondContact O-N 3.29Å; F152-T156 PolarHBondContact O-OG1 2.67Å; F152-Y336 HydrophobicContact CD2-CD2 4.38Å; F152-Y336 AromaticContact CD2-CE2 3.63Å; F152-Y336 HydrophobicContact CD2-CE2 3.63Å; F152-Y336 AromaticContact CE2-CE2 3.81Å; F152-Y336 HydrophobicContact CE2-CE2 3.81Å; F152-R343 HydrophobicContact CD1-CB 4.4Å; F152-L344 HydrophobicContact CE1-CD2 4.32Å; F152-L344 HydrophobicContact CE1-CG 4.42Å; F152-L344 HydrophobicContact CZ-CD1 4.22Å
153	I	89.5	Confident	90.7	Very high	53 Å²	53	73.1 Å²	73.1	27%	0.272	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-48.6	175.7	-67.2	161	0	0	0	110.2	L149 I150 T156 L157 Y339	L149-I153 HydrophobicContact CD1-CD1 3.92Å; L149-I153 HydrophobicContact CD1-CG1 4.18Å; L149-I153 HydrophobicContact CG-CD1 3.93Å; L149-I153 WeakPolarHBondContact O-CG1 3.25Å; L149-I153 PolarHBondContact O-N 3.08Å; I150-I153 PolarHBondContact O-N 2.8Å; I153-T156 WeakPolarHBondContact O-CB 3.42Å; I153-T156 PolarHBondContact O-N 2.85Å; I153-L157 HydrophobicContact CG2-CD1 3.92Å; I153-L157 HydrophobicContact CG2-CG 4.47Å; I153-L157 WeakPolarHBondContact O-CG 3.33Å; I153-L157 PolarHBondContact O-N 3.13Å; I153-Y339 HydrophobicContact CD1-CE2 4.22Å; I153-Y339 HydrophobicContact CG1-CD2 3.97Å; I153-Y339 HydrophobicContact CG1-CE2 3.41Å; I153-Y339 VanDerWaalsContact CG1-CE2 3.41Å
154	L	91.2	Very high	90.2	Very high	106 Å²	106	74.9 Å²	74.9	56%	0.555	39%	0.391	S	S	*	.	H	α-helix	trans	-62.8	-45.5	179.6	-177.3	64.6	0	0	0	111.7	I150 L151 T156 L157 V158	I150-L154 WeakPolarHBondContact O-CB 3.03Å; I150-L154 PolarHBondContact O-N 2.92Å; L151-L154 PolarHBondContact O-N 3.22Å; L154-T156 PolarHBondContact O-N 3.02Å; L154-L157 PolarHBondContact O-N 2.69Å; L154-V158 HydrophobicContact CD1-CG2 4.24Å; L154-V158 HydrophobicContact CG-CG2 4.43Å; L154-V158 WeakPolarHBondContact O-CB 3.35Å; L154-V158 VanDerWaalsContact O-CG2 3.23Å; L154-V158 WeakPolarHBondContact O-CG2 3.37Å; L154-V158 PolarHBondContact O-N 2.98Å
155	S	89.6	Confident	89.3	Confident	53 Å²	53	71.3 Å²	71.3	37%	0.371	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-30.1	175.6	-178.6	0	0	0	0	112.7	L151 V159	L151-S155 VanDerWaalsContact O-CB 3.25Å; L151-S155 WeakPolarHBondContact O-CB 3.4Å; L151-S155 PolarHBondContact O-N 3.28Å; S155-V159 VanDerWaalsContact O-CG2 3.29Å; S155-V159 WeakPolarHBondContact O-CG2 3.33Å; S155-V159 PolarHBondContact O-N 2.87Å
156	T	86.7	Confident	88.4	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.006	41%	0.405	C	S	.	.	H	α-helix	trans	-71.6	-56.8	176.3	-60.2	0	0	0	0	109.6	F152 I153 L154 V158 V159 D160 Y339 E342 R343	F152-T156 WeakPolarHBondContact O-CB 3.25Å; F152-T156 PolarHBondContact O-N 3.29Å; F152-T156 PolarHBondContact O-OG1 2.67Å; I153-T156 WeakPolarHBondContact O-CB 3.42Å; I153-T156 PolarHBondContact O-N 2.85Å; L154-T156 PolarHBondContact O-N 3.02Å; T156-V158 VanDerWaalsContact C-N 3.27Å; T156-V158 PolarHBondContact O-N 2.91Å; T156-V159 PolarHBondContact O-N 2.94Å; T156-V159 VanDerWaalsContact O-N 3.11Å; T156-D160 WeakPolarHBondContact CG2-OD2 3.46Å; T156-D160 PolarHBondContact O-N 3.34Å; T156-Y339 HydrophobicContact CG2-CD1 4.12Å; T156-Y339 HydrophobicContact CG2-CE1 3.78Å; T156-E342 WeakPolarHBondContact CG2-OE1 3.15Å; T156-R343 PolarHBondContact OG1-NE 2.89Å
157	L	87.4	Confident	87.3	Confident	48 Å²	48	79.4 Å²	79.4	25%	0.251	42%	0.419	S	S	.	.	H	α-helix	trans	-55	-37.9	177.4	-70.2	171.4	0	0	0	113.6	I153 L154 Y161 L167 L169	I153-L157 HydrophobicContact CG2-CD1 3.92Å; I153-L157 HydrophobicContact CG2-CG 4.47Å; I153-L157 WeakPolarHBondContact O-CG 3.33Å; I153-L157 PolarHBondContact O-N 3.13Å; L154-L157 PolarHBondContact O-N 2.69Å; L157-Y161 WeakPolarHBondContact O-CB 3.42Å; L157-Y161 PolarHBondContact O-N 2.86Å; L157-L167 HydrophobicContact CB-CD2 4.36Å; L157-L167 HydrophobicContact CD2-CD2 4.32Å; L157-L169 HydrophobicContact CD2-CD1 4.24Å; L157-L169 HydrophobicContact CD2-CD2 3.62Å; L157-L169 HydrophobicContact CD2-CG 3.81Å
158	V	89.7	Confident	85.6	Confident	72 Å²	72	80.2 Å²	80.2	44%	0.436	42%	0.418	S	S	.	.	H	α-helix	trans	-69.6	-43.3	178.5	167.6	0	0	0	0	111.7	L154 T156 I162	L154-V158 HydrophobicContact CD1-CG2 4.24Å; L154-V158 HydrophobicContact CG-CG2 4.43Å; L154-V158 WeakPolarHBondContact O-CB 3.35Å; L154-V158 VanDerWaalsContact O-CG2 3.23Å; L154-V158 WeakPolarHBondContact O-CG2 3.37Å; L154-V158 PolarHBondContact O-N 2.98Å; T156-V158 VanDerWaalsContact C-N 3.27Å; T156-V158 PolarHBondContact O-N 2.91Å; V158-I162 HydrophobicContact CG1-CD1 3.84Å; V158-I162 WeakPolarHBondContact O-CD1 3.48Å; V158-I162 WeakPolarHBondContact O-CG1 3.33Å; V158-I162 PolarHBondContact O-N 3.37Å
159	V	86.6	Confident	84.3	Confident	47 Å²	47	81 Å²	81	29%	0.285	42%	0.422	S	S	.	.	H	α-helix	trans	-68.8	-45.2	178.3	169.9	0	0	0	0	110.6	S155 T156 Y161 I162 D163 R343	S155-V159 VanDerWaalsContact O-CG2 3.29Å; S155-V159 WeakPolarHBondContact O-CG2 3.33Å; S155-V159 PolarHBondContact O-N 2.87Å; T156-V159 PolarHBondContact O-N 2.94Å; T156-V159 VanDerWaalsContact O-N 3.11Å; V159-Y161 VanDerWaalsContact C-N 3.25Å; V159-Y161 PolarHBondContact O-N 3.48Å; V159-I162 PolarHBondContact O-N 3.38Å; V159-D163 WeakPolarHBondContact CG1-OD2 3.37Å; V159-D163 PolarHBondContact O-N 3.04Å; V159-R343 VanDerWaalsContact CG1-NH1 3.26Å
160	D	84.5	Confident	83.1	Confident	39 Å²	39	86 Å²	86	21%	0.209	44%	0.444	C	S	.	.	H	α-helix	trans	-63.2	-35.9	-179.6	-56.1	-7.3	0	0	0	111	T156 E164 R343	T156-D160 WeakPolarHBondContact CG2-OD2 3.46Å; T156-D160 PolarHBondContact O-N 3.34Å; D160-E164 PolarHBondContact O-N 3.48Å; D160-R343 IonicContact OD1-CZ 2.73Å; D160-R343 IonicContact OD1-NH2 2.73Å; D160-R343 PolarHBondContact OD1-NH2 3.31Å; D160-R343 IonicContact OD2-NH2 3.05Å
161	Y	88.2	Confident	82.6	Confident	134 Å²	134	84.5 Å²	84.5	53%	0.525	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-35.7	172	179.8	-102.2	0	0	0	113.5	L157 V159 G165 L167	L157-Y161 WeakPolarHBondContact O-CB 3.42Å; L157-Y161 PolarHBondContact O-N 2.86Å; V159-Y161 VanDerWaalsContact C-N 3.25Å; V159-Y161 PolarHBondContact O-N 3.48Å; Y161-G165 WeakPolarHBondContact O-CA 3.38Å; Y161-G165 PolarHBondContact O-N 3.45Å; Y161-L167 HydrophobicContact CD2-CD2 4.21Å; Y161-L167 HydrophobicContact CD2-CG 4.06Å; Y161-L167 HydrophobicContact CG-CD2 4.37Å
162	I	89.5	Confident	82.1	Confident	119 Å²	119	82.4 Å²	82.4	61%	0.61	43%	0.428	S	S	*	.	H	α-helix	trans	-71.4	-42.4	176	-71.5	163.7	0	0	0	110.7	V158 V159	V158-I162 HydrophobicContact CG1-CD1 3.84Å; V158-I162 WeakPolarHBondContact O-CD1 3.48Å; V158-I162 WeakPolarHBondContact O-CG1 3.33Å; V158-I162 PolarHBondContact O-N 3.37Å; V159-I162 PolarHBondContact O-N 3.38Å
163	D	84.4	Confident	81.9	Confident	123 Å²	123	84.1 Å²	84.1	66%	0.658	44%	0.438	S	S	*	.	H	α-helix	trans	-77	-42.3	-173.9	-71.7	-13.9	0	0	0	112.5	V159	V159-D163 WeakPolarHBondContact CG1-OD2 3.37Å; V159-D163 PolarHBondContact O-N 3.04Å
164	E	82.8	Confident	81.8	Confident	140 Å²	140	82.9 Å²	82.9	65%	0.654	43%	0.432	S	S	*	.	H	α-helix	trans	-107.7	-7.5	-177.5	-61.8	-156.7	173.9	0	0	114.9	D160 R166	D160-E164 PolarHBondContact O-N 3.48Å; E164-R166 PolarHBondContact O-N 3.45Å
165	G	77.8	Confident	81.7	Confident	50 Å²	50	82.3 Å²	82.3	52%	0.515	44%	0.436	S	S	.	.	S	Bend	trans	67.9	10.9	-177	0	0	0	0	0	114.5	Y161	Y161-G165 WeakPolarHBondContact O-CA 3.38Å; Y161-G165 PolarHBondContact O-N 3.45Å
166	R	74.5	Confident	81.8	Confident	185 Å²	185	85.2 Å²	85.2	70%	0.698	44%	0.44	S	S	*	.	S	Bend	trans	-143.6	144.8	-178.8	-64	-175.9	177.9	-176.8	0.2	110.9	E164 V168	E164-R166 PolarHBondContact O-N 3.45Å; R166-V168 HydrophobicContact CB-CG2 3.92Å; R166-V168 PolarHBondContact O-N 3.02Å
167	L	71.6	Confident	81.9	Confident	118 Å²	118	85.9 Å²	85.9	62%	0.618	45%	0.445	S	S	*	.			trans	-80	60	173.8	-67	168.7	0	0	0	111.4	L157 Y161 L169	L157-L167 HydrophobicContact CB-CD2 4.36Å; L157-L167 HydrophobicContact CD2-CD2 4.32Å; Y161-L167 HydrophobicContact CD2-CD2 4.21Å; Y161-L167 HydrophobicContact CD2-CG 4.06Å; Y161-L167 HydrophobicContact CG-CD2 4.37Å; L167-L169 PolarHBondContact O-N 3.48Å
168	V	60.8	Low	82.1	Confident	74 Å²	74	86.5 Å²	86.5	45%	0.448	45%	0.446	S	S	.	.			trans	-88.8	101.7	174.3	-176.1	0	0	0	0	108.7	R166 E170	R166-V168 HydrophobicContact CB-CG2 3.92Å; R166-V168 PolarHBondContact O-N 3.02Å; V168-E170 HydrophobicContact CG1-CB 4.34Å; V168-E170 PolarHBondContact O-N 3.43Å
169	L	65.6	Low	82.1	Confident	81 Å²	81	84 Å²	84	42%	0.424	44%	0.435	S	S	.	.			trans	-69.9	77.8	169	-82.4	169.1	0	0	0	110.1	L157 L167 F171	L157-L169 HydrophobicContact CD2-CD1 4.24Å; L157-L169 HydrophobicContact CD2-CD2 3.62Å; L157-L169 HydrophobicContact CD2-CG 3.81Å; L167-L169 PolarHBondContact O-N 3.48Å; L169-F171 HydrophobicContact CB-CE2 3.88Å; L169-F171 HydrophobicContact CB-CZ 4.05Å; L169-F171 HydrophobicContact CD1-CZ 4.23Å; L169-F171 HydrophobicContact CD2-CE1 4.49Å; L169-F171 HydrophobicContact CD2-CZ 4.15Å; L169-F171 HydrophobicContact CG-CZ 4.39Å; L169-F171 WeakPolarHBondContact O-CD2 3.34Å; L169-F171 PolarHBondContact O-N 3.16Å; L169-F171 VanDerWaalsContact O-N 3.08Å
170	E	68.7	Low	82.4	Confident	130 Å²	130	86.4 Å²	86.4	61%	0.607	44%	0.442	S	S	*	.			trans	-79.4	92.7	177.7	-154.3	-164.6	-144.4	0	0	110.7	V168 S172	V168-E170 HydrophobicContact CG1-CB 4.34Å; V168-E170 PolarHBondContact O-N 3.43Å; E170-S172 PolarHBondContact O-N 3.08Å; E170-S172 VanDerWaalsContact OE2-CB 3.28Å; E170-S172 WeakPolarHBondContact OE2-CB 3.47Å; E170-S172 PolarHBondContact OE2-OG 3.44Å
171	F	82.4	Confident	82.9	Confident	74 Å²	74	89.5 Å²	89.5	33%	0.325	45%	0.454	S	S	.	.			trans	-71.4	40.3	172.5	-60.9	-67.9	0	0	0	113	L169 L173 L174 S175 F335 Y338	L169-F171 HydrophobicContact CB-CE2 3.88Å; L169-F171 HydrophobicContact CB-CZ 4.05Å; L169-F171 HydrophobicContact CD1-CZ 4.23Å; L169-F171 HydrophobicContact CD2-CE1 4.49Å; L169-F171 HydrophobicContact CD2-CZ 4.15Å; L169-F171 HydrophobicContact CG-CZ 4.39Å; L169-F171 WeakPolarHBondContact O-CD2 3.34Å; L169-F171 PolarHBondContact O-N 3.16Å; L169-F171 VanDerWaalsContact O-N 3.08Å; F171-L173 VanDerWaalsContact C-N 3.32Å; F171-L173 PolarHBondContact O-N 3.31Å; F171-L174 HydrophobicContact CB-CB 4.28Å; F171-L174 HydrophobicContact CB-CD1 4.26Å; F171-L174 HydrophobicContact CD1-CD1 4.05Å; F171-L174 HydrophobicContact CG-CD1 4.39Å; F171-L174 PolarHBondContact O-N 3.41Å; F171-S175 PolarHBondContact O-N 3.35Å; F171-F335 HydrophobicContact CD1-CE1 4.11Å; F171-F335 HydrophobicContact CE1-CD1 4.16Å; F171-F335 AromaticContact CE1-CE1 3.67Å; F171-F335 HydrophobicContact CE1-CE1 3.67Å; F171-F335 HydrophobicContact CZ-CE1 4.11Å; F171-Y338 HydrophobicContact CD1-CE1 4.27Å
172	S	83.3	Confident	83.2	Confident	58 Å²	58	88 Å²	88	41%	0.406	46%	0.46	S	S	.	.	H	α-helix	trans	-59.8	-39	-174.4	52.6	0	0	0	0	112.4	E170 L174 S175 Y176	E170-S172 PolarHBondContact O-N 3.08Å; E170-S172 VanDerWaalsContact OE2-CB 3.28Å; E170-S172 WeakPolarHBondContact OE2-CB 3.47Å; E170-S172 PolarHBondContact OE2-OG 3.44Å; S172-L174 PolarHBondContact O-N 3.35Å; S172-S175 PolarHBondContact O-N 2.94Å; S172-Y176 WeakPolarHBondContact O-CB 3.32Å; S172-Y176 PolarHBondContact O-N 3.44Å
173	L	85.6	Confident	83.5	Confident	62 Å²	62	84 Å²	84	33%	0.325	44%	0.442	S	S	.	.	H	α-helix	trans	-66.1	-34.6	174.5	172.5	67.3	0	0	0	112.7	F171 A177 Y338 F341	F171-L173 VanDerWaalsContact C-N 3.32Å; F171-L173 PolarHBondContact O-N 3.31Å; L173-A177 WeakPolarHBondContact O-CB 3.46Å; L173-A177 PolarHBondContact O-N 2.93Å; L173-Y338 HydrophobicContact CB-CE2 3.91Å; L173-Y338 HydrophobicContact CD2-CD2 4.3Å; L173-Y338 HydrophobicContact CD2-CE2 4.13Å; L173-Y338 HydrophobicContact CG-CE2 4.24Å; L173-F341 HydrophobicContact CD2-CB 4.41Å
174	L	87.7	Confident	84.1	Confident	27 Å²	27	78.3 Å²	78.3	14%	0.141	41%	0.411	C	S	.	.	H	α-helix	trans	-70.5	-45.5	172.7	-68.9	-179.6	0	0	0	111.3	F171 S172 Y176 A177 F178 F334 F335 Y338	F171-L174 HydrophobicContact CB-CB 4.28Å; F171-L174 HydrophobicContact CB-CD1 4.26Å; F171-L174 HydrophobicContact CD1-CD1 4.05Å; F171-L174 HydrophobicContact CG-CD1 4.39Å; F171-L174 PolarHBondContact O-N 3.41Å; S172-L174 PolarHBondContact O-N 3.35Å; L174-Y176 VanDerWaalsContact C-N 3.28Å; L174-Y176 PolarHBondContact O-N 3.32Å; L174-A177 PolarHBondContact O-N 2.94Å; L174-F178 HydrophobicContact CD2-CD2 4.35Å; L174-F178 HydrophobicContact CD2-CE2 4.19Å; L174-F178 PolarHBondContact O-N 3.17Å; L174-F334 HydrophobicContact CD1-CE1 4.19Å; L174-F334 HydrophobicContact CD2-CE1 3.85Å; L174-F334 HydrophobicContact CD2-CZ 3.62Å; L174-F335 HydrophobicContact CD1-CE1 3.8Å; L174-F335 HydrophobicContact CD1-CZ 4.19Å; L174-Y338 HydrophobicContact CD1-CD2 4.11Å; L174-Y338 HydrophobicContact CD1-CE2 4.36Å; L174-Y338 HydrophobicContact CD1-CG 4.48Å; L174-Y338 HydrophobicContact CD2-CD2 3.56Å; L174-Y338 HydrophobicContact CD2-CE2 4.24Å; L174-Y338 HydrophobicContact CD2-CG 4.27Å; L174-Y338 HydrophobicContact CG-CD2 3.47Å; L174-Y338 VanDerWaalsContact CG-CD2 3.47Å; L174-Y338 HydrophobicContact CG-CE2 3.67Å; L174-Y338 HydrophobicContact CG-CG 4.27Å
175	S	88.6	Confident	84.7	Confident	93 Å²	93	74.2 Å²	74.2	65%	0.65	40%	0.396	S	S	*	.	H	α-helix	trans	-57.1	-43.1	177.1	-174	0	0	0	0	111.6	F171 S172 G179	F171-S175 PolarHBondContact O-N 3.35Å; S172-S175 PolarHBondContact O-N 2.94Å; S175-G179 WeakPolarHBondContact O-CA 3.44Å; S175-G179 PolarHBondContact O-N 3.27Å; S175-G179 VanDerWaalsContact O-N 3.12Å
176	Y	90.8	Very high	85.6	Confident	115 Å²	115	79.1 Å²	79.1	45%	0.451	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-53.8	171.5	173.5	-100.7	0	0	0	112.1	S172 L174 F178 G179 P249	S172-Y176 WeakPolarHBondContact O-CB 3.32Å; S172-Y176 PolarHBondContact O-N 3.44Å; L174-Y176 VanDerWaalsContact C-N 3.28Å; L174-Y176 PolarHBondContact O-N 3.32Å; Y176-F178 VanDerWaalsContact C-N 3.35Å; Y176-F178 PolarHBondContact O-N 3Å; Y176-G179 PolarHBondContact O-N 3.11Å; Y176-P249 WeakPolarHBondContact O-CB 3.33Å; Y176-P249 WeakPolarHBondContact O-CG 3.29Å
177	A	90.3	Very high	86.7	Confident	14 Å²	14	70.6 Å²	70.6	12%	0.116	37%	0.367	C	S	.	.	H	α-helix	trans	-67.6	-30.6	-171.8	0	0	0	0	0	114.1	L173 L174 A251 S252	L173-A177 WeakPolarHBondContact O-CB 3.46Å; L173-A177 PolarHBondContact O-N 2.93Å; L174-A177 PolarHBondContact O-N 2.94Å; A177-A251 HydrophobicContact CB-CB 3.92Å; A177-A251 WeakPolarHBondContact O-CB 3.41Å; A177-A251 PolarHBondContact O-N 3.27Å; A177-S252 PolarHBondContact O-N 3.42Å; A177-S252 VanDerWaalsContact O-N 3.08Å
178	F	90.9	Very high	87.9	Confident	61 Å²	61	67.6 Å²	67.6	27%	0.268	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	13.1	177.5	-68.6	-91.1	0	0	0	113.2	L174 Y176 F181 A251 S252 I255 F334	L174-F178 HydrophobicContact CD2-CD2 4.35Å; L174-F178 HydrophobicContact CD2-CE2 4.19Å; L174-F178 PolarHBondContact O-N 3.17Å; Y176-F178 VanDerWaalsContact C-N 3.35Å; Y176-F178 PolarHBondContact O-N 3Å; F178-F181 PolarHBondContact O-N 3.33Å; F178-A251 HydrophobicContact CD2-CB 4.25Å; F178-A251 HydrophobicContact CE1-CB 4.07Å; F178-A251 HydrophobicContact CE2-CB 3.7Å; F178-A251 HydrophobicContact CZ-CB 3.6Å; F178-S252 WeakPolarHBondContact CA-OG 3.35Å; F178-S252 PolarHBondContact O-OG 3.46Å; F178-I255 HydrophobicContact CD1-CD1 4.17Å; F178-I255 HydrophobicContact CE1-CD1 3.94Å; F178-F334 HydrophobicContact CD2-CZ 4.28Å; F178-F334 AromaticContact CE2-CE2 3.75Å; F178-F334 HydrophobicContact CE2-CE2 3.75Å; F178-F334 AromaticContact CE2-CZ 3.46Å; F178-F334 HydrophobicContact CE2-CZ 3.46Å; F178-F334 VanDerWaalsContact CE2-CZ 3.46Å; F178-F334 AromaticContact CZ-CE2 3.53Å; F178-F334 HydrophobicContact CZ-CE2 3.53Å; F178-F334 AromaticContact CZ-CZ 3.62Å; F178-F334 HydrophobicContact CZ-CZ 3.62Å
179	G	90.1	Very high	89.6	Confident	20 Å²	20	70.4 Å²	70.4	21%	0.206	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	155.7	174.7	0	0	0	0	0	112.7	S175 Y176 F181 P249 S252	S175-G179 WeakPolarHBondContact O-CA 3.44Å; S175-G179 PolarHBondContact O-N 3.27Å; S175-G179 VanDerWaalsContact O-N 3.12Å; Y176-G179 PolarHBondContact O-N 3.11Å; G179-F181 PolarHBondContact O-N 2.95Å; G179-P249 VanDerWaalsContact O-CD 3.25Å; G179-P249 WeakPolarHBondContact O-CD 3.22Å; G179-S252 PolarHBondContact O-OG 3.34Å
180	K	93.3	Very high	91.1	Very high	97 Å²	97	70.3 Å²	70.3	42%	0.422	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	28	-175	-57.3	173.8	-179.1	169.6	0	113.9	P182 T183 V184 Y246 T247 L248	K180-P182 VanDerWaalsContact C-N 3.34Å; K180-T183 WeakPolarHBondContact O-CB 3.4Å; K180-T183 PolarHBondContact O-N 3.3Å; K180-V184 PolarHBondContact O-N 2.98Å; K180-Y246 PolarHBondContact NZ-O 3.47Å; K180-T247 PolarHBondContact NZ-O 3.37Å; K180-T247 PolarHBondContact NZ-OG1 2.9Å; K180-L248 HydrophobicContact CB-CD2 3.64Å; K180-L248 HydrophobicContact CD-CD2 3.8Å; K180-L248 HydrophobicContact CG-CD2 4.38Å
181	F	93.9	Very high	92.4	Very high	104 Å²	104	64.4 Å²	64.4	46%	0.456	32%	0.322	S	S	.	.	H	α-helix	trans	-50.4	-37.4	178.1	-166.4	-105.2	0	0	0	115.7	F178 G179 T183 V184 V185 I255	F178-F181 PolarHBondContact O-N 3.33Å; G179-F181 PolarHBondContact O-N 2.95Å; F181-T183 VanDerWaalsContact C-N 3.26Å; F181-T183 PolarHBondContact O-N 2.98Å; F181-V184 HydrophobicContact CD2-CB 4.49Å; F181-V184 WeakPolarHBondContact O-CA 3.18Å; F181-V184 WeakPolarHBondContact O-CB 3.41Å; F181-V184 PolarHBondContact O-N 2.86Å; F181-V185 HydrophobicContact CD1-CG2 3.8Å; F181-V185 HydrophobicContact CE1-CG2 3.39Å; F181-V185 HydrophobicContact CE2-CG2 4.5Å; F181-V185 HydrophobicContact CZ-CG2 3.78Å; F181-V185 PolarHBondContact O-N 3.36Å; F181-I255 HydrophobicContact CE2-CD1 4.39Å
182	P	95.6	Very high	93.1	Very high	102 Å²	102	61.6 Å²	61.6	66%	0.662	31%	0.31	S	S	*	.	H	α-helix	trans	-58.2	-36.8	175.3	-27.1	36.7	0	0	0	113.4	K180 V185 W186	K180-P182 VanDerWaalsContact C-N 3.34Å; P182-V185 PolarHBondContact O-N 3.44Å; P182-W186 WeakPolarHBondContact O-CB 3.2Å; P182-W186 PolarHBondContact O-N 3.08Å
183	T	95.3	Very high	93.8	Very high	37 Å²	37	63 Å²	63	23%	0.227	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-38	174.7	-49	0	0	0	0	111.3	K180 F181 T187 V242 Y246 L248	K180-T183 WeakPolarHBondContact O-CB 3.4Å; K180-T183 PolarHBondContact O-N 3.3Å; F181-T183 VanDerWaalsContact C-N 3.26Å; F181-T183 PolarHBondContact O-N 2.98Å; T183-T187 WeakPolarHBondContact O-CB 3.41Å; T183-T187 PolarHBondContact O-N 3.03Å; T183-T187 PolarHBondContact O-OG1 2.93Å; T183-V242 HydrophobicContact CG2-CG1 4.38Å; T183-Y246 HydrophobicContact CG2-CG 4.39Å; T183-L248 HydrophobicContact CG2-CD2 4.17Å
184	V	96.3	Very high	94.3	Very high	3 Å²	3	61 Å²	61	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-49.7	175	178	0	0	0	0	110.7	K180 F181 T187 W188 L248 I255 I256	K180-V184 PolarHBondContact O-N 2.98Å; F181-V184 HydrophobicContact CD2-CB 4.49Å; F181-V184 WeakPolarHBondContact O-CA 3.18Å; F181-V184 WeakPolarHBondContact O-CB 3.41Å; F181-V184 PolarHBondContact O-N 2.86Å; V184-T187 PolarHBondContact O-N 3.44Å; V184-W188 WeakPolarHBondContact O-CB 3.3Å; V184-W188 PolarHBondContact O-N 3.22Å; V184-L248 HydrophobicContact CG2-CD1 4.4Å; V184-I255 HydrophobicContact CG1-CB 4.16Å; V184-I255 HydrophobicContact CG1-CD1 4.29Å; V184-I255 HydrophobicContact CG1-CG2 3.86Å; V184-I256 HydrophobicContact CB-CD1 4.44Å; V184-I256 HydrophobicContact CB-CG1 4.48Å; V184-I256 HydrophobicContact CG1-CD1 4.4Å; V184-I256 HydrophobicContact CG1-CG1 3.9Å; V184-I256 HydrophobicContact CG2-CD1 4.21Å
185	V	96.3	Very high	94.8	Very high	54 Å²	54	59.7 Å²	59.7	33%	0.327	30%	0.296	S	S	.	.	H	α-helix	trans	-62.5	-45	179.9	174.1	0	0	0	0	111.6	F181 P182 W188 W189	F181-V185 HydrophobicContact CD1-CG2 3.8Å; F181-V185 HydrophobicContact CE1-CG2 3.39Å; F181-V185 HydrophobicContact CE2-CG2 4.5Å; F181-V185 HydrophobicContact CZ-CG2 3.78Å; F181-V185 PolarHBondContact O-N 3.36Å; P182-V185 PolarHBondContact O-N 3.44Å; V185-W188 PolarHBondContact O-N 2.96Å; V185-W189 VanDerWaalsContact O-CD1 3.29Å; V185-W189 PolarHBondContact O-N 3.41Å
186	W	96.5	Very high	95.2	Very high	152 Å²	152	57.6 Å²	57.6	58%	0.576	28%	0.275	S	S	*	.	H	α-helix	trans	-62.2	-43.9	177.3	-176.9	79.8	0	0	0	112.3	P182 W189 I190	P182-W186 WeakPolarHBondContact O-CB 3.2Å; P182-W186 PolarHBondContact O-N 3.08Å; W186-W189 PolarHBondContact O-N 3.08Å; W186-I190 HydrophobicContact CD2-CD1 3.7Å; W186-I190 VanDerWaalsContact CE2-CD1 3.44Å; W186-I190 HydrophobicContact CE3-CD1 3.85Å; W186-I190 HydrophobicContact CG-CD1 4.49Å; W186-I190 HydrophobicContact CH2-CD1 3.56Å; W186-I190 HydrophobicContact CZ2-CD1 3.39Å; W186-I190 HydrophobicContact CZ3-CD1 3.78Å; W186-I190 PolarHBondContact O-N 3.48Å; W186-I190 VanDerWaalsContact O-N 3.11Å
187	T	96.2	Very high	95.4	Very high	6 Å²	6	55 Å²	55	4%	0.037	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-44.8	176.9	-52.9	0	0	0	0	111.1	T183 V184 W189 I190 M191 V242 I256	T183-T187 WeakPolarHBondContact O-CB 3.41Å; T183-T187 PolarHBondContact O-N 3.03Å; T183-T187 PolarHBondContact O-OG1 2.93Å; V184-T187 PolarHBondContact O-N 3.44Å; T187-W189 PolarHBondContact O-N 3.37Å; T187-I190 PolarHBondContact O-N 3.08Å; T187-M191 HydrophobicContact CG2-CG 4.43Å; T187-M191 HydrophobicContact CG2-SD 3.73Å; T187-M191 VanDerWaalsContact O-CG 3.25Å; T187-M191 WeakPolarHBondContact O-CG 3.24Å; T187-M191 PolarHBondContact O-N 3.24Å; T187-V242 HydrophobicContact CG2-CB 4.39Å; T187-V242 HydrophobicContact CG2-CG1 4.12Å; T187-V242 WeakPolarHBondContact OG1-CG1 3.46Å; T187-I256 HydrophobicContact CG2-CD1 4.18Å; T187-I256 HydrophobicContact CG2-CG2 4.07Å
188	W	97.4	Very high	95.7	Very high	56 Å²	56	56.7 Å²	56.7	21%	0.212	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-43.3	176.7	-178.1	86.2	0	0	0	112.3	V184 V185 I190 M191 F192 E259 F263 F302	V184-W188 WeakPolarHBondContact O-CB 3.3Å; V184-W188 PolarHBondContact O-N 3.22Å; V185-W188 PolarHBondContact O-N 2.96Å; W188-I190 PolarHBondContact O-N 3.42Å; W188-M191 PolarHBondContact O-N 3.02Å; W188-F192 HydrophobicContact CH2-CB 4.46Å; W188-F192 HydrophobicContact CH2-CG 4.32Å; W188-F192 HydrophobicContact CZ3-CB 4.48Å; W188-F192 VanDerWaalsContact O-CB 3.29Å; W188-F192 WeakPolarHBondContact O-CB 3.34Å; W188-F192 PolarHBondContact O-N 3.43Å; W188-E259 PolarHBondContact NE1-OE2 2.87Å; W188-F263 AromaticContact NE1-CE2 3.98Å; W188-F302 HydrophobicContact CH2-CE1 4.33Å; W188-F302 HydrophobicContact CZ2-CE1 4.43Å
189	W	97.1	Very high	95.9	Very high	132 Å²	132	53.8 Å²	53.8	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175.8	-89.1	112.2	0	0	0	112.5	V185 W186 T187 F192 L193	V185-W189 VanDerWaalsContact O-CD1 3.29Å; V185-W189 PolarHBondContact O-N 3.41Å; W186-W189 PolarHBondContact O-N 3.08Å; T187-W189 PolarHBondContact O-N 3.37Å; W189-F192 HydrophobicContact CE3-CD1 4.06Å; W189-F192 AromaticContact CZ3-CD1 3.96Å; W189-F192 HydrophobicContact CZ3-CD1 3.96Å; W189-F192 HydrophobicContact CZ3-CE1 4.22Å; W189-F192 PolarHBondContact O-N 2.88Å; W189-L193 HydrophobicContact CE3-CD1 4.47Å; W189-L193 HydrophobicContact CE3-CG 4.35Å; W189-L193 WeakPolarHBondContact O-CB 3.36Å; W189-L193 VanDerWaalsContact O-CG 3.25Å; W189-L193 WeakPolarHBondContact O-CG 3.14Å; W189-L193 PolarHBondContact O-N 2.86Å
190	I	96.4	Very high	96.2	Very high	79 Å²	79	55 Å²	55	41%	0.405	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-44	176.7	-69.3	171.6	0	0	0	111	W186 T187 W188 F192 S194	W186-I190 HydrophobicContact CD2-CD1 3.7Å; W186-I190 VanDerWaalsContact CE2-CD1 3.44Å; W186-I190 HydrophobicContact CE3-CD1 3.85Å; W186-I190 HydrophobicContact CG-CD1 4.49Å; W186-I190 HydrophobicContact CH2-CD1 3.56Å; W186-I190 HydrophobicContact CZ2-CD1 3.39Å; W186-I190 HydrophobicContact CZ3-CD1 3.78Å; W186-I190 PolarHBondContact O-N 3.48Å; W186-I190 VanDerWaalsContact O-N 3.11Å; T187-I190 PolarHBondContact O-N 3.08Å; W188-I190 PolarHBondContact O-N 3.42Å; I190-F192 PolarHBondContact O-N 3.41Å; I190-S194 VanDerWaalsContact O-CB 3.25Å; I190-S194 WeakPolarHBondContact O-CB 3.4Å; I190-S194 PolarHBondContact O-N 3.4Å; I190-S194 PolarHBondContact O-OG 3.06Å
191	M	96.8	Very high	96.3	Very high	6 Å²	6	55.4 Å²	55.4	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-42.2	175.9	-70.4	165.3	59.2	0	0	111.9	T187 W188 S194 T195 P239 I256 E259 Q260 F263	T187-M191 HydrophobicContact CG2-CG 4.43Å; T187-M191 HydrophobicContact CG2-SD 3.73Å; T187-M191 VanDerWaalsContact O-CG 3.25Å; T187-M191 WeakPolarHBondContact O-CG 3.24Å; T187-M191 PolarHBondContact O-N 3.24Å; W188-M191 PolarHBondContact O-N 3.02Å; M191-S194 WeakPolarHBondContact CA-OG 3.4Å; M191-S194 PolarHBondContact O-OG 3.31Å; M191-S194 VanDerWaalsContact O-OG 3.07Å; M191-T195 VanDerWaalsContact O-CB 3.22Å; M191-T195 WeakPolarHBondContact O-CB 3.28Å; M191-T195 PolarHBondContact O-N 3.02Å; M191-T195 PolarHBondContact O-OG1 3.37Å; M191-P239 HydrophobicContact CE-CB 4.17Å; M191-P239 HydrophobicContact CE-CG 3.92Å; M191-P239 HydrophobicContact CG-CG 3.95Å; M191-P239 HydrophobicContact SD-CB 3.78Å; M191-P239 HydrophobicContact SD-CG 3.67Å; M191-I256 HydrophobicContact CE-CG2 4.36Å; M191-I256 HydrophobicContact SD-CG2 3.86Å; M191-E259 HydrophobicContact CE-CB 4.39Å; M191-Q260 VanDerWaalsContact CE-CA 3.44Å; M191-Q260 HydrophobicContact CE-CB 3.45Å; M191-Q260 VanDerWaalsContact CE-CB 3.45Å; M191-F263 HydrophobicContact CB-CD2 4.17Å; M191-F263 HydrophobicContact CB-CE2 4.17Å; M191-F263 HydrophobicContact CE-CD2 4.15Å
192	F	97.5	Very high	96.4	Very high	15 Å²	15	51.6 Å²	51.6	7%	0.066	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-51.9	177.3	173.9	-106.5	0	0	0	111.7	W188 W189 I190 S194 T195 F196 F263 L298 L301 F302	W188-F192 HydrophobicContact CH2-CB 4.46Å; W188-F192 HydrophobicContact CH2-CG 4.32Å; W188-F192 HydrophobicContact CZ3-CB 4.48Å; W188-F192 VanDerWaalsContact O-CB 3.29Å; W188-F192 WeakPolarHBondContact O-CB 3.34Å; W188-F192 PolarHBondContact O-N 3.43Å; W189-F192 HydrophobicContact CE3-CD1 4.06Å; W189-F192 AromaticContact CZ3-CD1 3.96Å; W189-F192 HydrophobicContact CZ3-CD1 3.96Å; W189-F192 HydrophobicContact CZ3-CE1 4.22Å; W189-F192 PolarHBondContact O-N 2.88Å; I190-F192 PolarHBondContact O-N 3.41Å; F192-S194 VanDerWaalsContact C-N 3.35Å; F192-S194 PolarHBondContact O-N 2.79Å; F192-T195 PolarHBondContact O-N 2.89Å; F192-F196 VanDerWaalsContact O-CB 3.26Å; F192-F196 WeakPolarHBondContact O-CB 3.3Å; F192-F196 PolarHBondContact O-N 2.86Å; F192-F263 HydrophobicContact CB-CE2 4.4Å; F192-F263 HydrophobicContact CB-CZ 3.85Å; F192-F263 AromaticContact CD2-CE1 3.89Å; F192-F263 HydrophobicContact CD2-CE1 3.89Å; F192-F263 AromaticContact CD2-CZ 3.84Å; F192-F263 HydrophobicContact CD2-CZ 3.84Å; F192-F263 HydrophobicContact CG-CZ 4.35Å; F192-L298 HydrophobicContact CE2-CD1 4.44Å; F192-L298 HydrophobicContact CZ-CD1 3.77Å; F192-L301 HydrophobicContact CE2-CB 4.38Å; F192-L301 HydrophobicContact CE2-CD1 4.13Å; F192-F302 HydrophobicContact CD2-CZ 4.26Å; F192-F302 HydrophobicContact CE1-CZ 4.39Å; F192-F302 HydrophobicContact CE2-CE1 4.34Å; F192-F302 AromaticContact CE2-CE2 3.61Å; F192-F302 HydrophobicContact CE2-CE2 3.61Å; F192-F302 AromaticContact CE2-CZ 3.47Å; F192-F302 HydrophobicContact CE2-CZ 3.47Å; F192-F302 VanDerWaalsContact CE2-CZ 3.47Å; F192-F302 AromaticContact CZ-CE2 3.58Å; F192-F302 HydrophobicContact CZ-CE2 3.58Å; F192-F302 AromaticContact CZ-CZ 3.56Å; F192-F302 HydrophobicContact CZ-CZ 3.56Å
193	L	97.1	Very high	96.4	Very high	89 Å²	89	47.1 Å²	47.1	47%	0.466	23%	0.226	S	C	.	.	H	α-helix	trans	-63.4	-39.2	-178.8	-71.1	170.6	0	0	0	112.3	W189 S197	W189-L193 HydrophobicContact CE3-CD1 4.47Å; W189-L193 HydrophobicContact CE3-CG 4.35Å; W189-L193 WeakPolarHBondContact O-CB 3.36Å; W189-L193 VanDerWaalsContact O-CG 3.25Å; W189-L193 WeakPolarHBondContact O-CG 3.14Å; W189-L193 PolarHBondContact O-N 2.86Å; L193-S197 VanDerWaalsContact O-CB 3.28Å; L193-S197 WeakPolarHBondContact O-CB 3.32Å; L193-S197 PolarHBondContact O-N 3.02Å; L193-S197 PolarHBondContact O-OG 3.44Å
194	S	96.8	Very high	96.3	Very high	18 Å²	18	48.1 Å²	48.1	13%	0.126	23%	0.228	C	C	.	.	H	α-helix	trans	-69	-43.1	175.8	59	0	0	0	0	112.3	I190 M191 F192 F196 S197 V198 P199	I190-S194 VanDerWaalsContact O-CB 3.25Å; I190-S194 WeakPolarHBondContact O-CB 3.4Å; I190-S194 PolarHBondContact O-N 3.4Å; I190-S194 PolarHBondContact O-OG 3.06Å; M191-S194 WeakPolarHBondContact CA-OG 3.4Å; M191-S194 PolarHBondContact O-OG 3.31Å; M191-S194 VanDerWaalsContact O-OG 3.07Å; F192-S194 VanDerWaalsContact C-N 3.35Å; F192-S194 PolarHBondContact O-N 2.79Å; S194-F196 VanDerWaalsContact C-N 3.33Å; S194-F196 PolarHBondContact O-N 3.43Å; S194-S197 PolarHBondContact O-N 2.98Å; S194-V198 WeakPolarHBondContact O-CB 3.4Å; S194-V198 PolarHBondContact O-N 3.37Å; S194-P199 WeakPolarHBondContact O-CD 3.29Å
195	T	97.2	Very high	96.2	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-33.1	174.3	-55.2	0	0	0	0	112.8	M191 F192 P199 L235 F263 A267 Y297 L301	M191-T195 VanDerWaalsContact O-CB 3.22Å; M191-T195 WeakPolarHBondContact O-CB 3.28Å; M191-T195 PolarHBondContact O-N 3.02Å; M191-T195 PolarHBondContact O-OG1 3.37Å; F192-T195 PolarHBondContact O-N 2.89Å; T195-P199 WeakPolarHBondContact O-CD 3.4Å; T195-P199 VanDerWaalsContact O-CG 3.28Å; T195-P199 WeakPolarHBondContact O-CG 3.3Å; T195-L235 WeakPolarHBondContact OG1-CD2 3.2Å; T195-F263 HydrophobicContact CG2-CB 3.97Å; T195-F263 HydrophobicContact CG2-CD1 3.76Å; T195-F263 HydrophobicContact CG2-CG 4.14Å; T195-A267 HydrophobicContact CG2-CB 4.34Å; T195-Y297 PolarHBondContact O-OH 3.43Å; T195-L301 HydrophobicContact CG2-CD2 4.1Å
196	F	96.9	Very high	96.1	Very high	49 Å²	49	53.1 Å²	53.1	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-71.6	-46	175.2	172.7	-116.3	0	0	0	111.9	F192 S194 Y200 V294 Y297 L298 L301	F192-F196 VanDerWaalsContact O-CB 3.26Å; F192-F196 WeakPolarHBondContact O-CB 3.3Å; F192-F196 PolarHBondContact O-N 2.86Å; S194-F196 VanDerWaalsContact C-N 3.33Å; S194-F196 PolarHBondContact O-N 3.43Å; F196-Y200 WeakPolarHBondContact O-CB 3.43Å; F196-V294 HydrophobicContact CE2-CG1 3.68Å; F196-V294 HydrophobicContact CZ-CG1 3.44Å; F196-V294 VanDerWaalsContact CZ-CG1 3.44Å; F196-Y297 HydrophobicContact CD2-CD1 4.21Å; F196-Y297 WeakPolarHBondContact O-CE1 3.14Å; F196-L298 HydrophobicContact CD2-CD1 4.06Å; F196-L298 HydrophobicContact CE2-CB 3.93Å; F196-L298 HydrophobicContact CE2-CD1 3.98Å; F196-L298 HydrophobicContact CE2-CG 4.41Å; F196-L301 HydrophobicContact CB-CD1 3.86Å; F196-L301 HydrophobicContact CD2-CD1 3.92Å; F196-L301 HydrophobicContact CG-CD1 4.37Å
197	S	95.9	Very high	95.8	Very high	62 Å²	62	45.9 Å²	45.9	43%	0.434	21%	0.213	S	C	.	.	H	α-helix	trans	-83.8	-49.4	-169.7	-49.4	0	0	0	0	113	L193 S194 F201	L193-S197 VanDerWaalsContact O-CB 3.28Å; L193-S197 WeakPolarHBondContact O-CB 3.32Å; L193-S197 PolarHBondContact O-N 3.02Å; L193-S197 PolarHBondContact O-OG 3.44Å; S194-S197 PolarHBondContact O-N 2.98Å; S197-F201 WeakPolarHBondContact O-CB 3.28Å; S197-F201 PolarHBondContact O-N 2.93Å
198	V	96	Very high	95.4	Very high	49 Å²	49	48.2 Å²	48.2	30%	0.297	23%	0.227	S	C	.	.	H	α-helix	trans	-74.3	-50.6	-165.8	-178.9	0	0	0	0	112.8	S194 Y200 F201 L202 F230	S194-V198 WeakPolarHBondContact O-CB 3.4Å; S194-V198 PolarHBondContact O-N 3.37Å; V198-Y200 VanDerWaalsContact C-N 3.34Å; V198-Y200 PolarHBondContact O-N 3.04Å; V198-F201 PolarHBondContact O-N 3.18Å; V198-L202 HydrophobicContact CG1-CD1 3.7Å; V198-L202 HydrophobicContact CG1-CG 4.05Å; V198-L202 WeakPolarHBondContact O-CB 3.31Å; V198-L202 VanDerWaalsContact O-CG 3.3Å; V198-L202 WeakPolarHBondContact O-CG 3.33Å; V198-L202 PolarHBondContact O-N 3.13Å; V198-F230 HydrophobicContact CB-CD2 3.74Å; V198-F230 HydrophobicContact CB-CE2 3.61Å; V198-F230 HydrophobicContact CB-CG 4.42Å; V198-F230 HydrophobicContact CB-CZ 4.18Å; V198-F230 HydrophobicContact CG1-CB 4.37Å; V198-F230 HydrophobicContact CG1-CD2 3.47Å; V198-F230 VanDerWaalsContact CG1-CD2 3.47Å; V198-F230 HydrophobicContact CG1-CE2 3.92Å; V198-F230 HydrophobicContact CG1-CG 3.88Å; V198-F230 HydrophobicContact CG2-CD2 4.23Å; V198-F230 HydrophobicContact CG2-CE2 3.98Å
199	P	96.2	Very high	94.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.3	-44.1	174.6	-26.9	36.6	0	0	0	113.4	S194 T195 F203 F227 F230 A267	S194-P199 WeakPolarHBondContact O-CD 3.29Å; T195-P199 WeakPolarHBondContact O-CD 3.4Å; T195-P199 VanDerWaalsContact O-CG 3.28Å; T195-P199 WeakPolarHBondContact O-CG 3.3Å; P199-F203 VanDerWaalsContact O-CB 3.26Å; P199-F203 WeakPolarHBondContact O-CB 3.01Å; P199-F203 PolarHBondContact O-N 2.93Å; P199-F227 HydrophobicContact CB-CE2 4.11Å; P199-F227 HydrophobicContact CG-CE2 4.31Å; P199-F230 HydrophobicContact CG-CD1 4.21Å; P199-F230 HydrophobicContact CG-CE1 3.57Å; P199-F230 HydrophobicContact CG-CZ 4.06Å; P199-A267 HydrophobicContact CG-CB 4.15Å
200	Y	96	Very high	94.4	Very high	44 Å²	44	43 Å²	43	17%	0.173	21%	0.214	C	C	.	.	H	α-helix	trans	-63.3	-47.7	179.2	-174.3	-90.2	0	0	0	111.3	F196 V198 F203 Q204 F270 P292 V294 Y297	F196-Y200 WeakPolarHBondContact O-CB 3.43Å; V198-Y200 VanDerWaalsContact C-N 3.34Å; V198-Y200 PolarHBondContact O-N 3.04Å; Y200-F203 PolarHBondContact O-N 2.76Å; Y200-Q204 WeakPolarHBondContact O-CB 3.39Å; Y200-Q204 PolarHBondContact O-N 3.29Å; Y200-F270 AromaticContact CD2-CZ 3.97Å; Y200-F270 HydrophobicContact CD2-CZ 3.97Å; Y200-P292 WeakPolarHBondContact CE2-O 3.35Å; Y200-P292 PolarHBondContact OH-O 2.95Å; Y200-P292 VanDerWaalsContact OH-O 3.07Å; Y200-V294 HydrophobicContact CD1-CG2 4.32Å; Y200-V294 HydrophobicContact CE1-CG2 3.59Å; Y200-V294 HydrophobicContact CE2-CG2 4.13Å; Y200-V294 VanDerWaalsContact CZ-CG2 3.48Å; Y200-V294 WeakPolarHBondContact OH-CG2 3.41Å; Y200-V294 PolarHBondContact OH-N 2.87Å; Y200-Y297 HydrophobicContact CD2-CD1 4.04Å; Y200-Y297 HydrophobicContact CD2-CG 4.32Å; Y200-Y297 HydrophobicContact CG-CD1 4.41Å
201	F	96	Very high	93.4	Very high	107 Å²	107	42.7 Å²	42.7	47%	0.469	22%	0.219	S	C	.	.	H	α-helix	trans	-69.6	-39.1	-178.4	-172.6	-113.7	0	0	0	113.5	S197 V198 Q204 R205	S197-F201 WeakPolarHBondContact O-CB 3.28Å; S197-F201 PolarHBondContact O-N 2.93Å; V198-F201 PolarHBondContact O-N 3.18Å; F201-Q204 PolarHBondContact O-N 3.08Å; F201-R205 VanDerWaalsContact CE1-NE 3.27Å; F201-R205 WeakPolarHBondContact O-CB 3.5Å; F201-R205 WeakPolarHBondContact O-CG 3.4Å; F201-R205 PolarHBondContact O-N 2.95Å
202	L	95.4	Very high	92.6	Very high	24 Å²	24	50.6 Å²	50.6	13%	0.126	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-44.2	172.8	-72.9	177.3	0	0	0	111	V198 R205 W206 L226 F227	V198-L202 HydrophobicContact CG1-CD1 3.7Å; V198-L202 HydrophobicContact CG1-CG 4.05Å; V198-L202 WeakPolarHBondContact O-CB 3.31Å; V198-L202 VanDerWaalsContact O-CG 3.3Å; V198-L202 WeakPolarHBondContact O-CG 3.33Å; V198-L202 PolarHBondContact O-N 3.13Å; L202-R205 PolarHBondContact O-N 3.09Å; L202-W206 VanDerWaalsContact O-CB 3.32Å; L202-W206 WeakPolarHBondContact O-CB 3.34Å; L202-W206 PolarHBondContact O-N 3.47Å; L202-L226 HydrophobicContact CD1-CB 4.34Å; L202-L226 HydrophobicContact CD2-CB 4.13Å; L202-L226 HydrophobicContact CD2-CD1 4.03Å; L202-F227 HydrophobicContact CD1-CB 4.34Å
203	F	95.2	Very high	91.8	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.035	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-44.6	175.8	-176.5	-93.1	0	0	0	112	P199 Y200 R205 W206 A207 F270 N274 V275 V278	P199-F203 VanDerWaalsContact O-CB 3.26Å; P199-F203 WeakPolarHBondContact O-CB 3.01Å; P199-F203 PolarHBondContact O-N 2.93Å; Y200-F203 PolarHBondContact O-N 2.76Å; F203-R205 PolarHBondContact O-N 2.95Å; F203-W206 AromaticContact CD2-CE3 3.93Å; F203-W206 HydrophobicContact CD2-CE3 3.93Å; F203-W206 HydrophobicContact CD2-CZ3 4.23Å; F203-W206 AromaticContact CE2-CE3 3.68Å; F203-W206 HydrophobicContact CE2-CE3 3.68Å; F203-W206 AromaticContact CE2-CZ3 3.52Å; F203-W206 HydrophobicContact CE2-CZ3 3.52Å; F203-W206 HydrophobicContact CZ-CE3 4.29Å; F203-W206 HydrophobicContact CZ-CZ3 4.01Å; F203-W206 PolarHBondContact O-N 3.04Å; F203-A207 HydrophobicContact CE1-CB 4.22Å; F203-A207 HydrophobicContact CZ-CB 4.4Å; F203-A207 WeakPolarHBondContact O-CB 3.42Å; F203-A207 PolarHBondContact O-N 3.04Å; F203-F270 HydrophobicContact CB-CE1 4.04Å; F203-F270 HydrophobicContact CD1-CE1 4.47Å; F203-F270 HydrophobicContact CD1-CZ 4.43Å; F203-F270 HydrophobicContact CG-CE1 4.2Å; F203-N274 HydrophobicContact CD2-CB 4.47Å; F203-N274 HydrophobicContact CE1-CB 4.02Å; F203-N274 HydrophobicContact CE2-CB 3.61Å; F203-N274 HydrophobicContact CZ-CB 3.36Å; F203-V275 HydrophobicContact CE2-CG2 4.13Å; F203-V278 HydrophobicContact CE1-CG2 4.47Å; F203-V278 HydrophobicContact CZ-CG2 3.75Å
204	Q	93.9	Very high	91	Very high	58 Å²	58	53.3 Å²	53.3	27%	0.271	28%	0.281	S	S	.	.	H	α-helix	trans	-56.1	-48.7	176.9	-174.7	67.7	21.9	0	0	112.1	Y200 F201 T208	Y200-Q204 WeakPolarHBondContact O-CB 3.39Å; Y200-Q204 PolarHBondContact O-N 3.29Å; F201-Q204 PolarHBondContact O-N 3.08Å; Q204-T208 WeakPolarHBondContact O-CB 3.41Å; Q204-T208 PolarHBondContact O-N 3.11Å; Q204-T208 PolarHBondContact O-OG1 3.49Å
205	R	92.9	Very high	90.5	Very high	146 Å²	146	58.5 Å²	58.5	55%	0.551	30%	0.303	S	S	*	.	H	α-helix	trans	-66.3	-44.7	179	-78.1	-175.7	163.9	-170	-2.2	111.5	F201 L202 F203 G209	F201-R205 VanDerWaalsContact CE1-NE 3.27Å; F201-R205 WeakPolarHBondContact O-CB 3.5Å; F201-R205 WeakPolarHBondContact O-CG 3.4Å; F201-R205 PolarHBondContact O-N 2.95Å; L202-R205 PolarHBondContact O-N 3.09Å; F203-R205 PolarHBondContact O-N 2.95Å; R205-G209 PolarHBondContact O-N 2.89Å
206	W	94.3	Very high	89.9	Confident	16 Å²	16	60.6 Å²	60.6	6%	0.061	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-53.2	175.5	172	72.2	0	0	0	111.5	L202 F203 T208 G209 Y210 S220 H223 V275 V278 L279	L202-W206 VanDerWaalsContact O-CB 3.32Å; L202-W206 WeakPolarHBondContact O-CB 3.34Å; L202-W206 PolarHBondContact O-N 3.47Å; F203-W206 AromaticContact CD2-CE3 3.93Å; F203-W206 HydrophobicContact CD2-CE3 3.93Å; F203-W206 HydrophobicContact CD2-CZ3 4.23Å; F203-W206 AromaticContact CE2-CE3 3.68Å; F203-W206 HydrophobicContact CE2-CE3 3.68Å; F203-W206 AromaticContact CE2-CZ3 3.52Å; F203-W206 HydrophobicContact CE2-CZ3 3.52Å; F203-W206 HydrophobicContact CZ-CE3 4.29Å; F203-W206 HydrophobicContact CZ-CZ3 4.01Å; F203-W206 PolarHBondContact O-N 3.04Å; W206-T208 PolarHBondContact O-N 3.01Å; W206-G209 CarbonylContact O-C 3.55Å; W206-G209 PolarHBondContact O-N 3.34Å; W206-Y210 HydrophobicContact CZ2-CD2 4.01Å; W206-Y210 HydrophobicContact CZ2-CE2 4.47Å; W206-Y210 AromaticContact NE1-CD2 3.97Å; W206-Y210 WeakPolarHBondContact O-CB 3.46Å; W206-Y210 PolarHBondContact O-N 2.96Å; W206-S220 PolarHBondContact NE1-OG 3.33Å; W206-H223 HydrophobicContact CB-CB 3.93Å; W206-H223 HydrophobicContact CG-CB 4.2Å; W206-V275 HydrophobicContact CE3-CG2 4.41Å; W206-V275 HydrophobicContact CH2-CB 4.1Å; W206-V275 HydrophobicContact CH2-CG1 3.94Å; W206-V275 HydrophobicContact CH2-CG2 3.86Å; W206-V275 HydrophobicContact CZ2-CG1 4.35Å; W206-V275 HydrophobicContact CZ2-CG2 4.47Å; W206-V275 HydrophobicContact CZ3-CB 4.38Å; W206-V275 HydrophobicContact CZ3-CG2 3.83Å; W206-V278 HydrophobicContact CH2-CB 3.85Å; W206-V278 HydrophobicContact CH2-CG1 3.84Å; W206-V278 HydrophobicContact CZ3-CB 3.76Å; W206-V278 HydrophobicContact CZ3-CG1 3.82Å; W206-V278 HydrophobicContact CZ3-CG2 4.03Å; W206-L279 HydrophobicContact CH2-CG 4.45Å; W206-L279 HydrophobicContact CZ2-CD2 4.29Å
207	A	91	Very high	89.5	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-40.8	-176.6	0	0	0	0	0	112.5	F203 V278 V289 I291	F203-A207 HydrophobicContact CE1-CB 4.22Å; F203-A207 HydrophobicContact CZ-CB 4.4Å; F203-A207 WeakPolarHBondContact O-CB 3.42Å; F203-A207 PolarHBondContact O-N 3.04Å; A207-V278 HydrophobicContact CB-CG1 4.21Å; A207-V278 HydrophobicContact CB-CG2 4.06Å; A207-V289 HydrophobicContact CB-CG1 4.1Å; A207-I291 HydrophobicContact CB-CD1 4.16Å; A207-I291 HydrophobicContact CB-CG1 4.23Å
208	T	87.5	Confident	89.3	Confident	55 Å²	55	66.6 Å²	66.6	34%	0.337	35%	0.345	S	S	.	.	H	α-helix	trans	-69.7	-37.1	176.2	-51.5	0	0	0	0	112	Q204 W206	Q204-T208 WeakPolarHBondContact O-CB 3.41Å; Q204-T208 PolarHBondContact O-N 3.11Å; Q204-T208 PolarHBondContact O-OG1 3.49Å; W206-T208 PolarHBondContact O-N 3.01Å
209	G	85.9	Confident	88.9	Confident	21 Å²	21	65.8 Å²	65.8	22%	0.216	34%	0.339	C	S	.	.	H	α-helix	trans	-76.9	-28.2	179	0	0	0	0	0	113.6	R205 W206 S211 K212 S213	R205-G209 PolarHBondContact O-N 2.89Å; W206-G209 CarbonylContact O-C 3.55Å; W206-G209 PolarHBondContact O-N 3.34Å; G209-S211 PolarHBondContact O-N 3.24Å; G209-K212 PolarHBondContact O-N 2.92Å; G209-S213 WeakPolarHBondContact O-CB 3.41Å; G209-S213 PolarHBondContact O-N 3.28Å
210	Y	86.5	Confident	88.7	Confident	57 Å²	57	67.1 Å²	67.1	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-48	-178.6	-171.2	-88.2	0	0	0	111.8	W206 K212 P216 S220 L279 A282	W206-Y210 HydrophobicContact CZ2-CD2 4.01Å; W206-Y210 HydrophobicContact CZ2-CE2 4.47Å; W206-Y210 AromaticContact NE1-CD2 3.97Å; W206-Y210 WeakPolarHBondContact O-CB 3.46Å; W206-Y210 PolarHBondContact O-N 2.96Å; Y210-K212 VanDerWaalsContact C-N 3.28Å; Y210-K212 PolarHBondContact O-N 2.97Å; Y210-P216 HydrophobicContact CD2-CB 3.94Å; Y210-P216 HydrophobicContact CE2-CB 3.71Å; Y210-P216 HydrophobicContact CG-CB 4.43Å; Y210-S220 WeakPolarHBondContact CD2-OG 3.48Å; Y210-L279 HydrophobicContact CD2-CD2 4.49Å; Y210-L279 HydrophobicContact CE1-CD2 4.06Å; Y210-L279 HydrophobicContact CE2-CD2 3.67Å; Y210-L279 VanDerWaalsContact CZ-CD2 3.43Å; Y210-L279 WeakPolarHBondContact OH-CD2 3.17Å; Y210-A282 HydrophobicContact CD1-CB 3.89Å; Y210-A282 HydrophobicContact CE1-CB 3.64Å
211	S	76.8	Confident	88.6	Confident	72 Å²	72	70.5 Å²	70.5	50%	0.503	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.4	179.4	-51	0	0	0	0	114.4	G209	G209-S211 PolarHBondContact O-N 3.24Å
212	K	80.5	Confident	88.6	Confident	172 Å²	172	71 Å²	71	75%	0.748	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-17.2	-176.5	-67.7	-175.7	177.8	-174.9	0	114.2	G209 Y210	G209-K212 PolarHBondContact O-N 2.92Å; Y210-K212 VanDerWaalsContact C-N 3.28Å; Y210-K212 PolarHBondContact O-N 2.97Å
213	S	79.8	Confident	88.5	Confident	49 Å²	49	71 Å²	71	34%	0.343	37%	0.37	S	S	.	.			trans	-86	136.7	-173.4	-176.5	0	0	0	0	112.3	G209 H215	G209-S213 WeakPolarHBondContact O-CB 3.41Å; G209-S213 PolarHBondContact O-N 3.28Å; S213-H215 PolarHBondContact O-N 2.88Å; S213-H215 PolarHBondContact OG-N 3.39Å; S213-H215 VanDerWaalsContact OG-N 3.15Å
214	S	79.5	Confident	88.5	Confident	112 Å²	112	72.5 Å²	72.5	78%	0.783	39%	0.388	S	S	*	.	S	Bend	trans	-64.6	-21.5	168.9	-45.2	0	0	0	0	113.3
215	H	86.8	Confident	88.6	Confident	127 Å²	127	75.9 Å²	75.9	59%	0.588	40%	0.402	S	S	*	.			trans	-129.7	71.5	-179.1	-62	-54	0	0	0	111.2	S213 L217 I218 N219	S213-H215 PolarHBondContact O-N 2.88Å; S213-H215 PolarHBondContact OG-N 3.39Å; S213-H215 VanDerWaalsContact OG-N 3.15Å; H215-L217 VanDerWaalsContact C-N 3.26Å; H215-L217 PolarHBondContact O-N 3.42Å; H215-I218 HydrophobicContact CB-CB 4.45Å; H215-I218 HydrophobicContact CB-CD1 4.16Å; H215-I218 HydrophobicContact CB-CG1 4.44Å; H215-I218 PolarHBondContact O-N 2.92Å; H215-N219 PolarHBondContact O-N 2.97Å
216	P	85.1	Confident	88.8	Confident	44 Å²	44	71.8 Å²	71.8	29%	0.286	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-28.9	-173	24.5	-34.3	0	0	0	113.5	Y210 S220	Y210-P216 HydrophobicContact CD2-CB 3.94Å; Y210-P216 HydrophobicContact CE2-CB 3.71Å; Y210-P216 HydrophobicContact CG-CB 4.43Å; P216-S220 VanDerWaalsContact O-CB 3.32Å; P216-S220 WeakPolarHBondContact O-CB 3.24Å; P216-S220 PolarHBondContact O-N 3.33Å; P216-S220 PolarHBondContact O-OG 2.93Å
217	L	88.9	Confident	88.9	Confident	123 Å²	123	72.3 Å²	72.3	64%	0.644	39%	0.394	S	S	*	.	H	α-helix	trans	-65.1	-50.6	177.4	-179.2	61.8	0	0	0	112	H215 N219 S220 L221	H215-L217 VanDerWaalsContact C-N 3.26Å; H215-L217 PolarHBondContact O-N 3.42Å; L217-N219 VanDerWaalsContact C-N 3.34Å; L217-N219 PolarHBondContact O-N 2.89Å; L217-S220 WeakPolarHBondContact O-CB 3.25Å; L217-S220 PolarHBondContact O-N 3.4Å; L217-S220 VanDerWaalsContact O-N 3.15Å; L217-L221 HydrophobicContact CD1-CD1 4.39Å; L217-L221 HydrophobicContact CD1-CG 4.43Å; L217-L221 HydrophobicContact CG-CD1 4.27Å; L217-L221 WeakPolarHBondContact O-CG 3.31Å; L217-L221 PolarHBondContact O-N 3.37Å
218	I	90.3	Very high	89.1	Confident	114 Å²	114	77.9 Å²	77.9	59%	0.585	42%	0.421	S	S	*	.	H	α-helix	trans	-62.6	-44.5	-179.8	-59.6	175.6	0	0	0	109.8	H215 S220 L221 F222	H215-I218 HydrophobicContact CB-CB 4.45Å; H215-I218 HydrophobicContact CB-CD1 4.16Å; H215-I218 HydrophobicContact CB-CG1 4.44Å; H215-I218 PolarHBondContact O-N 2.92Å; I218-S220 VanDerWaalsContact C-N 3.27Å; I218-S220 PolarHBondContact O-N 3.5Å; I218-L221 PolarHBondContact O-N 3.41Å; I218-F222 WeakPolarHBondContact O-CB 3.33Å; I218-F222 PolarHBondContact O-N 2.86Å
219	N	89.2	Confident	89.5	Confident	32 Å²	32	78.9 Å²	78.9	17%	0.171	43%	0.427	C	S	.	.	H	α-helix	trans	-60.3	-36.7	176.1	-173.7	41.2	0	0	0	112.6	H215 L217 H223	H215-N219 PolarHBondContact O-N 2.97Å; L217-N219 VanDerWaalsContact C-N 3.34Å; L217-N219 PolarHBondContact O-N 2.89Å; N219-H223 PolarHBondContact O-N 3.45Å; N219-H223 VanDerWaalsContact O-N 3.13Å; N219-H223 PolarHBondContact O-ND1 3.02Å; N219-H223 PolarHBondContact OD1-CE1 2.95Å; N219-H223 PolarHBondContact OD1-ND1 3.43Å; N219-H223 VanDerWaalsContact OD1-ND1 3.09Å
220	S	92.1	Very high	90	Very high	29 Å²	29	78.2 Å²	78.2	20%	0.203	42%	0.418	C	S	.	.	H	α-helix	trans	-71.3	-42.4	177.2	-58.9	0	0	0	0	112.6	W206 Y210 P216 L217 I218 F222 H223 G224	W206-S220 PolarHBondContact NE1-OG 3.33Å; Y210-S220 WeakPolarHBondContact CD2-OG 3.48Å; P216-S220 VanDerWaalsContact O-CB 3.32Å; P216-S220 WeakPolarHBondContact O-CB 3.24Å; P216-S220 PolarHBondContact O-N 3.33Å; P216-S220 PolarHBondContact O-OG 2.93Å; L217-S220 WeakPolarHBondContact O-CB 3.25Å; L217-S220 PolarHBondContact O-N 3.4Å; L217-S220 VanDerWaalsContact O-N 3.15Å; I218-S220 VanDerWaalsContact C-N 3.27Å; I218-S220 PolarHBondContact O-N 3.5Å; S220-F222 VanDerWaalsContact C-N 3.34Å; S220-H223 PolarHBondContact O-N 3.28Å; S220-G224 PolarHBondContact O-N 2.96Å
221	L	93.7	Very high	90.4	Very high	115 Å²	115	76.8 Å²	76.8	60%	0.602	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-40.9	175	-68.7	173.3	0	0	0	111.4	L217 I218 G224 F225	L217-L221 HydrophobicContact CD1-CD1 4.39Å; L217-L221 HydrophobicContact CD1-CG 4.43Å; L217-L221 HydrophobicContact CG-CD1 4.27Å; L217-L221 WeakPolarHBondContact O-CG 3.31Å; L217-L221 PolarHBondContact O-N 3.37Å; I218-L221 PolarHBondContact O-N 3.41Å; L221-G224 PolarHBondContact O-N 2.74Å; L221-F225 WeakPolarHBondContact O-CB 3.31Å; L221-F225 PolarHBondContact O-N 2.88Å
222	F	94.4	Very high	91.2	Very high	117 Å²	117	78.8 Å²	78.8	51%	0.513	42%	0.417	S	S	.	.	H	α-helix	trans	-61.5	-50.5	176.1	178.3	-106.6	0	0	0	112.6	I218 S220 G224 F225 L226	I218-F222 WeakPolarHBondContact O-CB 3.33Å; I218-F222 PolarHBondContact O-N 2.86Å; S220-F222 VanDerWaalsContact C-N 3.34Å; F222-G224 VanDerWaalsContact C-N 3.34Å; F222-G224 PolarHBondContact O-N 3.27Å; F222-F225 PolarHBondContact O-N 3.1Å; F222-L226 HydrophobicContact CD1-CD1 4.07Å; F222-L226 HydrophobicContact CE1-CD1 3.51Å; F222-L226 HydrophobicContact CE1-CG 4.33Å; F222-L226 HydrophobicContact CE2-CD1 4.42Å; F222-L226 HydrophobicContact CE2-CG 4.47Å; F222-L226 HydrophobicContact CZ-CD1 3.72Å; F222-L226 HydrophobicContact CZ-CD2 4.49Å; F222-L226 HydrophobicContact CZ-CG 4.23Å; F222-L226 WeakPolarHBondContact O-CG 3.31Å; F222-L226 PolarHBondContact O-N 2.81Å
223	H	94.1	Very high	91.9	Very high	24 Å²	24	72.2 Å²	72.2	11%	0.111	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	-34.7	177.5	-74.5	82.4	0	0	0	112.5	W206 N219 S220 L226 F227	W206-H223 HydrophobicContact CB-CB 3.93Å; W206-H223 HydrophobicContact CG-CB 4.2Å; N219-H223 PolarHBondContact O-N 3.45Å; N219-H223 VanDerWaalsContact O-N 3.13Å; N219-H223 PolarHBondContact O-ND1 3.02Å; N219-H223 PolarHBondContact OD1-CE1 2.95Å; N219-H223 PolarHBondContact OD1-ND1 3.43Å; N219-H223 VanDerWaalsContact OD1-ND1 3.09Å; S220-H223 PolarHBondContact O-N 3.28Å; H223-L226 PolarHBondContact O-N 3.32Å; H223-F227 WeakPolarHBondContact O-CB 3.46Å; H223-F227 PolarHBondContact O-N 3.41Å
224	G	94.7	Very high	92.5	Very high	40 Å²	40	74 Å²	74	41%	0.412	40%	0.403	S	S	.	.	H	α-helix	trans	-63.4	-42.3	172.8	0	0	0	0	0	112.7	S220 L221 F222 F227 M228	S220-G224 PolarHBondContact O-N 2.96Å; L221-G224 PolarHBondContact O-N 2.74Å; F222-G224 VanDerWaalsContact C-N 3.34Å; F222-G224 PolarHBondContact O-N 3.27Å; G224-F227 PolarHBondContact O-N 2.81Å; G224-M228 PolarHBondContact O-N 3.31Å
225	F	96.3	Very high	93.2	Very high	129 Å²	129	68.7 Å²	68.7	57%	0.566	37%	0.366	S	S	*	.	H	α-helix	trans	-64	-46.2	174	178.2	-101.9	0	0	0	111.9	L221 F222 F227 M228 V229	L221-F225 WeakPolarHBondContact O-CB 3.31Å; L221-F225 PolarHBondContact O-N 2.88Å; F222-F225 PolarHBondContact O-N 3.1Å; F225-F227 VanDerWaalsContact C-N 3.28Å; F225-F227 PolarHBondContact O-N 3.49Å; F225-M228 WeakPolarHBondContact O-CB 3.27Å; F225-M228 PolarHBondContact O-N 2.76Å; F225-M228 VanDerWaalsContact O-N 3.16Å; F225-V229 HydrophobicContact CD1-CG2 4.2Å; F225-V229 HydrophobicContact CD2-CG2 4.41Å; F225-V229 HydrophobicContact CE1-CG2 3.76Å; F225-V229 HydrophobicContact CE2-CG2 3.99Å; F225-V229 HydrophobicContact CZ-CG2 3.64Å; F225-V229 WeakPolarHBondContact O-CG2 3.43Å; F225-V229 PolarHBondContact O-N 2.68Å
226	L	96.5	Very high	93.5	Very high	60 Å²	60	63.7 Å²	63.7	31%	0.314	35%	0.349	S	S	.	.	H	α-helix	trans	-58	-40.7	174.6	-71.7	179	0	0	0	112.3	L202 F222 H223 V229 F230	L202-L226 HydrophobicContact CD1-CB 4.34Å; L202-L226 HydrophobicContact CD2-CB 4.13Å; L202-L226 HydrophobicContact CD2-CD1 4.03Å; F222-L226 HydrophobicContact CD1-CD1 4.07Å; F222-L226 HydrophobicContact CE1-CD1 3.51Å; F222-L226 HydrophobicContact CE1-CG 4.33Å; F222-L226 HydrophobicContact CE2-CD1 4.42Å; F222-L226 HydrophobicContact CE2-CG 4.47Å; F222-L226 HydrophobicContact CZ-CD1 3.72Å; F222-L226 HydrophobicContact CZ-CD2 4.49Å; F222-L226 HydrophobicContact CZ-CG 4.23Å; F222-L226 WeakPolarHBondContact O-CG 3.31Å; F222-L226 PolarHBondContact O-N 2.81Å; H223-L226 PolarHBondContact O-N 3.32Å; L226-V229 PolarHBondContact O-N 3.28Å; L226-F230 WeakPolarHBondContact O-CB 3.26Å; L226-F230 PolarHBondContact O-N 3.45Å
227	F	96.8	Very high	93.9	Very high	26 Å²	26	68.4 Å²	68.4	11%	0.114	37%	0.365	C	S	.	.	H	α-helix	trans	-67.7	-38.7	176.2	-179.6	-109.8	0	0	0	112.6	P199 L202 H223 G224 F225 F230 Q231 A267 V271	P199-F227 HydrophobicContact CB-CE2 4.11Å; P199-F227 HydrophobicContact CG-CE2 4.31Å; L202-F227 HydrophobicContact CD1-CB 4.34Å; H223-F227 WeakPolarHBondContact O-CB 3.46Å; H223-F227 PolarHBondContact O-N 3.41Å; G224-F227 PolarHBondContact O-N 2.81Å; F225-F227 VanDerWaalsContact C-N 3.28Å; F225-F227 PolarHBondContact O-N 3.49Å; F227-F230 HydrophobicContact CD2-CD1 4.47Å; F227-F230 WeakPolarHBondContact O-CB 3.47Å; F227-F230 PolarHBondContact O-N 2.81Å; F227-Q231 HydrophobicContact CE1-CG 4.22Å; F227-Q231 HydrophobicContact CE2-CG 4.25Å; F227-Q231 HydrophobicContact CZ-CG 4.02Å; F227-Q231 PolarHBondContact O-N 3.07Å; F227-A267 HydrophobicContact CE2-CB 4.34Å; F227-A267 HydrophobicContact CZ-CB 4.29Å; F227-A267 WeakPolarHBondContact CZ-O 3.41Å; F227-V271 HydrophobicContact CD1-CG2 4.46Å; F227-V271 HydrophobicContact CD2-CG2 4.17Å; F227-V271 HydrophobicContact CE1-CB 4.16Å; F227-V271 HydrophobicContact CE1-CG1 4.39Å; F227-V271 HydrophobicContact CE1-CG2 3.97Å; F227-V271 HydrophobicContact CE2-CG2 3.65Å; F227-V271 HydrophobicContact CZ-CB 4.09Å; F227-V271 HydrophobicContact CZ-CG2 3.52Å
228	M	96.1	Very high	94.2	Very high	118 Å²	118	63.7 Å²	63.7	58%	0.581	35%	0.347	S	S	*	.	H	α-helix	trans	-62.9	-46.9	173.1	-177.8	-176.9	175.7	0	0	111.5	G224 F225 F230 Q231 I232	G224-M228 PolarHBondContact O-N 3.31Å; F225-M228 WeakPolarHBondContact O-CB 3.27Å; F225-M228 PolarHBondContact O-N 2.76Å; F225-M228 VanDerWaalsContact O-N 3.16Å; M228-F230 VanDerWaalsContact C-N 3.3Å; M228-F230 PolarHBondContact O-N 2.7Å; M228-Q231 PolarHBondContact O-N 2.7Å; M228-I232 HydrophobicContact CG-CG1 4.37Å; M228-I232 WeakPolarHBondContact O-CG1 3.36Å; M228-I232 PolarHBondContact O-N 3.45Å
229	V	96.1	Very high	94.4	Very high	75 Å²	75	58.4 Å²	58.4	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-40.4	176	171.8	0	0	0	0	110.9	F225 L226 G233	F225-V229 HydrophobicContact CD1-CG2 4.2Å; F225-V229 HydrophobicContact CD2-CG2 4.41Å; F225-V229 HydrophobicContact CE1-CG2 3.76Å; F225-V229 HydrophobicContact CE2-CG2 3.99Å; F225-V229 HydrophobicContact CZ-CG2 3.64Å; F225-V229 WeakPolarHBondContact O-CG2 3.43Å; F225-V229 PolarHBondContact O-N 2.68Å; L226-V229 PolarHBondContact O-N 3.28Å; V229-G233 WeakPolarHBondContact O-CA 3.43Å; V229-G233 PolarHBondContact O-N 2.73Å
230	F	96.1	Very high	94.6	Very high	7 Å²	7	58 Å²	58	3%	0.031	32%	0.318	C	S	.	.	I	π-helix	trans	-59.4	-50.6	172.6	169.7	-96.9	0	0	0	112.2	V198 P199 L226 F227 M228 I234 L235	V198-F230 HydrophobicContact CB-CD2 3.74Å; V198-F230 HydrophobicContact CB-CE2 3.61Å; V198-F230 HydrophobicContact CB-CG 4.42Å; V198-F230 HydrophobicContact CB-CZ 4.18Å; V198-F230 HydrophobicContact CG1-CB 4.37Å; V198-F230 HydrophobicContact CG1-CD2 3.47Å; V198-F230 VanDerWaalsContact CG1-CD2 3.47Å; V198-F230 HydrophobicContact CG1-CE2 3.92Å; V198-F230 HydrophobicContact CG1-CG 3.88Å; V198-F230 HydrophobicContact CG2-CD2 4.23Å; V198-F230 HydrophobicContact CG2-CE2 3.98Å; P199-F230 HydrophobicContact CG-CD1 4.21Å; P199-F230 HydrophobicContact CG-CE1 3.57Å; P199-F230 HydrophobicContact CG-CZ 4.06Å; L226-F230 WeakPolarHBondContact O-CB 3.26Å; L226-F230 PolarHBondContact O-N 3.45Å; F227-F230 HydrophobicContact CD2-CD1 4.47Å; F227-F230 WeakPolarHBondContact O-CB 3.47Å; F227-F230 PolarHBondContact O-N 2.81Å; M228-F230 VanDerWaalsContact C-N 3.3Å; M228-F230 PolarHBondContact O-N 2.7Å; F230-I234 HydrophobicContact CD2-CB 4Å; F230-I234 HydrophobicContact CD2-CD1 3.7Å; F230-I234 HydrophobicContact CD2-CG1 4.37Å; F230-I234 HydrophobicContact CD2-CG2 4.31Å; F230-I234 HydrophobicContact CE2-CB 4.03Å; F230-I234 HydrophobicContact CE2-CD1 4.16Å; F230-I234 HydrophobicContact CE2-CG2 3.85Å; F230-I234 WeakPolarHBondContact O-CB 3.4Å; F230-I234 PolarHBondContact O-N 3.49Å; F230-L235 HydrophobicContact CE1-CD1 3.57Å; F230-L235 HydrophobicContact CE1-CG 3.96Å; F230-L235 HydrophobicContact CZ-CD1 3.85Å; F230-L235 HydrophobicContact CZ-CD2 4.22Å; F230-L235 HydrophobicContact CZ-CG 3.88Å; F230-L235 PolarHBondContact O-N 2.96Å
231	Q	94.7	Very high	94.8	Very high	28 Å²	28	62.9 Å²	62.9	13%	0.131	33%	0.333	C	S	.	.	I	π-helix	trans	-63.6	-47.7	-178.9	-72	-153.4	-22.3	0	0	112.4	F227 M228 L235 G236 V264	F227-Q231 HydrophobicContact CE1-CG 4.22Å; F227-Q231 HydrophobicContact CE2-CG 4.25Å; F227-Q231 HydrophobicContact CZ-CG 4.02Å; F227-Q231 PolarHBondContact O-N 3.07Å; M228-Q231 PolarHBondContact O-N 2.7Å; Q231-L235 CarbonylContact O-C 3.55Å; Q231-L235 WeakPolarHBondContact O-CB 3.46Å; Q231-L235 PolarHBondContact O-N 3.25Å; Q231-G236 PolarHBondContact O-N 2.97Å; Q231-V264 PolarHBondContact NE2-O 3.32Å
232	I	94.6	Very high	94.8	Very high	114 Å²	114	58.2 Å²	58.2	59%	0.585	31%	0.309	S	S	*	.	I	π-helix	trans	-74	-44.9	-176.5	-58.6	-58.1	0	0	0	111.5	M228 G236 F237	M228-I232 HydrophobicContact CG-CG1 4.37Å; M228-I232 WeakPolarHBondContact O-CG1 3.36Å; M228-I232 PolarHBondContact O-N 3.45Å; I232-G236 CarbonylContact O-C 3.55Å; I232-G236 WeakPolarHBondContact O-CA 3.36Å; I232-G236 PolarHBondContact O-N 2.88Å; I232-F237 PolarHBondContact O-N 2.88Å
233	G	93.3	Very high	94.8	Very high	33 Å²	33	52.7 Å²	52.7	34%	0.34	29%	0.285	S	S	.	.	I	π-helix	trans	-76.5	-58.9	-177.6	0	0	0	0	0	113.3	V229 F237 G238	V229-G233 WeakPolarHBondContact O-CA 3.43Å; V229-G233 PolarHBondContact O-N 2.73Å; G233-F237 WeakPolarHBondContact O-CB 3.36Å; G233-F237 PolarHBondContact O-N 3.39Å; G233-G238 PolarHBondContact O-N 3.41Å
234	I	93.8	Very high	94.6	Very high	87 Å²	87	55.5 Å²	55.5	45%	0.446	30%	0.301	S	S	.	.	I	π-helix	trans	-80	-38.9	-170.8	-67.5	168.4	0	0	0	111.9	F230 P239	F230-I234 HydrophobicContact CD2-CB 4Å; F230-I234 HydrophobicContact CD2-CD1 3.7Å; F230-I234 HydrophobicContact CD2-CG1 4.37Å; F230-I234 HydrophobicContact CD2-CG2 4.31Å; F230-I234 HydrophobicContact CE2-CB 4.03Å; F230-I234 HydrophobicContact CE2-CD1 4.16Å; F230-I234 HydrophobicContact CE2-CG2 3.85Å; F230-I234 WeakPolarHBondContact O-CB 3.4Å; F230-I234 PolarHBondContact O-N 3.49Å; I234-P239 WeakPolarHBondContact O-CD 3.42Å
235	L	93.5	Very high	94.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-98.5	-23.4	-178.3	-59.5	-177.2	0	0	0	114.9	T195 F230 Q231 P239 Q260 F263 V264	T195-L235 WeakPolarHBondContact OG1-CD2 3.2Å; F230-L235 HydrophobicContact CE1-CD1 3.57Å; F230-L235 HydrophobicContact CE1-CG 3.96Å; F230-L235 HydrophobicContact CZ-CD1 3.85Å; F230-L235 HydrophobicContact CZ-CD2 4.22Å; F230-L235 HydrophobicContact CZ-CG 3.88Å; F230-L235 PolarHBondContact O-N 2.96Å; Q231-L235 CarbonylContact O-C 3.55Å; Q231-L235 WeakPolarHBondContact O-CB 3.46Å; Q231-L235 PolarHBondContact O-N 3.25Å; L235-P239 WeakPolarHBondContact O-CD 3.37Å; L235-P239 WeakPolarHBondContact O-CG 3.44Å; L235-Q260 PolarHBondContact O-OE1 3.34Å; L235-F263 HydrophobicContact CD1-CB 4.46Å; L235-V264 HydrophobicContact CB-CG2 3.62Å; L235-V264 HydrophobicContact CD1-CG2 4.01Å; L235-V264 HydrophobicContact CG-CG2 4.49Å
236	G	92.4	Very high	94.2	Very high	23 Å²	23	55.7 Å²	55.7	24%	0.237	30%	0.297	C	S	.	.	I	π-helix	trans	-90.1	-64.3	175.2	0	0	0	0	0	112.7	Q231 I232 T240	Q231-G236 PolarHBondContact O-N 2.97Å; I232-G236 CarbonylContact O-C 3.55Å; I232-G236 WeakPolarHBondContact O-CA 3.36Å; I232-G236 PolarHBondContact O-N 2.88Å; G236-T240 WeakPolarHBondContact O-CB 3.38Å; G236-T240 PolarHBondContact O-OG1 2.74Å
237	F	94.6	Very high	93.9	Very high	142 Å²	142	57 Å²	57	62%	0.623	31%	0.308	S	S	*	.	I	π-helix	trans	-71	-44.1	-177.2	-179.4	-98.2	0	0	0	112.5	I232 G233 T240 Y241	I232-F237 PolarHBondContact O-N 2.88Å; G233-F237 WeakPolarHBondContact O-CB 3.36Å; G233-F237 PolarHBondContact O-N 3.39Å; F237-T240 PolarHBondContact O-N 3.35Å; F237-Y241 HydrophobicContact CE1-CD2 4.34Å; F237-Y241 HydrophobicContact CE1-CG 4.21Å; F237-Y241 HydrophobicContact CZ-CD2 4.03Å; F237-Y241 HydrophobicContact CZ-CG 4.3Å; F237-Y241 VanDerWaalsContact O-CB 3.24Å; F237-Y241 WeakPolarHBondContact O-CB 3.29Å; F237-Y241 PolarHBondContact O-N 3.43Å
238	G	94	Very high	93.7	Very high	25 Å²	25	56 Å²	56	26%	0.258	30%	0.303	S	S	.	.	H	α-helix	trans	-51.2	-59.8	-177.1	0	0	0	0	0	115.1	G233 T240 Y241 V242	G233-G238 PolarHBondContact O-N 3.41Å; G238-T240 PolarHBondContact O-N 3.5Å; G238-Y241 PolarHBondContact O-N 2.93Å; G238-V242 WeakPolarHBondContact O-CG2 3.26Å; G238-V242 PolarHBondContact O-N 3.28Å
239	P	95.2	Very high	93.5	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.013	28%	0.281	C	S	.	.	H	α-helix	trans	-68.9	-36.1	-176.6	-19.3	34	0	0	0	112.2	M191 I234 L235 V242 V243 I256 Q260	M191-P239 HydrophobicContact CE-CB 4.17Å; M191-P239 HydrophobicContact CE-CG 3.92Å; M191-P239 HydrophobicContact CG-CG 3.95Å; M191-P239 HydrophobicContact SD-CB 3.78Å; M191-P239 HydrophobicContact SD-CG 3.67Å; I234-P239 WeakPolarHBondContact O-CD 3.42Å; L235-P239 WeakPolarHBondContact O-CD 3.37Å; L235-P239 WeakPolarHBondContact O-CG 3.44Å; P239-V242 PolarHBondContact O-N 3.27Å; P239-V243 WeakPolarHBondContact O-CB 3.2Å; P239-V243 WeakPolarHBondContact O-CG2 3.48Å; P239-V243 PolarHBondContact O-N 2.86Å; P239-I256 HydrophobicContact CB-CG2 3.69Å; P239-Q260 HydrophobicContact CB-CB 4.27Å; P239-Q260 HydrophobicContact CG-CB 4.14Å
240	T	94.4	Very high	93.3	Very high	23 Å²	23	48.7 Å²	48.7	14%	0.141	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-45.9	174.1	-57.7	0	0	0	0	111.7	G236 F237 G238 V242 V243 L244 Y462 V466	G236-T240 WeakPolarHBondContact O-CB 3.38Å; G236-T240 PolarHBondContact O-OG1 2.74Å; F237-T240 PolarHBondContact O-N 3.35Å; G238-T240 PolarHBondContact O-N 3.5Å; T240-V242 PolarHBondContact O-N 3.02Å; T240-V243 PolarHBondContact O-N 3.06Å; T240-L244 HydrophobicContact CG2-CD1 3.97Å; T240-L244 WeakPolarHBondContact O-CG 3.45Å; T240-L244 PolarHBondContact O-N 3.04Å; T240-Y462 PolarHBondContact OG1-OH 3.01Å; T240-V466 HydrophobicContact CG2-CG1 4.21Å; T240-V466 HydrophobicContact CG2-CG2 4.19Å
241	Y	94.6	Very high	93	Very high	132 Å²	132	49.4 Å²	49.4	52%	0.518	27%	0.274	S	S	.	.	H	α-helix	trans	-59.7	-46.5	175.7	172.8	-99.1	0	0	0	111	F237 G238 V243 L244 A245	F237-Y241 HydrophobicContact CE1-CD2 4.34Å; F237-Y241 HydrophobicContact CE1-CG 4.21Å; F237-Y241 HydrophobicContact CZ-CD2 4.03Å; F237-Y241 HydrophobicContact CZ-CG 4.3Å; F237-Y241 VanDerWaalsContact O-CB 3.24Å; F237-Y241 WeakPolarHBondContact O-CB 3.29Å; F237-Y241 PolarHBondContact O-N 3.43Å; G238-Y241 PolarHBondContact O-N 2.93Å; Y241-V243 PolarHBondContact O-N 3.35Å; Y241-L244 PolarHBondContact O-N 3.41Å; Y241-A245 HydrophobicContact CD2-CB 4.44Å; Y241-A245 HydrophobicContact CE1-CB 4.25Å; Y241-A245 HydrophobicContact CE2-CB 4.07Å; Y241-A245 WeakPolarHBondContact O-CB 3.46Å; Y241-A245 PolarHBondContact O-N 2.95Å
242	V	94.5	Very high	93	Very high	18 Å²	18	48.1 Å²	48.1	11%	0.109	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-47.1	176.9	171.6	0	0	0	0	111.4	T183 T187 G238 P239 T240 L244 Y246	T183-V242 HydrophobicContact CG2-CG1 4.38Å; T187-V242 HydrophobicContact CG2-CB 4.39Å; T187-V242 HydrophobicContact CG2-CG1 4.12Å; T187-V242 WeakPolarHBondContact OG1-CG1 3.46Å; G238-V242 WeakPolarHBondContact O-CG2 3.26Å; G238-V242 PolarHBondContact O-N 3.28Å; P239-V242 PolarHBondContact O-N 3.27Å; T240-V242 PolarHBondContact O-N 3.02Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.29Å; V242-Y246 HydrophobicContact CB-CD2 4.3Å; V242-Y246 HydrophobicContact CG1-CD2 3.79Å; V242-Y246 HydrophobicContact CG1-CE2 4.3Å; V242-Y246 HydrophobicContact CG2-CE2 4.44Å; V242-Y246 WeakPolarHBondContact O-CB 3.18Å; V242-Y246 WeakPolarHBondContact O-CD2 3.39Å; V242-Y246 PolarHBondContact O-N 2.86Å
243	V	93.6	Very high	93	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-42.4	179.3	153.8	0	0	0	0	112.8	P239 T240 Y241 L248 R253 I256 I257 V466	P239-V243 WeakPolarHBondContact O-CB 3.2Å; P239-V243 WeakPolarHBondContact O-CG2 3.48Å; P239-V243 PolarHBondContact O-N 2.86Å; T240-V243 PolarHBondContact O-N 3.06Å; Y241-V243 PolarHBondContact O-N 3.35Å; V243-L248 HydrophobicContact CG2-CD1 4.16Å; V243-L248 PolarHBondContact O-N 3.38Å; V243-R253 HydrophobicContact CB-CG 4.34Å; V243-R253 HydrophobicContact CG1-CB 4.08Å; V243-R253 HydrophobicContact CG1-CG 3.52Å; V243-R253 HydrophobicContact CG2-CB 4.29Å; V243-R253 HydrophobicContact CG2-CG 4.11Å; V243-I256 HydrophobicContact CG2-CB 4.17Å; V243-I256 HydrophobicContact CG2-CD1 3.99Å; V243-I256 HydrophobicContact CG2-CG2 4.13Å; V243-I257 HydrophobicContact CG2-CD1 4.07Å; V243-I257 HydrophobicContact CG2-CG1 4.26Å; V243-V466 HydrophobicContact CB-CG1 4.35Å; V243-V466 HydrophobicContact CG1-CG1 3.55Å
244	L	90.6	Very high	93.1	Very high	84 Å²	84	44.5 Å²	44.5	44%	0.44	24%	0.238	S	C	.	.	H	α-helix	trans	-80.7	-48.3	-177.9	-64	176.2	0	0	0	112	T240 Y241 V242 T247	T240-L244 HydrophobicContact CG2-CD1 3.97Å; T240-L244 WeakPolarHBondContact O-CG 3.45Å; T240-L244 PolarHBondContact O-N 3.04Å; Y241-L244 PolarHBondContact O-N 3.41Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.29Å; L244-T247 PolarHBondContact O-N 2.85Å
245	A	92	Very high	93.2	Very high	52 Å²	52	43.1 Å²	43.1	43%	0.43	23%	0.231	S	C	.	.	H	α-helix	trans	-67.2	-45.1	-176.6	0	0	0	0	0	112.7	Y241 T247	Y241-A245 HydrophobicContact CD2-CB 4.44Å; Y241-A245 HydrophobicContact CE1-CB 4.25Å; Y241-A245 HydrophobicContact CE2-CB 4.07Å; Y241-A245 WeakPolarHBondContact O-CB 3.46Å; Y241-A245 PolarHBondContact O-N 2.95Å; A245-T247 PolarHBondContact O-N 3.33Å
246	Y	91.5	Very high	93.4	Very high	120 Å²	120	43.2 Å²	43.2	47%	0.471	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	5.3	178.2	-68.3	-86.9	0	0	0	113.5	K180 T183 V242 L248	K180-Y246 PolarHBondContact NZ-O 3.47Å; T183-Y246 HydrophobicContact CG2-CG 4.39Å; V242-Y246 HydrophobicContact CB-CD2 4.3Å; V242-Y246 HydrophobicContact CG1-CD2 3.79Å; V242-Y246 HydrophobicContact CG1-CE2 4.3Å; V242-Y246 HydrophobicContact CG2-CE2 4.44Å; V242-Y246 WeakPolarHBondContact O-CB 3.18Å; V242-Y246 WeakPolarHBondContact O-CD2 3.39Å; V242-Y246 PolarHBondContact O-N 2.86Å; Y246-L248 VanDerWaalsContact C-N 3.33Å; Y246-L248 PolarHBondContact O-N 2.94Å
247	T	89.9	Confident	93.6	Very high	89 Å²	89	42.1 Å²	42.1	55%	0.546	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.4	55.1	177.7	53.2	0	0	0	0	112.5	K180 L244 A245	K180-T247 PolarHBondContact NZ-O 3.37Å; K180-T247 PolarHBondContact NZ-OG1 2.9Å; L244-T247 PolarHBondContact O-N 2.85Å; A245-T247 PolarHBondContact O-N 3.33Å
248	L	92	Very high	93.7	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	21%	0.214	C	C	.	.			trans	-67.2	150.9	-179.1	-62.7	-178.2	0	0	0	111.3	K180 T183 V184 V243 Y246 R253 I256	K180-L248 HydrophobicContact CB-CD2 3.64Å; K180-L248 HydrophobicContact CD-CD2 3.8Å; K180-L248 HydrophobicContact CG-CD2 4.38Å; T183-L248 HydrophobicContact CG2-CD2 4.17Å; V184-L248 HydrophobicContact CG2-CD1 4.4Å; V243-L248 HydrophobicContact CG2-CD1 4.16Å; V243-L248 PolarHBondContact O-N 3.38Å; Y246-L248 VanDerWaalsContact C-N 3.33Å; Y246-L248 PolarHBondContact O-N 2.94Å; L248-R253 HydrophobicContact CB-CG 3.78Å; L248-R253 PolarHBondContact O-NE 2.96Å; L248-R253 PolarHBondContact O-NH2 3.46Å; L248-I256 HydrophobicContact CD1-CD1 3.4Å; L248-I256 VanDerWaalsContact CD1-CD1 3.4Å
249	P	92.9	Very high	93.8	Very high	19 Å²	19	41.4 Å²	41.4	12%	0.123	21%	0.21	C	C	.	.			trans	-69.2	160.3	172.4	-19.2	33.8	0	0	0	112.8	Y176 G179 A251 S252 R253	Y176-P249 WeakPolarHBondContact O-CB 3.33Å; Y176-P249 WeakPolarHBondContact O-CG 3.29Å; G179-P249 VanDerWaalsContact O-CD 3.25Å; G179-P249 WeakPolarHBondContact O-CD 3.22Å; P249-A251 PolarHBondContact O-N 3.01Å; P249-S252 WeakPolarHBondContact O-CB 3.37Å; P249-S252 PolarHBondContact O-N 3Å; P249-R253 WeakPolarHBondContact O-CG 3.43Å; P249-R253 PolarHBondContact O-N 3.45Å
250	P	90.4	Very high	93.9	Very high	22 Å²	22	41.5 Å²	41.5	14%	0.143	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-42.6	-165.4	21.7	-33	0	0	0	114.6	R253 F254 W522	P250-R253 WeakPolarHBondContact O-CB 3.44Å; P250-R253 PolarHBondContact O-N 3.02Å; P250-F254 WeakPolarHBondContact O-CD2 3.4Å; P250-F254 PolarHBondContact O-N 3.42Å; P250-F254 VanDerWaalsContact O-N 3.08Å; P250-W522 HydrophobicContact CB-CH2 4.09Å; P250-W522 HydrophobicContact CB-CZ3 4.48Å; P250-W522 HydrophobicContact CG-CH2 3.87Å; P250-W522 HydrophobicContact CG-CZ2 3.95Å
251	A	90.6	Very high	94	Very high	22 Å²	22	42 Å²	42	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-39.2	179.7	0	0	0	0	0	112.2	A177 F178 P249 R253 F254 I255	A177-A251 HydrophobicContact CB-CB 3.92Å; A177-A251 WeakPolarHBondContact O-CB 3.41Å; A177-A251 PolarHBondContact O-N 3.27Å; F178-A251 HydrophobicContact CD2-CB 4.25Å; F178-A251 HydrophobicContact CE1-CB 4.07Å; F178-A251 HydrophobicContact CE2-CB 3.7Å; F178-A251 HydrophobicContact CZ-CB 3.6Å; P249-A251 PolarHBondContact O-N 3.01Å; A251-R253 PolarHBondContact O-N 3.32Å; A251-F254 PolarHBondContact O-N 3.03Å; A251-F254 VanDerWaalsContact O-N 3.12Å; A251-I255 PolarHBondContact O-N 3.38Å
252	S	94.1	Very high	94.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-53.7	-36.8	168.4	-73.2	0	0	0	0	112.8	A177 F178 G179 P249	A177-S252 PolarHBondContact O-N 3.42Å; A177-S252 VanDerWaalsContact O-N 3.08Å; F178-S252 WeakPolarHBondContact CA-OG 3.35Å; F178-S252 PolarHBondContact O-OG 3.46Å; G179-S252 PolarHBondContact O-OG 3.34Å; P249-S252 WeakPolarHBondContact O-CB 3.37Å; P249-S252 PolarHBondContact O-N 3Å
253	R	95.3	Very high	94.3	Very high	20 Å²	20	37.3 Å²	37.3	8%	0.075	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-45.4	174.1	-63.2	173.3	174.2	162.4	-5.3	112.4	V243 L248 P249 P250 A251 I255 I256 I257 C467 S469	V243-R253 HydrophobicContact CB-CG 4.34Å; V243-R253 HydrophobicContact CG1-CB 4.08Å; V243-R253 HydrophobicContact CG1-CG 3.52Å; V243-R253 HydrophobicContact CG2-CB 4.29Å; V243-R253 HydrophobicContact CG2-CG 4.11Å; L248-R253 HydrophobicContact CB-CG 3.78Å; L248-R253 PolarHBondContact O-NE 2.96Å; L248-R253 PolarHBondContact O-NH2 3.46Å; P249-R253 WeakPolarHBondContact O-CG 3.43Å; P249-R253 PolarHBondContact O-N 3.45Å; P250-R253 WeakPolarHBondContact O-CB 3.44Å; P250-R253 PolarHBondContact O-N 3.02Å; A251-R253 PolarHBondContact O-N 3.32Å; R253-I255 PolarHBondContact O-N 3.46Å; R253-I256 PolarHBondContact O-N 3.47Å; R253-I256 VanDerWaalsContact O-N 3.08Å; R253-I257 WeakPolarHBondContact O-CB 3.26Å; R253-I257 VanDerWaalsContact O-CG1 3.26Å; R253-I257 WeakPolarHBondContact O-CG1 3.48Å; R253-I257 PolarHBondContact O-N 3.36Å; R253-C467 HydrophobicContact CB-CB 4.15Å; R253-C467 WeakPolarHBondContact CD-O 3.44Å; R253-C467 PolarHBondContact NH1-O 2.87Å; R253-S469 PolarHBondContact NH1-OG 2.93Å; R253-S469 PolarHBondContact NH2-OG 3.48Å
254	F	95	Very high	94.5	Very high	51 Å²	51	39.2 Å²	39.2	22%	0.224	20%	0.203	C	C	.	.	H	α-helix	trans	-54.1	-39.7	179.6	-85.2	-69.7	0	0	0	112.5	P250 A251 F258 L464 C467	P250-F254 WeakPolarHBondContact O-CD2 3.4Å; P250-F254 PolarHBondContact O-N 3.42Å; P250-F254 VanDerWaalsContact O-N 3.08Å; A251-F254 PolarHBondContact O-N 3.03Å; A251-F254 VanDerWaalsContact O-N 3.12Å; F254-F258 HydrophobicContact CB-CE2 4.37Å; F254-F258 AromaticContact CD1-CE1 3.99Å; F254-F258 HydrophobicContact CD1-CE1 3.99Å; F254-F258 AromaticContact CD1-CE2 3.83Å; F254-F258 HydrophobicContact CD1-CE2 3.83Å; F254-F258 AromaticContact CD1-CZ 3.52Å; F254-F258 HydrophobicContact CD1-CZ 3.52Å; F254-F258 HydrophobicContact CE1-CE1 4.42Å; F254-F258 AromaticContact CE1-CZ 3.98Å; F254-F258 HydrophobicContact CE1-CZ 3.98Å; F254-F258 HydrophobicContact CG-CE2 4.5Å; F254-F258 VanDerWaalsContact O-CB 3.31Å; F254-F258 WeakPolarHBondContact O-CB 3.27Å; F254-F258 WeakPolarHBondContact O-CD2 3.44Å; F254-F258 VanDerWaalsContact O-CG 3.31Å; F254-F258 WeakPolarHBondContact O-CG 3.37Å; F254-F258 PolarHBondContact O-N 2.83Å; F254-L464 HydrophobicContact CE1-CD2 3.98Å; F254-L464 HydrophobicContact CZ-CD2 3.86Å; F254-C467 VanDerWaalsContact CA-SG 3.53Å; F254-C467 HydrophobicContact CD1-CB 3.93Å; F254-C467 WeakPolarHBondContact CD1-SG 3.35Å; F254-C467 HydrophobicContact CD2-CB 3.74Å; F254-C467 HydrophobicContact CE1-CB 3.74Å; F254-C467 HydrophobicContact CE2-CB 3.54Å; F254-C467 HydrophobicContact CG-CB 3.93Å; F254-C467 HydrophobicContact CZ-CB 3.54Å; F254-C467 PolarHBondContact N-SG 3.46Å
255	I	96	Very high	94.8	Very high	58 Å²	58	36.1 Å²	36.1	30%	0.297	19%	0.187	S	C	.	.	H	α-helix	trans	-56.4	-57.1	174.1	-61.8	168.8	0	0	0	110.8	F178 F181 V184 A251 R253 I257 E259	F178-I255 HydrophobicContact CD1-CD1 4.17Å; F178-I255 HydrophobicContact CE1-CD1 3.94Å; F181-I255 HydrophobicContact CE2-CD1 4.39Å; V184-I255 HydrophobicContact CG1-CB 4.16Å; V184-I255 HydrophobicContact CG1-CD1 4.29Å; V184-I255 HydrophobicContact CG1-CG2 3.86Å; A251-I255 PolarHBondContact O-N 3.38Å; R253-I255 PolarHBondContact O-N 3.46Å; I255-I257 VanDerWaalsContact C-N 3.35Å; I255-I257 PolarHBondContact O-N 2.98Å; I255-E259 WeakPolarHBondContact O-CB 3.25Å; I255-E259 VanDerWaalsContact O-CG 3.31Å; I255-E259 WeakPolarHBondContact O-CG 3.28Å; I255-E259 PolarHBondContact O-N 3.49Å
256	I	96.9	Very high	95.1	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-46.6	-177.1	-60.8	178.2	0	0	0	110.4	V184 T187 M191 P239 V243 L248 R253 E259 Q260	V184-I256 HydrophobicContact CB-CD1 4.44Å; V184-I256 HydrophobicContact CB-CG1 4.48Å; V184-I256 HydrophobicContact CG1-CD1 4.4Å; V184-I256 HydrophobicContact CG1-CG1 3.9Å; V184-I256 HydrophobicContact CG2-CD1 4.21Å; T187-I256 HydrophobicContact CG2-CD1 4.18Å; T187-I256 HydrophobicContact CG2-CG2 4.07Å; M191-I256 HydrophobicContact CE-CG2 4.36Å; M191-I256 HydrophobicContact SD-CG2 3.86Å; P239-I256 HydrophobicContact CB-CG2 3.69Å; V243-I256 HydrophobicContact CG2-CB 4.17Å; V243-I256 HydrophobicContact CG2-CD1 3.99Å; V243-I256 HydrophobicContact CG2-CG2 4.13Å; L248-I256 HydrophobicContact CD1-CD1 3.4Å; L248-I256 VanDerWaalsContact CD1-CD1 3.4Å; R253-I256 PolarHBondContact O-N 3.47Å; R253-I256 VanDerWaalsContact O-N 3.08Å; I256-E259 PolarHBondContact O-N 2.93Å; I256-Q260 WeakPolarHBondContact O-CB 3.34Å; I256-Q260 PolarHBondContact O-N 2.86Å
257	I	97.1	Very high	95.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.4	-37.9	-172.1	-65	-58.7	0	0	0	111.9	V243 R253 I255 Q260 I261 A463 V466	V243-I257 HydrophobicContact CG2-CD1 4.07Å; V243-I257 HydrophobicContact CG2-CG1 4.26Å; R253-I257 WeakPolarHBondContact O-CB 3.26Å; R253-I257 VanDerWaalsContact O-CG1 3.26Å; R253-I257 WeakPolarHBondContact O-CG1 3.48Å; R253-I257 PolarHBondContact O-N 3.36Å; I255-I257 VanDerWaalsContact C-N 3.35Å; I255-I257 PolarHBondContact O-N 2.98Å; I257-Q260 WeakPolarHBondContact O-CG 3.49Å; I257-Q260 PolarHBondContact O-NE2 3.43Å; I257-I261 HydrophobicContact CG2-CD1 4.47Å; I257-I261 WeakPolarHBondContact O-CD1 3.29Å; I257-I261 WeakPolarHBondContact O-CG1 3.22Å; I257-I261 PolarHBondContact O-N 3.4Å; I257-A463 HydrophobicContact CG2-CB 4.04Å; I257-V466 HydrophobicContact CD1-CB 4.21Å; I257-V466 HydrophobicContact CD1-CG1 3.45Å; I257-V466 VanDerWaalsContact CD1-CG1 3.45Å; I257-V466 HydrophobicContact CG1-CB 4.42Å; I257-V466 HydrophobicContact CG1-CG1 3.89Å
258	F	96.5	Very high	95.7	Very high	112 Å²	112	26.6 Å²	26.6	49%	0.491	13%	0.131	S	C	.	.	H	α-helix	trans	-71.1	-39.9	172.7	-68.7	-21.5	0	0	0	112.3	F254 Q260 I261 R262 A463	F254-F258 HydrophobicContact CB-CE2 4.37Å; F254-F258 AromaticContact CD1-CE1 3.99Å; F254-F258 HydrophobicContact CD1-CE1 3.99Å; F254-F258 AromaticContact CD1-CE2 3.83Å; F254-F258 HydrophobicContact CD1-CE2 3.83Å; F254-F258 AromaticContact CD1-CZ 3.52Å; F254-F258 HydrophobicContact CD1-CZ 3.52Å; F254-F258 HydrophobicContact CE1-CE1 4.42Å; F254-F258 AromaticContact CE1-CZ 3.98Å; F254-F258 HydrophobicContact CE1-CZ 3.98Å; F254-F258 HydrophobicContact CG-CE2 4.5Å; F254-F258 VanDerWaalsContact O-CB 3.31Å; F254-F258 WeakPolarHBondContact O-CB 3.27Å; F254-F258 WeakPolarHBondContact O-CD2 3.44Å; F254-F258 VanDerWaalsContact O-CG 3.31Å; F254-F258 WeakPolarHBondContact O-CG 3.37Å; F254-F258 PolarHBondContact O-N 2.83Å; F258-Q260 VanDerWaalsContact C-N 3.32Å; F258-Q260 PolarHBondContact O-N 2.98Å; F258-I261 PolarHBondContact O-N 3.47Å; F258-R262 WeakPolarHBondContact O-CB 3.15Å; F258-R262 PolarHBondContact O-N 2.93Å; F258-A463 HydrophobicContact CD1-CB 4.45Å; F258-A463 HydrophobicContact CE1-CB 3.99Å
259	E	97	Very high	95.9	Very high	41 Å²	41	26.5 Å²	26.5	19%	0.192	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-36.2	174.9	-75.7	-68.4	104.2	0	0	112.1	W188 M191 I255 I256 I261 R262 F263	W188-E259 PolarHBondContact NE1-OE2 2.87Å; M191-E259 HydrophobicContact CE-CB 4.39Å; I255-E259 WeakPolarHBondContact O-CB 3.25Å; I255-E259 VanDerWaalsContact O-CG 3.31Å; I255-E259 WeakPolarHBondContact O-CG 3.28Å; I255-E259 PolarHBondContact O-N 3.49Å; I256-E259 PolarHBondContact O-N 2.93Å; E259-I261 PolarHBondContact O-N 2.99Å; E259-R262 PolarHBondContact O-N 2.97Å; E259-R262 WeakPolarHBondContact OE1-CD 3.42Å; E259-R262 IonicContact OE1-CZ 2.87Å; E259-R262 IonicContact OE1-NE 3.57Å; E259-R262 PolarHBondContact OE1-NE 3.43Å; E259-R262 IonicContact OE1-NH2 3.67Å; E259-R262 IonicContact OE2-CZ 3.85Å; E259-R262 IonicContact OE2-NE 3.94Å; E259-R262 PolarHBondContact OE2-NE 3.24Å; E259-R262 IonicContact OE2-NH2 2.69Å; E259-R262 PolarHBondContact OE2-NH2 3.47Å; E259-F263 HydrophobicContact CB-CE2 4.36Å; E259-F263 WeakPolarHBondContact O-CB 3.31Å; E259-F263 WeakPolarHBondContact O-CD2 3.15Å; E259-F263 WeakPolarHBondContact O-CG 3.31Å; E259-F263 PolarHBondContact O-N 2.86Å
260	Q	96.9	Very high	96	Very high	3 Å²	3	25.6 Å²	25.6	1%	0.014	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-44.7	173.8	110.5	-162.4	-65	0	0	111.2	M191 L235 P239 I256 I257 F258 R262 F263 V264 Y462	M191-Q260 VanDerWaalsContact CE-CA 3.44Å; M191-Q260 HydrophobicContact CE-CB 3.45Å; M191-Q260 VanDerWaalsContact CE-CB 3.45Å; L235-Q260 PolarHBondContact O-OE1 3.34Å; P239-Q260 HydrophobicContact CB-CB 4.27Å; P239-Q260 HydrophobicContact CG-CB 4.14Å; I256-Q260 WeakPolarHBondContact O-CB 3.34Å; I256-Q260 PolarHBondContact O-N 2.86Å; I257-Q260 WeakPolarHBondContact O-CG 3.49Å; I257-Q260 PolarHBondContact O-NE2 3.43Å; F258-Q260 VanDerWaalsContact C-N 3.32Å; F258-Q260 PolarHBondContact O-N 2.98Å; Q260-R262 VanDerWaalsContact C-N 3.34Å; Q260-R262 PolarHBondContact O-N 2.91Å; Q260-F263 PolarHBondContact O-N 3.4Å; Q260-V264 WeakPolarHBondContact O-CG2 3.35Å; Q260-V264 PolarHBondContact O-N 2.87Å; Q260-Y462 VanDerWaalsContact CD-OH 3.27Å; Q260-Y462 VanDerWaalsContact NE2-CE1 3.3Å; Q260-Y462 PolarHBondContact NE2-OH 2.98Å; Q260-Y462 PolarHBondContact OE1-OH 3.49Å; Q260-Y462 VanDerWaalsContact OE1-OH 3.08Å
261	I	97.3	Very high	96.3	Very high	33 Å²	33	25.9 Å²	25.9	17%	0.169	13%	0.126	C	C	.	.	H	α-helix	trans	-65.1	-44.6	-178.7	-69.7	162.5	0	0	0	108.5	I257 F258 E259 F263 V264 M265 V459 Y462 A463	I257-I261 HydrophobicContact CG2-CD1 4.47Å; I257-I261 WeakPolarHBondContact O-CD1 3.29Å; I257-I261 WeakPolarHBondContact O-CG1 3.22Å; I257-I261 PolarHBondContact O-N 3.4Å; F258-I261 PolarHBondContact O-N 3.47Å; E259-I261 PolarHBondContact O-N 2.99Å; I261-F263 PolarHBondContact O-N 3.07Å; I261-V264 PolarHBondContact O-N 3.17Å; I261-M265 HydrophobicContact CG2-CG 4.39Å; I261-M265 HydrophobicContact CG2-SD 3.73Å; I261-M265 WeakPolarHBondContact O-CB 3.25Å; I261-M265 WeakPolarHBondContact O-CG 3.1Å; I261-M265 PolarHBondContact O-N 3.43Å; I261-V459 HydrophobicContact CD1-CG1 3.86Å; I261-V459 HydrophobicContact CG1-CG1 4.28Å; I261-V459 HydrophobicContact CG2-CG1 4.17Å; I261-Y462 HydrophobicContact CD1-CD1 4.46Å; I261-A463 HydrophobicContact CD1-CB 4.17Å
262	R	97.6	Very high	96.4	Very high	52 Å²	52	29.1 Å²	29.1	20%	0.196	13%	0.133	C	C	.	.	H	α-helix	trans	-57.4	-46.1	174.7	-168.3	-177.5	69	74.8	-4.7	112.1	F258 E259 Q260 K266 L301 L306	F258-R262 WeakPolarHBondContact O-CB 3.15Å; F258-R262 PolarHBondContact O-N 2.93Å; E259-R262 PolarHBondContact O-N 2.97Å; E259-R262 WeakPolarHBondContact OE1-CD 3.42Å; E259-R262 IonicContact OE1-CZ 2.87Å; E259-R262 IonicContact OE1-NE 3.57Å; E259-R262 PolarHBondContact OE1-NE 3.43Å; E259-R262 IonicContact OE1-NH2 3.67Å; E259-R262 IonicContact OE2-CZ 3.85Å; E259-R262 IonicContact OE2-NE 3.94Å; E259-R262 PolarHBondContact OE2-NE 3.24Å; E259-R262 IonicContact OE2-NH2 2.69Å; E259-R262 PolarHBondContact OE2-NH2 3.47Å; Q260-R262 VanDerWaalsContact C-N 3.34Å; Q260-R262 PolarHBondContact O-N 2.91Å; R262-K266 WeakPolarHBondContact O-CB 3.43Å; R262-K266 WeakPolarHBondContact O-CG 3.46Å; R262-K266 PolarHBondContact O-N 3Å; R262-L301 PolarHBondContact NH1-O 2.99Å; R262-L306 HydrophobicContact CG-CD2 4.29Å
263	F	97.7	Very high	96.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.7	-42.5	179	-76.3	-49.3	0	0	0	112.8	W188 M191 F192 T195 L235 E259 Q260 I261 K266 A267	W188-F263 AromaticContact NE1-CE2 3.98Å; M191-F263 HydrophobicContact CB-CD2 4.17Å; M191-F263 HydrophobicContact CB-CE2 4.17Å; M191-F263 HydrophobicContact CE-CD2 4.15Å; F192-F263 HydrophobicContact CB-CE2 4.4Å; F192-F263 HydrophobicContact CB-CZ 3.85Å; F192-F263 AromaticContact CD2-CE1 3.89Å; F192-F263 HydrophobicContact CD2-CE1 3.89Å; F192-F263 AromaticContact CD2-CZ 3.84Å; F192-F263 HydrophobicContact CD2-CZ 3.84Å; F192-F263 HydrophobicContact CG-CZ 4.35Å; T195-F263 HydrophobicContact CG2-CB 3.97Å; T195-F263 HydrophobicContact CG2-CD1 3.76Å; T195-F263 HydrophobicContact CG2-CG 4.14Å; L235-F263 HydrophobicContact CD1-CB 4.46Å; E259-F263 HydrophobicContact CB-CE2 4.36Å; E259-F263 WeakPolarHBondContact O-CB 3.31Å; E259-F263 WeakPolarHBondContact O-CD2 3.15Å; E259-F263 WeakPolarHBondContact O-CG 3.31Å; E259-F263 PolarHBondContact O-N 2.86Å; Q260-F263 PolarHBondContact O-N 3.4Å; I261-F263 PolarHBondContact O-N 3.07Å; F263-K266 PolarHBondContact O-N 3.24Å; F263-A267 VanDerWaalsContact O-CB 3.29Å; F263-A267 WeakPolarHBondContact O-CB 3.46Å; F263-A267 PolarHBondContact O-N 3.39Å
264	V	97.6	Very high	96.3	Very high	40 Å²	40	30 Å²	30	24%	0.242	14%	0.138	C	C	.	.	H	α-helix	trans	-60.2	-47	174.8	170.8	0	0	0	0	111	Q231 L235 Q260 I261 K266 A267 H268	Q231-V264 PolarHBondContact NE2-O 3.32Å; L235-V264 HydrophobicContact CB-CG2 3.62Å; L235-V264 HydrophobicContact CD1-CG2 4.01Å; L235-V264 HydrophobicContact CG-CG2 4.49Å; Q260-V264 WeakPolarHBondContact O-CG2 3.35Å; Q260-V264 PolarHBondContact O-N 2.87Å; I261-V264 PolarHBondContact O-N 3.17Å; V264-K266 PolarHBondContact O-N 2.87Å; V264-A267 PolarHBondContact O-N 2.93Å; V264-H268 WeakPolarHBondContact O-CB 3.5Å; V264-H268 PolarHBondContact O-N 3.42Å
265	M	97.4	Very high	96.1	Very high	20 Å²	20	29.3 Å²	29.3	10%	0.099	14%	0.138	C	C	.	.	H	α-helix	trans	-61.1	-43.5	178.1	-69.9	173.2	94.3	0	0	112	I261 S269 L306 V424 W427	I261-M265 HydrophobicContact CG2-CG 4.39Å; I261-M265 HydrophobicContact CG2-SD 3.73Å; I261-M265 WeakPolarHBondContact O-CB 3.25Å; I261-M265 WeakPolarHBondContact O-CG 3.1Å; I261-M265 PolarHBondContact O-N 3.43Å; M265-S269 PolarHBondContact O-N 2.86Å; M265-S269 PolarHBondContact O-OG 2.98Å; M265-L306 HydrophobicContact CB-CD1 4.43Å; M265-L306 HydrophobicContact CB-CD2 4.14Å; M265-L306 HydrophobicContact CE-CD1 3.62Å; M265-L306 HydrophobicContact SD-CD1 3.88Å; M265-V424 HydrophobicContact CE-CG1 4.23Å; M265-W427 HydrophobicContact CB-CD2 4.29Å; M265-W427 HydrophobicContact CB-CZ2 4.08Å; M265-W427 HydrophobicContact CE-CB 4.02Å; M265-W427 HydrophobicContact CE-CD2 3.44Å; M265-W427 VanDerWaalsContact CE-CD2 3.44Å; M265-W427 HydrophobicContact CE-CE3 3.36Å; M265-W427 HydrophobicContact CE-CG 3.73Å; M265-W427 HydrophobicContact CE-CZ3 4.02Å; M265-W427 HydrophobicContact CG-CD2 4.14Å; M265-W427 HydrophobicContact CG-CE3 4.41Å; M265-W427 HydrophobicContact CG-CH2 4.22Å; M265-W427 HydrophobicContact CG-CZ2 3.93Å; M265-W427 HydrophobicContact CG-CZ3 4.44Å; M265-W427 PolarHBondContact O-NE1 3.47Å
266	K	97.3	Very high	95.9	Very high	5 Å²	5	29.1 Å²	29.1	2%	0.022	14%	0.141	C	C	.	.	H	α-helix	trans	-70.1	-40	177.3	-73	-165.8	178.9	-164.6	0	113.4	R262 F263 V264 H268 S269 F270 F300 L301 A303 T305 L306	R262-K266 WeakPolarHBondContact O-CB 3.43Å; R262-K266 WeakPolarHBondContact O-CG 3.46Å; R262-K266 PolarHBondContact O-N 3Å; F263-K266 PolarHBondContact O-N 3.24Å; V264-K266 PolarHBondContact O-N 2.87Å; K266-H268 VanDerWaalsContact C-N 3.32Å; K266-H268 PolarHBondContact O-N 2.88Å; K266-S269 PolarHBondContact O-OG 3.13Å; K266-F270 WeakPolarHBondContact O-CB 3.39Å; K266-F270 PolarHBondContact O-N 3.18Å; K266-F300 HydrophobicContact CB-CE1 3.7Å; K266-F300 HydrophobicContact CB-CZ 3.95Å; K266-F300 HydrophobicContact CD-CE1 4.18Å; K266-F300 HydrophobicContact CD-CE2 4.49Å; K266-F300 HydrophobicContact CD-CZ 4.12Å; K266-F300 HydrophobicContact CG-CE1 3.93Å; K266-F300 HydrophobicContact CG-CE2 4.45Å; K266-F300 HydrophobicContact CG-CZ 3.72Å; K266-F300 PolarHBondContact NZ-O 3.13Å; K266-F300 WeakPolarHBondContact O-CE1 3.47Å; K266-L301 HydrophobicContact CB-CD2 4.34Å; K266-L301 HydrophobicContact CD-CD2 4.45Å; K266-L301 VanDerWaalsContact NZ-C 3.32Å; K266-L301 PolarHBondContact NZ-O 3.11Å; K266-A303 PolarHBondContact NZ-O 3.17Å; K266-T305 WeakPolarHBondContact CE-O 3.45Å; K266-L306 HydrophobicContact CD-CD2 4.4Å; K266-L306 HydrophobicContact CG-CD2 3.65Å
267	A	97	Very high	95.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-43	174.8	0	0	0	0	0	110.7	T195 P199 F227 F263 V264 V271	T195-A267 HydrophobicContact CG2-CB 4.34Å; P199-A267 HydrophobicContact CG-CB 4.15Å; F227-A267 HydrophobicContact CE2-CB 4.34Å; F227-A267 HydrophobicContact CZ-CB 4.29Å; F227-A267 WeakPolarHBondContact CZ-O 3.41Å; F263-A267 VanDerWaalsContact O-CB 3.29Å; F263-A267 WeakPolarHBondContact O-CB 3.46Å; F263-A267 PolarHBondContact O-N 3.39Å; V264-A267 PolarHBondContact O-N 2.93Å; A267-V271 PolarHBondContact O-N 3.44Å
268	H	96.6	Very high	95.2	Very high	56 Å²	56	32.3 Å²	32.3	26%	0.259	15%	0.153	S	C	.	.	H	α-helix	trans	-62.3	-50.1	177.4	-176.8	88	0	0	0	112.1	V264 K266 F270 V271 R272 W427	V264-H268 WeakPolarHBondContact O-CB 3.5Å; V264-H268 PolarHBondContact O-N 3.42Å; K266-H268 VanDerWaalsContact C-N 3.32Å; K266-H268 PolarHBondContact O-N 2.88Å; H268-F270 PolarHBondContact O-N 3.48Å; H268-V271 PolarHBondContact O-N 2.81Å; H268-R272 WeakPolarHBondContact O-CB 3.48Å; H268-R272 PolarHBondContact O-N 2.98Å; H268-W427 HydrophobicContact CB-CZ2 4.09Å; H268-W427 AromaticContact CD2-CZ2 3.83Å
269	S	96.1	Very high	94.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67.4	-35.1	-177.7	59.1	0	0	0	0	113.1	M265 K266 R272 E273 F300 L306	M265-S269 PolarHBondContact O-N 2.86Å; M265-S269 PolarHBondContact O-OG 2.98Å; K266-S269 PolarHBondContact O-OG 3.13Å; S269-R272 PolarHBondContact O-N 3.24Å; S269-E273 WeakPolarHBondContact O-CB 3.45Å; S269-E273 VanDerWaalsContact O-CG 3.3Å; S269-E273 WeakPolarHBondContact O-CG 3.37Å; S269-E273 PolarHBondContact O-N 3.32Å; S269-F300 WeakPolarHBondContact OG-CZ 3.41Å; S269-L306 WeakPolarHBondContact CB-O 3.27Å; S269-L306 PolarHBondContact OG-O 3.44Å
270	F	96.3	Very high	94.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.9	-47.8	171.8	173.8	-102.4	0	0	0	112.3	Y200 F203 K266 H268 N274 P292 Y297 F300 Y308	Y200-F270 AromaticContact CD2-CZ 3.97Å; Y200-F270 HydrophobicContact CD2-CZ 3.97Å; F203-F270 HydrophobicContact CB-CE1 4.04Å; F203-F270 HydrophobicContact CD1-CE1 4.47Å; F203-F270 HydrophobicContact CD1-CZ 4.43Å; F203-F270 HydrophobicContact CG-CE1 4.2Å; K266-F270 WeakPolarHBondContact O-CB 3.39Å; K266-F270 PolarHBondContact O-N 3.18Å; H268-F270 PolarHBondContact O-N 3.48Å; F270-N274 WeakPolarHBondContact CD2-ND2 3.34Å; F270-N274 PolarHBondContact O-N 2.78Å; F270-N274 PolarHBondContact O-ND2 2.96Å; F270-P292 HydrophobicContact CE2-CB 4.27Å; F270-P292 HydrophobicContact CE2-CG 3.54Å; F270-P292 HydrophobicContact CZ-CG 3.7Å; F270-Y297 HydrophobicContact CB-CD2 4.24Å; F270-Y297 HydrophobicContact CB-CE2 3.66Å; F270-Y297 HydrophobicContact CD1-CD2 4.27Å; F270-Y297 AromaticContact CD1-CE2 3.88Å; F270-Y297 HydrophobicContact CD1-CE2 3.88Å; F270-Y297 AromaticContact CD2-CD2 3.26Å; F270-Y297 HydrophobicContact CD2-CD2 3.26Å; F270-Y297 AromaticContact CD2-CE2 3.56Å; F270-Y297 HydrophobicContact CD2-CE2 3.56Å; F270-Y297 HydrophobicContact CD2-CG 4.14Å; F270-Y297 HydrophobicContact CE1-CD2 4.49Å; F270-Y297 HydrophobicContact CE1-CE2 4.42Å; F270-Y297 AromaticContact CE2-CD2 3.53Å; F270-Y297 HydrophobicContact CE2-CD2 3.53Å; F270-Y297 HydrophobicContact CE2-CE2 4.13Å; F270-Y297 AromaticContact CE2-CG 3.93Å; F270-Y297 HydrophobicContact CE2-CG 3.93Å; F270-Y297 AromaticContact CG-CD2 3.66Å; F270-Y297 HydrophobicContact CG-CD2 3.66Å; F270-Y297 AromaticContact CG-CE2 3.4Å; F270-Y297 HydrophobicContact CG-CE2 3.4Å; F270-Y297 HydrophobicContact CZ-CD2 4.16Å; F270-Y297 HydrophobicContact CZ-CG 4.3Å; F270-F300 HydrophobicContact CB-CE1 4.47Å; F270-Y308 HydrophobicContact CD2-CD1 4.32Å; F270-Y308 AromaticContact CD2-CD2 3.84Å; F270-Y308 HydrophobicContact CD2-CD2 3.84Å; F270-Y308 HydrophobicContact CD2-CE1 4.44Å; F270-Y308 AromaticContact CD2-CE2 3.95Å; F270-Y308 HydrophobicContact CD2-CE2 3.95Å; F270-Y308 HydrophobicContact CD2-CG 4.05Å; F270-Y308 HydrophobicContact CE2-CE2 4.26Å
271	V	95.6	Very high	93.8	Very high	29 Å²	29	33.4 Å²	33.4	18%	0.176	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-44.4	177.7	175.8	0	0	0	0	110.8	F227 A267 H268 E273 N274 V275	F227-V271 HydrophobicContact CD1-CG2 4.46Å; F227-V271 HydrophobicContact CD2-CG2 4.17Å; F227-V271 HydrophobicContact CE1-CB 4.16Å; F227-V271 HydrophobicContact CE1-CG1 4.39Å; F227-V271 HydrophobicContact CE1-CG2 3.97Å; F227-V271 HydrophobicContact CE2-CG2 3.65Å; F227-V271 HydrophobicContact CZ-CB 4.09Å; F227-V271 HydrophobicContact CZ-CG2 3.52Å; A267-V271 PolarHBondContact O-N 3.44Å; H268-V271 PolarHBondContact O-N 2.81Å; V271-E273 PolarHBondContact O-N 3.21Å; V271-N274 PolarHBondContact O-N 2.9Å; V271-V275 HydrophobicContact CG1-CG2 3.81Å; V271-V275 WeakPolarHBondContact O-CB 3.47Å; V271-V275 VanDerWaalsContact O-CG2 3.27Å; V271-V275 WeakPolarHBondContact O-CG2 3.27Å; V271-V275 PolarHBondContact O-N 3.45Å
272	R	94.4	Very high	93.3	Very high	89 Å²	89	33.4 Å²	33.4	34%	0.336	17%	0.172	S	C	.	.	H	α-helix	trans	-65.4	-34.6	-175.2	-172.2	57.1	176.1	173.9	7.8	113.7	H268 S269 P276 Y431 D435	H268-R272 WeakPolarHBondContact O-CB 3.48Å; H268-R272 PolarHBondContact O-N 2.98Å; S269-R272 PolarHBondContact O-N 3.24Å; R272-P276 WeakPolarHBondContact O-CD 3.37Å; R272-Y431 HydrophobicContact CB-CD1 4.11Å; R272-Y431 HydrophobicContact CB-CE1 4.27Å; R272-Y431 HydrophobicContact CG-CD1 3.6Å; R272-Y431 HydrophobicContact CG-CE1 4.02Å; R272-D435 IonicContact CZ-OD1 3.98Å; R272-D435 IonicContact CZ-OD2 2.96Å; R272-D435 VanDerWaalsContact CZ-OD2 3.29Å; R272-D435 IonicContact NE-OD1 2.65Å; R272-D435 IonicContact NE-OD2 2.76Å; R272-D435 PolarHBondContact NE-OD2 2.76Å; R272-D435 IonicContact NH2-OD1 3.19Å; R272-D435 PolarHBondContact NH2-OD1 2.88Å; R272-D435 IonicContact NH2-OD2 2.8Å; R272-D435 PolarHBondContact NH2-OD2 2.87Å
273	E	92.6	Very high	92.7	Very high	38 Å²	38	39.5 Å²	39.5	18%	0.178	20%	0.2	C	C	.	.	H	α-helix	trans	-75.4	-37.5	175.9	-70.6	-77.1	149.4	0	0	112.9	S269 V271 Y308 R309 Y431	S269-E273 WeakPolarHBondContact O-CB 3.45Å; S269-E273 VanDerWaalsContact O-CG 3.3Å; S269-E273 WeakPolarHBondContact O-CG 3.37Å; S269-E273 PolarHBondContact O-N 3.32Å; V271-E273 PolarHBondContact O-N 3.21Å; E273-Y308 HydrophobicContact CB-CD1 4.07Å; E273-Y308 WeakPolarHBondContact CG-O 3.3Å; E273-R309 IonicContact OE1-NH1 2.79Å; E273-R309 IonicContact OE2-CZ 3.77Å; E273-R309 IonicContact OE2-NH1 3.29Å; E273-R309 PolarHBondContact OE2-NH1 2.89Å; E273-Y431 VanDerWaalsContact CD-OH 3.31Å; E273-Y431 HydrophobicContact CG-CE1 4.17Å; E273-Y431 WeakPolarHBondContact CG-OH 3.45Å; E273-Y431 WeakPolarHBondContact OE1-CE1 3.41Å; E273-Y431 PolarHBondContact OE1-OH 2.91Å
274	N	92.9	Very high	92.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-87.6	-26	-173.3	-68.3	-65.1	0	0	0	113.8	F203 F270 V271 R277 V278 Y308	F203-N274 HydrophobicContact CD2-CB 4.47Å; F203-N274 HydrophobicContact CE1-CB 4.02Å; F203-N274 HydrophobicContact CE2-CB 3.61Å; F203-N274 HydrophobicContact CZ-CB 3.36Å; F270-N274 WeakPolarHBondContact CD2-ND2 3.34Å; F270-N274 PolarHBondContact O-N 2.78Å; F270-N274 PolarHBondContact O-ND2 2.96Å; V271-N274 PolarHBondContact O-N 2.9Å; N274-R277 WeakPolarHBondContact O-CB 3.42Å; N274-R277 PolarHBondContact O-N 3.33Å; N274-R277 PolarHBondContact OD1-NH1 3.26Å; N274-V278 PolarHBondContact O-N 3.39Å; N274-Y308 VanDerWaalsContact ND2-CD1 3.31Å; N274-Y308 WeakPolarHBondContact ND2-CD1 3.45Å; N274-Y308 WeakPolarHBondContact ND2-CE1 3.46Å
275	V	92.5	Very high	91.2	Very high	37 Å²	37	53.5 Å²	53.5	22%	0.224	26%	0.26	C	S	.	.	H	α-helix	trans	-58.6	-52.1	177.3	162.9	0	0	0	0	112.8	F203 W206 V271 R277 V278 L279	F203-V275 HydrophobicContact CE2-CG2 4.13Å; W206-V275 HydrophobicContact CE3-CG2 4.41Å; W206-V275 HydrophobicContact CH2-CB 4.1Å; W206-V275 HydrophobicContact CH2-CG1 3.94Å; W206-V275 HydrophobicContact CH2-CG2 3.86Å; W206-V275 HydrophobicContact CZ2-CG1 4.35Å; W206-V275 HydrophobicContact CZ2-CG2 4.47Å; W206-V275 HydrophobicContact CZ3-CB 4.38Å; W206-V275 HydrophobicContact CZ3-CG2 3.83Å; V271-V275 HydrophobicContact CG1-CG2 3.81Å; V271-V275 WeakPolarHBondContact O-CB 3.47Å; V271-V275 VanDerWaalsContact O-CG2 3.27Å; V271-V275 WeakPolarHBondContact O-CG2 3.27Å; V271-V275 PolarHBondContact O-N 3.45Å; V275-R277 PolarHBondContact O-N 3.03Å; V275-V278 PolarHBondContact O-N 3.03Å; V275-L279 HydrophobicContact CG1-CD1 3.82Å; V275-L279 HydrophobicContact CG1-CG 4.33Å; V275-L279 WeakPolarHBondContact O-CG 3.49Å; V275-L279 PolarHBondContact O-N 2.83Å
276	P	90.9	Very high	90.1	Very high	55 Å²	55	54.8 Å²	54.8	36%	0.357	27%	0.271	S	S	.	.	H	α-helix	trans	-58.9	-32.7	178.8	-24.7	34.7	0	0	0	113.3	R272 L279 N280	R272-P276 WeakPolarHBondContact O-CD 3.37Å; P276-L279 PolarHBondContact O-N 3.44Å; P276-N280 WeakPolarHBondContact O-CB 3.15Å; P276-N280 PolarHBondContact O-N 3.38Å; P276-N280 PolarHBondContact O-ND2 3.36Å
277	R	88.8	Confident	88.7	Confident	68 Å²	68	60.6 Å²	60.6	26%	0.257	31%	0.312	S	S	.	.	H	α-helix	trans	-64.9	-49.2	178.9	-165.8	-168.4	-61.9	178.4	-10.7	111.6	N274 V275 L279 N280 S281 P290 D310	N274-R277 WeakPolarHBondContact O-CB 3.42Å; N274-R277 PolarHBondContact O-N 3.33Å; N274-R277 PolarHBondContact OD1-NH1 3.26Å; V275-R277 PolarHBondContact O-N 3.03Å; R277-L279 VanDerWaalsContact C-N 3.33Å; R277-L279 PolarHBondContact O-N 2.9Å; R277-N280 PolarHBondContact O-N 2.9Å; R277-S281 PolarHBondContact O-N 3.44Å; R277-S281 PolarHBondContact O-OG 2.95Å; R277-P290 HydrophobicContact CG-CB 4.15Å; R277-P290 HydrophobicContact CG-CG 3.59Å; R277-D310 IonicContact CZ-OD1 2.7Å; R277-D310 IonicContact CZ-OD2 3.97Å; R277-D310 IonicContact NH1-OD1 3.76Å; R277-D310 PolarHBondContact NH1-OD1 3.02Å; R277-D310 IonicContact NH1-OD2 3.99Å; R277-D310 PolarHBondContact NH1-OD2 3.02Å; R277-D310 IonicContact NH2-OD1 3.29Å; R277-D310 IonicContact NH2-OD2 2.68Å; R277-D310 PolarHBondContact NH2-OD2 2.88Å
278	V	89.4	Confident	87.8	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.006	34%	0.344	C	S	.	.	H	α-helix	trans	-63	-40.7	176.4	173.2	0	0	0	0	111.1	F203 W206 A207 N274 V275 A282 V289	F203-V278 HydrophobicContact CE1-CG2 4.47Å; F203-V278 HydrophobicContact CZ-CG2 3.75Å; W206-V278 HydrophobicContact CH2-CB 3.85Å; W206-V278 HydrophobicContact CH2-CG1 3.84Å; W206-V278 HydrophobicContact CZ3-CB 3.76Å; W206-V278 HydrophobicContact CZ3-CG1 3.82Å; W206-V278 HydrophobicContact CZ3-CG2 4.03Å; A207-V278 HydrophobicContact CB-CG1 4.21Å; A207-V278 HydrophobicContact CB-CG2 4.06Å; N274-V278 PolarHBondContact O-N 3.39Å; V275-V278 PolarHBondContact O-N 3.03Å; V278-A282 VanDerWaalsContact O-CB 3.28Å; V278-A282 WeakPolarHBondContact O-CB 3.34Å; V278-A282 PolarHBondContact O-N 3.48Å; V278-V289 HydrophobicContact CG1-CG1 4.14Å; V278-V289 HydrophobicContact CG2-CG1 4.06Å
279	L	89	Confident	87	Confident	64 Å²	64	65.5 Å²	65.5	34%	0.335	35%	0.346	S	S	.	.	H	α-helix	trans	-63.1	-42.4	177.2	-66.6	175.5	0	0	0	112.5	W206 Y210 V275 P276 R277 K283	W206-L279 HydrophobicContact CH2-CG 4.45Å; W206-L279 HydrophobicContact CZ2-CD2 4.29Å; Y210-L279 HydrophobicContact CD2-CD2 4.49Å; Y210-L279 HydrophobicContact CE1-CD2 4.06Å; Y210-L279 HydrophobicContact CE2-CD2 3.67Å; Y210-L279 VanDerWaalsContact CZ-CD2 3.43Å; Y210-L279 WeakPolarHBondContact OH-CD2 3.17Å; V275-L279 HydrophobicContact CG1-CD1 3.82Å; V275-L279 HydrophobicContact CG1-CG 4.33Å; V275-L279 WeakPolarHBondContact O-CG 3.49Å; V275-L279 PolarHBondContact O-N 2.83Å; P276-L279 PolarHBondContact O-N 3.44Å; R277-L279 VanDerWaalsContact C-N 3.33Å; R277-L279 PolarHBondContact O-N 2.9Å; L279-K283 WeakPolarHBondContact O-CB 3.17Å; L279-K283 PolarHBondContact O-N 3.04Å
280	N	87.9	Confident	86.5	Confident	94 Å²	94	67.4 Å²	67.4	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-66.8	-47.3	177.3	-71.3	-12.3	0	0	0	111.6	P276 R277 A282 K283 E284	P276-N280 WeakPolarHBondContact O-CB 3.15Å; P276-N280 PolarHBondContact O-N 3.38Å; P276-N280 PolarHBondContact O-ND2 3.36Å; R277-N280 PolarHBondContact O-N 2.9Å; N280-A282 VanDerWaalsContact C-N 3.32Å; N280-A282 PolarHBondContact O-N 2.92Å; N280-K283 WeakPolarHBondContact O-CA 3.2Å; N280-K283 WeakPolarHBondContact O-CB 3.21Å; N280-K283 PolarHBondContact O-N 3.43Å; N280-K283 VanDerWaalsContact O-N 3.08Å; N280-E284 WeakPolarHBondContact O-CG 3.36Å; N280-E284 PolarHBondContact O-N 3.38Å
281	S	86.1	Confident	86.1	Confident	21 Å²	21	69.7 Å²	69.7	15%	0.147	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-37.6	176.3	-67.1	0	0	0	0	113.1	R277 E284 K285 S286 P290	R277-S281 PolarHBondContact O-N 3.44Å; R277-S281 PolarHBondContact O-OG 2.95Å; S281-E284 CarbonylContact O-C 3.55Å; S281-E284 PolarHBondContact O-N 3.48Å; S281-K285 PolarHBondContact O-N 2.87Å; S281-S286 WeakPolarHBondContact CB-OG 3.34Å; S281-S286 PolarHBondContact O-N 3.34Å; S281-S286 VanDerWaalsContact O-N 3.12Å; S281-S286 PolarHBondContact O-OG 2.97Å; S281-P290 WeakPolarHBondContact OG-CG 3.44Å
282	A	85.4	Confident	85.9	Confident	33 Å²	33	68.4 Å²	68.4	27%	0.273	36%	0.362	S	S	.	.	H	α-helix	trans	-66.2	-36.1	173.3	0	0	0	0	0	112.5	Y210 V278 N280 K285	Y210-A282 HydrophobicContact CD1-CB 3.89Å; Y210-A282 HydrophobicContact CE1-CB 3.64Å; V278-A282 VanDerWaalsContact O-CB 3.28Å; V278-A282 WeakPolarHBondContact O-CB 3.34Å; V278-A282 PolarHBondContact O-N 3.48Å; N280-A282 VanDerWaalsContact C-N 3.32Å; N280-A282 PolarHBondContact O-N 2.92Å; A282-K285 PolarHBondContact O-N 3.16Å
283	K	85.2	Confident	85.9	Confident	179 Å²	179	67.5 Å²	67.5	78%	0.778	37%	0.367	S	S	*	.	H	α-helix	trans	-66.6	-38	173.1	-175.7	-174.8	176	-171.7	0	112	L279 N280 K285	L279-K283 WeakPolarHBondContact O-CB 3.17Å; L279-K283 PolarHBondContact O-N 3.04Å; N280-K283 WeakPolarHBondContact O-CA 3.2Å; N280-K283 WeakPolarHBondContact O-CB 3.21Å; N280-K283 PolarHBondContact O-N 3.43Å; N280-K283 VanDerWaalsContact O-N 3.08Å; K283-K285 PolarHBondContact O-N 2.93Å
284	E	85.4	Confident	86	Confident	147 Å²	147	68.4 Å²	68.4	69%	0.687	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-4.9	175.3	-70.5	169.8	-175.7	0	0	113.4	N280 S281 S286	N280-E284 WeakPolarHBondContact O-CG 3.36Å; N280-E284 PolarHBondContact O-N 3.38Å; S281-E284 CarbonylContact O-C 3.55Å; S281-E284 PolarHBondContact O-N 3.48Å; E284-S286 PolarHBondContact O-N 3.36Å
285	K	78.2	Confident	86.2	Confident	188 Å²	188	74.4 Å²	74.4	82%	0.817	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	30.8	-176.3	-57.6	-178.6	179.3	178.7	0	113.5	S281 A282 K283	S281-K285 PolarHBondContact O-N 2.87Å; A282-K285 PolarHBondContact O-N 3.16Å; K283-K285 PolarHBondContact O-N 2.93Å
286	S	75.6	Confident	86.3	Confident	47 Å²	47	75.6 Å²	75.6	33%	0.329	41%	0.41	S	S	.	.			trans	-67.1	136.8	177.7	66.5	0	0	0	0	110.8	S281 E284 T288	S281-S286 WeakPolarHBondContact CB-OG 3.34Å; S281-S286 PolarHBondContact O-N 3.34Å; S281-S286 VanDerWaalsContact O-N 3.12Å; S281-S286 PolarHBondContact O-OG 2.97Å; E284-S286 PolarHBondContact O-N 3.36Å; S286-T288 PolarHBondContact O-N 3.45Å; S286-T288 PolarHBondContact OG-O 2.96Å
287	S	67.1	Low	86.5	Confident	127 Å²	127	73 Å²	73	89%	0.888	39%	0.393	S	S	*	.	S	Bend	trans	-67.5	-24.4	-179.2	-177.9	0	0	0	0	112.8
288	T	77.4	Confident	86.9	Confident	111 Å²	111	72.5 Å²	72.5	68%	0.681	40%	0.395	S	S	*	.	S	Bend	trans	-97.7	112.7	-180	47.5	0	0	0	0	110.8	S286 P290	S286-T288 PolarHBondContact O-N 3.45Å; S286-T288 PolarHBondContact OG-O 2.96Å; T288-P290 WeakPolarHBondContact O-CD 3.49Å
289	V	80.6	Confident	87.3	Confident	47 Å²	47	74.4 Å²	74.4	29%	0.285	40%	0.402	S	S	.	.			trans	-76.4	121.7	171.1	-172.8	0	0	0	0	108.3	A207 V278 I291	A207-V289 HydrophobicContact CB-CG1 4.1Å; V278-V289 HydrophobicContact CG1-CG1 4.14Å; V278-V289 HydrophobicContact CG2-CG1 4.06Å; V289-I291 VanDerWaalsContact C-N 3.29Å; V289-I291 HydrophobicContact CB-CD1 4.4Å; V289-I291 HydrophobicContact CB-CG1 4.24Å; V289-I291 HydrophobicContact CG1-CD1 4.19Å; V289-I291 HydrophobicContact CG1-CG1 3.83Å; V289-I291 PolarHBondContact O-N 3.22Å
290	P	84.6	Confident	87.7	Confident	40 Å²	40	71.4 Å²	71.4	26%	0.26	39%	0.386	S	S	.	.			trans	-81.7	75.2	-171.8	34.1	-38.2	0	0	0	111.6	R277 S281 T288	R277-P290 HydrophobicContact CG-CB 4.15Å; R277-P290 HydrophobicContact CG-CG 3.59Å; S281-P290 WeakPolarHBondContact OG-CG 3.44Å; T288-P290 WeakPolarHBondContact O-CD 3.49Å
291	I	88.1	Confident	88.1	Confident	48 Å²	48	67 Å²	67	25%	0.246	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-86.3	132.7	-179.3	-63.4	-179.3	0	0	0	109.9	A207 V289	A207-I291 HydrophobicContact CB-CD1 4.16Å; A207-I291 HydrophobicContact CB-CG1 4.23Å; V289-I291 VanDerWaalsContact C-N 3.29Å; V289-I291 HydrophobicContact CB-CD1 4.4Å; V289-I291 HydrophobicContact CB-CG1 4.24Å; V289-I291 HydrophobicContact CG1-CD1 4.19Å; V289-I291 HydrophobicContact CG1-CG1 3.83Å; V289-I291 PolarHBondContact O-N 3.22Å
292	P	92.2	Very high	88.6	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.019	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-71	148.2	175.8	31.2	-35.8	0	0	0	111.8	Y200 F270 Y308	Y200-P292 WeakPolarHBondContact CE2-O 3.35Å; Y200-P292 PolarHBondContact OH-O 2.95Å; Y200-P292 VanDerWaalsContact OH-O 3.07Å; F270-P292 HydrophobicContact CE2-CB 4.27Å; F270-P292 HydrophobicContact CE2-CG 3.54Å; F270-P292 HydrophobicContact CZ-CG 3.7Å; P292-Y308 HydrophobicContact CB-CE1 4.47Å; P292-Y308 WeakPolarHBondContact CB-OH 3.37Å
293	T	94	Very high	89.1	Confident	70 Å²	70	67.8 Å²	67.8	43%	0.429	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-76.2	152.2	177.3	66	0	0	0	0	112.2	N295 Q296 Y297	T293-N295 PolarHBondContact O-N 3.37Å; T293-Q296 PolarHBondContact O-N 3.25Å; T293-Q296 VanDerWaalsContact O-N 3.1Å; T293-Q296 VanDerWaalsContact OG1-CD 3.26Å; T293-Q296 WeakPolarHBondContact OG1-CG 3.29Å; T293-Q296 PolarHBondContact OG1-N 3.02Å; T293-Q296 PolarHBondContact OG1-OE1 2.76Å; T293-Y297 PolarHBondContact O-N 3.43Å; T293-Y297 VanDerWaalsContact O-N 3.15Å
294	V	95.4	Very high	89.6	Confident	57 Å²	57	59.7 Å²	59.7	35%	0.345	32%	0.324	S	S	.	.	H	α-helix	trans	-51.3	-40.9	173.6	-178.7	0	0	0	0	111.7	F196 Y200 Q296 Y297 L298	F196-V294 HydrophobicContact CE2-CG1 3.68Å; F196-V294 HydrophobicContact CZ-CG1 3.44Å; F196-V294 VanDerWaalsContact CZ-CG1 3.44Å; Y200-V294 HydrophobicContact CD1-CG2 4.32Å; Y200-V294 HydrophobicContact CE1-CG2 3.59Å; Y200-V294 HydrophobicContact CE2-CG2 4.13Å; Y200-V294 VanDerWaalsContact CZ-CG2 3.48Å; Y200-V294 WeakPolarHBondContact OH-CG2 3.41Å; Y200-V294 PolarHBondContact OH-N 2.87Å; V294-Q296 PolarHBondContact O-N 3.47Å; V294-Y297 PolarHBondContact O-N 3.23Å; V294-L298 WeakPolarHBondContact O-CB 3.42Å; V294-L298 PolarHBondContact O-N 2.89Å
295	N	95.4	Very high	90.1	Very high	126 Å²	126	53 Å²	53	67%	0.674	29%	0.293	S	S	*	.	H	α-helix	trans	-65.9	-37.9	-178.9	-68.4	-18.4	0	0	0	112.8	T293 Y299	T293-N295 PolarHBondContact O-N 3.37Å; N295-Y299 VanDerWaalsContact O-CB 3.29Å; N295-Y299 WeakPolarHBondContact O-CB 3.32Å; N295-Y299 PolarHBondContact O-N 2.83Å
296	Q	94.9	Very high	91	Very high	62 Å²	62	44.6 Å²	44.6	29%	0.29	26%	0.257	S	S	.	.	H	α-helix	trans	-67.1	-40.7	174.9	-73.6	160.8	-47.4	0	0	111.3	T293 V294 F300 D310	T293-Q296 PolarHBondContact O-N 3.25Å; T293-Q296 VanDerWaalsContact O-N 3.1Å; T293-Q296 VanDerWaalsContact OG1-CD 3.26Å; T293-Q296 WeakPolarHBondContact OG1-CG 3.29Å; T293-Q296 PolarHBondContact OG1-N 3.02Å; T293-Q296 PolarHBondContact OG1-OE1 2.76Å; V294-Q296 PolarHBondContact O-N 3.47Å; Q296-F300 WeakPolarHBondContact O-CB 3.39Å; Q296-F300 PolarHBondContact O-N 3.46Å; Q296-D310 PolarHBondContact NE2-O 3.48Å
297	Y	96	Very high	91.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-46.3	176.4	-173.9	-128.9	0	0	0	112.2	T195 F196 Y200 F270 T293 V294 Y299 F300 L301	T195-Y297 PolarHBondContact O-OH 3.43Å; F196-Y297 HydrophobicContact CD2-CD1 4.21Å; F196-Y297 WeakPolarHBondContact O-CE1 3.14Å; Y200-Y297 HydrophobicContact CD2-CD1 4.04Å; Y200-Y297 HydrophobicContact CD2-CG 4.32Å; Y200-Y297 HydrophobicContact CG-CD1 4.41Å; F270-Y297 HydrophobicContact CB-CD2 4.24Å; F270-Y297 HydrophobicContact CB-CE2 3.66Å; F270-Y297 HydrophobicContact CD1-CD2 4.27Å; F270-Y297 AromaticContact CD1-CE2 3.88Å; F270-Y297 HydrophobicContact CD1-CE2 3.88Å; F270-Y297 AromaticContact CD2-CD2 3.26Å; F270-Y297 HydrophobicContact CD2-CD2 3.26Å; F270-Y297 AromaticContact CD2-CE2 3.56Å; F270-Y297 HydrophobicContact CD2-CE2 3.56Å; F270-Y297 HydrophobicContact CD2-CG 4.14Å; F270-Y297 HydrophobicContact CE1-CD2 4.49Å; F270-Y297 HydrophobicContact CE1-CE2 4.42Å; F270-Y297 AromaticContact CE2-CD2 3.53Å; F270-Y297 HydrophobicContact CE2-CD2 3.53Å; F270-Y297 HydrophobicContact CE2-CE2 4.13Å; F270-Y297 AromaticContact CE2-CG 3.93Å; F270-Y297 HydrophobicContact CE2-CG 3.93Å; F270-Y297 AromaticContact CG-CD2 3.66Å; F270-Y297 HydrophobicContact CG-CD2 3.66Å; F270-Y297 AromaticContact CG-CE2 3.4Å; F270-Y297 HydrophobicContact CG-CE2 3.4Å; F270-Y297 HydrophobicContact CZ-CD2 4.16Å; F270-Y297 HydrophobicContact CZ-CG 4.3Å; T293-Y297 PolarHBondContact O-N 3.43Å; T293-Y297 VanDerWaalsContact O-N 3.15Å; V294-Y297 PolarHBondContact O-N 3.23Å; Y297-Y299 VanDerWaalsContact C-N 3.34Å; Y297-Y299 PolarHBondContact O-N 3.14Å; Y297-F300 HydrophobicContact CD2-CD1 4.19Å; Y297-F300 HydrophobicContact CE2-CD1 4.19Å; Y297-F300 WeakPolarHBondContact O-CB 3.47Å; Y297-F300 PolarHBondContact O-N 2.83Å; Y297-F300 VanDerWaalsContact O-N 3.12Å; Y297-L301 HydrophobicContact CD1-CD1 4.36Å; Y297-L301 HydrophobicContact CE1-CD1 4.03Å; Y297-L301 HydrophobicContact CE1-CG 4.4Å; Y297-L301 HydrophobicContact CE2-CD2 4.06Å; Y297-L301 HydrophobicContact CE2-CG 4.29Å; Y297-L301 WeakPolarHBondContact O-CG 3.47Å; Y297-L301 PolarHBondContact O-N 3.45Å
298	L	96.9	Very high	93.2	Very high	58 Å²	58	36.5 Å²	36.5	30%	0.304	20%	0.2	S	C	.	.	H	α-helix	trans	-58.3	-44.9	175.9	-176.1	60	0	0	0	111.8	F192 F196 V294 F300 L301 F302	F192-L298 HydrophobicContact CE2-CD1 4.44Å; F192-L298 HydrophobicContact CZ-CD1 3.77Å; F196-L298 HydrophobicContact CD2-CD1 4.06Å; F196-L298 HydrophobicContact CE2-CB 3.93Å; F196-L298 HydrophobicContact CE2-CD1 3.98Å; F196-L298 HydrophobicContact CE2-CG 4.41Å; V294-L298 WeakPolarHBondContact O-CB 3.42Å; V294-L298 PolarHBondContact O-N 2.89Å; L298-F300 VanDerWaalsContact C-N 3.35Å; L298-F300 PolarHBondContact O-N 3.46Å; L298-L301 PolarHBondContact O-N 3.28Å; L298-F302 HydrophobicContact CD1-CD2 4.45Å; L298-F302 HydrophobicContact CD1-CE2 3.97Å; L298-F302 WeakPolarHBondContact O-CD2 3.36Å
299	Y	97.1	Very high	93.9	Very high	41 Å²	41	34 Å²	34	16%	0.161	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-45.8	174.1	-178.5	-92.2	0	0	0	111.6	N295 Y297 L301 F302 A303 Y312 L396	N295-Y299 VanDerWaalsContact O-CB 3.29Å; N295-Y299 WeakPolarHBondContact O-CB 3.32Å; N295-Y299 PolarHBondContact O-N 2.83Å; Y297-Y299 VanDerWaalsContact C-N 3.34Å; Y297-Y299 PolarHBondContact O-N 3.14Å; Y299-L301 VanDerWaalsContact C-N 3.33Å; Y299-L301 PolarHBondContact O-N 2.99Å; Y299-F302 PolarHBondContact O-N 2.9Å; Y299-A303 HydrophobicContact CD1-CB 4.42Å; Y299-A303 HydrophobicContact CE1-CB 4.21Å; Y299-A303 WeakPolarHBondContact O-CB 3.34Å; Y299-A303 PolarHBondContact O-N 3.49Å; Y299-Y312 AromaticContact CD1-CD2 3.98Å; Y299-Y312 HydrophobicContact CD1-CD2 3.98Å; Y299-Y312 HydrophobicContact CD1-CE2 4.11Å; Y299-Y312 AromaticContact CE1-CD2 3.68Å; Y299-Y312 HydrophobicContact CE1-CD2 3.68Å; Y299-Y312 HydrophobicContact CE1-CE2 4.19Å; Y299-L396 HydrophobicContact CD2-CD2 4.47Å; Y299-L396 HydrophobicContact CE2-CB 3.87Å; Y299-L396 HydrophobicContact CE2-CD2 4.28Å; Y299-L396 WeakPolarHBondContact CE2-O 3.09Å; Y299-L396 PolarHBondContact OH-O 3.28Å; Y299-L396 VanDerWaalsContact OH-O 3.1Å
300	F	97.3	Very high	94.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-36.7	176.8	169.7	-114.7	0	0	0	113	K266 S269 F270 Q296 Y297 L298 F302 A303 T305 I307 Y308 Y312	K266-F300 HydrophobicContact CB-CE1 3.7Å; K266-F300 HydrophobicContact CB-CZ 3.95Å; K266-F300 HydrophobicContact CD-CE1 4.18Å; K266-F300 HydrophobicContact CD-CE2 4.49Å; K266-F300 HydrophobicContact CD-CZ 4.12Å; K266-F300 HydrophobicContact CG-CE1 3.93Å; K266-F300 HydrophobicContact CG-CE2 4.45Å; K266-F300 HydrophobicContact CG-CZ 3.72Å; K266-F300 PolarHBondContact NZ-O 3.13Å; K266-F300 WeakPolarHBondContact O-CE1 3.47Å; S269-F300 WeakPolarHBondContact OG-CZ 3.41Å; F270-F300 HydrophobicContact CB-CE1 4.47Å; Q296-F300 WeakPolarHBondContact O-CB 3.39Å; Q296-F300 PolarHBondContact O-N 3.46Å; Y297-F300 HydrophobicContact CD2-CD1 4.19Å; Y297-F300 HydrophobicContact CE2-CD1 4.19Å; Y297-F300 WeakPolarHBondContact O-CB 3.47Å; Y297-F300 PolarHBondContact O-N 2.83Å; Y297-F300 VanDerWaalsContact O-N 3.12Å; L298-F300 VanDerWaalsContact C-N 3.35Å; L298-F300 PolarHBondContact O-N 3.46Å; F300-F302 PolarHBondContact O-N 3.29Å; F300-A303 PolarHBondContact O-N 2.94Å; F300-T305 HydrophobicContact CD2-CG2 4.35Å; F300-T305 HydrophobicContact CE2-CG2 4.33Å; F300-T305 WeakPolarHBondContact CE2-O 3.49Å; F300-I307 WeakPolarHBondContact CE2-O 3.43Å; F300-Y308 HydrophobicContact CB-CD2 3.91Å; F300-Y308 HydrophobicContact CB-CE2 4.24Å; F300-Y308 AromaticContact CD1-CD2 3.69Å; F300-Y308 HydrophobicContact CD1-CD2 3.69Å; F300-Y308 HydrophobicContact CD1-CG 4.47Å; F300-Y308 HydrophobicContact CD2-CD2 4.33Å; F300-Y308 HydrophobicContact CE1-CD2 4.27Å; F300-Y308 AromaticContact CG-CD2 3.7Å; F300-Y308 HydrophobicContact CG-CD2 3.7Å; F300-Y312 WeakPolarHBondContact CD2-OH 3.3Å
301	L	96.6	Very high	94.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-32.1	177.4	-71.3	178.7	0	0	0	112.7	F192 T195 F196 R262 K266 Y297 L298 Y299	F192-L301 HydrophobicContact CE2-CB 4.38Å; F192-L301 HydrophobicContact CE2-CD1 4.13Å; T195-L301 HydrophobicContact CG2-CD2 4.1Å; F196-L301 HydrophobicContact CB-CD1 3.86Å; F196-L301 HydrophobicContact CD2-CD1 3.92Å; F196-L301 HydrophobicContact CG-CD1 4.37Å; R262-L301 PolarHBondContact NH1-O 2.99Å; K266-L301 HydrophobicContact CB-CD2 4.34Å; K266-L301 HydrophobicContact CD-CD2 4.45Å; K266-L301 VanDerWaalsContact NZ-C 3.32Å; K266-L301 PolarHBondContact NZ-O 3.11Å; Y297-L301 HydrophobicContact CD1-CD1 4.36Å; Y297-L301 HydrophobicContact CE1-CD1 4.03Å; Y297-L301 HydrophobicContact CE1-CG 4.4Å; Y297-L301 HydrophobicContact CE2-CD2 4.06Å; Y297-L301 HydrophobicContact CE2-CG 4.29Å; Y297-L301 WeakPolarHBondContact O-CG 3.47Å; Y297-L301 PolarHBondContact O-N 3.45Å; L298-L301 PolarHBondContact O-N 3.28Å; Y299-L301 VanDerWaalsContact C-N 3.33Å; Y299-L301 PolarHBondContact O-N 2.99Å
302	F	96.8	Very high	94.8	Very high	70 Å²	70	35.6 Å²	35.6	31%	0.307	19%	0.189	S	C	.	.	H	α-helix	trans	-94.2	-23.5	174.2	-67.4	-74.8	0	0	0	114.7	W188 F192 L298 Y299 F300 L396	W188-F302 HydrophobicContact CH2-CE1 4.33Å; W188-F302 HydrophobicContact CZ2-CE1 4.43Å; F192-F302 HydrophobicContact CD2-CZ 4.26Å; F192-F302 HydrophobicContact CE1-CZ 4.39Å; F192-F302 HydrophobicContact CE2-CE1 4.34Å; F192-F302 AromaticContact CE2-CE2 3.61Å; F192-F302 HydrophobicContact CE2-CE2 3.61Å; F192-F302 AromaticContact CE2-CZ 3.47Å; F192-F302 HydrophobicContact CE2-CZ 3.47Å; F192-F302 VanDerWaalsContact CE2-CZ 3.47Å; F192-F302 AromaticContact CZ-CE2 3.58Å; F192-F302 HydrophobicContact CZ-CE2 3.58Å; F192-F302 AromaticContact CZ-CZ 3.56Å; F192-F302 HydrophobicContact CZ-CZ 3.56Å; L298-F302 HydrophobicContact CD1-CD2 4.45Å; L298-F302 HydrophobicContact CD1-CE2 3.97Å; L298-F302 WeakPolarHBondContact O-CD2 3.36Å; Y299-F302 PolarHBondContact O-N 2.9Å; F300-F302 PolarHBondContact O-N 3.29Å; F302-L396 VanDerWaalsContact C-CD1 3.44Å; F302-L396 HydrophobicContact CB-CD1 3.85Å; F302-L396 HydrophobicContact CB-CD2 4.25Å; F302-L396 WeakPolarHBondContact O-CD1 3.42Å
303	A	96.1	Very high	94.9	Very high	2 Å²	2	37 Å²	37	2%	0.017	20%	0.198	C	C	.	.	S	Bend	trans	-56.7	142.7	-177.9	0	0	0	0	0	113.1	K266 Y299 F300 T305	K266-A303 PolarHBondContact NZ-O 3.17Å; Y299-A303 HydrophobicContact CD1-CB 4.42Å; Y299-A303 HydrophobicContact CE1-CB 4.21Å; Y299-A303 WeakPolarHBondContact O-CB 3.34Å; Y299-A303 PolarHBondContact O-N 3.49Å; F300-A303 PolarHBondContact O-N 2.94Å; A303-T305 HydrophobicContact CB-CG2 4.01Å; A303-T305 PolarHBondContact O-N 3.34Å
304	P	95.7	Very high	94.9	Very high	9 Å²	9	39.8 Å²	39.8	6%	0.058	20%	0.201	C	C	.	.	S	Bend	trans	-78	41.6	-179.4	33.4	-36.6	0	0	0	113	L389 A393 F398 F403	P304-L389 HydrophobicContact CB-CB 4.27Å; P304-L389 HydrophobicContact CB-CD2 3.84Å; P304-A393 HydrophobicContact CG-CB 3.9Å; P304-F398 HydrophobicContact CG-CB 4.5Å; P304-F398 HydrophobicContact CG-CD1 3.6Å; P304-F398 HydrophobicContact CG-CE1 4.04Å; P304-F398 HydrophobicContact CG-CG 4.23Å; P304-F403 HydrophobicContact CB-CE1 3.77Å; P304-F403 HydrophobicContact CB-CZ 3.81Å; P304-F403 HydrophobicContact CG-CE1 3.82Å; P304-F403 HydrophobicContact CG-CZ 3.61Å; P304-F403 VanDerWaalsContact O-CE1 3.26Å; P304-F403 WeakPolarHBondContact O-CE1 3.46Å
305	T	96	Very high	94.8	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.031	19%	0.193	C	C	.	.			trans	-137.1	153	176	176.8	0	0	0	0	109.6	F122 K266 F300 A303 I307 Y312 F398	F122-T305 HydrophobicContact CE1-CG2 4.46Å; K266-T305 WeakPolarHBondContact CE-O 3.45Å; F300-T305 HydrophobicContact CD2-CG2 4.35Å; F300-T305 HydrophobicContact CE2-CG2 4.33Å; F300-T305 WeakPolarHBondContact CE2-O 3.49Å; A303-T305 HydrophobicContact CB-CG2 4.01Å; A303-T305 PolarHBondContact O-N 3.34Å; T305-I307 PolarHBondContact OG1-N 3.06Å; T305-Y312 HydrophobicContact CG2-CE1 3.92Å; T305-F398 HydrophobicContact CG2-CE2 4.11Å; T305-F398 HydrophobicContact CG2-CZ 3.94Å
306	L	96.8	Very high	94.8	Very high	12 Å²	12	38.1 Å²	38.1	6%	0.063	20%	0.196	C	C	.	.	S	Bend	trans	-106.3	-4	175.7	-65.5	174.3	0	0	0	113.1	R262 M265 K266 S269 V423 V424 W427	R262-L306 HydrophobicContact CG-CD2 4.29Å; M265-L306 HydrophobicContact CB-CD1 4.43Å; M265-L306 HydrophobicContact CB-CD2 4.14Å; M265-L306 HydrophobicContact CE-CD1 3.62Å; M265-L306 HydrophobicContact SD-CD1 3.88Å; K266-L306 HydrophobicContact CD-CD2 4.4Å; K266-L306 HydrophobicContact CG-CD2 3.65Å; S269-L306 WeakPolarHBondContact CB-O 3.27Å; S269-L306 PolarHBondContact OG-O 3.44Å; L306-V423 HydrophobicContact CB-CG1 4.24Å; L306-V423 HydrophobicContact CD1-CG1 3.97Å; L306-V423 HydrophobicContact CG-CG1 3.72Å; L306-V424 HydrophobicContact CD1-CG2 4.11Å; L306-W427 HydrophobicContact CB-CB 4Å; L306-W427 HydrophobicContact CB-CG 4.14Å; L306-W427 HydrophobicContact CD1-CB 4.25Å
307	I	95.3	Very high	94.8	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	-97.3	124	175.4	-71.5	167.2	0	0	0	108.8	K120 F122 F300 T305 Y312 D426 Y430 Y431	K120-I307 HydrophobicContact CB-CD1 4.02Å; K120-I307 HydrophobicContact CD-CD1 3.87Å; F122-I307 HydrophobicContact CE2-CG2 4.07Å; F122-I307 HydrophobicContact CZ-CB 4.09Å; F122-I307 HydrophobicContact CZ-CG2 4.08Å; F300-I307 WeakPolarHBondContact CE2-O 3.43Å; T305-I307 PolarHBondContact OG1-N 3.06Å; I307-Y312 PolarHBondContact O-OH 2.86Å; I307-D426 HydrophobicContact CD1-CB 3.77Å; I307-Y430 HydrophobicContact CD1-CD2 3.67Å; I307-Y430 HydrophobicContact CD1-CE2 4.17Å; I307-Y430 HydrophobicContact CD1-CG 4.47Å; I307-Y431 HydrophobicContact CG1-CE2 3.88Å
308	Y	95.1	Very high	94.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.221	C	C	.	.			trans	-79.1	135.1	178.2	176.7	-94.8	0	0	0	111.5	F270 E273 N274 P292 F300 D310 Y312	F270-Y308 HydrophobicContact CD2-CD1 4.32Å; F270-Y308 AromaticContact CD2-CD2 3.84Å; F270-Y308 HydrophobicContact CD2-CD2 3.84Å; F270-Y308 HydrophobicContact CD2-CE1 4.44Å; F270-Y308 AromaticContact CD2-CE2 3.95Å; F270-Y308 HydrophobicContact CD2-CE2 3.95Å; F270-Y308 HydrophobicContact CD2-CG 4.05Å; F270-Y308 HydrophobicContact CE2-CE2 4.26Å; E273-Y308 HydrophobicContact CB-CD1 4.07Å; E273-Y308 WeakPolarHBondContact CG-O 3.3Å; N274-Y308 VanDerWaalsContact ND2-CD1 3.31Å; N274-Y308 WeakPolarHBondContact ND2-CD1 3.45Å; N274-Y308 WeakPolarHBondContact ND2-CE1 3.46Å; P292-Y308 HydrophobicContact CB-CE1 4.47Å; P292-Y308 WeakPolarHBondContact CB-OH 3.37Å; F300-Y308 HydrophobicContact CB-CD2 3.91Å; F300-Y308 HydrophobicContact CB-CE2 4.24Å; F300-Y308 AromaticContact CD1-CD2 3.69Å; F300-Y308 HydrophobicContact CD1-CD2 3.69Å; F300-Y308 HydrophobicContact CD1-CG 4.47Å; F300-Y308 HydrophobicContact CD2-CD2 4.33Å; F300-Y308 HydrophobicContact CE1-CD2 4.27Å; F300-Y308 AromaticContact CG-CD2 3.7Å; F300-Y308 HydrophobicContact CG-CD2 3.7Å; Y308-D310 WeakPolarHBondContact CE1-OD1 3.42Å; Y308-D310 PolarHBondContact OH-OD1 3.5Å; Y308-Y312 WeakPolarHBondContact CA-OH 3.36Å
309	R	91.4	Very high	94.7	Very high	60 Å²	60	43.7 Å²	43.7	23%	0.226	23%	0.225	C	C	.	.			trans	-145.4	153.8	166.7	-60.4	-64	-163.5	-168.2	18.1	108.7	G119 K120 F122 E273 S311 Y312	G119-R309 VanDerWaalsContact C-NH2 3.28Å; K120-R309 PolarHBondContact O-NE 3.49Å; K120-R309 PolarHBondContact O-NH2 3Å; F122-R309 HydrophobicContact CD2-CG 4.01Å; F122-R309 HydrophobicContact CE2-CG 3.6Å; E273-R309 IonicContact OE1-NH1 2.79Å; E273-R309 IonicContact OE2-CZ 3.77Å; E273-R309 IonicContact OE2-NH1 3.29Å; E273-R309 PolarHBondContact OE2-NH1 2.89Å; R309-S311 VanDerWaalsContact C-N 3.33Å; R309-Y312 HydrophobicContact CB-CD1 4.28Å; R309-Y312 HydrophobicContact CB-CE1 3.79Å; R309-Y312 HydrophobicContact CG-CE1 4.19Å; R309-Y312 PolarHBondContact N-OH 3.49Å; R309-Y312 VanDerWaalsContact O-CE2 3.24Å; R309-Y312 WeakPolarHBondContact O-CE2 3.4Å; R309-Y312 PolarHBondContact O-OH 3.28Å
310	D	87.8	Confident	94.7	Very high	48 Å²	48	49.6 Å²	49.6	26%	0.257	25%	0.247	S	C	.	.	S	Bend	trans	-76.6	-23.3	-179.6	-41.4	-74.2	0	0	0	113	R277 Q296 Y308	R277-D310 IonicContact CZ-OD1 2.7Å; R277-D310 IonicContact CZ-OD2 3.97Å; R277-D310 IonicContact NH1-OD1 3.76Å; R277-D310 PolarHBondContact NH1-OD1 3.02Å; R277-D310 IonicContact NH1-OD2 3.99Å; R277-D310 PolarHBondContact NH1-OD2 3.02Å; R277-D310 IonicContact NH2-OD1 3.29Å; R277-D310 IonicContact NH2-OD2 2.68Å; R277-D310 PolarHBondContact NH2-OD2 2.88Å; Q296-D310 PolarHBondContact NE2-O 3.48Å; Y308-D310 WeakPolarHBondContact CE1-OD1 3.42Å; Y308-D310 PolarHBondContact OH-OD1 3.5Å
311	S	90.3	Very high	94.7	Very high	98 Å²	98	52.5 Å²	52.5	69%	0.685	28%	0.277	S	S	*	.			trans	-134.5	138.8	175.7	60.9	0	0	0	0	110.2	R309	R309-S311 VanDerWaalsContact C-N 3.33Å
312	Y	94.1	Very high	94.6	Very high	22 Å²	22	54.6 Å²	54.6	9%	0.086	29%	0.285	C	S	.	.			trans	-123.8	151.5	174	-59.7	-77.7	0	0	0	108.4	F122 Y299 F300 T305 I307 Y308 R309 R314 F398	F122-Y312 HydrophobicContact CD1-CD1 4.43Å; F122-Y312 HydrophobicContact CD2-CD1 4.23Å; F122-Y312 HydrophobicContact CD2-CE1 4.49Å; F122-Y312 HydrophobicContact CE1-CD1 4.46Å; F122-Y312 HydrophobicContact CE1-CE1 4.49Å; F122-Y312 HydrophobicContact CE2-CD1 4.28Å; F122-Y312 HydrophobicContact CE2-CE1 4.1Å; F122-Y312 HydrophobicContact CG-CD1 4.31Å; F122-Y312 HydrophobicContact CZ-CD1 4.38Å; F122-Y312 HydrophobicContact CZ-CE1 4.08Å; Y299-Y312 AromaticContact CD1-CD2 3.98Å; Y299-Y312 HydrophobicContact CD1-CD2 3.98Å; Y299-Y312 HydrophobicContact CD1-CE2 4.11Å; Y299-Y312 AromaticContact CE1-CD2 3.68Å; Y299-Y312 HydrophobicContact CE1-CD2 3.68Å; Y299-Y312 HydrophobicContact CE1-CE2 4.19Å; F300-Y312 WeakPolarHBondContact CD2-OH 3.3Å; T305-Y312 HydrophobicContact CG2-CE1 3.92Å; I307-Y312 PolarHBondContact O-OH 2.86Å; Y308-Y312 WeakPolarHBondContact CA-OH 3.36Å; R309-Y312 HydrophobicContact CB-CD1 4.28Å; R309-Y312 HydrophobicContact CB-CE1 3.79Å; R309-Y312 HydrophobicContact CG-CE1 4.19Å; R309-Y312 PolarHBondContact N-OH 3.49Å; R309-Y312 VanDerWaalsContact O-CE2 3.24Å; R309-Y312 WeakPolarHBondContact O-CE2 3.4Å; R309-Y312 PolarHBondContact O-OH 3.28Å; Y312-R314 WeakPolarHBondContact O-CG 3.43Å; Y312-R314 PolarHBondContact O-N 2.97Å; Y312-F398 AromaticContact CD1-CE2 3.64Å; Y312-F398 HydrophobicContact CD1-CE2 3.64Å; Y312-F398 HydrophobicContact CE1-CE2 4.36Å; Y312-F398 HydrophobicContact CG-CD2 4.21Å; Y312-F398 AromaticContact CG-CE2 3.77Å; Y312-F398 HydrophobicContact CG-CE2 3.77Å
313	P	94.5	Very high	94.6	Very high	31 Å²	31	51.5 Å²	51.5	20%	0.201	27%	0.272	C	S	.	.			trans	-57.4	134	169.5	25.9	-34.5	0	0	0	109	F122 A124 G399 D400	F122-P313 VanDerWaalsContact CB-CD 3.41Å; F122-P313 HydrophobicContact CB-CG 3.8Å; A124-P313 HydrophobicContact CB-CB 4.17Å; P313-G399 WeakPolarHBondContact O-CA 3.36Å; P313-G399 PolarHBondContact O-N 2.86Å; P313-D400 HydrophobicContact CG-CB 4.24Å
314	R	93.9	Very high	94.7	Very high	129 Å²	129	54.4 Å²	54.4	49%	0.487	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-120.3	144.8	-178.9	-54.4	-167.4	78.4	167.1	6.8	112.4	Y312 L396 R397	Y312-R314 WeakPolarHBondContact O-CG 3.43Å; Y312-R314 PolarHBondContact O-N 2.97Å; R314-L396 PolarHBondContact NH2-O 2.98Å; R314-R397 CarbonylContact C-O 3.58Å; R314-R397 WeakPolarHBondContact CA-O 3.33Å; R314-R397 WeakPolarHBondContact CB-O 3.29Å
315	N	93.3	Very high	94.7	Very high	33 Å²	33	59.2 Å²	59.2	18%	0.176	32%	0.319	C	S	.	.			trans	-78.4	147.1	170.7	-52.2	-47.4	0	0	0	109.4	R397 F398 R401	N315-R397 HydrophobicContact CB-CB 4.48Å; N315-R397 PolarHBondContact N-O 3.42Å; N315-R397 WeakPolarHBondContact O-CD 3.45Å; N315-F398 PolarHBondContact ND2-O 3.42Å; N315-R401 PolarHBondContact ND2-NH2 3.03Å
316	P	94.3	Very high	94.7	Very high	115 Å²	115	59.2 Å²	59.2	75%	0.747	32%	0.319	S	S	*	.	S	Bend	trans	-64.5	-45.4	-177.8	24.1	-33	0	0	0	112.1
317	T	95.1	Very high	94.7	Very high	95 Å²	95	61.7 Å²	61.7	58%	0.583	33%	0.329	S	S	*	.	S	Bend	trans	-123.4	167.3	-175.8	54.9	0	0	0	0	111.9
318	V	96.6	Very high	94.8	Very high	36 Å²	36	64.3 Å²	64.3	22%	0.218	35%	0.352	C	S	.	.			trans	-107.6	121.7	171.9	178.8	0	0	0	0	108.4	W320 V323 E394 R397	V318-W320 HydrophobicContact CG1-CD2 3.91Å; V318-W320 HydrophobicContact CG1-CE3 4.31Å; V318-W320 HydrophobicContact CG1-CG 4.32Å; V318-W320 HydrophobicContact CG1-CH2 4.46Å; V318-W320 HydrophobicContact CG1-CZ2 4.07Å; V318-W320 PolarHBondContact O-N 3.24Å; V318-V323 HydrophobicContact CG1-CG2 4.26Å; V318-E394 HydrophobicContact CG1-CG 4.44Å; V318-R397 HydrophobicContact CG2-CG 3.35Å
319	R	96	Very high	94.8	Very high	107 Å²	107	65.6 Å²	65.6	40%	0.404	36%	0.358	S	S	.	.			trans	-90	84.9	177	-60.4	173.1	-62.6	156.5	8.8	110.2	G321 Y322 V323 E394	R319-G321 PolarHBondContact O-N 3.24Å; R319-G321 VanDerWaalsContact O-N 3.17Å; R319-Y322 WeakPolarHBondContact O-CB 3.2Å; R319-Y322 PolarHBondContact O-N 3.48Å; R319-V323 PolarHBondContact O-N 3.16Å; R319-V323 VanDerWaalsContact O-N 3.11Å; R319-E394 HydrophobicContact CB-CG 4.49Å; R319-E394 VanDerWaalsContact CB-OE1 3.31Å; R319-E394 WeakPolarHBondContact CB-OE1 3.5Å; R319-E394 WeakPolarHBondContact CG-OE1 3.43Å; R319-E394 IonicContact CZ-OE1 2.98Å; R319-E394 IonicContact CZ-OE2 2.82Å; R319-E394 PolarHBondContact N-OE1 2.8Å; R319-E394 IonicContact NE-OE1 3.2Å; R319-E394 PolarHBondContact NE-OE1 2.79Å; R319-E394 VanDerWaalsContact NE-OE1 3.11Å; R319-E394 IonicContact NE-OE2 3.38Å; R319-E394 PolarHBondContact NE-OE2 2.89Å; R319-E394 IonicContact NH2-OE1 3.92Å; R319-E394 IonicContact NH2-OE2 2.83Å; R319-E394 PolarHBondContact NH2-OE2 3.4Å
320	W	96.5	Very high	95	Very high	165 Å²	165	64 Å²	64	63%	0.625	35%	0.354	S	S	*	.	H	α-helix	trans	-55.5	-33.4	-176.7	-69.5	110	0	0	0	114.6	V318 Y322 V323 A324 M395	V318-W320 HydrophobicContact CG1-CD2 3.91Å; V318-W320 HydrophobicContact CG1-CE3 4.31Å; V318-W320 HydrophobicContact CG1-CG 4.32Å; V318-W320 HydrophobicContact CG1-CH2 4.46Å; V318-W320 HydrophobicContact CG1-CZ2 4.07Å; V318-W320 PolarHBondContact O-N 3.24Å; W320-Y322 VanDerWaalsContact C-N 3.35Å; W320-Y322 PolarHBondContact O-N 3.41Å; W320-V323 HydrophobicContact CE3-CB 4.34Å; W320-V323 HydrophobicContact CE3-CG1 4.39Å; W320-V323 HydrophobicContact CE3-CG2 4.38Å; W320-V323 WeakPolarHBondContact O-CB 3.15Å; W320-V323 PolarHBondContact O-N 3.32Å; W320-A324 WeakPolarHBondContact O-CB 3.38Å; W320-A324 PolarHBondContact O-N 2.83Å; W320-M395 HydrophobicContact CH2-CG 4.26Å; W320-M395 HydrophobicContact CZ3-CG 4.31Å
321	G	97	Very high	95.4	Very high	60 Å²	60	68.1 Å²	68.1	62%	0.619	37%	0.37	S	S	*	.	H	α-helix	trans	-62.5	-37.9	173.1	0	0	0	0	0	113.6	R319 M325	R319-G321 PolarHBondContact O-N 3.24Å; R319-G321 VanDerWaalsContact O-N 3.17Å; G321-M325 WeakPolarHBondContact O-CB 3.28Å; G321-M325 PolarHBondContact O-N 3.13Å
322	Y	95.1	Very high	95.5	Very high	45 Å²	45	64.6 Å²	64.6	18%	0.176	35%	0.349	C	S	.	.	H	α-helix	trans	-69.1	-40.5	173.4	177.7	-88.6	0	0	0	111	D130 R319 W320 M325 Q326 N390 E394	D130-Y322 VanDerWaalsContact CG-OH 3.28Å; D130-Y322 PolarHBondContact OD1-OH 2.87Å; D130-Y322 PolarHBondContact OD2-OH 2.98Å; R319-Y322 WeakPolarHBondContact O-CB 3.2Å; R319-Y322 PolarHBondContact O-N 3.48Å; W320-Y322 VanDerWaalsContact C-N 3.35Å; W320-Y322 PolarHBondContact O-N 3.41Å; Y322-M325 PolarHBondContact O-N 3.43Å; Y322-Q326 HydrophobicContact CD1-CG 4.04Å; Y322-Q326 HydrophobicContact CE1-CG 3.7Å; Y322-Q326 HydrophobicContact CE2-CG 4.24Å; Y322-Q326 HydrophobicContact CG-CG 4.45Å; Y322-Q326 WeakPolarHBondContact O-CB 3.37Å; Y322-Q326 VanDerWaalsContact O-CG 3.28Å; Y322-Q326 WeakPolarHBondContact O-CG 3.36Å; Y322-Q326 PolarHBondContact O-N 3.19Å; Y322-Q326 PolarHBondContact OH-NE2 2.64Å; Y322-Q326 VanDerWaalsContact OH-NE2 3.13Å; Y322-N390 HydrophobicContact CE1-CB 4.28Å; Y322-E394 HydrophobicContact CD1-CB 4.08Å; Y322-E394 HydrophobicContact CD1-CG 3.92Å; Y322-E394 HydrophobicContact CE1-CB 4.32Å
323	V	96.8	Very high	95.6	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.03	35%	0.35	C	S	.	.	H	α-helix	trans	-58.8	-49.2	174.2	-179.5	0	0	0	0	111	V318 R319 W320 Q326 F327 E394 M395	V318-V323 HydrophobicContact CG1-CG2 4.26Å; R319-V323 PolarHBondContact O-N 3.16Å; R319-V323 VanDerWaalsContact O-N 3.11Å; W320-V323 HydrophobicContact CE3-CB 4.34Å; W320-V323 HydrophobicContact CE3-CG1 4.39Å; W320-V323 HydrophobicContact CE3-CG2 4.38Å; W320-V323 WeakPolarHBondContact O-CB 3.15Å; W320-V323 PolarHBondContact O-N 3.32Å; V323-Q326 PolarHBondContact O-N 2.88Å; V323-F327 HydrophobicContact CG1-CD2 3.69Å; V323-F327 HydrophobicContact CG1-CE2 3.59Å; V323-F327 VanDerWaalsContact O-CD2 3.29Å; V323-F327 WeakPolarHBondContact O-CD2 3.46Å; V323-F327 PolarHBondContact O-N 3.15Å; V323-E394 HydrophobicContact CG2-CB 3.81Å; V323-E394 HydrophobicContact CG2-CG 3.5Å; V323-E394 VanDerWaalsContact CG2-CG 3.5Å; V323-M395 HydrophobicContact CG1-CE 4.12Å
324	A	97.1	Very high	95.6	Very high	64 Å²	64	66.5 Å²	66.5	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-62.9	-44.3	179.4	0	0	0	0	0	112.1	W320 F327 A328	W320-A324 WeakPolarHBondContact O-CB 3.38Å; W320-A324 PolarHBondContact O-N 2.83Å; A324-F327 PolarHBondContact O-N 3.15Å; A324-A328 WeakPolarHBondContact O-CB 3.27Å; A324-A328 PolarHBondContact O-N 2.89Å
325	M	96.4	Very high	95.5	Very high	109 Å²	109	62.2 Å²	62.2	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-46.4	174.8	-178.1	60.4	70.8	0	0	111.7	G321 Y322 F327 A328 Q329	G321-M325 WeakPolarHBondContact O-CB 3.28Å; G321-M325 PolarHBondContact O-N 3.13Å; Y322-M325 PolarHBondContact O-N 3.43Å; M325-F327 PolarHBondContact O-N 3.26Å; M325-A328 PolarHBondContact O-N 3.43Å; M325-Q329 WeakPolarHBondContact O-CG 3.29Å; M325-Q329 PolarHBondContact O-N 2.78Å
326	Q	96.4	Very high	95.5	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.023	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-39.4	179.7	-71.2	-69.2	6.4	0	0	112.2	Y322 V323 Q329 V330 H386 C387 A391	Y322-Q326 HydrophobicContact CD1-CG 4.04Å; Y322-Q326 HydrophobicContact CE1-CG 3.7Å; Y322-Q326 HydrophobicContact CE2-CG 4.24Å; Y322-Q326 HydrophobicContact CG-CG 4.45Å; Y322-Q326 WeakPolarHBondContact O-CB 3.37Å; Y322-Q326 VanDerWaalsContact O-CG 3.28Å; Y322-Q326 WeakPolarHBondContact O-CG 3.36Å; Y322-Q326 PolarHBondContact O-N 3.19Å; Y322-Q326 PolarHBondContact OH-NE2 2.64Å; Y322-Q326 VanDerWaalsContact OH-NE2 3.13Å; V323-Q326 PolarHBondContact O-N 2.88Å; Q326-Q329 PolarHBondContact O-N 2.92Å; Q326-V330 WeakPolarHBondContact O-CG2 3.25Å; Q326-V330 PolarHBondContact O-N 3.24Å; Q326-H386 PolarHBondContact NE2-NE2 3.35Å; Q326-C387 PolarHBondContact OE1-SG 3.2Å; Q326-A391 HydrophobicContact CB-CB 3.94Å
327	F	96.9	Very high	95.5	Very high	65 Å²	65	56.9 Å²	56.9	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-37.4	172.3	-81.3	-64.6	0	0	0	113.1	V323 A324 M325 Q329 V330 F331 W388 A391 F392 M395	V323-F327 HydrophobicContact CG1-CD2 3.69Å; V323-F327 HydrophobicContact CG1-CE2 3.59Å; V323-F327 VanDerWaalsContact O-CD2 3.29Å; V323-F327 WeakPolarHBondContact O-CD2 3.46Å; V323-F327 PolarHBondContact O-N 3.15Å; A324-F327 PolarHBondContact O-N 3.15Å; M325-F327 PolarHBondContact O-N 3.26Å; F327-Q329 VanDerWaalsContact C-N 3.31Å; F327-Q329 PolarHBondContact O-N 3.12Å; F327-V330 PolarHBondContact O-N 3.37Å; F327-F331 PolarHBondContact O-N 3.38Å; F327-W388 HydrophobicContact CD1-CE3 4.41Å; F327-W388 HydrophobicContact CD1-CZ3 4.39Å; F327-W388 AromaticContact CE1-CE3 3.94Å; F327-W388 HydrophobicContact CE1-CE3 3.94Å; F327-W388 AromaticContact CE1-CZ3 3.84Å; F327-W388 HydrophobicContact CE1-CZ3 3.84Å; F327-A391 HydrophobicContact CD2-CB 4.05Å; F327-A391 HydrophobicContact CE1-CB 4.29Å; F327-A391 HydrophobicContact CE2-CB 3.78Å; F327-A391 HydrophobicContact CG-CB 4.42Å; F327-A391 HydrophobicContact CZ-CB 3.9Å; F327-F392 HydrophobicContact CE1-CE2 4.11Å; F327-F392 HydrophobicContact CZ-CD2 4.34Å; F327-F392 AromaticContact CZ-CE2 3.96Å; F327-F392 HydrophobicContact CZ-CE2 3.96Å; F327-M395 HydrophobicContact CE2-CE 3.63Å; F327-M395 HydrophobicContact CZ-CE 3.98Å
328	A	96.3	Very high	95.4	Very high	59 Å²	59	53.3 Å²	53.3	49%	0.488	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-38.1	173.4	0	0	0	0	0	111.8	A324 M325 F331 G332	A324-A328 WeakPolarHBondContact O-CB 3.27Å; A324-A328 PolarHBondContact O-N 2.89Å; M325-A328 PolarHBondContact O-N 3.43Å; A328-F331 PolarHBondContact O-N 3.02Å; A328-G332 PolarHBondContact O-N 3.5Å
329	Q	95.7	Very high	95.1	Very high	27 Å²	27	52.2 Å²	52.2	13%	0.126	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-43.7	172.3	-71.9	178.4	1.2	0	0	112.2	Y142 M325 Q326 F327 F331 G332 C333 F382 C387	Y142-Q329 PolarHBondContact OH-NE2 2.84Å; M325-Q329 WeakPolarHBondContact O-CG 3.29Å; M325-Q329 PolarHBondContact O-N 2.78Å; Q326-Q329 PolarHBondContact O-N 2.92Å; F327-Q329 VanDerWaalsContact C-N 3.31Å; F327-Q329 PolarHBondContact O-N 3.12Å; Q329-F331 VanDerWaalsContact C-N 3.32Å; Q329-F331 PolarHBondContact O-N 3.4Å; Q329-G332 PolarHBondContact O-N 2.99Å; Q329-C333 WeakPolarHBondContact O-CB 3.35Å; Q329-C333 PolarHBondContact O-N 3.04Å; Q329-C333 PolarHBondContact O-SG 2.69Å; Q329-C333 VanDerWaalsContact O-SG 3.33Å; Q329-F382 HydrophobicContact CB-CE1 4.5Å; Q329-C387 HydrophobicContact CB-CB 4.45Å; Q329-C387 PolarHBondContact OE1-SG 2.78Å; Q329-C387 VanDerWaalsContact OE1-SG 3.32Å
330	V	96.2	Very high	94.9	Very high	26 Å²	26	47.1 Å²	47.1	16%	0.158	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-46.9	173.2	174.1	0	0	0	0	111	Q326 F327 C333 F334 C387 W388	Q326-V330 WeakPolarHBondContact O-CG2 3.25Å; Q326-V330 PolarHBondContact O-N 3.24Å; F327-V330 PolarHBondContact O-N 3.37Å; V330-C333 PolarHBondContact O-N 3.24Å; V330-F334 WeakPolarHBondContact O-CB 3.32Å; V330-F334 PolarHBondContact O-N 2.73Å; V330-C387 HydrophobicContact CG2-CB 3.51Å; V330-W388 HydrophobicContact CG1-CE3 4.1Å; V330-W388 HydrophobicContact CG2-CB 4.05Å; V330-W388 HydrophobicContact CG2-CE3 4.41Å
331	F	94.4	Very high	94.6	Very high	134 Å²	134	43.2 Å²	43.2	59%	0.588	24%	0.244	S	C	*	.	H	α-helix	trans	-62.1	-47.5	178.7	-168.5	-103.1	0	0	0	111.2	F327 A328 Q329 C333 F334 F335	F327-F331 PolarHBondContact O-N 3.38Å; A328-F331 PolarHBondContact O-N 3.02Å; Q329-F331 VanDerWaalsContact C-N 3.32Å; Q329-F331 PolarHBondContact O-N 3.4Å; F331-C333 PolarHBondContact O-N 3.01Å; F331-F334 WeakPolarHBondContact O-CB 3.4Å; F331-F334 PolarHBondContact O-N 3.42Å; F331-F334 VanDerWaalsContact O-N 3.16Å; F331-F335 HydrophobicContact CD1-CD2 4.02Å; F331-F335 AromaticContact CD1-CE2 3.9Å; F331-F335 HydrophobicContact CD1-CE2 3.9Å; F331-F335 HydrophobicContact CD2-CE2 4.15Å; F331-F335 AromaticContact CE1-CD2 3.97Å; F331-F335 HydrophobicContact CE1-CD2 3.97Å; F331-F335 AromaticContact CE1-CE2 3.45Å; F331-F335 HydrophobicContact CE1-CE2 3.45Å; F331-F335 VanDerWaalsContact CE1-CE2 3.45Å; F331-F335 HydrophobicContact CE1-CZ 4.37Å; F331-F335 AromaticContact CE2-CE2 3.74Å; F331-F335 HydrophobicContact CE2-CE2 3.74Å; F331-F335 HydrophobicContact CG-CD2 4.41Å; F331-F335 HydrophobicContact CG-CE2 4.25Å; F331-F335 HydrophobicContact CZ-CD2 4.31Å; F331-F335 AromaticContact CZ-CE2 3.39Å; F331-F335 HydrophobicContact CZ-CE2 3.39Å; F331-F335 HydrophobicContact CZ-CZ 4.09Å; F331-F335 WeakPolarHBondContact O-CD2 3.47Å; F331-F335 PolarHBondContact O-N 3.38Å; F331-F335 VanDerWaalsContact O-N 3.08Å
332	G	94.2	Very high	94.1	Very high	24 Å²	24	42.1 Å²	42.1	25%	0.247	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-45.4	175.5	0	0	0	0	0	113.3	A328 Q329 F334 F335 Y336	A328-G332 PolarHBondContact O-N 3.5Å; Q329-G332 PolarHBondContact O-N 2.99Å; G332-F334 VanDerWaalsContact C-N 3.31Å; G332-F334 PolarHBondContact O-N 2.85Å; G332-F335 PolarHBondContact O-N 3.23Å; G332-Y336 PolarHBondContact O-N 3.41Å
333	C	95.7	Very high	93.7	Very high	14 Å²	14	42.6 Å²	42.6	10%	0.095	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-31.8	175.9	-68.8	0	0	0	0	113.1	Q329 V330 F331 Y336 V337 L379 A383	Q329-C333 WeakPolarHBondContact O-CB 3.35Å; Q329-C333 PolarHBondContact O-N 3.04Å; Q329-C333 PolarHBondContact O-SG 2.69Å; Q329-C333 VanDerWaalsContact O-SG 3.33Å; V330-C333 PolarHBondContact O-N 3.24Å; F331-C333 PolarHBondContact O-N 3.01Å; C333-Y336 WeakPolarHBondContact O-CB 3.35Å; C333-Y336 PolarHBondContact O-N 3.5Å; C333-V337 WeakPolarHBondContact O-CG2 3.21Å; C333-V337 PolarHBondContact O-N 3.05Å; C333-L379 HydrophobicContact CB-CD2 4.46Å; C333-A383 HydrophobicContact CB-CB 3.67Å
334	F	93.5	Very high	93.4	Very high	79 Å²	79	44.3 Å²	44.3	35%	0.346	23%	0.233	S	C	.	.	H	α-helix	trans	-65	-45.6	173.9	173	-100.5	0	0	0	111.8	L174 F178 V330 F331 G332 Y336 V337 Y338	L174-F334 HydrophobicContact CD1-CE1 4.19Å; L174-F334 HydrophobicContact CD2-CE1 3.85Å; L174-F334 HydrophobicContact CD2-CZ 3.62Å; F178-F334 HydrophobicContact CD2-CZ 4.28Å; F178-F334 AromaticContact CE2-CE2 3.75Å; F178-F334 HydrophobicContact CE2-CE2 3.75Å; F178-F334 AromaticContact CE2-CZ 3.46Å; F178-F334 HydrophobicContact CE2-CZ 3.46Å; F178-F334 VanDerWaalsContact CE2-CZ 3.46Å; F178-F334 AromaticContact CZ-CE2 3.53Å; F178-F334 HydrophobicContact CZ-CE2 3.53Å; F178-F334 AromaticContact CZ-CZ 3.62Å; F178-F334 HydrophobicContact CZ-CZ 3.62Å; V330-F334 WeakPolarHBondContact O-CB 3.32Å; V330-F334 PolarHBondContact O-N 2.73Å; F331-F334 WeakPolarHBondContact O-CB 3.4Å; F331-F334 PolarHBondContact O-N 3.42Å; F331-F334 VanDerWaalsContact O-N 3.16Å; G332-F334 VanDerWaalsContact C-N 3.31Å; G332-F334 PolarHBondContact O-N 2.85Å; F334-Y336 VanDerWaalsContact C-N 3.29Å; F334-Y336 PolarHBondContact O-N 3.24Å; F334-V337 PolarHBondContact O-N 2.87Å; F334-Y338 PolarHBondContact O-N 2.94Å
335	F	91.8	Very high	92.9	Very high	40 Å²	40	41.3 Å²	41.3	18%	0.175	21%	0.208	C	C	.	.	H	α-helix	trans	-63.9	-34.6	171.1	-80.6	-82.9	0	0	0	112.5	F171 L174 F331 G332 Y338 Y339	F171-F335 HydrophobicContact CD1-CE1 4.11Å; F171-F335 HydrophobicContact CE1-CD1 4.16Å; F171-F335 AromaticContact CE1-CE1 3.67Å; F171-F335 HydrophobicContact CE1-CE1 3.67Å; F171-F335 HydrophobicContact CZ-CE1 4.11Å; L174-F335 HydrophobicContact CD1-CE1 3.8Å; L174-F335 HydrophobicContact CD1-CZ 4.19Å; F331-F335 HydrophobicContact CD1-CD2 4.02Å; F331-F335 AromaticContact CD1-CE2 3.9Å; F331-F335 HydrophobicContact CD1-CE2 3.9Å; F331-F335 HydrophobicContact CD2-CE2 4.15Å; F331-F335 AromaticContact CE1-CD2 3.97Å; F331-F335 HydrophobicContact CE1-CD2 3.97Å; F331-F335 AromaticContact CE1-CE2 3.45Å; F331-F335 HydrophobicContact CE1-CE2 3.45Å; F331-F335 VanDerWaalsContact CE1-CE2 3.45Å; F331-F335 HydrophobicContact CE1-CZ 4.37Å; F331-F335 AromaticContact CE2-CE2 3.74Å; F331-F335 HydrophobicContact CE2-CE2 3.74Å; F331-F335 HydrophobicContact CG-CD2 4.41Å; F331-F335 HydrophobicContact CG-CE2 4.25Å; F331-F335 HydrophobicContact CZ-CD2 4.31Å; F331-F335 AromaticContact CZ-CE2 3.39Å; F331-F335 HydrophobicContact CZ-CE2 3.39Å; F331-F335 HydrophobicContact CZ-CZ 4.09Å; F331-F335 WeakPolarHBondContact O-CD2 3.47Å; F331-F335 PolarHBondContact O-N 3.38Å; F331-F335 VanDerWaalsContact O-N 3.08Å; G332-F335 PolarHBondContact O-N 3.23Å; F335-Y338 WeakPolarHBondContact O-CB 3.45Å; F335-Y338 PolarHBondContact O-N 3.27Å; F335-Y339 HydrophobicContact CB-CD2 4.48Å; F335-Y339 HydrophobicContact CB-CE2 4.14Å; F335-Y339 HydrophobicContact CD1-CE2 4.47Å; F335-Y339 WeakPolarHBondContact O-CD2 3.42Å; F335-Y339 PolarHBondContact O-N 3.46Å
336	Y	94.6	Very high	92.3	Very high	5 Å²	5	36.6 Å²	36.6	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-46.7	174.7	-156.4	161.5	0	0	0	111.7	F145 L148 L149 F152 G332 C333 F334 Y338 Y339 I340 L379	F145-Y336 HydrophobicContact CB-CE1 4.44Å; F145-Y336 HydrophobicContact CD1-CE1 4.03Å; F145-Y336 VanDerWaalsContact O-CE1 3.27Å; F145-Y336 WeakPolarHBondContact O-CE1 3.27Å; F145-Y336 PolarHBondContact O-OH 3.39Å; L148-Y336 WeakPolarHBondContact CB-OH 3.36Å; L148-Y336 VanDerWaalsContact CD2-OH 3.31Å; L148-Y336 WeakPolarHBondContact CD2-OH 3.45Å; L148-Y336 VanDerWaalsContact CG-OH 3.24Å; L148-Y336 WeakPolarHBondContact CG-OH 3.16Å; L149-Y336 HydrophobicContact CB-CD1 3.82Å; L149-Y336 HydrophobicContact CB-CE1 3.79Å; L149-Y336 HydrophobicContact CB-CG 4.21Å; L149-Y336 HydrophobicContact CD1-CD1 4.19Å; L149-Y336 HydrophobicContact CD1-CD2 4.06Å; L149-Y336 HydrophobicContact CD1-CG 3.77Å; L149-Y336 HydrophobicContact CD2-CD1 4.13Å; L149-Y336 HydrophobicContact CD2-CG 4.41Å; L149-Y336 HydrophobicContact CG-CD1 4.27Å; L149-Y336 HydrophobicContact CG-CG 4.35Å; F152-Y336 HydrophobicContact CD2-CD2 4.38Å; F152-Y336 AromaticContact CD2-CE2 3.63Å; F152-Y336 HydrophobicContact CD2-CE2 3.63Å; F152-Y336 AromaticContact CE2-CE2 3.81Å; F152-Y336 HydrophobicContact CE2-CE2 3.81Å; G332-Y336 PolarHBondContact O-N 3.41Å; C333-Y336 WeakPolarHBondContact O-CB 3.35Å; C333-Y336 PolarHBondContact O-N 3.5Å; F334-Y336 VanDerWaalsContact C-N 3.29Å; F334-Y336 PolarHBondContact O-N 3.24Å; Y336-Y338 VanDerWaalsContact C-N 3.28Å; Y336-Y338 PolarHBondContact O-N 2.94Å; Y336-Y339 PolarHBondContact O-N 3.46Å; Y336-I340 HydrophobicContact CD2-CD1 3.71Å; Y336-I340 HydrophobicContact CD2-CG1 4.07Å; Y336-I340 HydrophobicContact CE2-CD1 3.88Å; Y336-I340 HydrophobicContact CE2-CG1 4.21Å; Y336-I340 WeakPolarHBondContact O-CG1 3.42Å; Y336-I340 PolarHBondContact O-N 3Å; Y336-L379 HydrophobicContact CD1-CD1 3.8Å; Y336-L379 HydrophobicContact CD1-CD2 3.45Å; Y336-L379 VanDerWaalsContact CD1-CD2 3.45Å; Y336-L379 HydrophobicContact CD1-CG 4.27Å; Y336-L379 HydrophobicContact CD2-CD1 3.77Å; Y336-L379 HydrophobicContact CE1-CD1 4.22Å; Y336-L379 HydrophobicContact CE1-CD2 3.91Å; Y336-L379 HydrophobicContact CE2-CD1 4.17Å; Y336-L379 HydrophobicContact CG-CD1 3.55Å; Y336-L379 HydrophobicContact CG-CD2 4Å; Y336-L379 HydrophobicContact CG-CG 4.45Å
337	V	93.7	Very high	91.7	Very high	30 Å²	30	39.4 Å²	39.4	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-39.1	174.3	171.3	0	0	0	0	111.2	C333 F334 I340 F341 L379	C333-V337 WeakPolarHBondContact O-CG2 3.21Å; C333-V337 PolarHBondContact O-N 3.05Å; F334-V337 PolarHBondContact O-N 2.87Å; V337-I340 PolarHBondContact O-N 3.09Å; V337-F341 HydrophobicContact CG1-CD2 3.88Å; V337-F341 HydrophobicContact CG1-CE2 3.85Å; V337-F341 WeakPolarHBondContact O-CD2 3.46Å; V337-F341 PolarHBondContact O-N 3.16Å; V337-L379 HydrophobicContact CG2-CB 3.98Å; V337-L379 HydrophobicContact CG2-CD1 4.25Å
338	Y	92.1	Very high	91	Very high	21 Å²	21	38.6 Å²	38.6	8%	0.082	20%	0.203	C	C	.	.	H	α-helix	trans	-57.5	-53.5	172.6	167.9	-89.8	0	0	0	112.6	F171 L173 L174 F334 F335 Y336 I340 F341 E342	F171-Y338 HydrophobicContact CD1-CE1 4.27Å; L173-Y338 HydrophobicContact CB-CE2 3.91Å; L173-Y338 HydrophobicContact CD2-CD2 4.3Å; L173-Y338 HydrophobicContact CD2-CE2 4.13Å; L173-Y338 HydrophobicContact CG-CE2 4.24Å; L174-Y338 HydrophobicContact CD1-CD2 4.11Å; L174-Y338 HydrophobicContact CD1-CE2 4.36Å; L174-Y338 HydrophobicContact CD1-CG 4.48Å; L174-Y338 HydrophobicContact CD2-CD2 3.56Å; L174-Y338 HydrophobicContact CD2-CE2 4.24Å; L174-Y338 HydrophobicContact CD2-CG 4.27Å; L174-Y338 HydrophobicContact CG-CD2 3.47Å; L174-Y338 VanDerWaalsContact CG-CD2 3.47Å; L174-Y338 HydrophobicContact CG-CE2 3.67Å; L174-Y338 HydrophobicContact CG-CG 4.27Å; F334-Y338 PolarHBondContact O-N 2.94Å; F335-Y338 WeakPolarHBondContact O-CB 3.45Å; F335-Y338 PolarHBondContact O-N 3.27Å; Y336-Y338 VanDerWaalsContact C-N 3.28Å; Y336-Y338 PolarHBondContact O-N 2.94Å; Y338-I340 VanDerWaalsContact C-N 3.27Å; Y338-I340 PolarHBondContact O-N 3.04Å; Y338-F341 WeakPolarHBondContact O-CB 3.2Å; Y338-F341 PolarHBondContact O-N 3.49Å; Y338-E342 WeakPolarHBondContact CE1-OE2 3.39Å; Y338-E342 PolarHBondContact O-N 2.86Å; Y338-E342 PolarHBondContact OH-OE2 3.37Å
339	Y	91.3	Very high	90.3	Very high	12 Å²	12	36 Å²	36	5%	0.047	18%	0.181	C	C	.	.	H	α-helix	trans	-64.5	-30.3	-179.8	-68.5	-62.3	0	0	0	112.6	L149 I153 T156 F335 Y336 E342 R343	L149-Y339 HydrophobicContact CD1-CD2 4.07Å; I153-Y339 HydrophobicContact CD1-CE2 4.22Å; I153-Y339 HydrophobicContact CG1-CD2 3.97Å; I153-Y339 HydrophobicContact CG1-CE2 3.41Å; I153-Y339 VanDerWaalsContact CG1-CE2 3.41Å; T156-Y339 HydrophobicContact CG2-CD1 4.12Å; T156-Y339 HydrophobicContact CG2-CE1 3.78Å; F335-Y339 HydrophobicContact CB-CD2 4.48Å; F335-Y339 HydrophobicContact CB-CE2 4.14Å; F335-Y339 HydrophobicContact CD1-CE2 4.47Å; F335-Y339 WeakPolarHBondContact O-CD2 3.42Å; F335-Y339 PolarHBondContact O-N 3.46Å; Y336-Y339 PolarHBondContact O-N 3.46Å; Y339-E342 PolarHBondContact O-N 3.46Å; Y339-R343 WeakPolarHBondContact O-CB 3.49Å; Y339-R343 PolarHBondContact O-N 2.87Å
340	I	92.3	Very high	89.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-44.1	171.1	-72.4	161.4	0	0	0	111.1	Y336 V337 Y338 E342 L344 C345 P372 L375 I376 L379	Y336-I340 HydrophobicContact CD2-CD1 3.71Å; Y336-I340 HydrophobicContact CD2-CG1 4.07Å; Y336-I340 HydrophobicContact CE2-CD1 3.88Å; Y336-I340 HydrophobicContact CE2-CG1 4.21Å; Y336-I340 WeakPolarHBondContact O-CG1 3.42Å; Y336-I340 PolarHBondContact O-N 3Å; V337-I340 PolarHBondContact O-N 3.09Å; Y338-I340 VanDerWaalsContact C-N 3.27Å; Y338-I340 PolarHBondContact O-N 3.04Å; I340-E342 VanDerWaalsContact C-N 3.33Å; I340-E342 PolarHBondContact O-N 2.95Å; I340-L344 HydrophobicContact CG1-CD1 4.48Å; I340-L344 HydrophobicContact CG2-CD1 4.21Å; I340-L344 WeakPolarHBondContact O-CA 3.32Å; I340-L344 VanDerWaalsContact O-CB 3.32Å; I340-L344 WeakPolarHBondContact O-CB 3.25Å; I340-L344 PolarHBondContact O-N 3.41Å; I340-C345 PolarHBondContact O-N 3.21Å; I340-C345 VanDerWaalsContact O-N 3.14Å; I340-P372 HydrophobicContact CG2-CB 3.76Å; I340-L375 HydrophobicContact CD1-CB 3.75Å; I340-L375 HydrophobicContact CD1-CD1 4.4Å; I340-I376 HydrophobicContact CG2-CD1 3.83Å; I340-I376 HydrophobicContact CG2-CG1 3.84Å; I340-L379 HydrophobicContact CD1-CD1 3.35Å
341	F	89.9	Confident	87.8	Confident	83 Å²	83	45.1 Å²	45.1	36%	0.364	22%	0.219	S	C	.	.	I	π-helix	trans	-63.2	-40.1	175.6	-90.6	-71.3	0	0	0	112.4	L173 V337 Y338 C345 A346 I376 L515	L173-F341 HydrophobicContact CD2-CB 4.41Å; V337-F341 HydrophobicContact CG1-CD2 3.88Å; V337-F341 HydrophobicContact CG1-CE2 3.85Å; V337-F341 WeakPolarHBondContact O-CD2 3.46Å; V337-F341 PolarHBondContact O-N 3.16Å; Y338-F341 WeakPolarHBondContact O-CB 3.2Å; Y338-F341 PolarHBondContact O-N 3.49Å; F341-C345 HydrophobicContact CD1-CB 3.98Å; F341-C345 CarbonylContact O-C 3.48Å; F341-C345 WeakPolarHBondContact O-CB 3.39Å; F341-C345 PolarHBondContact O-N 3.13Å; F341-A346 PolarHBondContact O-N 3.3Å; F341-I376 HydrophobicContact CE2-CD1 4.05Å; F341-I376 HydrophobicContact CZ-CD1 4.13Å; F341-L515 HydrophobicContact CE1-CD1 4.38Å
342	E	86.8	Confident	86.5	Confident	37 Å²	37	40 Å²	40	17%	0.173	20%	0.198	C	C	.	.	I	π-helix	trans	-71.2	-55.4	-179.8	-166	-154.1	121.5	0	0	112.2	T156 Y338 Y339 I340 A346 P347	T156-E342 WeakPolarHBondContact CG2-OE1 3.15Å; Y338-E342 WeakPolarHBondContact CE1-OE2 3.39Å; Y338-E342 PolarHBondContact O-N 2.86Å; Y338-E342 PolarHBondContact OH-OE2 3.37Å; Y339-E342 PolarHBondContact O-N 3.46Å; I340-E342 VanDerWaalsContact C-N 3.33Å; I340-E342 PolarHBondContact O-N 2.95Å; E342-A346 WeakPolarHBondContact O-CB 3.31Å; E342-P347 WeakPolarHBondContact O-CD 3.37Å
343	R	86.6	Confident	84.9	Confident	56 Å²	56	43.1 Å²	43.1	21%	0.211	21%	0.205	C	C	.	.	I	π-helix	trans	-85.8	-30.5	-170.6	-64.2	-73.8	151.3	-179.5	-6.6	114.1	F152 T156 V159 D160 Y339 P347	F152-R343 HydrophobicContact CD1-CB 4.4Å; T156-R343 PolarHBondContact OG1-NE 2.89Å; V159-R343 VanDerWaalsContact CG1-NH1 3.26Å; D160-R343 IonicContact OD1-CZ 2.73Å; D160-R343 IonicContact OD1-NH2 2.73Å; D160-R343 PolarHBondContact OD1-NH2 3.31Å; D160-R343 IonicContact OD2-NH2 3.05Å; Y339-R343 WeakPolarHBondContact O-CB 3.49Å; Y339-R343 PolarHBondContact O-N 2.87Å; R343-P347 WeakPolarHBondContact O-CG 3.28Å
344	L	89.1	Confident	83.1	Confident	40 Å²	40	49.5 Å²	49.5	21%	0.209	23%	0.233	C	C	.	.	I	π-helix	trans	-101.5	-46.3	-179.5	-55.3	-177.4	0	0	0	112.1	F152 I340 L348 P372 L375	F152-L344 HydrophobicContact CE1-CD2 4.32Å; F152-L344 HydrophobicContact CE1-CG 4.42Å; F152-L344 HydrophobicContact CZ-CD1 4.22Å; I340-L344 HydrophobicContact CG1-CD1 4.48Å; I340-L344 HydrophobicContact CG2-CD1 4.21Å; I340-L344 WeakPolarHBondContact O-CA 3.32Å; I340-L344 VanDerWaalsContact O-CB 3.32Å; I340-L344 WeakPolarHBondContact O-CB 3.25Å; I340-L344 PolarHBondContact O-N 3.41Å; L344-L348 VanDerWaalsContact O-CD1 3.3Å; L344-L348 WeakPolarHBondContact O-CD1 3.14Å; L344-L348 VanDerWaalsContact O-CG 3.28Å; L344-L348 WeakPolarHBondContact O-CG 3.27Å; L344-P372 HydrophobicContact CB-CB 3.95Å; L344-P372 HydrophobicContact CB-CG 4.28Å; L344-P372 HydrophobicContact CD1-CB 3.99Å; L344-L375 HydrophobicContact CD1-CD1 4.17Å
345	C	87.4	Confident	81.4	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.014	24%	0.242	C	C	.	.	I	π-helix	trans	-82.6	-43.3	-175.1	-56	0	0	0	0	113.2	I340 F341 L348 F349	I340-C345 PolarHBondContact O-N 3.21Å; I340-C345 VanDerWaalsContact O-N 3.14Å; F341-C345 HydrophobicContact CD1-CB 3.98Å; F341-C345 CarbonylContact O-C 3.48Å; F341-C345 WeakPolarHBondContact O-CB 3.39Å; F341-C345 PolarHBondContact O-N 3.13Å; C345-L348 PolarHBondContact O-N 3.31Å; C345-F349 HydrophobicContact CB-CD2 4.07Å; C345-F349 HydrophobicContact CB-CE2 4.04Å; C345-F349 WeakPolarHBondContact O-CD2 3.33Å; C345-F349 PolarHBondContact O-N 2.94Å
346	A	83.8	Confident	80	Confident	10 Å²	10	53.8 Å²	53.8	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-47.8	-175	0	0	0	0	0	114.3	F341 E342 L348 F349 R350	F341-A346 PolarHBondContact O-N 3.3Å; E342-A346 WeakPolarHBondContact O-CB 3.31Å; A346-L348 VanDerWaalsContact C-N 3.32Å; A346-L348 PolarHBondContact O-N 2.92Å; A346-F349 PolarHBondContact O-N 3.32Å; A346-R350 WeakPolarHBondContact O-CB 3.31Å; A346-R350 VanDerWaalsContact O-CG 3.25Å; A346-R350 WeakPolarHBondContact O-CG 3.41Å; A346-R350 PolarHBondContact O-N 2.88Å
347	P	84.1	Confident	78.6	Confident	64 Å²	64	58.5 Å²	58.5	42%	0.416	28%	0.283	S	S	.	.	H	α-helix	trans	-66.6	-34	178.5	25.8	-34.3	0	0	0	112.4	E342 R343 N351	E342-P347 WeakPolarHBondContact O-CD 3.37Å; R343-P347 WeakPolarHBondContact O-CG 3.28Å; P347-N351 PolarHBondContact O-ND2 3.03Å
348	L	82.4	Confident	77.8	Confident	47 Å²	47	59.7 Å²	59.7	25%	0.246	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-46.4	176.3	-72.1	177.6	0	0	0	111.8	L344 C345 A346 I352 N368	L344-L348 VanDerWaalsContact O-CD1 3.3Å; L344-L348 WeakPolarHBondContact O-CD1 3.14Å; L344-L348 VanDerWaalsContact O-CG 3.28Å; L344-L348 WeakPolarHBondContact O-CG 3.27Å; C345-L348 PolarHBondContact O-N 3.31Å; A346-L348 VanDerWaalsContact C-N 3.32Å; A346-L348 PolarHBondContact O-N 2.92Å; L348-I352 VanDerWaalsContact O-CD1 3.24Å; L348-I352 WeakPolarHBondContact O-CD1 3.41Å; L348-I352 WeakPolarHBondContact O-CG1 3.18Å; L348-N368 HydrophobicContact CD1-CB 3.9Å; L348-N368 HydrophobicContact CD2-CB 3.84Å
349	F	79.9	Confident	77.2	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-96.6	-26.7	-172	-58.7	-67.3	0	0	0	115.3	C345 A346 N351 I352 Y523	C345-F349 HydrophobicContact CB-CD2 4.07Å; C345-F349 HydrophobicContact CB-CE2 4.04Å; C345-F349 WeakPolarHBondContact O-CD2 3.33Å; C345-F349 PolarHBondContact O-N 2.94Å; A346-F349 PolarHBondContact O-N 3.32Å; F349-N351 VanDerWaalsContact C-N 3.3Å; F349-N351 PolarHBondContact O-N 2.97Å; F349-I352 HydrophobicContact CD1-CD1 3.83Å; F349-Y523 HydrophobicContact CB-CD2 3.38Å; F349-Y523 HydrophobicContact CB-CE2 3.41Å; F349-Y523 VanDerWaalsContact CB-CE2 3.41Å; F349-Y523 HydrophobicContact CB-CG 4.24Å; F349-Y523 HydrophobicContact CD2-CE2 4.28Å; F349-Y523 HydrophobicContact CG-CD2 4.11Å; F349-Y523 HydrophobicContact CG-CE2 4.11Å
350	R	74.4	Confident	76.9	Confident	142 Å²	142	70.9 Å²	70.9	54%	0.536	35%	0.351	S	S	.	.	H	α-helix	trans	-69.1	-28	177.7	-71.2	179.9	176	-173.8	-0	112.7	A346 K353 Y523	A346-R350 WeakPolarHBondContact O-CB 3.31Å; A346-R350 VanDerWaalsContact O-CG 3.25Å; A346-R350 WeakPolarHBondContact O-CG 3.41Å; A346-R350 PolarHBondContact O-N 2.88Å; R350-K353 WeakPolarHBondContact O-CE 3.46Å; R350-Y523 HydrophobicContact CG-CE1 4.28Å
351	N	66.8	Low	76.5	Confident	103 Å²	103	73.1 Å²	73.1	55%	0.551	36%	0.364	S	S	*	.	S	Bend	trans	-90.4	-9.5	-174.7	-66.4	-11.9	0	0	0	114.2	P347 F349 K353 Q354	P347-N351 PolarHBondContact O-ND2 3.03Å; F349-N351 VanDerWaalsContact C-N 3.3Å; F349-N351 PolarHBondContact O-N 2.97Å; N351-K353 PolarHBondContact O-N 3.32Å; N351-Q354 PolarHBondContact O-N 2.89Å
352	I	66.4	Low	76.2	Confident	26 Å²	26	71.4 Å²	71.4	13%	0.133	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-65.5	-7.4	-178.9	-62.5	169.3	0	0	0	112.8	L348 F349 Q354 Y548	L348-I352 VanDerWaalsContact O-CD1 3.24Å; L348-I352 WeakPolarHBondContact O-CD1 3.41Å; L348-I352 WeakPolarHBondContact O-CG1 3.18Å; F349-I352 HydrophobicContact CD1-CD1 3.83Å; I352-Q354 PolarHBondContact O-N 3.38Å; I352-Q354 VanDerWaalsContact O-N 3.14Å; I352-Y548 WeakPolarHBondContact O-CE2 3.42Å
353	K	60.8	Low	76.3	Confident	91 Å²	91	73.3 Å²	73.3	40%	0.396	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-56.6	-25.5	171.1	-51.1	-174	-143	-157.1	0	113.4	R350 N351 H527 Y548 F550	R350-K353 WeakPolarHBondContact O-CE 3.46Å; N351-K353 PolarHBondContact O-N 3.32Å; K353-H527 WeakPolarHBondContact CE-NE2 3.28Å; K353-H527 PolarHBondContact NZ-NE2 3.2Å; K353-Y548 HydrophobicContact CB-CD1 4.46Å; K353-Y548 HydrophobicContact CB-CE1 4.47Å; K353-Y548 HydrophobicContact CG-CE1 4.43Å; K353-F550 WeakPolarHBondContact O-CE1 3.11Å; K353-F550 WeakPolarHBondContact O-CZ 3.28Å
354	Q	58.5	Low	76.4	Confident	147 Å²	147	74.7 Å²	74.7	69%	0.687	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-91.6	-14.8	-168.1	-68.7	-179.9	-14.9	0	0	115.4	N351 I352	N351-Q354 PolarHBondContact O-N 2.89Å; I352-Q354 PolarHBondContact O-N 3.38Å; I352-Q354 VanDerWaalsContact O-N 3.14Å
355	E	57.4	Low	76.3	Confident	115 Å²	115	73.4 Å²	73.4	54%	0.537	38%	0.378	S	S	.	.	S	Bend	trans	-119.9	136.2	-172.6	-74.2	-71.1	163.5	0	0	111.7
356	P	61.4	Low	76.5	Confident	95 Å²	95	74 Å²	74	62%	0.617	38%	0.381	S	S	*	.			trans	-65.3	152.5	174.6	28.5	-34.6	0	0	0	111.5	S358	P356-S358 PolarHBondContact O-N 3.01Å
357	F	66.1	Low	76.9	Confident	103 Å²	103	79.5 Å²	79.5	45%	0.452	40%	0.404	S	S	.	.			trans	-64.4	92.7	-178.7	-169.4	-88	0	0	0	111.8	L362 W544	F357-L362 HydrophobicContact CE2-CD1 4.12Å; F357-L362 HydrophobicContact CZ-CD1 4.08Å; F357-L362 HydrophobicContact CZ-CD2 3.97Å; F357-L362 HydrophobicContact CZ-CG 4.45Å; F357-W544 AromaticContact CD1-CD1 3.93Å; F357-W544 AromaticContact CE1-CD1 3.4Å; F357-W544 VanDerWaalsContact CE1-CD1 3.4Å; F357-W544 AromaticContact CE1-NE1 3.36Å; F357-W544 AromaticContact CE2-CD1 3.94Å; F357-W544 AromaticContact CE2-NE1 3.96Å; F357-W544 AromaticContact CZ-CD1 3.42Å; F357-W544 VanDerWaalsContact CZ-CD1 3.42Å; F357-W544 AromaticContact CZ-NE1 3.14Å
358	S	76.3	Confident	77.3	Confident	56 Å²	56	80.7 Å²	80.7	39%	0.392	41%	0.406	S	S	.	.			trans	-109.4	140.3	176.9	175.5	0	0	0	0	110.6	P356 R360 V361 L362	P356-S358 PolarHBondContact O-N 3.01Å; S358-R360 PolarHBondContact O-N 3.43Å; S358-R360 VanDerWaalsContact O-N 3.15Å; S358-R360 PolarHBondContact OG-N 2.96Å; S358-V361 PolarHBondContact O-N 3.38Å; S358-L362 PolarHBondContact O-N 3.09Å
359	A	79.5	Confident	77.8	Confident	72 Å²	72	78.4 Å²	78.4	60%	0.595	40%	0.395	S	S	*	.	H	α-helix	trans	-55.9	-32.1	176	0	0	0	0	0	112.4	L362 V363	A359-L362 PolarHBondContact O-N 3.48Å; A359-V363 VanDerWaalsContact O-CG2 3.3Å; A359-V363 WeakPolarHBondContact O-CG2 3.37Å; A359-V363 PolarHBondContact O-N 3.44Å
360	R	84.6	Confident	78.5	Confident	196 Å²	196	79.9 Å²	79.9	74%	0.74	40%	0.402	S	S	*	.	H	α-helix	trans	-62.3	-46.6	174.2	-177.5	-178.9	177.3	-168.2	-1.3	111.8	S358 V363 L364	S358-R360 PolarHBondContact O-N 3.43Å; S358-R360 VanDerWaalsContact O-N 3.15Å; S358-R360 PolarHBondContact OG-N 2.96Å; R360-V363 PolarHBondContact O-N 3.43Å; R360-L364 HydrophobicContact CG-CD1 4.13Å; R360-L364 VanDerWaalsContact O-CG 3.31Å; R360-L364 WeakPolarHBondContact O-CG 3.34Å; R360-L364 PolarHBondContact O-N 3.49Å
361	V	83.6	Confident	79.4	Confident	46 Å²	46	78.4 Å²	78.4	28%	0.279	40%	0.404	S	S	.	.	H	α-helix	trans	-66.4	-41.5	179.6	178.4	0	0	0	0	110.2	S358 V363 L364 C365	S358-V361 PolarHBondContact O-N 3.38Å; V361-V363 PolarHBondContact O-N 2.84Å; V361-L364 PolarHBondContact O-N 3.07Å; V361-C365 VanDerWaalsContact O-CB 3.28Å; V361-C365 WeakPolarHBondContact O-CB 3.36Å; V361-C365 PolarHBondContact O-N 3.5Å
362	L	84.4	Confident	80.7	Confident	47 Å²	47	73.6 Å²	73.6	25%	0.246	38%	0.379	C	S	.	.	H	α-helix	trans	-59.3	-47.5	176.1	-171.4	69.8	0	0	0	112	F357 S358 A359 C365 V366 F517	F357-L362 HydrophobicContact CE2-CD1 4.12Å; F357-L362 HydrophobicContact CZ-CD1 4.08Å; F357-L362 HydrophobicContact CZ-CD2 3.97Å; F357-L362 HydrophobicContact CZ-CG 4.45Å; S358-L362 PolarHBondContact O-N 3.09Å; A359-L362 PolarHBondContact O-N 3.48Å; L362-C365 PolarHBondContact O-N 2.95Å; L362-V366 WeakPolarHBondContact O-CG2 3.35Å; L362-V366 PolarHBondContact O-N 3.11Å; L362-F517 HydrophobicContact CD1-CD1 4.47Å; L362-F517 HydrophobicContact CD1-CE1 3.79Å; L362-F517 HydrophobicContact CD2-CE1 4.42Å; L362-F517 HydrophobicContact CD2-CZ 4.47Å; L362-F517 HydrophobicContact CG-CE1 4.26Å
363	V	89	Confident	82.1	Confident	77 Å²	77	72.7 Å²	72.7	47%	0.467	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-44.5	179	169.5	0	0	0	0	111.3	A359 R360 V361 C365 V366 F367	A359-V363 VanDerWaalsContact O-CG2 3.3Å; A359-V363 WeakPolarHBondContact O-CG2 3.37Å; A359-V363 PolarHBondContact O-N 3.44Å; R360-V363 PolarHBondContact O-N 3.43Å; V361-V363 PolarHBondContact O-N 2.84Å; V363-C365 VanDerWaalsContact C-N 3.35Å; V363-C365 PolarHBondContact O-N 2.86Å; V363-V366 PolarHBondContact O-N 3.32Å; V363-F367 HydrophobicContact CG1-CD2 3.68Å; V363-F367 HydrophobicContact CG1-CE2 3.51Å; V363-F367 WeakPolarHBondContact O-CD2 3.25Å; V363-F367 PolarHBondContact O-N 2.92Å
364	L	88.2	Confident	83.7	Confident	86 Å²	86	69.1 Å²	69.1	45%	0.45	36%	0.362	S	S	.	.	H	α-helix	trans	-61.2	-42	174.9	-71.3	169.5	0	0	0	112	R360 V361 F367 N368	R360-L364 HydrophobicContact CG-CD1 4.13Å; R360-L364 VanDerWaalsContact O-CG 3.31Å; R360-L364 WeakPolarHBondContact O-CG 3.34Å; R360-L364 PolarHBondContact O-N 3.49Å; V361-L364 PolarHBondContact O-N 3.07Å; L364-F367 PolarHBondContact O-N 2.84Å; L364-N368 WeakPolarHBondContact O-CB 3.34Å; L364-N368 VanDerWaalsContact O-CG 3.27Å; L364-N368 PolarHBondContact O-N 3.1Å
365	C	87.9	Confident	85.4	Confident	12 Å²	12	63 Å²	63	8%	0.081	33%	0.334	C	S	.	.	H	α-helix	trans	-64.2	-41.1	177.7	-166.1	0	0	0	0	111.8	V361 L362 V363 S369	V361-C365 VanDerWaalsContact O-CB 3.28Å; V361-C365 WeakPolarHBondContact O-CB 3.36Å; V361-C365 PolarHBondContact O-N 3.5Å; L362-C365 PolarHBondContact O-N 2.95Å; V363-C365 VanDerWaalsContact C-N 3.35Å; V363-C365 PolarHBondContact O-N 2.86Å; C365-S369 VanDerWaalsContact O-CB 3.26Å; C365-S369 WeakPolarHBondContact O-CB 3.17Å; C365-S369 PolarHBondContact O-N 3.05Å; C365-S369 PolarHBondContact O-OG 2.97Å
366	V	91.3	Very high	87.2	Confident	15 Å²	15	59 Å²	59	9%	0.091	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-50.4	173.2	169.1	0	0	0	0	111	L362 V363 N368 S369 I370 L509 V513 C516 F517	L362-V366 WeakPolarHBondContact O-CG2 3.35Å; L362-V366 PolarHBondContact O-N 3.11Å; V363-V366 PolarHBondContact O-N 3.32Å; V366-N368 PolarHBondContact O-N 2.76Å; V366-S369 WeakPolarHBondContact O-CB 3.13Å; V366-S369 PolarHBondContact O-N 3.13Å; V366-S369 VanDerWaalsContact O-N 3.08Å; V366-I370 WeakPolarHBondContact O-CG1 3.39Å; V366-I370 PolarHBondContact O-N 2.79Å; V366-L509 HydrophobicContact CG1-CD1 4.22Å; V366-V513 HydrophobicContact CG1-CG2 3.69Å; V366-V513 HydrophobicContact CG2-CG2 4.33Å; V366-C516 HydrophobicContact CG2-CB 4.03Å; V366-F517 HydrophobicContact CG2-CE1 4.03Å
367	F	92.3	Very high	88.8	Confident	125 Å²	125	55.7 Å²	55.7	55%	0.548	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-45.4	179.4	-81.1	-64.4	0	0	0	112.5	V363 L364 S369 I370	V363-F367 HydrophobicContact CG1-CD2 3.68Å; V363-F367 HydrophobicContact CG1-CE2 3.51Å; V363-F367 WeakPolarHBondContact O-CD2 3.25Å; V363-F367 PolarHBondContact O-N 2.92Å; L364-F367 PolarHBondContact O-N 2.84Å; F367-S369 PolarHBondContact O-N 2.69Å; F367-I370 HydrophobicContact CD1-CD1 3.81Å; F367-I370 HydrophobicContact CE1-CD1 4.35Å; F367-I370 WeakPolarHBondContact O-CB 3.45Å; F367-I370 PolarHBondContact O-N 2.72Å; F367-I370 VanDerWaalsContact O-N 3.13Å
368	N	91.8	Very high	90.2	Very high	89 Å²	89	53.9 Å²	53.9	48%	0.476	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-25.7	176.1	-68.5	-9.6	0	0	0	112.5	L348 L364 V366 P372	L348-N368 HydrophobicContact CD1-CB 3.9Å; L348-N368 HydrophobicContact CD2-CB 3.84Å; L364-N368 WeakPolarHBondContact O-CB 3.34Å; L364-N368 VanDerWaalsContact O-CG 3.27Å; L364-N368 PolarHBondContact O-N 3.1Å; V366-N368 PolarHBondContact O-N 2.76Å; N368-P372 WeakPolarHBondContact O-CD 3.47Å
369	S	93.5	Very high	91.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-80.5	-13.5	175.5	-60	0	0	0	0	114.2	C365 V366 F367 P372 G373 G512	C365-S369 VanDerWaalsContact O-CB 3.26Å; C365-S369 WeakPolarHBondContact O-CB 3.17Å; C365-S369 PolarHBondContact O-N 3.05Å; C365-S369 PolarHBondContact O-OG 2.97Å; V366-S369 WeakPolarHBondContact O-CB 3.13Å; V366-S369 PolarHBondContact O-N 3.13Å; V366-S369 VanDerWaalsContact O-N 3.08Å; F367-S369 PolarHBondContact O-N 2.69Å; S369-P372 WeakPolarHBondContact O-CG 3.49Å; S369-G373 PolarHBondContact O-N 3.35Å; S369-G512 WeakPolarHBondContact CB-O 3.49Å
370	I	94.8	Very high	91.8	Very high	34 Å²	34	51.5 Å²	51.5	17%	0.174	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-49.3	179.1	-67.4	172.9	0	0	0	110.5	V366 F367 G373 V374 F508 L509	V366-I370 WeakPolarHBondContact O-CG1 3.39Å; V366-I370 PolarHBondContact O-N 2.79Å; F367-I370 HydrophobicContact CD1-CD1 3.81Å; F367-I370 HydrophobicContact CE1-CD1 4.35Å; F367-I370 WeakPolarHBondContact O-CB 3.45Å; F367-I370 PolarHBondContact O-N 2.72Å; F367-I370 VanDerWaalsContact O-N 3.13Å; I370-G373 PolarHBondContact O-N 2.73Å; I370-V374 HydrophobicContact CG2-CG2 4.06Å; I370-V374 WeakPolarHBondContact O-CB 3.47Å; I370-V374 VanDerWaalsContact O-CG2 3.27Å; I370-V374 WeakPolarHBondContact O-CG2 3.48Å; I370-V374 PolarHBondContact O-N 2.73Å; I370-F508 HydrophobicContact CG2-CB 3.96Å; I370-L509 HydrophobicContact CD1-CD1 4.34Å
371	L	93.5	Very high	92.4	Very high	111 Å²	111	42.7 Å²	42.7	58%	0.581	23%	0.228	S	C	*	.	H	α-helix	trans	-57.2	-55.6	-178.5	179.4	63.3	0	0	0	113	G373 V374 L375	L371-G373 VanDerWaalsContact C-N 3.32Å; L371-G373 PolarHBondContact O-N 2.73Å; L371-V374 PolarHBondContact O-N 3.45Å; L371-L375 HydrophobicContact CD1-CD1 4.19Å; L371-L375 HydrophobicContact CD1-CG 4.37Å; L371-L375 HydrophobicContact CG-CD1 4.26Å; L371-L375 WeakPolarHBondContact O-CG 3.34Å; L371-L375 PolarHBondContact O-N 3.36Å
372	P	94.5	Very high	93	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.013	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-36.8	175.8	23.3	-32.1	0	0	0	112.4	I340 L344 N368 S369 V374 L375 I376 L515	I340-P372 HydrophobicContact CG2-CB 3.76Å; L344-P372 HydrophobicContact CB-CB 3.95Å; L344-P372 HydrophobicContact CB-CG 4.28Å; L344-P372 HydrophobicContact CD1-CB 3.99Å; N368-P372 WeakPolarHBondContact O-CD 3.47Å; S369-P372 WeakPolarHBondContact O-CG 3.49Å; P372-V374 VanDerWaalsContact C-N 3.34Å; P372-V374 PolarHBondContact O-N 2.86Å; P372-L375 PolarHBondContact O-N 3.42Å; P372-I376 WeakPolarHBondContact O-CB 3.26Å; P372-I376 WeakPolarHBondContact O-CD1 3.37Å; P372-I376 VanDerWaalsContact O-CG1 3.27Å; P372-I376 WeakPolarHBondContact O-CG1 3.47Å; P372-I376 PolarHBondContact O-N 2.72Å; P372-L515 HydrophobicContact CB-CD2 3.96Å; P372-L515 HydrophobicContact CG-CD2 3.89Å
373	G	94.3	Very high	93.6	Very high	7 Å²	7	40.4 Å²	40.4	7%	0.072	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-37.3	177.3	0	0	0	0	0	113.7	S369 I370 L371 L377	S369-G373 PolarHBondContact O-N 3.35Å; I370-G373 PolarHBondContact O-N 2.73Å; L371-G373 VanDerWaalsContact C-N 3.32Å; L371-G373 PolarHBondContact O-N 2.73Å; G373-L377 WeakPolarHBondContact O-CB 3.46Å; G373-L377 PolarHBondContact O-N 3.15Å
374	V	95	Very high	93.9	Very high	17 Å²	17	41.5 Å²	41.5	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-73.8	-42	176.2	172.3	0	0	0	0	111.5	I370 L371 P372 L377 F378 F508	I370-V374 HydrophobicContact CG2-CG2 4.06Å; I370-V374 WeakPolarHBondContact O-CB 3.47Å; I370-V374 VanDerWaalsContact O-CG2 3.27Å; I370-V374 WeakPolarHBondContact O-CG2 3.48Å; I370-V374 PolarHBondContact O-N 2.73Å; L371-V374 PolarHBondContact O-N 3.45Å; P372-V374 VanDerWaalsContact C-N 3.34Å; P372-V374 PolarHBondContact O-N 2.86Å; V374-L377 WeakPolarHBondContact O-CB 3.48Å; V374-L377 PolarHBondContact O-N 2.98Å; V374-F378 HydrophobicContact CG1-CD2 3.69Å; V374-F378 HydrophobicContact CG1-CE2 3.49Å; V374-F378 VanDerWaalsContact CG1-CE2 3.49Å; V374-F378 VanDerWaalsContact O-CD2 3.25Å; V374-F378 WeakPolarHBondContact O-CD2 3.16Å; V374-F378 PolarHBondContact O-N 3.35Å; V374-F508 HydrophobicContact CB-CD1 4.32Å; V374-F508 HydrophobicContact CB-CE1 4.41Å; V374-F508 HydrophobicContact CG1-CD1 4.02Å; V374-F508 HydrophobicContact CG1-CE1 3.62Å; V374-F508 HydrophobicContact CG1-CZ 4.24Å; V374-F508 HydrophobicContact CG2-CB 4.01Å; V374-F508 HydrophobicContact CG2-CD1 3.27Å; V374-F508 HydrophobicContact CG2-CE1 3.8Å; V374-F508 HydrophobicContact CG2-CG 3.75Å
375	L	94.6	Very high	94.2	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.099	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-45.4	174.5	-68.2	172.8	0	0	0	111.7	F145 I340 L344 L371 P372 L377 F378 L379	F145-L375 HydrophobicContact CE1-CD2 3.93Å; F145-L375 HydrophobicContact CZ-CD2 4.49Å; I340-L375 HydrophobicContact CD1-CB 3.75Å; I340-L375 HydrophobicContact CD1-CD1 4.4Å; L344-L375 HydrophobicContact CD1-CD1 4.17Å; L371-L375 HydrophobicContact CD1-CD1 4.19Å; L371-L375 HydrophobicContact CD1-CG 4.37Å; L371-L375 HydrophobicContact CG-CD1 4.26Å; L371-L375 WeakPolarHBondContact O-CG 3.34Å; L371-L375 PolarHBondContact O-N 3.36Å; P372-L375 PolarHBondContact O-N 3.42Å; L375-L377 VanDerWaalsContact C-N 3.32Å; L375-L377 PolarHBondContact O-N 3.1Å; L375-F378 PolarHBondContact O-N 3.19Å; L375-L379 WeakPolarHBondContact O-CB 3.32Å; L375-L379 VanDerWaalsContact O-CG 3.31Å; L375-L379 WeakPolarHBondContact O-CG 3.48Å; L375-L379 PolarHBondContact O-N 3.41Å
376	I	95.1	Very high	94.6	Very high	29 Å²	29	37.3 Å²	37.3	15%	0.149	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-41.1	175.2	-72.5	161.9	0	0	0	111	I340 F341 P372 T380 L515	I340-I376 HydrophobicContact CG2-CD1 3.83Å; I340-I376 HydrophobicContact CG2-CG1 3.84Å; F341-I376 HydrophobicContact CE2-CD1 4.05Å; F341-I376 HydrophobicContact CZ-CD1 4.13Å; P372-I376 WeakPolarHBondContact O-CB 3.26Å; P372-I376 WeakPolarHBondContact O-CD1 3.37Å; P372-I376 VanDerWaalsContact O-CG1 3.27Å; P372-I376 WeakPolarHBondContact O-CG1 3.47Å; P372-I376 PolarHBondContact O-N 2.72Å; I376-T380 WeakPolarHBondContact O-CB 3.36Å; I376-T380 PolarHBondContact O-N 3.13Å; I376-T380 PolarHBondContact O-OG1 3.4Å; I376-L515 HydrophobicContact CD1-CD1 4.33Å; I376-L515 HydrophobicContact CD1-CD2 4.25Å
377	L	94.8	Very high	94.8	Very high	27 Å²	27	36.6 Å²	36.6	14%	0.141	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-54.1	176	179.8	76.2	0	0	0	111.3	G373 V374 L375 L379 T380 F381 W420 L507 N511	G373-L377 WeakPolarHBondContact O-CB 3.46Å; G373-L377 PolarHBondContact O-N 3.15Å; V374-L377 WeakPolarHBondContact O-CB 3.48Å; V374-L377 PolarHBondContact O-N 2.98Å; L375-L377 VanDerWaalsContact C-N 3.32Å; L375-L377 PolarHBondContact O-N 3.1Å; L377-L379 PolarHBondContact O-N 3.5Å; L377-T380 PolarHBondContact O-N 3.27Å; L377-F381 WeakPolarHBondContact O-CB 3.49Å; L377-F381 PolarHBondContact O-N 3.14Å; L377-W420 HydrophobicContact CD1-CH2 3.48Å; L377-W420 VanDerWaalsContact CD1-CH2 3.48Å; L377-W420 HydrophobicContact CD1-CZ2 3.74Å; L377-W420 HydrophobicContact CD1-CZ3 4.39Å; L377-W420 HydrophobicContact CD2-CH2 4Å; L377-W420 HydrophobicContact CD2-CZ3 4.28Å; L377-W420 HydrophobicContact CG-CH2 3.69Å; L377-W420 HydrophobicContact CG-CZ2 4.4Å; L377-W420 HydrophobicContact CG-CZ3 4.45Å; L377-L507 HydrophobicContact CD2-CD1 4.4Å; L377-L507 HydrophobicContact CD2-CD2 3.54Å; L377-L507 HydrophobicContact CD2-CG 4.3Å; L377-N511 WeakPolarHBondContact CB-ND2 3.2Å; L377-N511 WeakPolarHBondContact CD2-ND2 3.48Å
378	F	95.3	Very high	95.1	Very high	64 Å²	64	35.4 Å²	35.4	28%	0.281	18%	0.178	S	C	.	.	H	α-helix	trans	-62.9	-43.3	-178	-79	-63.8	0	0	0	112.1	V374 L375 F381 F382 W407 W504	V374-F378 HydrophobicContact CG1-CD2 3.69Å; V374-F378 HydrophobicContact CG1-CE2 3.49Å; V374-F378 VanDerWaalsContact CG1-CE2 3.49Å; V374-F378 VanDerWaalsContact O-CD2 3.25Å; V374-F378 WeakPolarHBondContact O-CD2 3.16Å; V374-F378 PolarHBondContact O-N 3.35Å; L375-F378 PolarHBondContact O-N 3.19Å; F378-F381 PolarHBondContact O-N 2.97Å; F378-F382 WeakPolarHBondContact O-CB 3.45Å; F378-F382 PolarHBondContact O-N 3.05Å; F378-W407 HydrophobicContact CD1-CH2 4.2Å; F378-W407 HydrophobicContact CD1-CZ2 4.42Å; F378-W407 AromaticContact CE1-CH2 3.65Å; F378-W407 HydrophobicContact CE1-CH2 3.65Å; F378-W407 HydrophobicContact CE1-CZ2 4.18Å; F378-W407 HydrophobicContact CZ-CH2 4.45Å; F378-W504 AromaticContact CE1-CH2 3.84Å; F378-W504 HydrophobicContact CE1-CH2 3.84Å; F378-W504 HydrophobicContact CE1-CZ3 4.26Å; F378-W504 HydrophobicContact CE2-CZ3 4.42Å; F378-W504 AromaticContact CZ-CH2 3.53Å; F378-W504 HydrophobicContact CZ-CH2 3.53Å; F378-W504 AromaticContact CZ-CZ3 3.62Å; F378-W504 HydrophobicContact CZ-CZ3 3.62Å
379	L	95.7	Very high	95.3	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-40.4	178.5	-72.1	167.7	0	0	0	112.2	C333 Y336 V337 I340 L375 L377 F382 A383	C333-L379 HydrophobicContact CB-CD2 4.46Å; Y336-L379 HydrophobicContact CD1-CD1 3.8Å; Y336-L379 HydrophobicContact CD1-CD2 3.45Å; Y336-L379 VanDerWaalsContact CD1-CD2 3.45Å; Y336-L379 HydrophobicContact CD1-CG 4.27Å; Y336-L379 HydrophobicContact CD2-CD1 3.77Å; Y336-L379 HydrophobicContact CE1-CD1 4.22Å; Y336-L379 HydrophobicContact CE1-CD2 3.91Å; Y336-L379 HydrophobicContact CE2-CD1 4.17Å; Y336-L379 HydrophobicContact CG-CD1 3.55Å; Y336-L379 HydrophobicContact CG-CD2 4Å; Y336-L379 HydrophobicContact CG-CG 4.45Å; V337-L379 HydrophobicContact CG2-CB 3.98Å; V337-L379 HydrophobicContact CG2-CD1 4.25Å; I340-L379 HydrophobicContact CD1-CD1 3.35Å; L375-L379 WeakPolarHBondContact O-CB 3.32Å; L375-L379 VanDerWaalsContact O-CG 3.31Å; L375-L379 WeakPolarHBondContact O-CG 3.48Å; L375-L379 PolarHBondContact O-N 3.41Å; L377-L379 PolarHBondContact O-N 3.5Å; L379-F382 PolarHBondContact O-N 2.97Å; L379-A383 WeakPolarHBondContact O-CB 3.5Å; L379-A383 PolarHBondContact O-N 2.96Å
380	T	94.6	Very high	95.5	Very high	71 Å²	71	32.1 Å²	32.1	44%	0.436	16%	0.16	S	C	.	.	H	α-helix	trans	-68.6	-39.8	177.3	-59.7	0	0	0	0	111.1	I376 L377 F384	I376-T380 WeakPolarHBondContact O-CB 3.36Å; I376-T380 PolarHBondContact O-N 3.13Å; I376-T380 PolarHBondContact O-OG1 3.4Å; L377-T380 PolarHBondContact O-N 3.27Å; T380-F384 VanDerWaalsContact O-CB 3.27Å; T380-F384 WeakPolarHBondContact O-CB 3.42Å; T380-F384 PolarHBondContact O-N 3.07Å
381	F	96.1	Very high	95.6	Very high	11 Å²	11	30.5 Å²	30.5	5%	0.048	15%	0.152	C	C	.	.	I	π-helix	trans	-58.9	-52	172	168.8	-96.7	0	0	0	111.4	L377 F378 L385 H386 Y404 W407 W420	L377-F381 WeakPolarHBondContact O-CB 3.49Å; L377-F381 PolarHBondContact O-N 3.14Å; F378-F381 PolarHBondContact O-N 2.97Å; F381-L385 HydrophobicContact CD2-CB 4.14Å; F381-L385 HydrophobicContact CD2-CD1 4.2Å; F381-L385 HydrophobicContact CD2-CD2 4.11Å; F381-L385 HydrophobicContact CD2-CG 4.39Å; F381-L385 HydrophobicContact CE2-CB 4.12Å; F381-L385 HydrophobicContact CE2-CD2 4.1Å; F381-L385 WeakPolarHBondContact O-CA 3.24Å; F381-L385 WeakPolarHBondContact O-CB 3.33Å; F381-L385 PolarHBondContact O-N 3.3Å; F381-H386 PolarHBondContact O-N 2.93Å; F381-Y404 HydrophobicContact CE2-CD1 4.11Å; F381-Y404 HydrophobicContact CE2-CD2 4.17Å; F381-Y404 AromaticContact CE2-CG 3.82Å; F381-Y404 HydrophobicContact CE2-CG 3.82Å; F381-Y404 HydrophobicContact CZ-CD1 4.01Å; F381-Y404 AromaticContact CZ-CD2 3.59Å; F381-Y404 HydrophobicContact CZ-CD2 3.59Å; F381-Y404 HydrophobicContact CZ-CE1 4.25Å; F381-Y404 AromaticContact CZ-CE2 3.82Å; F381-Y404 HydrophobicContact CZ-CE2 3.82Å; F381-Y404 AromaticContact CZ-CG 3.68Å; F381-Y404 HydrophobicContact CZ-CG 3.68Å; F381-W407 HydrophobicContact CD1-CZ2 4.23Å; F381-W407 AromaticContact CD2-NE1 3.69Å; F381-W407 HydrophobicContact CE1-CZ2 4.37Å; F381-W407 AromaticContact CE1-NE1 3.64Å; F381-W407 AromaticContact CE2-CD1 3.76Å; F381-W407 AromaticContact CE2-NE1 3.12Å; F381-W407 HydrophobicContact CG-CZ2 4.33Å; F381-W407 AromaticContact CZ-CD1 3.89Å; F381-W407 AromaticContact CZ-NE1 3.1Å; F381-W420 HydrophobicContact CB-CH2 3.7Å; F381-W420 HydrophobicContact CB-CZ2 3.9Å; F381-W420 HydrophobicContact CD2-CD2 4.5Å; F381-W420 HydrophobicContact CD2-CE3 4.49Å; F381-W420 AromaticContact CD2-CH2 3.91Å; F381-W420 HydrophobicContact CD2-CH2 3.91Å; F381-W420 AromaticContact CD2-CZ2 3.92Å; F381-W420 HydrophobicContact CD2-CZ2 3.92Å; F381-W420 HydrophobicContact CD2-CZ3 4.24Å; F381-W420 HydrophobicContact CG-CH2 4.01Å; F381-W420 HydrophobicContact CG-CZ2 4.3Å
382	F	96.1	Very high	95.7	Very high	29 Å²	29	27.5 Å²	27.5	13%	0.127	13%	0.134	C	C	.	.	I	π-helix	trans	-64.6	-52.1	-178.8	-177.7	-103.4	0	0	0	111.7	L129 Y142 Q329 F378 L379 F384 H386 C387	L129-F382 HydrophobicContact CD2-CD2 3.54Å; L129-F382 HydrophobicContact CD2-CE2 3.7Å; Y142-F382 HydrophobicContact CD2-CZ 4.2Å; Y142-F382 HydrophobicContact CE2-CE1 4.15Å; Y142-F382 AromaticContact CE2-CZ 3.82Å; Y142-F382 HydrophobicContact CE2-CZ 3.82Å; Q329-F382 HydrophobicContact CB-CE1 4.5Å; F378-F382 WeakPolarHBondContact O-CB 3.45Å; F378-F382 PolarHBondContact O-N 3.05Å; L379-F382 PolarHBondContact O-N 2.97Å; F382-F384 PolarHBondContact O-N 3.19Å; F382-H386 HydrophobicContact CD2-CB 4.29Å; F382-H386 AromaticContact CD2-CD2 3.94Å; F382-H386 AromaticContact CE2-CD2 3.47Å; F382-H386 VanDerWaalsContact CE2-CD2 3.47Å; F382-H386 WeakPolarHBondContact CE2-CD2 3.31Å; F382-H386 CarbonylContact O-C 3.6Å; F382-H386 WeakPolarHBondContact O-CA 3.42Å; F382-H386 VanDerWaalsContact O-CB 3.3Å; F382-H386 WeakPolarHBondContact O-CB 3.39Å; F382-H386 PolarHBondContact O-N 3.15Å; F382-C387 WeakPolarHBondContact CE1-SG 3.3Å; F382-C387 VanDerWaalsContact CZ-SG 3.57Å; F382-C387 PolarHBondContact O-N 3.21Å
383	A	96.6	Very high	95.8	Very high	15 Å²	15	27.4 Å²	27.4	12%	0.124	13%	0.134	C	C	.	.	I	π-helix	trans	-61.6	-46.1	-178.6	0	0	0	0	0	112.6	C333 L379 W388	C333-A383 HydrophobicContact CB-CB 3.67Å; L379-A383 WeakPolarHBondContact O-CB 3.5Å; L379-A383 PolarHBondContact O-N 2.96Å; A383-W388 VanDerWaalsContact O-CB 3.27Å; A383-W388 WeakPolarHBondContact O-CB 3.47Å; A383-W388 PolarHBondContact O-N 3.44Å
384	F	95.3	Very high	95.9	Very high	100 Å²	100	27.1 Å²	27.1	44%	0.439	13%	0.131	S	C	.	.	I	π-helix	trans	-86.7	-57.2	-175.4	-171.3	-106	0	0	0	113	T380 F382 W388 L389	T380-F384 VanDerWaalsContact O-CB 3.27Å; T380-F384 WeakPolarHBondContact O-CB 3.42Å; T380-F384 PolarHBondContact O-N 3.07Å; F382-F384 PolarHBondContact O-N 3.19Å; F384-W388 HydrophobicContact CD2-CB 4.44Å; F384-W388 AromaticContact CD2-CD1 3.9Å; F384-W388 HydrophobicContact CD2-CG 4.26Å; F384-W388 AromaticContact CE2-CD1 3.74Å; F384-W388 HydrophobicContact CE2-CG 4.49Å; F384-W388 WeakPolarHBondContact O-CB 3.09Å; F384-L389 WeakPolarHBondContact O-CG 3.49Å; F384-L389 PolarHBondContact O-N 3.33Å
385	L	95.4	Very high	96	Very high	9 Å²	9	29.7 Å²	29.7	5%	0.047	14%	0.142	C	C	.	.	I	π-helix	trans	-76.7	-30.6	-172.1	-74.3	87.5	0	0	0	113.1	F381 Y404 W420 N421	F381-L385 HydrophobicContact CD2-CB 4.14Å; F381-L385 HydrophobicContact CD2-CD1 4.2Å; F381-L385 HydrophobicContact CD2-CD2 4.11Å; F381-L385 HydrophobicContact CD2-CG 4.39Å; F381-L385 HydrophobicContact CE2-CB 4.12Å; F381-L385 HydrophobicContact CE2-CD2 4.1Å; F381-L385 WeakPolarHBondContact O-CA 3.24Å; F381-L385 WeakPolarHBondContact O-CB 3.33Å; F381-L385 PolarHBondContact O-N 3.3Å; L385-Y404 HydrophobicContact CB-CD1 4.04Å; L385-W420 WeakPolarHBondContact CD2-O 3.38Å; L385-N421 HydrophobicContact CD2-CB 3.78Å
386	H	95.9	Very high	96.1	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.009	15%	0.146	C	C	.	.	I	π-helix	trans	-92.7	-73.7	173.8	-178.8	71.6	0	0	0	111.1	L129 D130 Q326 F381 F382 N390 Y404	L129-H386 HydrophobicContact CD2-CB 4.48Å; D130-H386 IonicContact OD1-CE1 2.77Å; D130-H386 PolarHBondContact OD1-CE1 3.18Å; D130-H386 IonicContact OD1-NE2 3.23Å; Q326-H386 PolarHBondContact NE2-NE2 3.35Å; F381-H386 PolarHBondContact O-N 2.93Å; F382-H386 HydrophobicContact CD2-CB 4.29Å; F382-H386 AromaticContact CD2-CD2 3.94Å; F382-H386 AromaticContact CE2-CD2 3.47Å; F382-H386 VanDerWaalsContact CE2-CD2 3.47Å; F382-H386 WeakPolarHBondContact CE2-CD2 3.31Å; F382-H386 CarbonylContact O-C 3.6Å; F382-H386 WeakPolarHBondContact O-CA 3.42Å; F382-H386 VanDerWaalsContact O-CB 3.3Å; F382-H386 WeakPolarHBondContact O-CB 3.39Å; F382-H386 PolarHBondContact O-N 3.15Å; H386-N390 PolarHBondContact ND1-ND2 3.19Å; H386-N390 VanDerWaalsContact ND1-ND2 3.16Å; H386-N390 WeakPolarHBondContact O-CB 3.12Å; H386-N390 PolarHBondContact O-N 2.78Å; H386-N390 PolarHBondContact O-ND2 3.46Å; H386-Y404 HydrophobicContact CB-CE1 4.02Å; H386-Y404 PolarHBondContact ND1-OH 3.01Å
387	C	96.9	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-64.8	-53.2	-166.4	-57	0	0	0	0	113.4	Q326 Q329 V330 F382 N390 A391	Q326-C387 PolarHBondContact OE1-SG 3.2Å; Q329-C387 HydrophobicContact CB-CB 4.45Å; Q329-C387 PolarHBondContact OE1-SG 2.78Å; Q329-C387 VanDerWaalsContact OE1-SG 3.32Å; V330-C387 HydrophobicContact CG2-CB 3.51Å; F382-C387 WeakPolarHBondContact CE1-SG 3.3Å; F382-C387 VanDerWaalsContact CZ-SG 3.57Å; F382-C387 PolarHBondContact O-N 3.21Å; C387-N390 PolarHBondContact O-N 3.44Å; C387-A391 VanDerWaalsContact O-CB 3.32Å; C387-A391 WeakPolarHBondContact O-CB 3.43Å; C387-A391 PolarHBondContact O-N 2.89Å
388	W	97.2	Very high	96.2	Very high	99 Å²	99	32.5 Å²	32.5	38%	0.375	15%	0.15	S	C	.	.	I	π-helix	trans	-63.7	-51.8	-177.6	-179	-94.9	0	0	0	112.1	F327 V330 A383 F384 N390 A391 F392	F327-W388 HydrophobicContact CD1-CE3 4.41Å; F327-W388 HydrophobicContact CD1-CZ3 4.39Å; F327-W388 AromaticContact CE1-CE3 3.94Å; F327-W388 HydrophobicContact CE1-CE3 3.94Å; F327-W388 AromaticContact CE1-CZ3 3.84Å; F327-W388 HydrophobicContact CE1-CZ3 3.84Å; V330-W388 HydrophobicContact CG1-CE3 4.1Å; V330-W388 HydrophobicContact CG2-CB 4.05Å; V330-W388 HydrophobicContact CG2-CE3 4.41Å; A383-W388 VanDerWaalsContact O-CB 3.27Å; A383-W388 WeakPolarHBondContact O-CB 3.47Å; A383-W388 PolarHBondContact O-N 3.44Å; F384-W388 HydrophobicContact CD2-CB 4.44Å; F384-W388 AromaticContact CD2-CD1 3.9Å; F384-W388 HydrophobicContact CD2-CG 4.26Å; F384-W388 AromaticContact CE2-CD1 3.74Å; F384-W388 HydrophobicContact CE2-CG 4.49Å; F384-W388 WeakPolarHBondContact O-CB 3.09Å; W388-N390 VanDerWaalsContact C-N 3.33Å; W388-N390 PolarHBondContact O-N 3.5Å; W388-A391 PolarHBondContact O-N 3.06Å; W388-F392 HydrophobicContact CD2-CD2 4.13Å; W388-F392 AromaticContact CD2-CE2 3.8Å; W388-F392 HydrophobicContact CD2-CE2 3.8Å; W388-F392 AromaticContact CE2-CD2 3.92Å; W388-F392 AromaticContact CE2-CE2 3.38Å; W388-F392 HydrophobicContact CE3-CE2 4.16Å; W388-F392 HydrophobicContact CG-CD2 4.33Å; W388-F392 HydrophobicContact CG-CE2 4.45Å; W388-F392 AromaticContact CH2-CE2 3.86Å; W388-F392 HydrophobicContact CH2-CE2 3.86Å; W388-F392 HydrophobicContact CH2-CZ 4.31Å; W388-F392 HydrophobicContact CZ2-CD2 4.4Å; W388-F392 AromaticContact CZ2-CE2 3.44Å; W388-F392 HydrophobicContact CZ2-CE2 3.44Å; W388-F392 VanDerWaalsContact CZ2-CE2 3.44Å; W388-F392 AromaticContact CZ2-CZ 3.92Å; W388-F392 HydrophobicContact CZ2-CZ 3.92Å; W388-F392 HydrophobicContact CZ3-CE2 4.2Å; W388-F392 AromaticContact NE1-CD2 3.91Å; W388-F392 AromaticContact NE1-CE2 3.79Å; W388-F392 WeakPolarHBondContact O-CD2 3.32Å; W388-F392 PolarHBondContact O-N 2.85Å
389	L	96.7	Very high	96	Very high	20 Å²	20	29.5 Å²	29.5	11%	0.105	14%	0.137	C	C	.	.	H	α-helix	trans	-63.6	-36	178.7	-66.3	-178.2	0	0	0	112.6	P304 F384 A393 F403 V423	P304-L389 HydrophobicContact CB-CB 4.27Å; P304-L389 HydrophobicContact CB-CD2 3.84Å; F384-L389 WeakPolarHBondContact O-CG 3.49Å; F384-L389 PolarHBondContact O-N 3.33Å; L389-A393 VanDerWaalsContact O-CB 3.25Å; L389-A393 WeakPolarHBondContact O-CB 3.16Å; L389-A393 PolarHBondContact O-N 2.65Å; L389-F403 HydrophobicContact CB-CD2 3.51Å; L389-F403 HydrophobicContact CB-CE2 3.65Å; L389-F403 HydrophobicContact CB-CG 3.99Å; L389-F403 HydrophobicContact CB-CZ 4.23Å; L389-F403 HydrophobicContact CD1-CB 3.79Å; L389-F403 HydrophobicContact CD1-CD1 4.16Å; L389-F403 HydrophobicContact CD1-CD2 4.12Å; L389-F403 HydrophobicContact CD1-CG 3.74Å; L389-F403 HydrophobicContact CG-CD2 4.48Å; L389-V423 HydrophobicContact CD1-CG2 4.48Å
390	N	96.8	Very high	95.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-71.7	-34.2	174.7	-76.9	-53.8	0	0	0	113.3	S127 Y322 H386 C387 W388 A393 E394 R401	S127-N390 VanDerWaalsContact CB-ND2 3.34Å; S127-N390 WeakPolarHBondContact CB-ND2 3.12Å; S127-N390 PolarHBondContact OG-ND2 3.38Å; S127-N390 VanDerWaalsContact OG-ND2 3.15Å; Y322-N390 HydrophobicContact CE1-CB 4.28Å; H386-N390 PolarHBondContact ND1-ND2 3.19Å; H386-N390 VanDerWaalsContact ND1-ND2 3.16Å; H386-N390 WeakPolarHBondContact O-CB 3.12Å; H386-N390 PolarHBondContact O-N 2.78Å; H386-N390 PolarHBondContact O-ND2 3.46Å; C387-N390 PolarHBondContact O-N 3.44Å; W388-N390 VanDerWaalsContact C-N 3.33Å; W388-N390 PolarHBondContact O-N 3.5Å; N390-A393 PolarHBondContact O-N 3.28Å; N390-E394 WeakPolarHBondContact O-CB 3.11Å; N390-E394 PolarHBondContact O-N 3.31Å; N390-R401 WeakPolarHBondContact OD1-CD 3.13Å
391	A	96.6	Very high	95.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-47.9	173.7	0	0	0	0	0	111.3	Q326 F327 C387 W388 E394 M395	Q326-A391 HydrophobicContact CB-CB 3.94Å; F327-A391 HydrophobicContact CD2-CB 4.05Å; F327-A391 HydrophobicContact CE1-CB 4.29Å; F327-A391 HydrophobicContact CE2-CB 3.78Å; F327-A391 HydrophobicContact CG-CB 4.42Å; F327-A391 HydrophobicContact CZ-CB 3.9Å; C387-A391 VanDerWaalsContact O-CB 3.32Å; C387-A391 WeakPolarHBondContact O-CB 3.43Å; C387-A391 PolarHBondContact O-N 2.89Å; W388-A391 PolarHBondContact O-N 3.06Å; A391-E394 PolarHBondContact O-N 2.84Å; A391-M395 VanDerWaalsContact O-CB 3.31Å; A391-M395 WeakPolarHBondContact O-CB 3.31Å; A391-M395 PolarHBondContact O-N 2.89Å
392	F	96.7	Very high	95.8	Very high	48 Å²	48	28.1 Å²	28.1	21%	0.211	13%	0.126	C	C	.	.	H	α-helix	trans	-66.3	-35.4	173.7	-83.5	-90.3	0	0	0	112.6	F327 W388 L396	F327-F392 HydrophobicContact CE1-CE2 4.11Å; F327-F392 HydrophobicContact CZ-CD2 4.34Å; F327-F392 AromaticContact CZ-CE2 3.96Å; F327-F392 HydrophobicContact CZ-CE2 3.96Å; W388-F392 HydrophobicContact CD2-CD2 4.13Å; W388-F392 AromaticContact CD2-CE2 3.8Å; W388-F392 HydrophobicContact CD2-CE2 3.8Å; W388-F392 AromaticContact CE2-CD2 3.92Å; W388-F392 AromaticContact CE2-CE2 3.38Å; W388-F392 HydrophobicContact CE3-CE2 4.16Å; W388-F392 HydrophobicContact CG-CD2 4.33Å; W388-F392 HydrophobicContact CG-CE2 4.45Å; W388-F392 AromaticContact CH2-CE2 3.86Å; W388-F392 HydrophobicContact CH2-CE2 3.86Å; W388-F392 HydrophobicContact CH2-CZ 4.31Å; W388-F392 HydrophobicContact CZ2-CD2 4.4Å; W388-F392 AromaticContact CZ2-CE2 3.44Å; W388-F392 HydrophobicContact CZ2-CE2 3.44Å; W388-F392 VanDerWaalsContact CZ2-CE2 3.44Å; W388-F392 AromaticContact CZ2-CZ 3.92Å; W388-F392 HydrophobicContact CZ2-CZ 3.92Å; W388-F392 HydrophobicContact CZ3-CE2 4.2Å; W388-F392 AromaticContact NE1-CD2 3.91Å; W388-F392 AromaticContact NE1-CE2 3.79Å; W388-F392 WeakPolarHBondContact O-CD2 3.32Å; W388-F392 PolarHBondContact O-N 2.85Å; F392-L396 WeakPolarHBondContact O-CB 3.33Å; F392-L396 WeakPolarHBondContact O-CG 3.34Å; F392-L396 PolarHBondContact O-N 3.34Å
393	A	96.4	Very high	95.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.8	-48.9	175.3	0	0	0	0	0	112.1	P304 L389 N390 R397 F398 R401 F403	P304-A393 HydrophobicContact CG-CB 3.9Å; L389-A393 VanDerWaalsContact O-CB 3.25Å; L389-A393 WeakPolarHBondContact O-CB 3.16Å; L389-A393 PolarHBondContact O-N 2.65Å; N390-A393 PolarHBondContact O-N 3.28Å; A393-R397 CarbonylContact O-C 3.6Å; A393-R397 PolarHBondContact O-N 3.31Å; A393-R397 VanDerWaalsContact O-N 3.13Å; A393-F398 HydrophobicContact CB-CB 4.27Å; A393-F398 HydrophobicContact CB-CD1 4.35Å; A393-F398 PolarHBondContact O-N 3.45Å; A393-R401 HydrophobicContact CB-CG 4.28Å; A393-F403 HydrophobicContact CB-CE2 4.28Å; A393-F403 HydrophobicContact CB-CZ 3.95Å
394	E	96.8	Very high	95.7	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-48.4	178.1	-174	78.8	-142.6	0	0	110.7	V318 R319 Y322 V323 N390 A391 L396 R397 R401	V318-E394 HydrophobicContact CG1-CG 4.44Å; R319-E394 HydrophobicContact CB-CG 4.49Å; R319-E394 VanDerWaalsContact CB-OE1 3.31Å; R319-E394 WeakPolarHBondContact CB-OE1 3.5Å; R319-E394 WeakPolarHBondContact CG-OE1 3.43Å; R319-E394 IonicContact CZ-OE1 2.98Å; R319-E394 IonicContact CZ-OE2 2.82Å; R319-E394 PolarHBondContact N-OE1 2.8Å; R319-E394 IonicContact NE-OE1 3.2Å; R319-E394 PolarHBondContact NE-OE1 2.79Å; R319-E394 VanDerWaalsContact NE-OE1 3.11Å; R319-E394 IonicContact NE-OE2 3.38Å; R319-E394 PolarHBondContact NE-OE2 2.89Å; R319-E394 IonicContact NH2-OE1 3.92Å; R319-E394 IonicContact NH2-OE2 2.83Å; R319-E394 PolarHBondContact NH2-OE2 3.4Å; Y322-E394 HydrophobicContact CD1-CB 4.08Å; Y322-E394 HydrophobicContact CD1-CG 3.92Å; Y322-E394 HydrophobicContact CE1-CB 4.32Å; V323-E394 HydrophobicContact CG2-CB 3.81Å; V323-E394 HydrophobicContact CG2-CG 3.5Å; V323-E394 VanDerWaalsContact CG2-CG 3.5Å; N390-E394 WeakPolarHBondContact O-CB 3.11Å; N390-E394 PolarHBondContact O-N 3.31Å; A391-E394 PolarHBondContact O-N 2.84Å; E394-L396 VanDerWaalsContact C-N 3.34Å; E394-L396 PolarHBondContact O-N 3.4Å; E394-R397 PolarHBondContact O-N 2.86Å; E394-R401 IonicContact OE1-NH2 3.02Å; E394-R401 IonicContact OE2-CZ 2.68Å; E394-R401 IonicContact OE2-NH1 3.61Å; E394-R401 PolarHBondContact OE2-NH1 3.08Å; E394-R401 IonicContact OE2-NH2 3.28Å; E394-R401 PolarHBondContact OE2-NH2 3.19Å
395	M	96.6	Very high	95.6	Very high	71 Å²	71	25.2 Å²	25.2	35%	0.35	11%	0.11	S	C	.	.	H	α-helix	trans	-58.1	-41.5	-179.9	-171.9	-170.6	-62.5	0	0	112.9	W320 V323 F327 A391 R397	W320-M395 HydrophobicContact CH2-CG 4.26Å; W320-M395 HydrophobicContact CZ3-CG 4.31Å; V323-M395 HydrophobicContact CG1-CE 4.12Å; F327-M395 HydrophobicContact CE2-CE 3.63Å; F327-M395 HydrophobicContact CZ-CE 3.98Å; A391-M395 VanDerWaalsContact O-CB 3.31Å; A391-M395 WeakPolarHBondContact O-CB 3.31Å; A391-M395 PolarHBondContact O-N 2.89Å; M395-R397 VanDerWaalsContact C-N 3.3Å; M395-R397 PolarHBondContact O-N 3Å
396	L	95.6	Very high	95.5	Very high	33 Å²	33	27.9 Å²	27.9	17%	0.173	12%	0.124	C	C	.	.	H	α-helix	trans	-82	-7.5	178.9	-66.5	170.4	0	0	0	113.5	Y299 F302 R314 F392 E394	Y299-L396 HydrophobicContact CD2-CD2 4.47Å; Y299-L396 HydrophobicContact CE2-CB 3.87Å; Y299-L396 HydrophobicContact CE2-CD2 4.28Å; Y299-L396 WeakPolarHBondContact CE2-O 3.09Å; Y299-L396 PolarHBondContact OH-O 3.28Å; Y299-L396 VanDerWaalsContact OH-O 3.1Å; F302-L396 VanDerWaalsContact C-CD1 3.44Å; F302-L396 HydrophobicContact CB-CD1 3.85Å; F302-L396 HydrophobicContact CB-CD2 4.25Å; F302-L396 WeakPolarHBondContact O-CD1 3.42Å; R314-L396 PolarHBondContact NH2-O 2.98Å; F392-L396 WeakPolarHBondContact O-CB 3.33Å; F392-L396 WeakPolarHBondContact O-CG 3.34Å; F392-L396 PolarHBondContact O-N 3.34Å; E394-L396 VanDerWaalsContact C-N 3.34Å; E394-L396 PolarHBondContact O-N 3.4Å
397	R	95.9	Very high	95.4	Very high	100 Å²	100	27.9 Å²	27.9	38%	0.377	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	37.2	-166.5	-58.3	-178.7	-75.7	170.1	-6	113.3	R314 N315 V318 A393 E394 M395	R314-R397 CarbonylContact C-O 3.58Å; R314-R397 WeakPolarHBondContact CA-O 3.33Å; R314-R397 WeakPolarHBondContact CB-O 3.29Å; N315-R397 HydrophobicContact CB-CB 4.48Å; N315-R397 PolarHBondContact N-O 3.42Å; N315-R397 WeakPolarHBondContact O-CD 3.45Å; V318-R397 HydrophobicContact CG2-CG 3.35Å; A393-R397 CarbonylContact O-C 3.6Å; A393-R397 PolarHBondContact O-N 3.31Å; A393-R397 VanDerWaalsContact O-N 3.13Å; E394-R397 PolarHBondContact O-N 2.86Å; M395-R397 VanDerWaalsContact C-N 3.3Å; M395-R397 PolarHBondContact O-N 3Å
398	F	96.3	Very high	95.2	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-79.1	129.4	173.9	-173.5	-110.9	0	0	0	111.5	F122 P304 T305 Y312 N315 A393 D400 F403	F122-F398 HydrophobicContact CD1-CE2 4.48Å; F122-F398 AromaticContact CD1-CZ 3.98Å; F122-F398 HydrophobicContact CD1-CZ 3.98Å; F122-F398 HydrophobicContact CE1-CZ 4.03Å; P304-F398 HydrophobicContact CG-CB 4.5Å; P304-F398 HydrophobicContact CG-CD1 3.6Å; P304-F398 HydrophobicContact CG-CE1 4.04Å; P304-F398 HydrophobicContact CG-CG 4.23Å; T305-F398 HydrophobicContact CG2-CE2 4.11Å; T305-F398 HydrophobicContact CG2-CZ 3.94Å; Y312-F398 AromaticContact CD1-CE2 3.64Å; Y312-F398 HydrophobicContact CD1-CE2 3.64Å; Y312-F398 HydrophobicContact CE1-CE2 4.36Å; Y312-F398 HydrophobicContact CG-CD2 4.21Å; Y312-F398 AromaticContact CG-CE2 3.77Å; Y312-F398 HydrophobicContact CG-CE2 3.77Å; N315-F398 PolarHBondContact ND2-O 3.42Å; A393-F398 HydrophobicContact CB-CB 4.27Å; A393-F398 HydrophobicContact CB-CD1 4.35Å; A393-F398 PolarHBondContact O-N 3.45Å; F398-D400 HydrophobicContact CE1-CB 4.12Å; F398-D400 WeakPolarHBondContact CE1-O 3.36Å; F398-D400 HydrophobicContact CZ-CB 4.14Å; F398-F403 HydrophobicContact CD1-CE1 4.45Å; F398-F403 HydrophobicContact CD1-CZ 4.34Å; F398-F403 HydrophobicContact CE1-CE1 4.07Å; F398-F403 HydrophobicContact CE1-CZ 4.39Å
399	G	92.3	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.14	C	C	.	.			trans	-92.8	-22.6	-170	0	0	0	0	0	116.6	A124 R125 P313 R401	A124-G399 WeakPolarHBondContact CA-O 3.09Å; R125-G399 PolarHBondContact N-O 3.29Å; P313-G399 WeakPolarHBondContact O-CA 3.36Å; P313-G399 PolarHBondContact O-N 2.86Å; G399-R401 PolarHBondContact O-N 3.43Å
400	D	94	Very high	94.5	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-94	92.8	-177.3	-175.6	-2.8	0	0	0	111.4	F122 I123 R125 P313 F398 M402	F122-D400 HydrophobicContact CB-CB 4.32Å; F122-D400 HydrophobicContact CD1-CB 3.96Å; F122-D400 WeakPolarHBondContact CD1-OD2 3.34Å; I123-D400 WeakPolarHBondContact O-CA 3.4Å; I123-D400 VanDerWaalsContact O-CB 3.29Å; I123-D400 WeakPolarHBondContact O-CB 3.44Å; R125-D400 IonicContact CZ-OD1 3.55Å; R125-D400 IonicContact CZ-OD2 3.24Å; R125-D400 IonicContact NE-OD1 3.58Å; R125-D400 PolarHBondContact NE-OD1 2.88Å; R125-D400 VanDerWaalsContact NH2-CG 3.3Å; R125-D400 IonicContact NH2-OD1 2.72Å; R125-D400 PolarHBondContact NH2-OD1 3Å; R125-D400 IonicContact NH2-OD2 2.73Å; R125-D400 PolarHBondContact NH2-OD2 2.91Å; P313-D400 HydrophobicContact CG-CB 4.24Å; F398-D400 HydrophobicContact CE1-CB 4.12Å; F398-D400 WeakPolarHBondContact CE1-O 3.36Å; F398-D400 HydrophobicContact CZ-CB 4.14Å; D400-M402 PolarHBondContact OD1-N 2.87Å
401	R	93.6	Very high	94	Very high	11 Å²	11	30.9 Å²	30.9	4%	0.042	15%	0.145	C	C	.	.			trans	-94.6	17.8	-174.5	-55.5	-175.9	-167.2	-158.4	3.2	115	R125 S127 N315 N390 A393 E394 G399 F403	R125-R401 WeakPolarHBondContact O-CB 3.38Å; R125-R401 PolarHBondContact O-N 2.82Å; R125-R401 VanDerWaalsContact O-N 3.12Å; S127-R401 PolarHBondContact OG-O 2.85Å; N315-R401 PolarHBondContact ND2-NH2 3.03Å; N390-R401 WeakPolarHBondContact OD1-CD 3.13Å; A393-R401 HydrophobicContact CB-CG 4.28Å; E394-R401 IonicContact OE1-NH2 3.02Å; E394-R401 IonicContact OE2-CZ 2.68Å; E394-R401 IonicContact OE2-NH1 3.61Å; E394-R401 PolarHBondContact OE2-NH1 3.08Å; E394-R401 IonicContact OE2-NH2 3.28Å; E394-R401 PolarHBondContact OE2-NH2 3.19Å; G399-R401 PolarHBondContact O-N 3.43Å; R401-F403 VanDerWaalsContact C-N 3.29Å; R401-F403 HydrophobicContact CB-CE2 4.17Å; R401-F403 HydrophobicContact CB-CZ 4.44Å; R401-F403 PolarHBondContact O-N 2.79Å
402	M	93.5	Very high	93.5	Very high	47 Å²	47	31 Å²	31	23%	0.232	15%	0.145	C	C	.	.			trans	-80.7	76.7	172.3	-175.5	-171.1	-98.9	0	0	110.5	R125 D400 Y404 K405	R125-M402 VanDerWaalsContact CZ-SD 3.59Å; R125-M402 VanDerWaalsContact NE-CB 3.27Å; R125-M402 PolarHBondContact NH1-SD 2.79Å; D400-M402 PolarHBondContact OD1-N 2.87Å; M402-Y404 WeakPolarHBondContact CG-O 3.05Å; M402-K405 HydrophobicContact CE-CD 3.91Å; M402-K405 HydrophobicContact CE-CG 4.07Å; M402-K405 HydrophobicContact CG-CG 4.33Å; M402-K405 HydrophobicContact SD-CD 4.18Å; M402-K405 VanDerWaalsContact SD-CE 3.54Å; M402-K405 HydrophobicContact SD-CG 4.16Å
403	F	95	Very high	92.9	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.018	14%	0.139	C	C	.	.	S	Bend	trans	-81.9	-18.8	172.2	-51.3	-51	0	0	0	112.7	P304 L389 A393 F398 R401 V422 V423	P304-F403 HydrophobicContact CB-CE1 3.77Å; P304-F403 HydrophobicContact CB-CZ 3.81Å; P304-F403 HydrophobicContact CG-CE1 3.82Å; P304-F403 HydrophobicContact CG-CZ 3.61Å; P304-F403 VanDerWaalsContact O-CE1 3.26Å; P304-F403 WeakPolarHBondContact O-CE1 3.46Å; L389-F403 HydrophobicContact CB-CD2 3.51Å; L389-F403 HydrophobicContact CB-CE2 3.65Å; L389-F403 HydrophobicContact CB-CG 3.99Å; L389-F403 HydrophobicContact CB-CZ 4.23Å; L389-F403 HydrophobicContact CD1-CB 3.79Å; L389-F403 HydrophobicContact CD1-CD1 4.16Å; L389-F403 HydrophobicContact CD1-CD2 4.12Å; L389-F403 HydrophobicContact CD1-CG 3.74Å; L389-F403 HydrophobicContact CG-CD2 4.48Å; A393-F403 HydrophobicContact CB-CE2 4.28Å; A393-F403 HydrophobicContact CB-CZ 3.95Å; F398-F403 HydrophobicContact CD1-CE1 4.45Å; F398-F403 HydrophobicContact CD1-CZ 4.34Å; F398-F403 HydrophobicContact CE1-CE1 4.07Å; F398-F403 HydrophobicContact CE1-CZ 4.39Å; R401-F403 VanDerWaalsContact C-N 3.29Å; R401-F403 HydrophobicContact CB-CE2 4.17Å; R401-F403 HydrophobicContact CB-CZ 4.44Å; R401-F403 PolarHBondContact O-N 2.79Å; F403-V422 WeakPolarHBondContact O-CB 3.27Å; F403-V422 PolarHBondContact O-N 3.11Å; F403-V423 HydrophobicContact CB-CG2 4.08Å; F403-V423 HydrophobicContact CD1-CG2 3.61Å; F403-V423 HydrophobicContact CG-CG2 4.28Å
404	Y	95.9	Very high	92.3	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.008	15%	0.146	C	C	.	.			trans	-152.4	173.7	177.7	56	-89.4	0	0	0	109.6	S127 L128 L129 F381 L385 H386 M402 T419 W420	S127-Y404 PolarHBondContact OG-OH 2.87Å; L128-Y404 HydrophobicContact CB-CE2 4.23Å; L129-Y404 HydrophobicContact CB-CE2 4.12Å; L129-Y404 WeakPolarHBondContact CB-OH 3.26Å; L129-Y404 PolarHBondContact N-OH 3.3Å; F381-Y404 HydrophobicContact CE2-CD1 4.11Å; F381-Y404 HydrophobicContact CE2-CD2 4.17Å; F381-Y404 AromaticContact CE2-CG 3.82Å; F381-Y404 HydrophobicContact CE2-CG 3.82Å; F381-Y404 HydrophobicContact CZ-CD1 4.01Å; F381-Y404 AromaticContact CZ-CD2 3.59Å; F381-Y404 HydrophobicContact CZ-CD2 3.59Å; F381-Y404 HydrophobicContact CZ-CE1 4.25Å; F381-Y404 AromaticContact CZ-CE2 3.82Å; F381-Y404 HydrophobicContact CZ-CE2 3.82Å; F381-Y404 AromaticContact CZ-CG 3.68Å; F381-Y404 HydrophobicContact CZ-CG 3.68Å; L385-Y404 HydrophobicContact CB-CD1 4.04Å; H386-Y404 HydrophobicContact CB-CE1 4.02Å; H386-Y404 PolarHBondContact ND1-OH 3.01Å; M402-Y404 WeakPolarHBondContact CG-O 3.05Å; Y404-T419 CarbonylContact C-O 3.56Å; Y404-T419 WeakPolarHBondContact CA-O 3.43Å; Y404-W420 WeakPolarHBondContact CB-O 3.24Å
405	K	93.9	Very high	91.9	Very high	77 Å²	77	32.7 Å²	32.7	34%	0.335	16%	0.157	S	C	.	.			trans	-127.8	-164.4	169	-43.6	-163	-171.5	-168.5	0	110.7	M402 W407 T419 V422	M402-K405 HydrophobicContact CE-CD 3.91Å; M402-K405 HydrophobicContact CE-CG 4.07Å; M402-K405 HydrophobicContact CG-CG 4.33Å; M402-K405 HydrophobicContact SD-CD 4.18Å; M402-K405 VanDerWaalsContact SD-CE 3.54Å; M402-K405 HydrophobicContact SD-CG 4.16Å; K405-W407 VanDerWaalsContact O-CD1 3.31Å; K405-W407 PolarHBondContact O-N 3.1Å; K405-T419 HydrophobicContact CB-CG2 3.91Å; K405-T419 HydrophobicContact CD-CG2 4.17Å; K405-T419 HydrophobicContact CG-CG2 4.2Å; K405-T419 PolarHBondContact N-O 3Å; K405-V422 HydrophobicContact CG-CG2 4.07Å
406	D	92.9	Very high	91.6	Very high	65 Å²	65	30.7 Å²	30.7	35%	0.348	15%	0.146	S	C	.	.			trans	-68.7	53.5	176.4	61.2	-43.6	0	0	0	113.3	L128 W408 N409	L128-D406 HydrophobicContact CD2-CB 3.98Å; L128-D406 VanDerWaalsContact CD2-N 3.32Å; D406-W408 HydrophobicContact CB-CZ2 4.16Å; D406-W408 PolarHBondContact O-N 3.27Å; D406-W408 VanDerWaalsContact O-N 3.1Å; D406-N409 PolarHBondContact O-N 3.2Å
407	W	93.9	Very high	91.3	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.008	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-59.5	-27.1	-175.1	62.5	-100.6	0	0	0	113.1	F378 F381 K405 N409 S410 Y416 T419 W420 W504	F378-W407 HydrophobicContact CD1-CH2 4.2Å; F378-W407 HydrophobicContact CD1-CZ2 4.42Å; F378-W407 AromaticContact CE1-CH2 3.65Å; F378-W407 HydrophobicContact CE1-CH2 3.65Å; F378-W407 HydrophobicContact CE1-CZ2 4.18Å; F378-W407 HydrophobicContact CZ-CH2 4.45Å; F381-W407 HydrophobicContact CD1-CZ2 4.23Å; F381-W407 AromaticContact CD2-NE1 3.69Å; F381-W407 HydrophobicContact CE1-CZ2 4.37Å; F381-W407 AromaticContact CE1-NE1 3.64Å; F381-W407 AromaticContact CE2-CD1 3.76Å; F381-W407 AromaticContact CE2-NE1 3.12Å; F381-W407 HydrophobicContact CG-CZ2 4.33Å; F381-W407 AromaticContact CZ-CD1 3.89Å; F381-W407 AromaticContact CZ-NE1 3.1Å; K405-W407 VanDerWaalsContact O-CD1 3.31Å; K405-W407 PolarHBondContact O-N 3.1Å; W407-N409 PolarHBondContact O-N 3.25Å; W407-S410 WeakPolarHBondContact O-CB 3.01Å; W407-S410 PolarHBondContact O-N 3.46Å; W407-S410 VanDerWaalsContact O-N 3.11Å; W407-S410 PolarHBondContact O-OG 2.99Å; W407-Y416 HydrophobicContact CB-CD2 4.49Å; W407-Y416 HydrophobicContact CE3-CD2 4.16Å; W407-Y416 AromaticContact CE3-CE2 3.83Å; W407-Y416 HydrophobicContact CE3-CE2 3.83Å; W407-Y416 HydrophobicContact CZ3-CE2 4.37Å; W407-T419 VanDerWaalsContact CA-OG1 3.3Å; W407-T419 WeakPolarHBondContact CA-OG1 3.35Å; W407-T419 VanDerWaalsContact CB-OG1 3.27Å; W407-T419 WeakPolarHBondContact CB-OG1 3.35Å; W407-W420 AromaticContact CD2-CE3 3.45Å; W407-W420 HydrophobicContact CD2-CE3 3.45Å; W407-W420 VanDerWaalsContact CD2-CE3 3.45Å; W407-W420 AromaticContact CD2-CZ3 3.67Å; W407-W420 HydrophobicContact CD2-CZ3 3.67Å; W407-W420 AromaticContact CE2-CE3 3.6Å; W407-W420 AromaticContact CE2-CZ3 3.43Å; W407-W420 VanDerWaalsContact CE2-CZ3 3.43Å; W407-W420 AromaticContact CE3-CE3 3.71Å; W407-W420 HydrophobicContact CE3-CE3 3.71Å; W407-W420 AromaticContact CE3-CZ3 3.75Å; W407-W420 HydrophobicContact CE3-CZ3 3.75Å; W407-W420 AromaticContact CG-CE3 3.87Å; W407-W420 HydrophobicContact CG-CE3 3.87Å; W407-W420 HydrophobicContact CG-CZ3 4.5Å; W407-W420 HydrophobicContact CH2-CE3 4.27Å; W407-W420 HydrophobicContact CH2-CH2 4.35Å; W407-W420 AromaticContact CH2-CZ3 3.48Å; W407-W420 HydrophobicContact CH2-CZ3 3.48Å; W407-W420 VanDerWaalsContact CH2-CZ3 3.48Å; W407-W420 HydrophobicContact CZ2-CE3 4.04Å; W407-W420 HydrophobicContact CZ2-CH2 4.14Å; W407-W420 AromaticContact CZ2-CZ3 3.36Å; W407-W420 HydrophobicContact CZ2-CZ3 3.36Å; W407-W420 HydrophobicContact CZ3-CE3 4.1Å; W407-W420 AromaticContact CZ3-CZ3 3.65Å; W407-W420 HydrophobicContact CZ3-CZ3 3.65Å; W407-W420 AromaticContact NE1-CE3 3.97Å; W407-W504 HydrophobicContact CE3-CH2 4.39Å; W407-W504 AromaticContact CH2-CH2 3.5Å; W407-W504 HydrophobicContact CH2-CH2 3.5Å; W407-W504 HydrophobicContact CH2-CZ2 4.33Å; W407-W504 HydrophobicContact CH2-CZ3 4.15Å; W407-W504 AromaticContact CZ3-CH2 3.27Å; W407-W504 HydrophobicContact CZ3-CH2 3.27Å; W407-W504 AromaticContact CZ3-CZ2 3.82Å; W407-W504 HydrophobicContact CZ3-CZ2 3.82Å; W407-W504 AromaticContact CZ3-CZ3 3.87Å; W407-W504 HydrophobicContact CZ3-CZ3 3.87Å
408	W	92.7	Very high	91	Very high	57 Å²	57	30.1 Å²	30.1	22%	0.216	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-64.6	-19.4	175.8	51.3	84.6	0	0	0	114.5	L128 L132 D406 N500 W504	L128-W408 HydrophobicContact CD2-CH2 3.82Å; L128-W408 HydrophobicContact CD2-CZ2 3.97Å; L128-W408 HydrophobicContact CG-CH2 4.41Å; L132-W408 HydrophobicContact CD2-CZ2 4Å; D406-W408 HydrophobicContact CB-CZ2 4.16Å; D406-W408 PolarHBondContact O-N 3.27Å; D406-W408 VanDerWaalsContact O-N 3.1Å; W408-N500 PolarHBondContact O-ND2 3.15Å; W408-N500 PolarHBondContact O-OD1 3.34Å; W408-W504 HydrophobicContact CB-CH2 4.38Å; W408-W504 HydrophobicContact CB-CZ2 3.65Å; W408-W504 PolarHBondContact O-NE1 3.04Å
409	N	91.6	Very high	90.8	Very high	91 Å²	91	30.4 Å²	30.4	49%	0.487	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-93.3	7.2	175	-69.7	-25.8	0	0	0	113	D406 W407 T411	D406-N409 PolarHBondContact O-N 3.2Å; W407-N409 PolarHBondContact O-N 3.25Å; N409-T411 PolarHBondContact O-N 2.94Å
410	S	87.8	Confident	90.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.152	C	C	.	.			trans	-71.9	111.4	-174	-64.6	0	0	0	0	113.1	W407 S412 N415 Y416 N500	W407-S410 WeakPolarHBondContact O-CB 3.01Å; W407-S410 PolarHBondContact O-N 3.46Å; W407-S410 VanDerWaalsContact O-N 3.11Å; W407-S410 PolarHBondContact O-OG 2.99Å; S410-S412 VanDerWaalsContact C-N 3.25Å; S410-S412 PolarHBondContact O-N 3.14Å; S410-N415 PolarHBondContact OG-ND2 2.96Å; S410-Y416 PolarHBondContact OG-N 3Å; S410-N500 PolarHBondContact O-OD1 3.33Å
411	T	86.4	Confident	91	Very high	35 Å²	35	33.9 Å²	33.9	22%	0.215	16%	0.159	C	C	.	.	S	Bend	trans	-78.2	-4.2	171.1	53.3	0	0	0	0	114	N409 V490 W499 N500	N409-T411 PolarHBondContact O-N 2.94Å; T411-V490 WeakPolarHBondContact O-CG1 3.39Å; T411-W499 VanDerWaalsContact O-CB 3.24Å; T411-W499 WeakPolarHBondContact O-CB 3.37Å; T411-N500 HydrophobicContact CG2-CB 4.43Å
412	S	86	Confident	91	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.007	16%	0.159	C	C	.	.	S	Bend	trans	-141.5	145.3	178.7	173.4	0	0	0	0	111.4	S410 S414 N415 Y416 V490	S410-S412 VanDerWaalsContact C-N 3.25Å; S410-S412 PolarHBondContact O-N 3.14Å; S412-S414 VanDerWaalsContact C-N 3.25Å; S412-S414 PolarHBondContact O-N 3.42Å; S412-S414 WeakPolarHBondContact OG-CB 3.31Å; S412-S414 PolarHBondContact OG-N 2.82Å; S412-S414 VanDerWaalsContact OG-N 3.15Å; S412-N415 WeakPolarHBondContact O-CA 3.37Å; S412-N415 WeakPolarHBondContact O-CB 3.33Å; S412-N415 PolarHBondContact O-N 2.79Å; S412-Y416 PolarHBondContact O-N 3.36Å; S412-V490 VanDerWaalsContact CB-O 3.25Å; S412-V490 WeakPolarHBondContact CB-O 3.48Å; S412-V490 PolarHBondContact OG-O 3.15Å
413	Y	84.1	Confident	91.1	Very high	19 Å²	19	32.2 Å²	32.2	8%	0.075	15%	0.153	C	C	.	.	H	α-helix	trans	-59.6	-34.1	170.9	-89.2	-90.9	0	0	0	112.9	N415 Y416 Y417 F486 M503 S506	Y413-N415 VanDerWaalsContact C-N 3.28Å; Y413-N415 PolarHBondContact O-N 3.29Å; Y413-Y416 PolarHBondContact O-N 3.33Å; Y413-Y417 AromaticContact CD1-CE2 3.91Å; Y413-Y417 HydrophobicContact CD1-CE2 3.91Å; Y413-Y417 WeakPolarHBondContact O-CD2 3.46Å; Y413-Y417 PolarHBondContact O-N 2.99Å; Y413-F486 HydrophobicContact CD2-CB 3.36Å; Y413-F486 HydrophobicContact CD2-CD2 4.37Å; Y413-F486 HydrophobicContact CD2-CG 4.06Å; Y413-F486 HydrophobicContact CE2-CB 3.6Å; Y413-F486 AromaticContact CE2-CD2 3.73Å; Y413-F486 HydrophobicContact CE2-CD2 3.73Å; Y413-F486 AromaticContact CE2-CG 3.76Å; Y413-F486 HydrophobicContact CE2-CG 3.76Å; Y413-F486 HydrophobicContact CG-CB 3.92Å; Y413-F486 AromaticContact CZ-CD2 3.91Å; Y413-M503 HydrophobicContact CD2-CG 4.44Å; Y413-M503 HydrophobicContact CE2-CB 4.43Å; Y413-M503 HydrophobicContact CE2-CG 4.14Å; Y413-S506 VanDerWaalsContact OH-CB 3.24Å; Y413-S506 WeakPolarHBondContact OH-CB 3.45Å; Y413-S506 PolarHBondContact OH-OG 3.39Å; Y413-S506 VanDerWaalsContact OH-OG 3.14Å
414	S	84.3	Confident	91.2	Very high	21 Å²	21	34.1 Å²	34.1	15%	0.147	17%	0.165	C	C	.	.	H	α-helix	trans	-55.9	-45.1	170.4	174.4	0	0	0	0	110.8	S412 R418 N487 D492	S412-S414 VanDerWaalsContact C-N 3.25Å; S412-S414 PolarHBondContact O-N 3.42Å; S412-S414 WeakPolarHBondContact OG-CB 3.31Å; S412-S414 PolarHBondContact OG-N 2.82Å; S412-S414 VanDerWaalsContact OG-N 3.15Å; S414-R418 WeakPolarHBondContact O-CD 3.42Å; S414-R418 WeakPolarHBondContact O-CG 3.44Å; S414-R418 PolarHBondContact O-N 3.38Å; S414-R418 PolarHBondContact O-NE 3.38Å; S414-R418 PolarHBondContact OG-NH1 2.95Å; S414-R418 VanDerWaalsContact OG-NH1 3.15Å; S414-R418 PolarHBondContact OG-NH2 3.42Å; S414-N487 WeakPolarHBondContact CB-OD1 3.38Å; S414-D492 PolarHBondContact OG-OD2 3.28Å
415	N	88	Confident	91.1	Very high	47 Å²	47	36 Å²	36	25%	0.251	17%	0.173	S	C	.	.	H	α-helix	trans	-67.1	-49.3	176.3	-159.1	67.9	0	0	0	112	S410 S412 Y413 Y417 R418 T419	S410-N415 PolarHBondContact OG-ND2 2.96Å; S412-N415 WeakPolarHBondContact O-CA 3.37Å; S412-N415 WeakPolarHBondContact O-CB 3.33Å; S412-N415 PolarHBondContact O-N 2.79Å; Y413-N415 VanDerWaalsContact C-N 3.28Å; Y413-N415 PolarHBondContact O-N 3.29Å; N415-Y417 PolarHBondContact O-N 2.97Å; N415-R418 VanDerWaalsContact CA-NH2 3.29Å; N415-R418 WeakPolarHBondContact O-CA 3.15Å; N415-R418 WeakPolarHBondContact O-CB 3.42Å; N415-R418 PolarHBondContact O-N 3.31Å; N415-R418 PolarHBondContact OD1-NH2 3.26Å; N415-T419 WeakPolarHBondContact O-CG2 3.21Å; N415-T419 PolarHBondContact O-N 3.16Å; N415-T419 PolarHBondContact O-OG1 3.14Å
416	Y	89.9	Confident	91.1	Very high	28 Å²	28	33.4 Å²	33.4	11%	0.11	16%	0.163	C	C	.	.	H	α-helix	trans	-49.9	-53.7	178.8	173.6	-98.7	0	0	0	112.3	W407 S410 S412 Y413 R418 T419 W420 M503 L507	W407-Y416 HydrophobicContact CB-CD2 4.49Å; W407-Y416 HydrophobicContact CE3-CD2 4.16Å; W407-Y416 AromaticContact CE3-CE2 3.83Å; W407-Y416 HydrophobicContact CE3-CE2 3.83Å; W407-Y416 HydrophobicContact CZ3-CE2 4.37Å; S410-Y416 PolarHBondContact OG-N 3Å; S412-Y416 PolarHBondContact O-N 3.36Å; Y413-Y416 PolarHBondContact O-N 3.33Å; Y416-R418 VanDerWaalsContact C-N 3.28Å; Y416-R418 PolarHBondContact O-N 3.02Å; Y416-T419 PolarHBondContact O-N 2.98Å; Y416-T419 VanDerWaalsContact O-N 3.08Å; Y416-T419 PolarHBondContact O-OG1 3.3Å; Y416-W420 HydrophobicContact CE2-CB 4.41Å; Y416-W420 HydrophobicContact CE2-CD2 4.22Å; Y416-W420 AromaticContact CE2-CE3 3.52Å; Y416-W420 HydrophobicContact CE2-CE3 3.52Å; Y416-W420 HydrophobicContact CE2-CZ3 4.19Å; Y416-W420 AromaticContact CZ-CE3 3.73Å; Y416-W420 WeakPolarHBondContact O-CB 3.45Å; Y416-W420 PolarHBondContact O-N 2.93Å; Y416-M503 HydrophobicContact CD2-SD 4.22Å; Y416-L507 HydrophobicContact CD2-CD1 4.47Å; Y416-L507 HydrophobicContact CE2-CD1 3.61Å
417	Y	88.3	Confident	91.3	Very high	47 Å²	47	32 Å²	32	18%	0.184	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-29.7	179.8	-68.4	-56.7	0	0	0	113.7	Y413 N415 F453 F479	Y413-Y417 AromaticContact CD1-CE2 3.91Å; Y413-Y417 HydrophobicContact CD1-CE2 3.91Å; Y413-Y417 WeakPolarHBondContact O-CD2 3.46Å; Y413-Y417 PolarHBondContact O-N 2.99Å; N415-Y417 PolarHBondContact O-N 2.97Å; Y417-F453 AromaticContact CD2-CE1 3.67Å; Y417-F453 HydrophobicContact CD2-CE1 3.67Å; Y417-F453 AromaticContact CD2-CZ 3.96Å; Y417-F453 HydrophobicContact CD2-CZ 3.96Å; Y417-F453 AromaticContact CE2-CE1 3.9Å; Y417-F453 HydrophobicContact CE2-CE1 3.9Å; Y417-F453 HydrophobicContact CE2-CZ 4.32Å; Y417-F453 HydrophobicContact CG-CE1 4.1Å; Y417-F479 HydrophobicContact CD1-CZ 4.47Å; Y417-F479 AromaticContact CE1-CE2 3.59Å; Y417-F479 HydrophobicContact CE1-CE2 3.59Å; Y417-F479 AromaticContact CE1-CZ 3.77Å; Y417-F479 HydrophobicContact CE1-CZ 3.77Å; Y417-F479 AromaticContact CZ-CE2 3.99Å
418	R	89.6	Confident	91.3	Very high	75 Å²	75	32.9 Å²	32.9	28%	0.283	16%	0.158	S	C	.	.	H	α-helix	trans	-76.6	-20.7	175.2	-68.9	175.5	-56.9	-162	4	113.5	S414 N415 Y416 D492	S414-R418 WeakPolarHBondContact O-CD 3.42Å; S414-R418 WeakPolarHBondContact O-CG 3.44Å; S414-R418 PolarHBondContact O-N 3.38Å; S414-R418 PolarHBondContact O-NE 3.38Å; S414-R418 PolarHBondContact OG-NH1 2.95Å; S414-R418 VanDerWaalsContact OG-NH1 3.15Å; S414-R418 PolarHBondContact OG-NH2 3.42Å; N415-R418 VanDerWaalsContact CA-NH2 3.29Å; N415-R418 WeakPolarHBondContact O-CA 3.15Å; N415-R418 WeakPolarHBondContact O-CB 3.42Å; N415-R418 PolarHBondContact O-N 3.31Å; N415-R418 PolarHBondContact OD1-NH2 3.26Å; Y416-R418 VanDerWaalsContact C-N 3.28Å; Y416-R418 PolarHBondContact O-N 3.02Å; R418-D492 IonicContact CZ-OD1 3.11Å; R418-D492 IonicContact CZ-OD2 3.99Å; R418-D492 VanDerWaalsContact CZ-OD2 3.29Å; R418-D492 IonicContact NH1-OD1 2.69Å; R418-D492 IonicContact NH1-OD2 3.19Å; R418-D492 PolarHBondContact NH1-OD2 3.44Å; R418-D492 VanDerWaalsContact NH2-CG 3.26Å; R418-D492 IonicContact NH2-OD1 3.32Å; R418-D492 PolarHBondContact NH2-OD1 3.33Å; R418-D492 IonicContact NH2-OD2 3.45Å; R418-D492 PolarHBondContact NH2-OD2 3.42Å
419	T	93.5	Very high	91.3	Very high	6 Å²	6	34.1 Å²	34.1	4%	0.037	16%	0.163	C	C	.	.	H	α-helix	trans	-113.1	-24.4	-171.5	52.9	0	0	0	0	114.7	Y404 K405 W407 N415 Y416	Y404-T419 CarbonylContact C-O 3.56Å; Y404-T419 WeakPolarHBondContact CA-O 3.43Å; K405-T419 HydrophobicContact CB-CG2 3.91Å; K405-T419 HydrophobicContact CD-CG2 4.17Å; K405-T419 HydrophobicContact CG-CG2 4.2Å; K405-T419 PolarHBondContact N-O 3Å; W407-T419 VanDerWaalsContact CA-OG1 3.3Å; W407-T419 WeakPolarHBondContact CA-OG1 3.35Å; W407-T419 VanDerWaalsContact CB-OG1 3.27Å; W407-T419 WeakPolarHBondContact CB-OG1 3.35Å; N415-T419 WeakPolarHBondContact O-CG2 3.21Å; N415-T419 PolarHBondContact O-N 3.16Å; N415-T419 PolarHBondContact O-OG1 3.14Å; Y416-T419 PolarHBondContact O-N 2.98Å; Y416-T419 VanDerWaalsContact O-N 3.08Å; Y416-T419 PolarHBondContact O-OG1 3.3Å
420	W	93.6	Very high	91.3	Very high	45 Å²	45	32.1 Å²	32.1	17%	0.17	15%	0.149	C	C	.	.	S	Bend	trans	-63.3	-57.8	-176.9	173.9	-93.1	0	0	0	112.6	L377 F381 L385 Y404 W407 Y416	L377-W420 HydrophobicContact CD1-CH2 3.48Å; L377-W420 VanDerWaalsContact CD1-CH2 3.48Å; L377-W420 HydrophobicContact CD1-CZ2 3.74Å; L377-W420 HydrophobicContact CD1-CZ3 4.39Å; L377-W420 HydrophobicContact CD2-CH2 4Å; L377-W420 HydrophobicContact CD2-CZ3 4.28Å; L377-W420 HydrophobicContact CG-CH2 3.69Å; L377-W420 HydrophobicContact CG-CZ2 4.4Å; L377-W420 HydrophobicContact CG-CZ3 4.45Å; F381-W420 HydrophobicContact CB-CH2 3.7Å; F381-W420 HydrophobicContact CB-CZ2 3.9Å; F381-W420 HydrophobicContact CD2-CD2 4.5Å; F381-W420 HydrophobicContact CD2-CE3 4.49Å; F381-W420 AromaticContact CD2-CH2 3.91Å; F381-W420 HydrophobicContact CD2-CH2 3.91Å; F381-W420 AromaticContact CD2-CZ2 3.92Å; F381-W420 HydrophobicContact CD2-CZ2 3.92Å; F381-W420 HydrophobicContact CD2-CZ3 4.24Å; F381-W420 HydrophobicContact CG-CH2 4.01Å; F381-W420 HydrophobicContact CG-CZ2 4.3Å; L385-W420 WeakPolarHBondContact CD2-O 3.38Å; Y404-W420 WeakPolarHBondContact CB-O 3.24Å; W407-W420 AromaticContact CD2-CE3 3.45Å; W407-W420 HydrophobicContact CD2-CE3 3.45Å; W407-W420 VanDerWaalsContact CD2-CE3 3.45Å; W407-W420 AromaticContact CD2-CZ3 3.67Å; W407-W420 HydrophobicContact CD2-CZ3 3.67Å; W407-W420 AromaticContact CE2-CE3 3.6Å; W407-W420 AromaticContact CE2-CZ3 3.43Å; W407-W420 VanDerWaalsContact CE2-CZ3 3.43Å; W407-W420 AromaticContact CE3-CE3 3.71Å; W407-W420 HydrophobicContact CE3-CE3 3.71Å; W407-W420 AromaticContact CE3-CZ3 3.75Å; W407-W420 HydrophobicContact CE3-CZ3 3.75Å; W407-W420 AromaticContact CG-CE3 3.87Å; W407-W420 HydrophobicContact CG-CE3 3.87Å; W407-W420 HydrophobicContact CG-CZ3 4.5Å; W407-W420 HydrophobicContact CH2-CE3 4.27Å; W407-W420 HydrophobicContact CH2-CH2 4.35Å; W407-W420 AromaticContact CH2-CZ3 3.48Å; W407-W420 HydrophobicContact CH2-CZ3 3.48Å; W407-W420 VanDerWaalsContact CH2-CZ3 3.48Å; W407-W420 HydrophobicContact CZ2-CE3 4.04Å; W407-W420 HydrophobicContact CZ2-CH2 4.14Å; W407-W420 AromaticContact CZ2-CZ3 3.36Å; W407-W420 HydrophobicContact CZ2-CZ3 3.36Å; W407-W420 HydrophobicContact CZ3-CE3 4.1Å; W407-W420 AromaticContact CZ3-CZ3 3.65Å; W407-W420 HydrophobicContact CZ3-CZ3 3.65Å; W407-W420 AromaticContact NE1-CE3 3.97Å; Y416-W420 HydrophobicContact CE2-CB 4.41Å; Y416-W420 HydrophobicContact CE2-CD2 4.22Å; Y416-W420 AromaticContact CE2-CE3 3.52Å; Y416-W420 HydrophobicContact CE2-CE3 3.52Å; Y416-W420 HydrophobicContact CE2-CZ3 4.19Å; Y416-W420 AromaticContact CZ-CE3 3.73Å; Y416-W420 WeakPolarHBondContact O-CB 3.45Å; Y416-W420 PolarHBondContact O-N 2.93Å
421	N	95.4	Very high	91.6	Very high	32 Å²	32	32.8 Å²	32.8	17%	0.171	15%	0.152	C	C	.	.			trans	-131.8	88.6	178.1	-175	-25.1	0	0	0	108.8	L385 V423 V424 H425	L385-N421 HydrophobicContact CD2-CB 3.78Å; N421-V423 PolarHBondContact O-N 3.11Å; N421-V423 PolarHBondContact OD1-N 2.94Å; N421-V424 WeakPolarHBondContact ND2-CG2 3.49Å; N421-V424 PolarHBondContact O-N 3.16Å; N421-V424 PolarHBondContact OD1-N 3.15Å; N421-H425 WeakPolarHBondContact O-CB 3.46Å; N421-H425 PolarHBondContact O-N 2.83Å
422	V	95.3	Very high	91.9	Very high	6 Å²	6	32.2 Å²	32.2	4%	0.036	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-30.3	-178.3	173.6	0	0	0	0	111	F403 K405 D426	F403-V422 WeakPolarHBondContact O-CB 3.27Å; F403-V422 PolarHBondContact O-N 3.11Å; K405-V422 HydrophobicContact CG-CG2 4.07Å; V422-D426 VanDerWaalsContact CG1-OD2 3.3Å; V422-D426 WeakPolarHBondContact CG1-OD2 3.3Å; V422-D426 WeakPolarHBondContact O-CB 3.33Å; V422-D426 PolarHBondContact O-N 3.46Å
423	V	95.9	Very high	92.1	Very high	17 Å²	17	34.5 Å²	34.5	10%	0.103	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-48.8	-179.3	-177.8	0	0	0	0	111.9	L306 L389 F403 N421 W427	L306-V423 HydrophobicContact CB-CG1 4.24Å; L306-V423 HydrophobicContact CD1-CG1 3.97Å; L306-V423 HydrophobicContact CG-CG1 3.72Å; L389-V423 HydrophobicContact CD1-CG2 4.48Å; F403-V423 HydrophobicContact CB-CG2 4.08Å; F403-V423 HydrophobicContact CD1-CG2 3.61Å; F403-V423 HydrophobicContact CG-CG2 4.28Å; N421-V423 PolarHBondContact O-N 3.11Å; N421-V423 PolarHBondContact OD1-N 2.94Å; V423-W427 PolarHBondContact O-N 3.35Å
424	V	96.2	Very high	92.4	Very high	44 Å²	44	36.2 Å²	36.2	27%	0.267	17%	0.167	S	C	.	.	H	α-helix	trans	-75.1	-41.2	177.4	171.9	0	0	0	0	111	M265 L306 N421 D426 W427 L428	M265-V424 HydrophobicContact CE-CG1 4.23Å; L306-V424 HydrophobicContact CD1-CG2 4.11Å; N421-V424 WeakPolarHBondContact ND2-CG2 3.49Å; N421-V424 PolarHBondContact O-N 3.16Å; N421-V424 PolarHBondContact OD1-N 3.15Å; V424-D426 PolarHBondContact O-N 3.45Å; V424-W427 PolarHBondContact O-N 2.95Å; V424-L428 HydrophobicContact CG1-CD1 3.94Å; V424-L428 HydrophobicContact CG1-CG 4.42Å; V424-L428 WeakPolarHBondContact O-CG 3.23Å; V424-L428 PolarHBondContact O-N 3.32Å
425	H	94.1	Very high	92.7	Very high	41 Å²	41	37 Å²	37	19%	0.19	17%	0.169	C	C	.	.	H	α-helix	trans	-56.1	-48.2	175.9	169.4	-85.9	0	0	0	111.7	N421 W427 L428 Y429	N421-H425 WeakPolarHBondContact O-CB 3.46Å; N421-H425 PolarHBondContact O-N 2.83Å; H425-W427 VanDerWaalsContact C-N 3.35Å; H425-W427 PolarHBondContact O-N 3.27Å; H425-L428 PolarHBondContact O-N 3.31Å; H425-Y429 VanDerWaalsContact O-CB 3.31Å; H425-Y429 WeakPolarHBondContact O-CB 3.16Å; H425-Y429 PolarHBondContact O-N 2.87Å
426	D	94.1	Very high	92.7	Very high	23 Å²	23	37.8 Å²	37.8	12%	0.123	17%	0.171	C	C	.	.	H	α-helix	trans	-66.6	-37.9	-177.4	-70.6	-11.3	0	0	0	111.2	K120 I307 V422 V424 Y429 Y430	K120-D426 WeakPolarHBondContact CD-OD2 3.04Å; K120-D426 WeakPolarHBondContact CE-OD2 3.15Å; K120-D426 IonicContact NZ-OD2 3.96Å; K120-D426 PolarHBondContact NZ-OD2 3.18Å; I307-D426 HydrophobicContact CD1-CB 3.77Å; V422-D426 VanDerWaalsContact CG1-OD2 3.3Å; V422-D426 WeakPolarHBondContact CG1-OD2 3.3Å; V422-D426 WeakPolarHBondContact O-CB 3.33Å; V422-D426 PolarHBondContact O-N 3.46Å; V424-D426 PolarHBondContact O-N 3.45Å; D426-Y429 PolarHBondContact O-N 3.01Å; D426-Y430 HydrophobicContact CB-CD2 4.28Å; D426-Y430 HydrophobicContact CB-CE2 4.43Å; D426-Y430 WeakPolarHBondContact O-CB 3.21Å; D426-Y430 VanDerWaalsContact O-CD2 3.23Å; D426-Y430 WeakPolarHBondContact O-CD2 3.27Å; D426-Y430 PolarHBondContact O-N 3.41Å
427	W	96.1	Very high	92.7	Very high	34 Å²	34	37.6 Å²	37.6	13%	0.129	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-48.4	173.1	-173.7	96.6	0	0	0	111.7	M265 H268 L306 V423 V424 H425 Y429 Y431	M265-W427 HydrophobicContact CB-CD2 4.29Å; M265-W427 HydrophobicContact CB-CZ2 4.08Å; M265-W427 HydrophobicContact CE-CB 4.02Å; M265-W427 HydrophobicContact CE-CD2 3.44Å; M265-W427 VanDerWaalsContact CE-CD2 3.44Å; M265-W427 HydrophobicContact CE-CE3 3.36Å; M265-W427 HydrophobicContact CE-CG 3.73Å; M265-W427 HydrophobicContact CE-CZ3 4.02Å; M265-W427 HydrophobicContact CG-CD2 4.14Å; M265-W427 HydrophobicContact CG-CE3 4.41Å; M265-W427 HydrophobicContact CG-CH2 4.22Å; M265-W427 HydrophobicContact CG-CZ2 3.93Å; M265-W427 HydrophobicContact CG-CZ3 4.44Å; M265-W427 PolarHBondContact O-NE1 3.47Å; H268-W427 HydrophobicContact CB-CZ2 4.09Å; H268-W427 AromaticContact CD2-CZ2 3.83Å; L306-W427 HydrophobicContact CB-CB 4Å; L306-W427 HydrophobicContact CB-CG 4.14Å; L306-W427 HydrophobicContact CD1-CB 4.25Å; V423-W427 PolarHBondContact O-N 3.35Å; V424-W427 PolarHBondContact O-N 2.95Å; H425-W427 VanDerWaalsContact C-N 3.35Å; H425-W427 PolarHBondContact O-N 3.27Å; W427-Y429 VanDerWaalsContact C-N 3.31Å; W427-Y429 PolarHBondContact O-N 3.14Å; W427-Y431 HydrophobicContact CB-CD2 4.43Å; W427-Y431 AromaticContact CD1-CD2 3.4Å; W427-Y431 AromaticContact CD1-CE2 3.65Å; W427-Y431 HydrophobicContact CD2-CD2 4.12Å; W427-Y431 AromaticContact CG-CD2 3.76Å; W427-Y431 HydrophobicContact CG-CD2 3.76Å; W427-Y431 HydrophobicContact CG-CE2 4.29Å; W427-Y431 AromaticContact NE1-CD2 3.56Å; W427-Y431 PolarHBondContact O-N 3.31Å
428	L	94.9	Very high	92.7	Very high	22 Å²	22	43.8 Å²	43.8	12%	0.115	20%	0.195	C	C	.	.	I	π-helix	trans	-62.2	-38.2	176.3	-72.3	170.6	0	0	0	111.7	V424 H425 A432 Y433 V452	V424-L428 HydrophobicContact CG1-CD1 3.94Å; V424-L428 HydrophobicContact CG1-CG 4.42Å; V424-L428 WeakPolarHBondContact O-CG 3.23Å; V424-L428 PolarHBondContact O-N 3.32Å; H425-L428 PolarHBondContact O-N 3.31Å; L428-A432 CarbonylContact O-C 3.58Å; L428-A432 WeakPolarHBondContact O-CA 3.3Å; L428-A432 VanDerWaalsContact O-CB 3.29Å; L428-A432 WeakPolarHBondContact O-CB 3.14Å; L428-A432 PolarHBondContact O-N 3.47Å; L428-A432 VanDerWaalsContact O-N 3.14Å; L428-Y433 PolarHBondContact O-N 2.81Å; L428-V452 HydrophobicContact CB-CG1 4Å; L428-V452 HydrophobicContact CD2-CG1 4.34Å
429	Y	92.5	Very high	92.6	Very high	82 Å²	82	47.4 Å²	47.4	32%	0.322	21%	0.213	S	C	.	.	I	π-helix	trans	-69.3	-48.9	179.2	178.8	-103.3	0	0	0	112.4	H425 D426 W427 Y433 K434	H425-Y429 VanDerWaalsContact O-CB 3.31Å; H425-Y429 WeakPolarHBondContact O-CB 3.16Å; H425-Y429 PolarHBondContact O-N 2.87Å; D426-Y429 PolarHBondContact O-N 3.01Å; W427-Y429 VanDerWaalsContact C-N 3.31Å; W427-Y429 PolarHBondContact O-N 3.14Å; Y429-Y433 AromaticContact CD2-CD1 3.88Å; Y429-Y433 HydrophobicContact CD2-CD1 3.88Å; Y429-Y433 HydrophobicContact CD2-CG 4.4Å; Y429-Y433 AromaticContact CE2-CD1 3.72Å; Y429-Y433 HydrophobicContact CE2-CD1 3.72Å; Y429-Y433 HydrophobicContact CE2-CE1 4.12Å; Y429-Y433 WeakPolarHBondContact O-CB 3.32Å; Y429-K434 HydrophobicContact CD1-CD 4.42Å; Y429-K434 HydrophobicContact CE1-CD 3.91Å; Y429-K434 HydrophobicContact CE1-CG 4.26Å; Y429-K434 WeakPolarHBondContact O-CG 3.31Å; Y429-K434 PolarHBondContact O-N 3.47Å
430	Y	91.9	Very high	92.3	Very high	49 Å²	49	51.1 Å²	51.1	19%	0.192	23%	0.229	C	C	.	.	I	π-helix	trans	-76.9	-40	-175.7	-76.1	-76.1	0	0	0	113.2	K120 I307 D426 K434	K120-Y430 HydrophobicContact CB-CE2 3.85Å; K120-Y430 PolarHBondContact N-OH 2.9Å; I307-Y430 HydrophobicContact CD1-CD2 3.67Å; I307-Y430 HydrophobicContact CD1-CE2 4.17Å; I307-Y430 HydrophobicContact CD1-CG 4.47Å; D426-Y430 HydrophobicContact CB-CD2 4.28Å; D426-Y430 HydrophobicContact CB-CE2 4.43Å; D426-Y430 WeakPolarHBondContact O-CB 3.21Å; D426-Y430 VanDerWaalsContact O-CD2 3.23Å; D426-Y430 WeakPolarHBondContact O-CD2 3.27Å; D426-Y430 PolarHBondContact O-N 3.41Å; Y430-K434 HydrophobicContact CD1-CD 3.79Å; Y430-K434 HydrophobicContact CE1-CD 4.2Å
431	Y	93.1	Very high	91.6	Very high	15 Å²	15	53.4 Å²	53.4	6%	0.059	25%	0.252	C	S	.	.	I	π-helix	trans	-106	-17.8	-172.2	-51.6	-55.1	0	0	0	115.3	R272 E273 I307 W427 D435	R272-Y431 HydrophobicContact CB-CD1 4.11Å; R272-Y431 HydrophobicContact CB-CE1 4.27Å; R272-Y431 HydrophobicContact CG-CD1 3.6Å; R272-Y431 HydrophobicContact CG-CE1 4.02Å; E273-Y431 VanDerWaalsContact CD-OH 3.31Å; E273-Y431 HydrophobicContact CG-CE1 4.17Å; E273-Y431 WeakPolarHBondContact CG-OH 3.45Å; E273-Y431 WeakPolarHBondContact OE1-CE1 3.41Å; E273-Y431 PolarHBondContact OE1-OH 2.91Å; I307-Y431 HydrophobicContact CG1-CE2 3.88Å; W427-Y431 HydrophobicContact CB-CD2 4.43Å; W427-Y431 AromaticContact CD1-CD2 3.4Å; W427-Y431 AromaticContact CD1-CE2 3.65Å; W427-Y431 HydrophobicContact CD2-CD2 4.12Å; W427-Y431 AromaticContact CG-CD2 3.76Å; W427-Y431 HydrophobicContact CG-CD2 3.76Å; W427-Y431 HydrophobicContact CG-CE2 4.29Å; W427-Y431 AromaticContact NE1-CD2 3.56Å; W427-Y431 PolarHBondContact O-N 3.31Å; Y431-D435 WeakPolarHBondContact O-CB 3.49Å
432	A	92.2	Very high	90.7	Very high	23 Å²	23	58.9 Å²	58.9	19%	0.19	27%	0.274	C	S	.	.	I	π-helix	trans	-104.5	-59.4	171.8	0	0	0	0	0	111.3	L428 F436 V452	L428-A432 CarbonylContact O-C 3.58Å; L428-A432 WeakPolarHBondContact O-CA 3.3Å; L428-A432 VanDerWaalsContact O-CB 3.29Å; L428-A432 WeakPolarHBondContact O-CB 3.14Å; L428-A432 PolarHBondContact O-N 3.47Å; L428-A432 VanDerWaalsContact O-N 3.14Å; A432-F436 WeakPolarHBondContact O-CB 3.46Å; A432-F436 PolarHBondContact O-N 3.36Å; A432-V452 HydrophobicContact CB-CG2 3.87Å
433	Y	91.4	Very high	89.9	Confident	48 Å²	48	68.6 Å²	68.6	19%	0.188	31%	0.31	C	S	.	.	I	π-helix	trans	-64.6	-55	-174.9	-177.8	-99.6	0	0	0	113.1	L428 Y429 D435 L437 A448 M449 V452	L428-Y433 PolarHBondContact O-N 2.81Å; Y429-Y433 AromaticContact CD2-CD1 3.88Å; Y429-Y433 HydrophobicContact CD2-CD1 3.88Å; Y429-Y433 HydrophobicContact CD2-CG 4.4Å; Y429-Y433 AromaticContact CE2-CD1 3.72Å; Y429-Y433 HydrophobicContact CE2-CD1 3.72Å; Y429-Y433 HydrophobicContact CE2-CE1 4.12Å; Y429-Y433 WeakPolarHBondContact O-CB 3.32Å; Y433-D435 PolarHBondContact O-N 3.45Å; Y433-L437 HydrophobicContact CE1-CD2 4.02Å; Y433-L437 WeakPolarHBondContact O-CB 3.29Å; Y433-L437 PolarHBondContact O-N 2.69Å; Y433-A448 HydrophobicContact CD2-CB 3.87Å; Y433-A448 HydrophobicContact CE2-CB 3.67Å; Y433-M449 HydrophobicContact CE2-CB 4.46Å; Y433-V452 HydrophobicContact CD2-CG2 4.43Å
434	K	89.4	Confident	89.2	Confident	56 Å²	56	73.7 Å²	73.7	24%	0.243	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-39.6	-178.3	-74.2	-176.7	75.6	179.6	0	112.1	P116 Y429 Y430 L437 W438	P116-K434 PolarHBondContact O-NZ 2.91Å; Y429-K434 HydrophobicContact CD1-CD 4.42Å; Y429-K434 HydrophobicContact CE1-CD 3.91Å; Y429-K434 HydrophobicContact CE1-CG 4.26Å; Y429-K434 WeakPolarHBondContact O-CG 3.31Å; Y429-K434 PolarHBondContact O-N 3.47Å; Y430-K434 HydrophobicContact CD1-CD 3.79Å; Y430-K434 HydrophobicContact CE1-CD 4.2Å; K434-L437 PolarHBondContact O-N 2.93Å; K434-W438 WeakPolarHBondContact O-CB 3.42Å; K434-W438 PolarHBondContact O-N 2.84Å
435	D	90.4	Very high	88.6	Confident	36 Å²	36	77.9 Å²	77.9	19%	0.193	35%	0.345	C	S	.	.	H	α-helix	trans	-73.2	-41.2	-177.4	-73.2	-22.1	0	0	0	112.4	R272 Y431 Y433 L437 W438 F439	R272-D435 IonicContact CZ-OD1 3.98Å; R272-D435 IonicContact CZ-OD2 2.96Å; R272-D435 VanDerWaalsContact CZ-OD2 3.29Å; R272-D435 IonicContact NE-OD1 2.65Å; R272-D435 IonicContact NE-OD2 2.76Å; R272-D435 PolarHBondContact NE-OD2 2.76Å; R272-D435 IonicContact NH2-OD1 3.19Å; R272-D435 PolarHBondContact NH2-OD1 2.88Å; R272-D435 IonicContact NH2-OD2 2.8Å; R272-D435 PolarHBondContact NH2-OD2 2.87Å; Y431-D435 WeakPolarHBondContact O-CB 3.49Å; Y433-D435 PolarHBondContact O-N 3.45Å; D435-L437 VanDerWaalsContact C-N 3.35Å; D435-W438 PolarHBondContact O-N 3.12Å; D435-F439 WeakPolarHBondContact O-CB 3.49Å; D435-F439 PolarHBondContact O-N 3.27Å
436	F	89.5	Confident	88.1	Confident	64 Å²	64	79.8 Å²	79.8	28%	0.281	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-44.7	169.5	-173.7	-78.5	0	0	0	111	A432 W438 F439 F440 A448 A451	A432-F436 WeakPolarHBondContact O-CB 3.46Å; A432-F436 PolarHBondContact O-N 3.36Å; F436-W438 VanDerWaalsContact C-N 3.29Å; F436-W438 PolarHBondContact O-N 3.02Å; F436-F439 PolarHBondContact O-N 3.27Å; F436-F440 AromaticContact CD1-CD2 3.65Å; F436-F440 HydrophobicContact CD1-CD2 3.65Å; F436-F440 HydrophobicContact CD1-CE2 4.14Å; F436-F440 HydrophobicContact CD2-CD2 4.27Å; F436-F440 AromaticContact CD2-CE2 3.99Å; F436-F440 HydrophobicContact CD2-CE2 3.99Å; F436-F440 AromaticContact CE1-CD2 3.42Å; F436-F440 HydrophobicContact CE1-CD2 3.42Å; F436-F440 VanDerWaalsContact CE1-CD2 3.42Å; F436-F440 AromaticContact CE1-CE2 3.71Å; F436-F440 HydrophobicContact CE1-CE2 3.71Å; F436-F440 HydrophobicContact CE1-CG 4.39Å; F436-F440 HydrophobicContact CE2-CD2 4.08Å; F436-F440 AromaticContact CE2-CE2 3.54Å; F436-F440 HydrophobicContact CE2-CE2 3.54Å; F436-F440 HydrophobicContact CG-CD2 4.08Å; F436-F440 HydrophobicContact CG-CE2 4.27Å; F436-F440 AromaticContact CZ-CD2 3.66Å; F436-F440 HydrophobicContact CZ-CD2 3.66Å; F436-F440 AromaticContact CZ-CE2 3.39Å; F436-F440 HydrophobicContact CZ-CE2 3.39Å; F436-F440 HydrophobicContact CZ-CZ 4.34Å; F436-F440 WeakPolarHBondContact O-CD2 3.46Å; F436-F440 PolarHBondContact O-N 3.36Å; F436-A448 HydrophobicContact CD1-CB 3.53Å; F436-A448 HydrophobicContact CE1-CB 3.98Å; F436-A448 HydrophobicContact CG-CB 4.48Å; F436-A451 HydrophobicContact CD2-CB 4.24Å; F436-A451 HydrophobicContact CE2-CB 3.81Å; F436-A451 HydrophobicContact CZ-CB 3.97Å
437	L	89.3	Confident	87.8	Confident	25 Å²	25	80.8 Å²	80.8	13%	0.131	38%	0.375	C	S	.	.	H	α-helix	trans	-64.9	-33.5	178.2	-172.2	67	0	0	0	112.2	Y433 K434 D435 S441 K442 K445 A448	Y433-L437 HydrophobicContact CE1-CD2 4.02Å; Y433-L437 WeakPolarHBondContact O-CB 3.29Å; Y433-L437 PolarHBondContact O-N 2.69Å; K434-L437 PolarHBondContact O-N 2.93Å; D435-L437 VanDerWaalsContact C-N 3.35Å; L437-S441 PolarHBondContact O-N 2.71Å; L437-K442 HydrophobicContact CG-CB 4.39Å; L437-K442 HydrophobicContact CG-CG 4.31Å; L437-K442 VanDerWaalsContact O-CA 3.31Å; L437-K442 WeakPolarHBondContact O-CA 3.43Å; L437-K442 PolarHBondContact O-N 2.69Å; L437-K445 HydrophobicContact CD1-CG 4.03Å; L437-A448 HydrophobicContact CB-CB 4.48Å; L437-A448 HydrophobicContact CD1-CB 4.42Å
438	W	87.5	Confident	87.3	Confident	177 Å²	177	79.1 Å²	79.1	67%	0.67	37%	0.368	S	S	*	.	H	α-helix	trans	-69.7	-45.8	173.4	179.2	82.3	0	0	0	111.7	K434 D435 F436 F440 S441	K434-W438 WeakPolarHBondContact O-CB 3.42Å; K434-W438 PolarHBondContact O-N 2.84Å; D435-W438 PolarHBondContact O-N 3.12Å; F436-W438 VanDerWaalsContact C-N 3.29Å; F436-W438 PolarHBondContact O-N 3.02Å; W438-F440 VanDerWaalsContact C-N 3.3Å; W438-F440 PolarHBondContact O-N 2.83Å; W438-S441 PolarHBondContact O-N 3.42Å; W438-S441 VanDerWaalsContact O-N 3.11Å
439	F	87.5	Confident	86.9	Confident	151 Å²	151	81 Å²	81	66%	0.662	38%	0.377	S	S	*	.	H	α-helix	trans	-58.9	-38.5	177	-173.2	-96.2	0	0	0	112.6	D435 F436 S441	D435-F439 WeakPolarHBondContact O-CB 3.49Å; D435-F439 PolarHBondContact O-N 3.27Å; F436-F439 PolarHBondContact O-N 3.27Å; F439-S441 PolarHBondContact O-N 2.98Å
440	F	87.1	Confident	86.7	Confident	84 Å²	84	80.9 Å²	80.9	37%	0.368	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	29.4	176.1	-69.4	-74.6	0	0	0	114.2	F436 W438 K442 R443 F444	F436-F440 AromaticContact CD1-CD2 3.65Å; F436-F440 HydrophobicContact CD1-CD2 3.65Å; F436-F440 HydrophobicContact CD1-CE2 4.14Å; F436-F440 HydrophobicContact CD2-CD2 4.27Å; F436-F440 AromaticContact CD2-CE2 3.99Å; F436-F440 HydrophobicContact CD2-CE2 3.99Å; F436-F440 AromaticContact CE1-CD2 3.42Å; F436-F440 HydrophobicContact CE1-CD2 3.42Å; F436-F440 VanDerWaalsContact CE1-CD2 3.42Å; F436-F440 AromaticContact CE1-CE2 3.71Å; F436-F440 HydrophobicContact CE1-CE2 3.71Å; F436-F440 HydrophobicContact CE1-CG 4.39Å; F436-F440 HydrophobicContact CE2-CD2 4.08Å; F436-F440 AromaticContact CE2-CE2 3.54Å; F436-F440 HydrophobicContact CE2-CE2 3.54Å; F436-F440 HydrophobicContact CG-CD2 4.08Å; F436-F440 HydrophobicContact CG-CE2 4.27Å; F436-F440 AromaticContact CZ-CD2 3.66Å; F436-F440 HydrophobicContact CZ-CD2 3.66Å; F436-F440 AromaticContact CZ-CE2 3.39Å; F436-F440 HydrophobicContact CZ-CE2 3.39Å; F436-F440 HydrophobicContact CZ-CZ 4.34Å; F436-F440 WeakPolarHBondContact O-CD2 3.46Å; F436-F440 PolarHBondContact O-N 3.36Å; W438-F440 VanDerWaalsContact C-N 3.3Å; W438-F440 PolarHBondContact O-N 2.83Å; F440-K442 PolarHBondContact O-N 2.7Å; F440-R443 PolarHBondContact O-N 2.91Å; F440-F444 HydrophobicContact CB-CD2 4.29Å
441	S	80.2	Confident	86.6	Confident	93 Å²	93	79.9 Å²	79.9	65%	0.65	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	36.4	171.8	-64.8	0	0	0	0	115	L437 W438 F439 R443	L437-S441 PolarHBondContact O-N 2.71Å; W438-S441 PolarHBondContact O-N 3.42Å; W438-S441 VanDerWaalsContact O-N 3.11Å; F439-S441 PolarHBondContact O-N 2.98Å; S441-R443 PolarHBondContact O-N 3.38Å
442	K	76.9	Confident	86.5	Confident	146 Å²	146	80.2 Å²	80.2	64%	0.635	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	5.5	178.1	-57.2	176.2	-179	173.8	0	116.7	L437 F440	L437-K442 HydrophobicContact CG-CB 4.39Å; L437-K442 HydrophobicContact CG-CG 4.31Å; L437-K442 VanDerWaalsContact O-CA 3.31Å; L437-K442 WeakPolarHBondContact O-CA 3.43Å; L437-K442 PolarHBondContact O-N 2.69Å; F440-K442 PolarHBondContact O-N 2.7Å
443	R	77.9	Confident	86.4	Confident	211 Å²	211	80.5 Å²	80.5	80%	0.796	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-43.6	-175.1	-68.5	-177.5	178.9	178.4	-1.1	113.3	F440 S441 K445	F440-R443 PolarHBondContact O-N 2.91Å; S441-R443 PolarHBondContact O-N 3.38Å; R443-K445 PolarHBondContact O-N 3.49Å
444	F	81.4	Confident	86.4	Confident	123 Å²	123	79.6 Å²	79.6	54%	0.539	39%	0.386	S	S	.	.			trans	-100.2	64.8	-167.8	-60.7	-77.8	0	0	0	114.4	F440 S446 A447 A448	F440-F444 HydrophobicContact CB-CD2 4.29Å; F444-S446 PolarHBondContact O-N 3.22Å; F444-A447 HydrophobicContact CB-CB 3.9Å; F444-A447 PolarHBondContact O-N 3.07Å; F444-A448 PolarHBondContact O-N 3.2Å
445	K	83.6	Confident	86.6	Confident	133 Å²	133	80.4 Å²	80.4	58%	0.578	40%	0.396	S	S	*	.	H	α-helix	trans	-57.5	-42.6	-179.7	-66.6	179.1	-176.9	173.5	0	113.7	L437 R443 A448 M449	L437-K445 HydrophobicContact CD1-CG 4.03Å; R443-K445 PolarHBondContact O-N 3.49Å; K445-A448 PolarHBondContact O-N 3.31Å; K445-M449 PolarHBondContact O-N 3.22Å
446	S	83.6	Confident	86.7	Confident	80 Å²	80	79.5 Å²	79.5	56%	0.559	39%	0.392	S	S	*	.	H	α-helix	trans	-68.6	-37.1	179.7	-48	0	0	0	0	112.4	F444 M449 L450	F444-S446 PolarHBondContact O-N 3.22Å; S446-M449 PolarHBondContact O-N 2.64Å; S446-L450 WeakPolarHBondContact O-CB 3.48Å; S446-L450 PolarHBondContact O-N 3.15Å
447	A	86.6	Confident	86.9	Confident	44 Å²	44	76.4 Å²	76.4	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-68.5	-39.7	174.8	0	0	0	0	0	111.5	F444 M449 L450 A451	F444-A447 HydrophobicContact CB-CB 3.9Å; F444-A447 PolarHBondContact O-N 3.07Å; A447-M449 VanDerWaalsContact C-N 3.32Å; A447-M449 PolarHBondContact O-N 3.2Å; A447-L450 PolarHBondContact O-N 3.26Å; A447-A451 VanDerWaalsContact O-CB 3.25Å; A447-A451 WeakPolarHBondContact O-CB 3.42Å; A447-A451 PolarHBondContact O-N 3.22Å
448	A	87.1	Confident	87.2	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-61.1	-40.7	173.8	0	0	0	0	0	112	Y433 F436 L437 F444 K445 V452	Y433-A448 HydrophobicContact CD2-CB 3.87Å; Y433-A448 HydrophobicContact CE2-CB 3.67Å; F436-A448 HydrophobicContact CD1-CB 3.53Å; F436-A448 HydrophobicContact CE1-CB 3.98Å; F436-A448 HydrophobicContact CG-CB 4.48Å; L437-A448 HydrophobicContact CB-CB 4.48Å; L437-A448 HydrophobicContact CD1-CB 4.42Å; F444-A448 PolarHBondContact O-N 3.2Å; K445-A448 PolarHBondContact O-N 3.31Å; A448-V452 VanDerWaalsContact O-CG2 3.27Å; A448-V452 WeakPolarHBondContact O-CG2 3.47Å; A448-V452 PolarHBondContact O-N 2.68Å; A448-V452 VanDerWaalsContact O-N 3.16Å
449	M	86	Confident	87.5	Confident	62 Å²	62	73.3 Å²	73.3	31%	0.305	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-49.7	174.6	-178.6	-179.7	-73.5	0	0	111.7	Y433 K445 S446 A447 A451 V452 F453 N487	Y433-M449 HydrophobicContact CE2-CB 4.46Å; K445-M449 PolarHBondContact O-N 3.22Å; S446-M449 PolarHBondContact O-N 2.64Å; A447-M449 VanDerWaalsContact C-N 3.32Å; A447-M449 PolarHBondContact O-N 3.2Å; M449-A451 PolarHBondContact O-N 3.31Å; M449-V452 PolarHBondContact O-N 3.24Å; M449-F453 HydrophobicContact CG-CD2 3.73Å; M449-F453 HydrophobicContact CG-CE2 3.46Å; M449-F453 VanDerWaalsContact CG-CE2 3.46Å; M449-F453 WeakPolarHBondContact O-CD2 3.37Å; M449-F453 PolarHBondContact O-N 2.73Å; M449-F453 HydrophobicContact SD-CE2 4.1Å; M449-N487 PolarHBondContact SD-ND2 2.91Å
450	L	88	Confident	87.8	Confident	79 Å²	79	70.3 Å²	70.3	41%	0.414	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-42.5	177.7	-180	65.3	0	0	0	112.1	S446 A447 V452 F453 A454 M480 M484	S446-L450 WeakPolarHBondContact O-CB 3.48Å; S446-L450 PolarHBondContact O-N 3.15Å; A447-L450 PolarHBondContact O-N 3.26Å; L450-V452 PolarHBondContact O-N 3.33Å; L450-F453 PolarHBondContact O-N 2.72Å; L450-A454 VanDerWaalsContact O-CB 3.3Å; L450-A454 WeakPolarHBondContact O-CB 3.09Å; L450-A454 PolarHBondContact O-N 2.97Å; L450-M480 HydrophobicContact CD1-CE 3.7Å; L450-M484 HydrophobicContact CB-CE 4.37Å; L450-M484 HydrophobicContact CD1-CE 3.87Å; L450-M484 HydrophobicContact CD1-CG 4.13Å; L450-M484 HydrophobicContact CD1-SD 3.91Å
451	A	90.4	Very high	88.2	Confident	28 Å²	28	66.5 Å²	66.5	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-42.8	178.2	0	0	0	0	0	111.9	F436 A447 M449 A454 V455	F436-A451 HydrophobicContact CD2-CB 4.24Å; F436-A451 HydrophobicContact CE2-CB 3.81Å; F436-A451 HydrophobicContact CZ-CB 3.97Å; A447-A451 VanDerWaalsContact O-CB 3.25Å; A447-A451 WeakPolarHBondContact O-CB 3.42Å; A447-A451 PolarHBondContact O-N 3.22Å; M449-A451 PolarHBondContact O-N 3.31Å; A451-A454 PolarHBondContact O-N 2.96Å; A451-V455 WeakPolarHBondContact O-CB 3.39Å; A451-V455 VanDerWaalsContact O-CG2 3.31Å; A451-V455 WeakPolarHBondContact O-CG2 3.41Å; A451-V455 PolarHBondContact O-N 3.36Å
452	V	91.1	Very high	88.9	Confident	21 Å²	21	65.6 Å²	65.6	13%	0.127	33%	0.334	C	S	.	.	H	α-helix	trans	-68.9	-39.9	178.3	172.8	0	0	0	0	111.8	L428 A432 Y433 A448 M449 L450 S456	L428-V452 HydrophobicContact CB-CG1 4Å; L428-V452 HydrophobicContact CD2-CG1 4.34Å; A432-V452 HydrophobicContact CB-CG2 3.87Å; Y433-V452 HydrophobicContact CD2-CG2 4.43Å; A448-V452 VanDerWaalsContact O-CG2 3.27Å; A448-V452 WeakPolarHBondContact O-CG2 3.47Å; A448-V452 PolarHBondContact O-N 2.68Å; A448-V452 VanDerWaalsContact O-N 3.16Å; M449-V452 PolarHBondContact O-N 3.24Å; L450-V452 PolarHBondContact O-N 3.33Å; V452-S456 WeakPolarHBondContact O-CB 3.37Å; V452-S456 PolarHBondContact O-N 2.76Å
453	F	89.3	Confident	89.7	Confident	30 Å²	30	58.9 Å²	58.9	13%	0.132	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-40.3	172.7	-76.1	-58	0	0	0	112.2	Y417 M449 L450 S456 A457 F479 M484 N487	Y417-F453 AromaticContact CD2-CE1 3.67Å; Y417-F453 HydrophobicContact CD2-CE1 3.67Å; Y417-F453 AromaticContact CD2-CZ 3.96Å; Y417-F453 HydrophobicContact CD2-CZ 3.96Å; Y417-F453 AromaticContact CE2-CE1 3.9Å; Y417-F453 HydrophobicContact CE2-CE1 3.9Å; Y417-F453 HydrophobicContact CE2-CZ 4.32Å; Y417-F453 HydrophobicContact CG-CE1 4.1Å; M449-F453 HydrophobicContact CG-CD2 3.73Å; M449-F453 HydrophobicContact CG-CE2 3.46Å; M449-F453 VanDerWaalsContact CG-CE2 3.46Å; M449-F453 WeakPolarHBondContact O-CD2 3.37Å; M449-F453 PolarHBondContact O-N 2.73Å; M449-F453 HydrophobicContact SD-CE2 4.1Å; L450-F453 PolarHBondContact O-N 2.72Å; F453-S456 WeakPolarHBondContact O-CB 3.08Å; F453-S456 PolarHBondContact O-N 3.15Å; F453-A457 WeakPolarHBondContact O-CB 3.15Å; F453-A457 PolarHBondContact O-N 2.89Å; F453-F479 HydrophobicContact CB-CE1 4.35Å; F453-F479 AromaticContact CD1-CE1 3.77Å; F453-F479 HydrophobicContact CD1-CE1 3.77Å; F453-F479 HydrophobicContact CD1-CZ 4.19Å; F453-M484 HydrophobicContact CB-SD 3.99Å; F453-M484 HydrophobicContact CD2-CE 4.43Å; F453-M484 HydrophobicContact CD2-SD 3.47Å; F453-M484 WeakPolarHBondContact CD2-SD 3.45Å; F453-M484 HydrophobicContact CE2-SD 4.22Å; F453-M484 HydrophobicContact CG-SD 3.99Å; F453-N487 WeakPolarHBondContact CE2-ND2 3.42Å
454	A	91.7	Very high	90.4	Very high	28 Å²	28	50.6 Å²	50.6	23%	0.231	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-45.2	176.1	0	0	0	0	0	112.1	L450 A451 S456 A457 V458 M480	L450-A454 VanDerWaalsContact O-CB 3.3Å; L450-A454 WeakPolarHBondContact O-CB 3.09Å; L450-A454 PolarHBondContact O-N 2.97Å; A451-A454 PolarHBondContact O-N 2.96Å; A454-S456 VanDerWaalsContact C-N 3.33Å; A454-S456 PolarHBondContact O-N 3.35Å; A454-A457 PolarHBondContact O-N 2.8Å; A454-V458 WeakPolarHBondContact O-CB 3.48Å; A454-V458 VanDerWaalsContact O-CG2 3.31Å; A454-V458 WeakPolarHBondContact O-CG2 3.27Å; A454-V458 PolarHBondContact O-N 3.41Å; A454-M480 HydrophobicContact CB-CE 4.09Å; A454-M480 HydrophobicContact CB-SD 4.11Å
455	V	93.8	Very high	91	Very high	74 Å²	74	45.5 Å²	45.5	45%	0.448	26%	0.258	S	S	.	.	H	α-helix	trans	-58.9	-45.4	173.7	168	0	0	0	0	110.7	A451 V458 V459	A451-V455 WeakPolarHBondContact O-CB 3.39Å; A451-V455 VanDerWaalsContact O-CG2 3.31Å; A451-V455 WeakPolarHBondContact O-CG2 3.41Å; A451-V455 PolarHBondContact O-N 3.36Å; V455-V458 PolarHBondContact O-N 2.9Å; V455-V459 VanDerWaalsContact O-CG2 3.32Å; V455-V459 WeakPolarHBondContact O-CG2 3.25Å; V455-V459 PolarHBondContact O-N 2.85Å
456	S	93.3	Very high	91.4	Very high	16 Å²	16	39.9 Å²	39.9	11%	0.112	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-49.6	175.5	-173.2	0	0	0	0	111.6	V452 F453 A454 V458 V459 H460	V452-S456 WeakPolarHBondContact O-CB 3.37Å; V452-S456 PolarHBondContact O-N 2.76Å; F453-S456 WeakPolarHBondContact O-CB 3.08Å; F453-S456 PolarHBondContact O-N 3.15Å; A454-S456 VanDerWaalsContact C-N 3.33Å; A454-S456 PolarHBondContact O-N 3.35Å; S456-V458 PolarHBondContact O-N 3.3Å; S456-V459 PolarHBondContact O-N 3.42Å; S456-H460 PolarHBondContact O-N 2.95Å; S456-H460 PolarHBondContact O-ND1 2.6Å; S456-H460 PolarHBondContact OG-CE1 3.45Å
457	A	92.9	Very high	91.8	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-44.6	-179.6	0	0	0	0	0	112.2	F453 A454 H460 E461 F476 F479 M480	F453-A457 WeakPolarHBondContact O-CB 3.15Å; F453-A457 PolarHBondContact O-N 2.89Å; A454-A457 PolarHBondContact O-N 2.8Å; A457-H460 PolarHBondContact O-N 3.3Å; A457-E461 WeakPolarHBondContact O-CB 3.22Å; A457-E461 PolarHBondContact O-N 2.94Å; A457-F476 HydrophobicContact CB-CD2 3.62Å; A457-F476 HydrophobicContact CB-CE2 3.99Å; A457-F479 HydrophobicContact CB-CB 4.34Å; A457-F479 HydrophobicContact CB-CD1 3.77Å; A457-F479 HydrophobicContact CB-CE1 4.44Å; A457-F479 HydrophobicContact CB-CG 4.33Å; A457-M480 HydrophobicContact CB-CG 4.09Å; A457-M480 HydrophobicContact CB-SD 4.18Å
458	V	94.6	Very high	91.9	Very high	82 Å²	82	35.1 Å²	35.1	50%	0.497	20%	0.197	S	C	.	.	H	α-helix	trans	-62.8	-41.4	176.7	170.5	0	0	0	0	111.4	A454 V455 S456 E461 Y462 F476	A454-V458 WeakPolarHBondContact O-CB 3.48Å; A454-V458 VanDerWaalsContact O-CG2 3.31Å; A454-V458 WeakPolarHBondContact O-CG2 3.27Å; A454-V458 PolarHBondContact O-N 3.41Å; V455-V458 PolarHBondContact O-N 2.9Å; S456-V458 PolarHBondContact O-N 3.3Å; V458-E461 PolarHBondContact O-N 3.47Å; V458-Y462 WeakPolarHBondContact O-CB 3.21Å; V458-Y462 PolarHBondContact O-N 3.35Å; V458-F476 HydrophobicContact CG2-CD2 4.2Å; V458-F476 HydrophobicContact CG2-CE2 3.83Å
459	V	95.1	Very high	91.9	Very high	55 Å²	55	36.8 Å²	36.8	33%	0.333	21%	0.208	S	C	.	.	H	α-helix	trans	-67.4	-38	178.5	170.9	0	0	0	0	112	I261 V455 S456 A463	I261-V459 HydrophobicContact CD1-CG1 3.86Å; I261-V459 HydrophobicContact CG1-CG1 4.28Å; I261-V459 HydrophobicContact CG2-CG1 4.17Å; V455-V459 VanDerWaalsContact O-CG2 3.32Å; V455-V459 WeakPolarHBondContact O-CG2 3.25Å; V455-V459 PolarHBondContact O-N 2.85Å; S456-V459 PolarHBondContact O-N 3.42Å; V459-A463 WeakPolarHBondContact O-CB 3.35Å; V459-A463 PolarHBondContact O-N 3.48Å
460	H	93.9	Very high	91.9	Very high	87 Å²	87	34.1 Å²	34.1	40%	0.403	20%	0.195	S	C	.	.	H	α-helix	trans	-68.7	-43.4	175.1	-71.8	79	0	0	0	111.8	S456 A457 A463 L464 L475	S456-H460 PolarHBondContact O-N 2.95Å; S456-H460 PolarHBondContact O-ND1 2.6Å; S456-H460 PolarHBondContact OG-CE1 3.45Å; A457-H460 PolarHBondContact O-N 3.3Å; H460-A463 PolarHBondContact O-N 3.3Å; H460-L464 PolarHBondContact O-N 3.4Å; H460-L475 HydrophobicContact CB-CD2 3.7Å
461	E	94.5	Very high	91.9	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.023	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-42.5	176.2	-168.6	63.3	-130.4	0	0	111.5	A457 V458 A463 L464 A465 F471 P473 L475 F476 Y518	A457-E461 WeakPolarHBondContact O-CB 3.22Å; A457-E461 PolarHBondContact O-N 2.94Å; V458-E461 PolarHBondContact O-N 3.47Å; E461-A463 VanDerWaalsContact C-N 3.32Å; E461-A463 PolarHBondContact O-N 3.4Å; E461-L464 PolarHBondContact O-N 2.97Å; E461-A465 WeakPolarHBondContact O-CB 3.17Å; E461-A465 PolarHBondContact O-N 3.38Å; E461-F471 HydrophobicContact CG-CD2 4.4Å; E461-F471 HydrophobicContact CG-CE2 3.8Å; E461-P473 VanDerWaalsContact CD-CA 3.47Å; E461-P473 HydrophobicContact CG-CB 4.35Å; E461-P473 WeakPolarHBondContact OE2-CA 3.2Å; E461-L475 PolarHBondContact OE2-N 3.13Å; E461-F476 HydrophobicContact CB-CB 4.24Å; E461-F476 HydrophobicContact CG-CB 4.23Å; E461-F476 PolarHBondContact OE2-N 3.29Å; E461-Y518 PolarHBondContact OE1-OH 2.92Å; E461-Y518 VanDerWaalsContact OE1-OH 3.04Å; E461-Y518 PolarHBondContact OE2-OH 3.26Å; E461-Y518 VanDerWaalsContact OE2-OH 3.09Å
462	Y	94.6	Very high	91.8	Very high	73 Å²	73	34.2 Å²	34.2	29%	0.286	19%	0.186	S	C	.	.	H	α-helix	trans	-56.1	-45.6	172.3	164.5	-105.1	0	0	0	111.9	T240 Q260 I261 V458 A465 V466	T240-Y462 PolarHBondContact OG1-OH 3.01Å; Q260-Y462 VanDerWaalsContact CD-OH 3.27Å; Q260-Y462 VanDerWaalsContact NE2-CE1 3.3Å; Q260-Y462 PolarHBondContact NE2-OH 2.98Å; Q260-Y462 PolarHBondContact OE1-OH 3.49Å; Q260-Y462 VanDerWaalsContact OE1-OH 3.08Å; I261-Y462 HydrophobicContact CD1-CD1 4.46Å; V458-Y462 WeakPolarHBondContact O-CB 3.21Å; V458-Y462 PolarHBondContact O-N 3.35Å; Y462-A465 PolarHBondContact O-N 3.28Å; Y462-V466 HydrophobicContact CD2-CG2 3.84Å; Y462-V466 HydrophobicContact CE2-CG2 3.67Å; Y462-V466 WeakPolarHBondContact O-CG2 3.41Å; Y462-V466 PolarHBondContact O-N 3.38Å
463	A	94.4	Very high	91.7	Very high	5 Å²	5	35.1 Å²	35.1	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-46.1	178.8	0	0	0	0	0	111.8	I257 F258 I261 V459 H460 E461 C467	I257-A463 HydrophobicContact CG2-CB 4.04Å; F258-A463 HydrophobicContact CD1-CB 4.45Å; F258-A463 HydrophobicContact CE1-CB 3.99Å; I261-A463 HydrophobicContact CD1-CB 4.17Å; V459-A463 WeakPolarHBondContact O-CB 3.35Å; V459-A463 PolarHBondContact O-N 3.48Å; H460-A463 PolarHBondContact O-N 3.3Å; E461-A463 VanDerWaalsContact C-N 3.32Å; E461-A463 PolarHBondContact O-N 3.4Å; A463-C467 WeakPolarHBondContact O-CB 3.3Å; A463-C467 PolarHBondContact O-N 2.65Å; A463-C467 PolarHBondContact O-SG 3.22Å
464	L	93.4	Very high	91.8	Very high	37 Å²	37	34.7 Å²	34.7	19%	0.194	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-46.1	175.7	-67	-176.1	0	0	0	112.1	F254 H460 E461 V466 C467 L468 L475 Y518	F254-L464 HydrophobicContact CE1-CD2 3.98Å; F254-L464 HydrophobicContact CZ-CD2 3.86Å; H460-L464 PolarHBondContact O-N 3.4Å; E461-L464 PolarHBondContact O-N 2.97Å; L464-V466 PolarHBondContact O-N 3.31Å; L464-C467 PolarHBondContact O-N 3.46Å; L464-L468 VanDerWaalsContact O-CB 3.32Å; L464-L468 WeakPolarHBondContact O-CB 3.46Å; L464-L468 WeakPolarHBondContact O-CG 3.4Å; L464-L468 PolarHBondContact O-N 3.38Å; L464-L475 HydrophobicContact CD1-CB 4.19Å; L464-L475 HydrophobicContact CD1-CD2 3.58Å; L464-L475 HydrophobicContact CG-CD2 4.43Å; L464-Y518 HydrophobicContact CB-CE1 4.42Å; L464-Y518 HydrophobicContact CD1-CD2 4.16Å; L464-Y518 HydrophobicContact CD1-CE1 4.08Å; L464-Y518 HydrophobicContact CD1-CE2 3.57Å
465	A	92.1	Very high	91.8	Very high	16 Å²	16	34.5 Å²	34.5	13%	0.132	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-40.3	-174.3	0	0	0	0	0	112.9	E461 Y462 S469 F470 F471	E461-A465 WeakPolarHBondContact O-CB 3.17Å; E461-A465 PolarHBondContact O-N 3.38Å; Y462-A465 PolarHBondContact O-N 3.28Å; A465-S469 VanDerWaalsContact O-CA 3.3Å; A465-S469 WeakPolarHBondContact O-CA 3.14Å; A465-S469 PolarHBondContact O-N 3.36Å; A465-F470 WeakPolarHBondContact CA-O 3.23Å; A465-F470 WeakPolarHBondContact CB-O 3.34Å; A465-F470 PolarHBondContact O-N 3.34Å; A465-F471 HydrophobicContact CB-CD2 4.15Å
466	V	92.1	Very high	91.6	Very high	15 Å²	15	34.2 Å²	34.2	9%	0.091	18%	0.181	C	C	.	.	H	α-helix	trans	-71.8	-39.6	176.3	178.7	0	0	0	0	111.1	T240 V243 I257 Y462 L464	T240-V466 HydrophobicContact CG2-CG1 4.21Å; T240-V466 HydrophobicContact CG2-CG2 4.19Å; V243-V466 HydrophobicContact CB-CG1 4.35Å; V243-V466 HydrophobicContact CG1-CG1 3.55Å; I257-V466 HydrophobicContact CD1-CB 4.21Å; I257-V466 HydrophobicContact CD1-CG1 3.45Å; I257-V466 VanDerWaalsContact CD1-CG1 3.45Å; I257-V466 HydrophobicContact CG1-CB 4.42Å; I257-V466 HydrophobicContact CG1-CG1 3.89Å; Y462-V466 HydrophobicContact CD2-CG2 3.84Å; Y462-V466 HydrophobicContact CE2-CG2 3.67Å; Y462-V466 WeakPolarHBondContact O-CG2 3.41Å; Y462-V466 PolarHBondContact O-N 3.38Å; L464-V466 PolarHBondContact O-N 3.31Å
467	C	91.9	Very high	91.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-69.7	-37.9	179.5	-63.6	0	0	0	0	112.7	R253 F254 A463 L464	R253-C467 HydrophobicContact CB-CB 4.15Å; R253-C467 WeakPolarHBondContact CD-O 3.44Å; R253-C467 PolarHBondContact NH1-O 2.87Å; F254-C467 VanDerWaalsContact CA-SG 3.53Å; F254-C467 HydrophobicContact CD1-CB 3.93Å; F254-C467 WeakPolarHBondContact CD1-SG 3.35Å; F254-C467 HydrophobicContact CD2-CB 3.74Å; F254-C467 HydrophobicContact CE1-CB 3.74Å; F254-C467 HydrophobicContact CE2-CB 3.54Å; F254-C467 HydrophobicContact CG-CB 3.93Å; F254-C467 HydrophobicContact CZ-CB 3.54Å; F254-C467 PolarHBondContact N-SG 3.46Å; A463-C467 WeakPolarHBondContact O-CB 3.3Å; A463-C467 PolarHBondContact O-N 2.65Å; A463-C467 PolarHBondContact O-SG 3.22Å; L464-C467 PolarHBondContact O-N 3.46Å
468	L	90.1	Very high	91.3	Very high	25 Å²	25	39.4 Å²	39.4	13%	0.131	21%	0.21	C	C	.	.	H	α-helix	trans	-90.2	-8.1	179.6	-59.3	176	0	0	0	113.8	L464 F470 Y518 W522	L464-L468 VanDerWaalsContact O-CB 3.32Å; L464-L468 WeakPolarHBondContact O-CB 3.46Å; L464-L468 WeakPolarHBondContact O-CG 3.4Å; L464-L468 PolarHBondContact O-N 3.38Å; L468-F470 VanDerWaalsContact C-N 3.25Å; L468-F470 HydrophobicContact CB-CD1 3.91Å; L468-F470 HydrophobicContact CB-CE1 3.64Å; L468-F470 HydrophobicContact CB-CE2 4.39Å; L468-F470 HydrophobicContact CB-CG 4.43Å; L468-F470 HydrophobicContact CB-CZ 3.89Å; L468-F470 HydrophobicContact CD1-CE1 4.34Å; L468-F470 HydrophobicContact CD1-CE2 4.23Å; L468-F470 HydrophobicContact CD1-CZ 3.79Å; L468-F470 HydrophobicContact CG-CE1 4.48Å; L468-F470 HydrophobicContact CG-CZ 4.4Å; L468-F470 WeakPolarHBondContact O-CD1 3.38Å; L468-F470 PolarHBondContact O-N 2.92Å; L468-Y518 HydrophobicContact CD1-CD1 3.61Å; L468-Y518 HydrophobicContact CD1-CE1 4.39Å; L468-Y518 HydrophobicContact CD1-CG 4.15Å; L468-W522 HydrophobicContact CB-CE3 4.21Å; L468-W522 HydrophobicContact CB-CZ3 4.45Å; L468-W522 HydrophobicContact CD2-CD2 4.46Å; L468-W522 HydrophobicContact CD2-CE3 3.79Å; L468-W522 HydrophobicContact CD2-CZ3 4.21Å; L468-W522 WeakPolarHBondContact O-CZ3 3.4Å
469	S	86.6	Confident	90.8	Very high	34 Å²	34	36.9 Å²	36.9	24%	0.238	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	31.8	-174.9	-65.3	0	0	0	0	115.3	R253 A465 Y538	R253-S469 PolarHBondContact NH1-OG 2.93Å; R253-S469 PolarHBondContact NH2-OG 3.48Å; A465-S469 VanDerWaalsContact O-CA 3.3Å; A465-S469 WeakPolarHBondContact O-CA 3.14Å; A465-S469 PolarHBondContact O-N 3.36Å; S469-Y538 VanDerWaalsContact O-CD1 3.27Å; S469-Y538 WeakPolarHBondContact O-CD1 3.49Å; S469-Y538 WeakPolarHBondContact O-CE1 3.37Å
470	F	86.4	Confident	90.4	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.026	19%	0.185	C	C	.	.	S	Bend	trans	-148.7	153.3	170.1	60	-106.2	0	0	0	110.9	A465 L468 Y472 Y518 E521 W522 R525	A465-F470 WeakPolarHBondContact CA-O 3.23Å; A465-F470 WeakPolarHBondContact CB-O 3.34Å; A465-F470 PolarHBondContact O-N 3.34Å; L468-F470 VanDerWaalsContact C-N 3.25Å; L468-F470 HydrophobicContact CB-CD1 3.91Å; L468-F470 HydrophobicContact CB-CE1 3.64Å; L468-F470 HydrophobicContact CB-CE2 4.39Å; L468-F470 HydrophobicContact CB-CG 4.43Å; L468-F470 HydrophobicContact CB-CZ 3.89Å; L468-F470 HydrophobicContact CD1-CE1 4.34Å; L468-F470 HydrophobicContact CD1-CE2 4.23Å; L468-F470 HydrophobicContact CD1-CZ 3.79Å; L468-F470 HydrophobicContact CG-CE1 4.48Å; L468-F470 HydrophobicContact CG-CZ 4.4Å; L468-F470 WeakPolarHBondContact O-CD1 3.38Å; L468-F470 PolarHBondContact O-N 2.92Å; F470-Y472 HydrophobicContact CE2-CD1 4.41Å; F470-Y518 AromaticContact CE2-CD1 3.88Å; F470-Y518 HydrophobicContact CE2-CD1 3.88Å; F470-Y518 HydrophobicContact CE2-CE1 4.35Å; F470-Y518 HydrophobicContact CZ-CD1 4.24Å; F470-E521 HydrophobicContact CD1-CG 4.37Å; F470-E521 HydrophobicContact CD2-CG 3.77Å; F470-E521 HydrophobicContact CE1-CB 4.47Å; F470-E521 HydrophobicContact CE1-CG 4.08Å; F470-E521 HydrophobicContact CE2-CB 3.94Å; F470-E521 HydrophobicContact CE2-CG 3.48Å; F470-E521 VanDerWaalsContact CE2-CG 3.48Å; F470-E521 HydrophobicContact CG-CG 4.21Å; F470-E521 HydrophobicContact CZ-CB 3.8Å; F470-E521 HydrophobicContact CZ-CG 3.64Å; F470-W522 HydrophobicContact CE1-CB 4.03Å; F470-W522 HydrophobicContact CE1-CE3 4.06Å; F470-W522 HydrophobicContact CZ-CB 4.39Å; F470-R525 VanDerWaalsContact CB-CZ 3.45Å; F470-R525 VanDerWaalsContact CB-NE 3.32Å
471	F	88.2	Confident	89.9	Confident	89 Å²	89	38.5 Å²	38.5	39%	0.39	20%	0.195	S	C	.	.			trans	-105.9	104.1	179.3	-177.6	-105.6	0	0	0	109.7	E461 A465 P473 Y538 V539	E461-F471 HydrophobicContact CG-CD2 4.4Å; E461-F471 HydrophobicContact CG-CE2 3.8Å; A465-F471 HydrophobicContact CB-CD2 4.15Å; F471-P473 HydrophobicContact CD1-CG 4.39Å; F471-P473 HydrophobicContact CE1-CB 4.09Å; F471-P473 HydrophobicContact CE1-CG 3.74Å; F471-P473 HydrophobicContact CE2-CB 4.34Å; F471-P473 HydrophobicContact CZ-CB 3.79Å; F471-P473 HydrophobicContact CZ-CG 3.97Å; F471-Y538 PolarHBondContact N-O 3.03Å; F471-V539 HydrophobicContact CD1-CG1 4.44Å; F471-V539 HydrophobicContact CD1-CG2 4.34Å
472	Y	88.2	Confident	89.1	Confident	20 Å²	20	42.5 Å²	42.5	8%	0.078	21%	0.212	C	C	.	.			trans	-133.5	88.5	-179.5	-176.3	-146.6	0	0	0	109.5	F470 V474 F517 Y518 E521 P541 W544	F470-Y472 HydrophobicContact CE2-CD1 4.41Å; Y472-V474 HydrophobicContact CD1-CG2 3.8Å; Y472-V474 HydrophobicContact CD2-CG2 3.88Å; Y472-V474 HydrophobicContact CE1-CG2 3.51Å; Y472-V474 HydrophobicContact CE2-CG2 3.54Å; Y472-V474 HydrophobicContact CG-CG2 3.98Å; Y472-V474 PolarHBondContact O-N 3.48Å; Y472-F517 HydrophobicContact CE1-CB 3.91Å; Y472-Y518 WeakPolarHBondContact O-CE1 3.29Å; Y472-Y518 PolarHBondContact O-OH 3.44Å; Y472-Y518 VanDerWaalsContact O-OH 3.04Å; Y472-E521 HydrophobicContact CD1-CB 3.92Å; Y472-E521 HydrophobicContact CD1-CG 4.04Å; Y472-E521 HydrophobicContact CE1-CB 4.2Å; Y472-E521 HydrophobicContact CG-CG 4.48Å; Y472-P541 HydrophobicContact CD2-CB 4.11Å; Y472-P541 HydrophobicContact CE2-CB 4.08Å; Y472-W544 AromaticContact CE2-CH2 3.94Å; Y472-W544 HydrophobicContact CE2-CH2 3.94Å; Y472-W544 AromaticContact CE2-CZ3 3.66Å; Y472-W544 HydrophobicContact CE2-CZ3 3.66Å; Y472-W544 AromaticContact CZ-CH2 3.85Å; Y472-W544 AromaticContact CZ-CZ3 3.76Å; Y472-W544 WeakPolarHBondContact OH-CH2 3.34Å; Y472-W544 WeakPolarHBondContact OH-CZ3 3.36Å
473	P	89.4	Confident	88.4	Confident	41 Å²	41	39.2 Å²	39.2	27%	0.266	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	41.3	-160.8	30.9	-37.4	0	0	0	116	E461 F471 F476 V477	E461-P473 VanDerWaalsContact CD-CA 3.47Å; E461-P473 HydrophobicContact CG-CB 4.35Å; E461-P473 WeakPolarHBondContact OE2-CA 3.2Å; F471-P473 HydrophobicContact CD1-CG 4.39Å; F471-P473 HydrophobicContact CE1-CB 4.09Å; F471-P473 HydrophobicContact CE1-CG 3.74Å; F471-P473 HydrophobicContact CE2-CB 4.34Å; F471-P473 HydrophobicContact CZ-CB 3.79Å; F471-P473 HydrophobicContact CZ-CG 3.97Å; P473-F476 HydrophobicContact CB-CB 4.08Å; P473-F476 PolarHBondContact O-N 3.11Å; P473-V477 WeakPolarHBondContact O-CG2 3.46Å; P473-V477 PolarHBondContact O-N 3.01Å
474	V	90.8	Very high	87.6	Confident	20 Å²	20	40 Å²	40	12%	0.121	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-44.5	177.5	-179.5	0	0	0	0	110.4	Y472 V477 L478 V513 L514 F517 Y518	Y472-V474 HydrophobicContact CD1-CG2 3.8Å; Y472-V474 HydrophobicContact CD2-CG2 3.88Å; Y472-V474 HydrophobicContact CE1-CG2 3.51Å; Y472-V474 HydrophobicContact CE2-CG2 3.54Å; Y472-V474 HydrophobicContact CG-CG2 3.98Å; Y472-V474 PolarHBondContact O-N 3.48Å; V474-V477 PolarHBondContact O-N 3.06Å; V474-L478 WeakPolarHBondContact O-CB 3.38Å; V474-L478 PolarHBondContact O-N 3.05Å; V474-V513 HydrophobicContact CG1-CG1 4.37Å; V474-L514 HydrophobicContact CG1-CD2 4.19Å; V474-F517 HydrophobicContact CG1-CB 4.43Å; V474-F517 HydrophobicContact CG1-CD2 3.77Å; V474-F517 HydrophobicContact CG2-CB 4.33Å; V474-F517 HydrophobicContact CG2-CD2 3.9Å; V474-Y518 HydrophobicContact CB-CE2 4.37Å
475	L	90.8	Very high	86.9	Confident	24 Å²	24	39.7 Å²	39.7	13%	0.126	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-44.4	178	-179.5	57.8	0	0	0	111	H460 E461 L464 V477 L478 F479 L514 Y518	H460-L475 HydrophobicContact CB-CD2 3.7Å; E461-L475 PolarHBondContact OE2-N 3.13Å; L464-L475 HydrophobicContact CD1-CB 4.19Å; L464-L475 HydrophobicContact CD1-CD2 3.58Å; L464-L475 HydrophobicContact CG-CD2 4.43Å; L475-V477 PolarHBondContact O-N 3.48Å; L475-L478 PolarHBondContact O-N 3.31Å; L475-F479 WeakPolarHBondContact O-CB 3.41Å; L475-F479 PolarHBondContact O-N 2.74Å; L475-L514 HydrophobicContact CB-CD2 3.81Å; L475-L514 HydrophobicContact CD1-CD1 3.84Å; L475-L514 HydrophobicContact CD1-CD2 3.8Å; L475-L514 HydrophobicContact CG-CD2 4.37Å; L475-Y518 HydrophobicContact CB-CE2 4.15Å; L475-Y518 WeakPolarHBondContact CB-OH 3.34Å; L475-Y518 PolarHBondContact N-OH 3.09Å; L475-Y518 VanDerWaalsContact N-OH 3.11Å
476	F	91.2	Very high	86.2	Confident	69 Å²	69	40.9 Å²	40.9	30%	0.303	21%	0.209	S	C	.	.	H	α-helix	trans	-55.7	-50.3	174.2	179.2	-94.5	0	0	0	112.3	A457 V458 E461 P473 F479 M480	A457-F476 HydrophobicContact CB-CD2 3.62Å; A457-F476 HydrophobicContact CB-CE2 3.99Å; V458-F476 HydrophobicContact CG2-CD2 4.2Å; V458-F476 HydrophobicContact CG2-CE2 3.83Å; E461-F476 HydrophobicContact CB-CB 4.24Å; E461-F476 HydrophobicContact CG-CB 4.23Å; E461-F476 PolarHBondContact OE2-N 3.29Å; P473-F476 HydrophobicContact CB-CB 4.08Å; P473-F476 PolarHBondContact O-N 3.11Å; F476-F479 PolarHBondContact O-N 3.46Å; F476-M480 HydrophobicContact CD1-CG 4.4Å; F476-M480 HydrophobicContact CD2-CG 4.16Å; F476-M480 HydrophobicContact CE1-CG 4.06Å; F476-M480 HydrophobicContact CE2-CG 3.78Å; F476-M480 HydrophobicContact CE2-SD 4.48Å; F476-M480 HydrophobicContact CG-CG 4.45Å; F476-M480 HydrophobicContact CZ-CG 3.74Å; F476-M480 VanDerWaalsContact O-CB 3.27Å; F476-M480 WeakPolarHBondContact O-CB 3.34Å; F476-M480 VanDerWaalsContact O-CG 3.28Å; F476-M480 WeakPolarHBondContact O-CG 3.07Å; F476-M480 PolarHBondContact O-N 2.78Å
477	V	90.6	Very high	85.5	Confident	86 Å²	86	40.7 Å²	40.7	52%	0.521	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-43.2	179.4	171.6	0	0	0	0	111.4	P473 V474 L475 F481	P473-V477 WeakPolarHBondContact O-CG2 3.46Å; P473-V477 PolarHBondContact O-N 3.01Å; V474-V477 PolarHBondContact O-N 3.06Å; L475-V477 PolarHBondContact O-N 3.48Å; V477-F481 WeakPolarHBondContact O-CB 3.35Å; V477-F481 PolarHBondContact O-N 3.39Å
478	L	88.5	Confident	84.7	Confident	39 Å²	39	46.8 Å²	46.8	20%	0.204	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-46.1	179.7	-171.7	152.4	0	0	0	111	V474 L475 F482 G483 L514	V474-L478 WeakPolarHBondContact O-CB 3.38Å; V474-L478 PolarHBondContact O-N 3.05Å; L475-L478 PolarHBondContact O-N 3.31Å; L478-F482 HydrophobicContact CG-CD2 4.06Å; L478-F482 WeakPolarHBondContact O-CB 3.3Å; L478-F482 PolarHBondContact O-N 3.27Å; L478-G483 PolarHBondContact O-N 3.32Å; L478-L514 HydrophobicContact CD1-CD2 4.36Å; L478-L514 HydrophobicContact CD1-CG 4.2Å
479	F	84.2	Confident	83.8	Confident	29 Å²	29	50 Å²	50	13%	0.127	25%	0.251	C	S	.	.	H	α-helix	trans	-69	-40	-179.5	-162.7	-85.7	0	0	0	112.2	Y417 F453 A457 L475 F476 G483	Y417-F479 HydrophobicContact CD1-CZ 4.47Å; Y417-F479 AromaticContact CE1-CE2 3.59Å; Y417-F479 HydrophobicContact CE1-CE2 3.59Å; Y417-F479 AromaticContact CE1-CZ 3.77Å; Y417-F479 HydrophobicContact CE1-CZ 3.77Å; Y417-F479 AromaticContact CZ-CE2 3.99Å; F453-F479 HydrophobicContact CB-CE1 4.35Å; F453-F479 AromaticContact CD1-CE1 3.77Å; F453-F479 HydrophobicContact CD1-CE1 3.77Å; F453-F479 HydrophobicContact CD1-CZ 4.19Å; A457-F479 HydrophobicContact CB-CB 4.34Å; A457-F479 HydrophobicContact CB-CD1 3.77Å; A457-F479 HydrophobicContact CB-CE1 4.44Å; A457-F479 HydrophobicContact CB-CG 4.33Å; L475-F479 WeakPolarHBondContact O-CB 3.41Å; L475-F479 PolarHBondContact O-N 2.74Å; F476-F479 PolarHBondContact O-N 3.46Å; F479-G483 WeakPolarHBondContact O-CA 3.19Å; F479-G483 PolarHBondContact O-N 3.34Å; F479-G483 VanDerWaalsContact O-N 3.13Å
480	M	85.6	Confident	82.9	Confident	39 Å²	39	48.6 Å²	48.6	19%	0.192	24%	0.241	C	C	.	.	H	α-helix	trans	-75.3	-43.3	178.4	-71.4	-63.7	-67.2	0	0	112.9	L450 A454 A457 F476 M484	L450-M480 HydrophobicContact CD1-CE 3.7Å; A454-M480 HydrophobicContact CB-CE 4.09Å; A454-M480 HydrophobicContact CB-SD 4.11Å; A457-M480 HydrophobicContact CB-CG 4.09Å; A457-M480 HydrophobicContact CB-SD 4.18Å; F476-M480 HydrophobicContact CD1-CG 4.4Å; F476-M480 HydrophobicContact CD2-CG 4.16Å; F476-M480 HydrophobicContact CE1-CG 4.06Å; F476-M480 HydrophobicContact CE2-CG 3.78Å; F476-M480 HydrophobicContact CE2-SD 4.48Å; F476-M480 HydrophobicContact CG-CG 4.45Å; F476-M480 HydrophobicContact CZ-CG 3.74Å; F476-M480 VanDerWaalsContact O-CB 3.27Å; F476-M480 WeakPolarHBondContact O-CB 3.34Å; F476-M480 VanDerWaalsContact O-CG 3.28Å; F476-M480 WeakPolarHBondContact O-CG 3.07Å; F476-M480 PolarHBondContact O-N 2.78Å; M480-M484 WeakPolarHBondContact O-CB 3.48Å; M480-M484 WeakPolarHBondContact O-CG 3.41Å; M480-M484 PolarHBondContact O-N 3.12Å
481	F	83.4	Confident	82.2	Confident	136 Å²	136	52.5 Å²	52.5	60%	0.596	26%	0.262	S	S	*	.	H	α-helix	trans	-76.5	-62.4	-178.6	-175	-100.1	0	0	0	111.3	V477 A485	V477-F481 WeakPolarHBondContact O-CB 3.35Å; V477-F481 PolarHBondContact O-N 3.39Å; F481-A485 WeakPolarHBondContact O-CB 3.33Å; F481-A485 PolarHBondContact O-N 3.27Å
482	F	79.4	Confident	81.2	Confident	90 Å²	90	51.2 Å²	51.2	40%	0.395	26%	0.259	S	S	.	.	H	α-helix	trans	-72.2	-39.9	-177.3	-65.9	-81.3	0	0	0	111.8	L478 M484 A485 F486	L478-F482 HydrophobicContact CG-CD2 4.06Å; L478-F482 WeakPolarHBondContact O-CB 3.3Å; L478-F482 PolarHBondContact O-N 3.27Å; F482-M484 PolarHBondContact O-N 3.27Å; F482-A485 PolarHBondContact O-N 3.05Å; F482-F486 HydrophobicContact CB-CD2 3.9Å; F482-F486 HydrophobicContact CB-CE2 3.8Å; F482-F486 HydrophobicContact CD1-CD2 4.46Å; F482-F486 AromaticContact CD1-CE2 3.62Å; F482-F486 HydrophobicContact CD1-CE2 3.62Å; F482-F486 HydrophobicContact CD1-CZ 4.04Å; F482-F486 HydrophobicContact CG-CE2 4.15Å; F482-F486 VanDerWaalsContact O-CB 3.32Å; F482-F486 WeakPolarHBondContact O-CB 3.33Å; F482-F486 WeakPolarHBondContact O-CD2 3.24Å; F482-F486 WeakPolarHBondContact O-CG 3.25Å; F482-F486 PolarHBondContact O-N 3.32Å
483	G	78.8	Confident	80.3	Confident	4 Å²	4	54.6 Å²	54.6	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-44.8	178.1	0	0	0	0	0	112.8	L478 F479 N487	L478-G483 PolarHBondContact O-N 3.32Å; F479-G483 WeakPolarHBondContact O-CA 3.19Å; F479-G483 PolarHBondContact O-N 3.34Å; F479-G483 VanDerWaalsContact O-N 3.13Å; G483-N487 WeakPolarHBondContact O-CB 3.22Å; G483-N487 PolarHBondContact O-N 3.25Å; G483-N487 VanDerWaalsContact O-N 3.07Å
484	M	78.3	Confident	79.5	Confident	20 Å²	20	58.2 Å²	58.2	10%	0.099	29%	0.294	C	S	.	.	H	α-helix	trans	-71.4	-44.8	175.3	-63.3	-61.5	-53.8	0	0	112.2	L450 F453 M480 F482 F486 N487 F488	L450-M484 HydrophobicContact CB-CE 4.37Å; L450-M484 HydrophobicContact CD1-CE 3.87Å; L450-M484 HydrophobicContact CD1-CG 4.13Å; L450-M484 HydrophobicContact CD1-SD 3.91Å; F453-M484 HydrophobicContact CB-SD 3.99Å; F453-M484 HydrophobicContact CD2-CE 4.43Å; F453-M484 HydrophobicContact CD2-SD 3.47Å; F453-M484 WeakPolarHBondContact CD2-SD 3.45Å; F453-M484 HydrophobicContact CE2-SD 4.22Å; F453-M484 HydrophobicContact CG-SD 3.99Å; M480-M484 WeakPolarHBondContact O-CB 3.48Å; M480-M484 WeakPolarHBondContact O-CG 3.41Å; M480-M484 PolarHBondContact O-N 3.12Å; F482-M484 PolarHBondContact O-N 3.27Å; M484-F486 PolarHBondContact O-N 2.91Å; M484-N487 PolarHBondContact O-N 3.44Å; M484-F488 HydrophobicContact CE-CD2 4.42Å; M484-F488 HydrophobicContact CE-CE2 3.49Å; M484-F488 VanDerWaalsContact CE-CE2 3.49Å; M484-F488 HydrophobicContact CE-CZ 3.88Å; M484-F488 WeakPolarHBondContact O-CD2 3.42Å; M484-F488 PolarHBondContact O-N 3.41Å; M484-F488 VanDerWaalsContact O-N 3.14Å
485	A	78.3	Confident	78.9	Confident	32 Å²	32	64.7 Å²	64.7	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-59	-50.5	179.6	0	0	0	0	0	111.3	F481 F482 N487 F488 I489	F481-A485 WeakPolarHBondContact O-CB 3.33Å; F481-A485 PolarHBondContact O-N 3.27Å; F482-A485 PolarHBondContact O-N 3.05Å; A485-N487 PolarHBondContact O-N 3.08Å; A485-F488 PolarHBondContact O-N 2.79Å; A485-I489 HydrophobicContact CB-CD1 4.27Å; A485-I489 VanDerWaalsContact O-CB 3.3Å; A485-I489 WeakPolarHBondContact O-CB 3.48Å; A485-I489 WeakPolarHBondContact O-CD1 3.41Å; A485-I489 WeakPolarHBondContact O-CG1 3.2Å; A485-I489 PolarHBondContact O-N 3.48Å
486	F	76.7	Confident	78.6	Confident	40 Å²	40	70.8 Å²	70.8	18%	0.175	35%	0.346	C	S	.	.	H	α-helix	trans	-70.1	-29.6	179	-66.7	-52.4	0	0	0	113.5	Y413 F482 M484 F488 V490 S506	Y413-F486 HydrophobicContact CD2-CB 3.36Å; Y413-F486 HydrophobicContact CD2-CD2 4.37Å; Y413-F486 HydrophobicContact CD2-CG 4.06Å; Y413-F486 HydrophobicContact CE2-CB 3.6Å; Y413-F486 AromaticContact CE2-CD2 3.73Å; Y413-F486 HydrophobicContact CE2-CD2 3.73Å; Y413-F486 AromaticContact CE2-CG 3.76Å; Y413-F486 HydrophobicContact CE2-CG 3.76Å; Y413-F486 HydrophobicContact CG-CB 3.92Å; Y413-F486 AromaticContact CZ-CD2 3.91Å; F482-F486 HydrophobicContact CB-CD2 3.9Å; F482-F486 HydrophobicContact CB-CE2 3.8Å; F482-F486 HydrophobicContact CD1-CD2 4.46Å; F482-F486 AromaticContact CD1-CE2 3.62Å; F482-F486 HydrophobicContact CD1-CE2 3.62Å; F482-F486 HydrophobicContact CD1-CZ 4.04Å; F482-F486 HydrophobicContact CG-CE2 4.15Å; F482-F486 VanDerWaalsContact O-CB 3.32Å; F482-F486 WeakPolarHBondContact O-CB 3.33Å; F482-F486 WeakPolarHBondContact O-CD2 3.24Å; F482-F486 WeakPolarHBondContact O-CG 3.25Å; F482-F486 PolarHBondContact O-N 3.32Å; M484-F486 PolarHBondContact O-N 2.91Å; F486-F488 VanDerWaalsContact C-N 3.32Å; F486-F488 PolarHBondContact O-N 3.27Å; F486-V490 HydrophobicContact CB-CG2 4.37Å; F486-V490 HydrophobicContact CD1-CG2 4.22Å; F486-V490 WeakPolarHBondContact O-CA 3.16Å; F486-V490 WeakPolarHBondContact O-CB 3.43Å; F486-V490 PolarHBondContact O-N 3.17Å; F486-S506 WeakPolarHBondContact CE2-OG 3.48Å
487	N	77.8	Confident	78.5	Confident	11 Å²	11	72.4 Å²	72.4	6%	0.059	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-34.2	174.3	-171.8	33.2	0	0	0	112.3	S414 M449 F453 G483 M484 A485	S414-N487 WeakPolarHBondContact CB-OD1 3.38Å; M449-N487 PolarHBondContact SD-ND2 2.91Å; F453-N487 WeakPolarHBondContact CE2-ND2 3.42Å; G483-N487 WeakPolarHBondContact O-CB 3.22Å; G483-N487 PolarHBondContact O-N 3.25Å; G483-N487 VanDerWaalsContact O-N 3.07Å; M484-N487 PolarHBondContact O-N 3.44Å; A485-N487 PolarHBondContact O-N 3.08Å
488	F	74.9	Confident	78.5	Confident	128 Å²	128	72.7 Å²	72.7	56%	0.561	36%	0.361	S	S	*	.	H	α-helix	trans	-82.3	-40.1	173.6	-68.7	-58.5	0	0	0	113.7	M484 A485 F486	M484-F488 HydrophobicContact CE-CD2 4.42Å; M484-F488 HydrophobicContact CE-CE2 3.49Å; M484-F488 VanDerWaalsContact CE-CE2 3.49Å; M484-F488 HydrophobicContact CE-CZ 3.88Å; M484-F488 WeakPolarHBondContact O-CD2 3.42Å; M484-F488 PolarHBondContact O-N 3.41Å; M484-F488 VanDerWaalsContact O-N 3.14Å; A485-F488 PolarHBondContact O-N 2.79Å; F486-F488 VanDerWaalsContact C-N 3.32Å; F486-F488 PolarHBondContact O-N 3.27Å
489	I	71.8	Confident	78.5	Confident	94 Å²	94	72.7 Å²	72.7	48%	0.482	36%	0.358	S	S	.	.	H	α-helix	trans	-72.5	-44.4	-178.5	-66.8	165.1	0	0	0	111.2	A485 N491	A485-I489 HydrophobicContact CB-CD1 4.27Å; A485-I489 VanDerWaalsContact O-CB 3.3Å; A485-I489 WeakPolarHBondContact O-CB 3.48Å; A485-I489 WeakPolarHBondContact O-CD1 3.41Å; A485-I489 WeakPolarHBondContact O-CG1 3.2Å; A485-I489 PolarHBondContact O-N 3.48Å; I489-N491 PolarHBondContact O-N 3.19Å
490	V	67.4	Low	78.8	Confident	4 Å²	4	73 Å²	73	2%	0.024	36%	0.361	C	S	.	.	S	Bend	trans	-100	64.6	-177.1	-164.5	0	0	0	0	109.8	T411 S412 F486 W499	T411-V490 WeakPolarHBondContact O-CG1 3.39Å; S412-V490 VanDerWaalsContact CB-O 3.25Å; S412-V490 WeakPolarHBondContact CB-O 3.48Å; S412-V490 PolarHBondContact OG-O 3.15Å; F486-V490 HydrophobicContact CB-CG2 4.37Å; F486-V490 HydrophobicContact CD1-CG2 4.22Å; F486-V490 WeakPolarHBondContact O-CA 3.16Å; F486-V490 WeakPolarHBondContact O-CB 3.43Å; F486-V490 PolarHBondContact O-N 3.17Å; V490-W499 HydrophobicContact CB-CE3 4.26Å; V490-W499 HydrophobicContact CG1-CB 4.05Å; V490-W499 HydrophobicContact CG1-CD2 4.13Å; V490-W499 HydrophobicContact CG1-CE3 3.65Å; V490-W499 HydrophobicContact CG1-CG 4.3Å; V490-W499 HydrophobicContact CG1-CZ3 4.49Å; V490-W499 HydrophobicContact CG2-CE3 3.82Å; V490-W499 HydrophobicContact CG2-CZ3 4Å
491	N	71.2	Confident	79.2	Confident	88 Å²	88	75.1 Å²	75.1	47%	0.471	38%	0.376	S	S	.	.			trans	-67.1	153.2	-179.2	-168.6	5.2	0	0	0	112.6	I489 S493 R494	I489-N491 PolarHBondContact O-N 3.19Å; N491-S493 PolarHBondContact O-N 3.21Å; N491-R494 PolarHBondContact O-N 3.17Å
492	D	68.8	Low	79.5	Confident	61 Å²	61	72.1 Å²	72.1	33%	0.326	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-15.6	179.2	-83.4	-20.9	0	0	0	114.3	S414 R418 R494	S414-D492 PolarHBondContact OG-OD2 3.28Å; R418-D492 IonicContact CZ-OD1 3.11Å; R418-D492 IonicContact CZ-OD2 3.99Å; R418-D492 VanDerWaalsContact CZ-OD2 3.29Å; R418-D492 IonicContact NH1-OD1 2.69Å; R418-D492 IonicContact NH1-OD2 3.19Å; R418-D492 PolarHBondContact NH1-OD2 3.44Å; R418-D492 VanDerWaalsContact NH2-CG 3.26Å; R418-D492 IonicContact NH2-OD1 3.32Å; R418-D492 PolarHBondContact NH2-OD1 3.33Å; R418-D492 IonicContact NH2-OD2 3.45Å; R418-D492 PolarHBondContact NH2-OD2 3.42Å; D492-R494 VanDerWaalsContact C-N 3.32Å
493	S	69.3	Low	80	Confident	91 Å²	91	68 Å²	68	64%	0.636	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-18.7	173.8	57.5	0	0	0	0	113.9	N491 K495	N491-S493 PolarHBondContact O-N 3.21Å; S493-K495 PolarHBondContact O-N 2.91Å
494	R	72.1	Confident	80.6	Confident	117 Å²	117	70 Å²	70	44%	0.442	35%	0.353	S	S	.	.			trans	-92.7	82.9	-173.7	-61.5	-166.9	-179	-136.2	-2.4	112	N491 D492 K496 W499	N491-R494 PolarHBondContact O-N 3.17Å; D492-R494 VanDerWaalsContact C-N 3.32Å; R494-K496 PolarHBondContact O-N 3.43Å; R494-W499 HydrophobicContact CB-CD2 4.31Å; R494-W499 HydrophobicContact CB-CG 4.2Å
495	K	77.2	Confident	81.3	Confident	156 Å²	156	73.1 Å²	73.1	68%	0.678	37%	0.374	S	S	*	.			trans	-83.2	1.8	-177.3	-60.2	-173.2	177.7	-173.9	0	116.5	S493	S493-K495 PolarHBondContact O-N 2.91Å
496	K	85.9	Confident	81.9	Confident	152 Å²	152	72.9 Å²	72.9	66%	0.661	37%	0.37	S	S	*	.			trans	-67.5	143	-177.5	-66	-170.6	177	-172.2	0	111.1	R494 I498 W499	R494-K496 PolarHBondContact O-N 3.43Å; K496-I498 HydrophobicContact CB-CG2 3.93Å; K496-I498 PolarHBondContact O-N 2.68Å; K496-I498 VanDerWaalsContact O-N 3.13Å; K496-W499 VanDerWaalsContact O-CD1 3.28Å; K496-W499 PolarHBondContact O-N 3.08Å; K496-W499 VanDerWaalsContact O-N 3.11Å
497	P	89.5	Confident	82.6	Confident	103 Å²	103	71.6 Å²	71.6	67%	0.669	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.4	-175.1	23.8	-34.4	0	0	0	114	W499 N500 V501	P497-W499 PolarHBondContact O-N 3.24Å; P497-W499 VanDerWaalsContact O-N 3.14Å; P497-N500 WeakPolarHBondContact O-CB 3.36Å; P497-N500 PolarHBondContact O-N 3.25Å; P497-V501 PolarHBondContact O-N 3.01Å
498	I	89.9	Confident	83.4	Confident	93 Å²	93	74.3 Å²	74.3	48%	0.477	38%	0.376	S	S	.	.	H	α-helix	trans	-54	-31.4	174.2	-171.7	59.4	0	0	0	113.4	K496 V501 M502	K496-I498 HydrophobicContact CB-CG2 3.93Å; K496-I498 PolarHBondContact O-N 2.68Å; K496-I498 VanDerWaalsContact O-N 3.13Å; I498-V501 PolarHBondContact O-N 3.42Å; I498-M502 WeakPolarHBondContact O-CG 3.42Å; I498-M502 PolarHBondContact O-N 2.97Å
499	W	88.1	Confident	84.3	Confident	39 Å²	39	72.1 Å²	72.1	15%	0.148	37%	0.37	C	S	.	.	H	α-helix	trans	-73.6	-28.2	178.5	-58.1	101.7	0	0	0	112.5	T411 V490 R494 K496 P497 M502 M503	T411-W499 VanDerWaalsContact O-CB 3.24Å; T411-W499 WeakPolarHBondContact O-CB 3.37Å; V490-W499 HydrophobicContact CB-CE3 4.26Å; V490-W499 HydrophobicContact CG1-CB 4.05Å; V490-W499 HydrophobicContact CG1-CD2 4.13Å; V490-W499 HydrophobicContact CG1-CE3 3.65Å; V490-W499 HydrophobicContact CG1-CG 4.3Å; V490-W499 HydrophobicContact CG1-CZ3 4.49Å; V490-W499 HydrophobicContact CG2-CE3 3.82Å; V490-W499 HydrophobicContact CG2-CZ3 4Å; R494-W499 HydrophobicContact CB-CD2 4.31Å; R494-W499 HydrophobicContact CB-CG 4.2Å; K496-W499 VanDerWaalsContact O-CD1 3.28Å; K496-W499 PolarHBondContact O-N 3.08Å; K496-W499 VanDerWaalsContact O-N 3.11Å; P497-W499 PolarHBondContact O-N 3.24Å; P497-W499 VanDerWaalsContact O-N 3.14Å; W499-M502 HydrophobicContact CD2-SD 4.46Å; W499-M502 HydrophobicContact CE3-CE 3.82Å; W499-M502 HydrophobicContact CE3-SD 3.71Å; W499-M502 HydrophobicContact CH2-SD 4.45Å; W499-M502 HydrophobicContact CZ3-CE 3.59Å; W499-M502 HydrophobicContact CZ3-SD 3.73Å; W499-M503 WeakPolarHBondContact O-CB 3.28Å; W499-M503 PolarHBondContact O-N 3.27Å
500	N	91.6	Very high	85.3	Confident	34 Å²	34	68.1 Å²	68.1	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-67.7	-45.1	169.9	-165.3	14.5	0	0	0	110.1	W408 S410 T411 P497 M502 M503 W504	W408-N500 PolarHBondContact O-ND2 3.15Å; W408-N500 PolarHBondContact O-OD1 3.34Å; S410-N500 PolarHBondContact O-OD1 3.33Å; T411-N500 HydrophobicContact CG2-CB 4.43Å; P497-N500 WeakPolarHBondContact O-CB 3.36Å; P497-N500 PolarHBondContact O-N 3.25Å; N500-M502 PolarHBondContact O-N 3.11Å; N500-M503 WeakPolarHBondContact O-CB 3.48Å; N500-M503 PolarHBondContact O-N 2.99Å; N500-M503 VanDerWaalsContact O-N 3.16Å; N500-M503 WeakPolarHBondContact OD1-CE 3.41Å; N500-W504 PolarHBondContact O-N 2.94Å; N500-W504 PolarHBondContact OD1-NE1 3.2Å; N500-W504 VanDerWaalsContact OD1-NE1 3.16Å
501	V	92.4	Very high	86.5	Confident	84 Å²	84	69.6 Å²	69.6	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-58	-47.3	175.7	-178.3	0	0	0	0	111.2	P497 I498 M503 W504 T505	P497-V501 PolarHBondContact O-N 3.01Å; I498-V501 PolarHBondContact O-N 3.42Å; V501-M503 PolarHBondContact O-N 2.92Å; V501-W504 PolarHBondContact O-N 3.4Å; V501-T505 PolarHBondContact O-N 3.21Å; V501-T505 PolarHBondContact O-OG1 2.8Å; V501-T505 VanDerWaalsContact O-OG1 3.09Å
502	M	90.3	Very high	87.6	Confident	74 Å²	74	65.4 Å²	65.4	37%	0.365	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-41.7	175.3	-75.9	177	51.9	0	0	113.2	I498 W499 N500 S506	I498-M502 WeakPolarHBondContact O-CG 3.42Å; I498-M502 PolarHBondContact O-N 2.97Å; W499-M502 HydrophobicContact CD2-SD 4.46Å; W499-M502 HydrophobicContact CE3-CE 3.82Å; W499-M502 HydrophobicContact CE3-SD 3.71Å; W499-M502 HydrophobicContact CH2-SD 4.45Å; W499-M502 HydrophobicContact CZ3-CE 3.59Å; W499-M502 HydrophobicContact CZ3-SD 3.73Å; N500-M502 PolarHBondContact O-N 3.11Å; M502-S506 WeakPolarHBondContact O-CB 3.49Å; M502-S506 PolarHBondContact O-N 2.85Å
503	M	89.3	Confident	88.7	Confident	3 Å²	3	64 Å²	64	2%	0.015	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-49.1	176.9	-176.6	-76.7	-70.9	0	0	110.3	Y413 Y416 W499 N500 V501 S506 L507	Y413-M503 HydrophobicContact CD2-CG 4.44Å; Y413-M503 HydrophobicContact CE2-CB 4.43Å; Y413-M503 HydrophobicContact CE2-CG 4.14Å; Y416-M503 HydrophobicContact CD2-SD 4.22Å; W499-M503 WeakPolarHBondContact O-CB 3.28Å; W499-M503 PolarHBondContact O-N 3.27Å; N500-M503 WeakPolarHBondContact O-CB 3.48Å; N500-M503 PolarHBondContact O-N 2.99Å; N500-M503 VanDerWaalsContact O-N 3.16Å; N500-M503 WeakPolarHBondContact OD1-CE 3.41Å; V501-M503 PolarHBondContact O-N 2.92Å; M503-S506 PolarHBondContact O-N 3.44Å; M503-L507 VanDerWaalsContact O-CB 3.25Å; M503-L507 WeakPolarHBondContact O-CB 3.36Å; M503-L507 PolarHBondContact O-N 3.47Å; M503-L507 HydrophobicContact SD-CB 4.41Å; M503-L507 HydrophobicContact SD-CD1 3.98Å
504	W	92.8	Very high	89.8	Confident	46 Å²	46	60.9 Å²	60.9	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-48.4	176.3	-80.6	111.2	0	0	0	113.2	F378 W407 W408 N500 V501 S506 L507 F508	F378-W504 AromaticContact CE1-CH2 3.84Å; F378-W504 HydrophobicContact CE1-CH2 3.84Å; F378-W504 HydrophobicContact CE1-CZ3 4.26Å; F378-W504 HydrophobicContact CE2-CZ3 4.42Å; F378-W504 AromaticContact CZ-CH2 3.53Å; F378-W504 HydrophobicContact CZ-CH2 3.53Å; F378-W504 AromaticContact CZ-CZ3 3.62Å; F378-W504 HydrophobicContact CZ-CZ3 3.62Å; W407-W504 HydrophobicContact CE3-CH2 4.39Å; W407-W504 AromaticContact CH2-CH2 3.5Å; W407-W504 HydrophobicContact CH2-CH2 3.5Å; W407-W504 HydrophobicContact CH2-CZ2 4.33Å; W407-W504 HydrophobicContact CH2-CZ3 4.15Å; W407-W504 AromaticContact CZ3-CH2 3.27Å; W407-W504 HydrophobicContact CZ3-CH2 3.27Å; W407-W504 AromaticContact CZ3-CZ2 3.82Å; W407-W504 HydrophobicContact CZ3-CZ2 3.82Å; W407-W504 AromaticContact CZ3-CZ3 3.87Å; W407-W504 HydrophobicContact CZ3-CZ3 3.87Å; W408-W504 HydrophobicContact CB-CH2 4.38Å; W408-W504 HydrophobicContact CB-CZ2 3.65Å; W408-W504 PolarHBondContact O-NE1 3.04Å; N500-W504 PolarHBondContact O-N 2.94Å; N500-W504 PolarHBondContact OD1-NE1 3.2Å; N500-W504 VanDerWaalsContact OD1-NE1 3.16Å; V501-W504 PolarHBondContact O-N 3.4Å; W504-S506 VanDerWaalsContact C-N 3.31Å; W504-S506 PolarHBondContact O-N 3.13Å; W504-L507 HydrophobicContact CE3-CD2 4.16Å; W504-L507 HydrophobicContact CZ3-CD2 4.2Å; W504-L507 PolarHBondContact O-N 3.5Å; W504-F508 HydrophobicContact CD2-CE1 4.45Å; W504-F508 HydrophobicContact CD2-CZ 4.36Å; W504-F508 HydrophobicContact CE3-CD1 4.08Å; W504-F508 AromaticContact CE3-CE1 3.31Å; W504-F508 HydrophobicContact CE3-CE1 3.31Å; W504-F508 AromaticContact CE3-CZ 3.57Å; W504-F508 HydrophobicContact CE3-CZ 3.57Å; W504-F508 AromaticContact CZ3-CE1 3.6Å; W504-F508 HydrophobicContact CZ3-CE1 3.6Å; W504-F508 HydrophobicContact CZ3-CZ 4.04Å; W504-F508 WeakPolarHBondContact O-CB 3.36Å; W504-F508 WeakPolarHBondContact O-CG 3.31Å; W504-F508 PolarHBondContact O-N 3.25Å
505	T	92.7	Very high	90.8	Very high	86 Å²	86	56.6 Å²	56.6	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-57.7	-43.9	176.8	-59.3	0	0	0	0	111.6	V501 L509	V501-T505 PolarHBondContact O-N 3.21Å; V501-T505 PolarHBondContact O-OG1 2.8Å; V501-T505 VanDerWaalsContact O-OG1 3.09Å; T505-L509 WeakPolarHBondContact O-CB 3.33Å; T505-L509 PolarHBondContact O-N 3.46Å
506	S	91.4	Very high	91.5	Very high	26 Å²	26	49.2 Å²	49.2	18%	0.182	26%	0.26	C	S	.	.	H	α-helix	trans	-71.9	-32.2	179.6	-174.1	0	0	0	0	113.2	Y413 F486 M502 M503 W504 G510	Y413-S506 VanDerWaalsContact OH-CB 3.24Å; Y413-S506 WeakPolarHBondContact OH-CB 3.45Å; Y413-S506 PolarHBondContact OH-OG 3.39Å; Y413-S506 VanDerWaalsContact OH-OG 3.14Å; F486-S506 WeakPolarHBondContact CE2-OG 3.48Å; M502-S506 WeakPolarHBondContact O-CB 3.49Å; M502-S506 PolarHBondContact O-N 2.85Å; M503-S506 PolarHBondContact O-N 3.44Å; W504-S506 VanDerWaalsContact C-N 3.31Å; W504-S506 PolarHBondContact O-N 3.13Å; S506-G510 PolarHBondContact O-N 3.37Å
507	L	91.6	Very high	91.7	Very high	13 Å²	13	44 Å²	44	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-71.4	-41.7	175.8	175.1	159.5	0	0	0	111.2	L377 Y416 M503 W504 G510 N511	L377-L507 HydrophobicContact CD2-CD1 4.4Å; L377-L507 HydrophobicContact CD2-CD2 3.54Å; L377-L507 HydrophobicContact CD2-CG 4.3Å; Y416-L507 HydrophobicContact CD2-CD1 4.47Å; Y416-L507 HydrophobicContact CE2-CD1 3.61Å; M503-L507 VanDerWaalsContact O-CB 3.25Å; M503-L507 WeakPolarHBondContact O-CB 3.36Å; M503-L507 PolarHBondContact O-N 3.47Å; M503-L507 HydrophobicContact SD-CB 4.41Å; M503-L507 HydrophobicContact SD-CD1 3.98Å; W504-L507 HydrophobicContact CE3-CD2 4.16Å; W504-L507 HydrophobicContact CZ3-CD2 4.2Å; W504-L507 PolarHBondContact O-N 3.5Å; L507-G510 PolarHBondContact O-N 3.47Å; L507-N511 PolarHBondContact O-N 3.01Å
508	F	94.5	Very high	91.8	Very high	68 Å²	68	40.1 Å²	40.1	30%	0.298	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-49.5	173.9	-68.5	-10.1	0	0	0	111.9	I370 V374 W504 G510 N511 G512	I370-F508 HydrophobicContact CG2-CB 3.96Å; V374-F508 HydrophobicContact CB-CD1 4.32Å; V374-F508 HydrophobicContact CB-CE1 4.41Å; V374-F508 HydrophobicContact CG1-CD1 4.02Å; V374-F508 HydrophobicContact CG1-CE1 3.62Å; V374-F508 HydrophobicContact CG1-CZ 4.24Å; V374-F508 HydrophobicContact CG2-CB 4.01Å; V374-F508 HydrophobicContact CG2-CD1 3.27Å; V374-F508 HydrophobicContact CG2-CE1 3.8Å; V374-F508 HydrophobicContact CG2-CG 3.75Å; W504-F508 HydrophobicContact CD2-CE1 4.45Å; W504-F508 HydrophobicContact CD2-CZ 4.36Å; W504-F508 HydrophobicContact CE3-CD1 4.08Å; W504-F508 AromaticContact CE3-CE1 3.31Å; W504-F508 HydrophobicContact CE3-CE1 3.31Å; W504-F508 AromaticContact CE3-CZ 3.57Å; W504-F508 HydrophobicContact CE3-CZ 3.57Å; W504-F508 AromaticContact CZ3-CE1 3.6Å; W504-F508 HydrophobicContact CZ3-CE1 3.6Å; W504-F508 HydrophobicContact CZ3-CZ 4.04Å; W504-F508 WeakPolarHBondContact O-CB 3.36Å; W504-F508 WeakPolarHBondContact O-CG 3.31Å; W504-F508 PolarHBondContact O-N 3.25Å; F508-G510 VanDerWaalsContact C-N 3.34Å; F508-G510 PolarHBondContact O-N 3.07Å; F508-N511 PolarHBondContact O-N 3.45Å; F508-G512 PolarHBondContact O-N 3.04Å
509	L	93.1	Very high	91.8	Very high	82 Å²	82	36.4 Å²	36.4	43%	0.429	19%	0.192	S	C	.	.	H	α-helix	trans	-62.3	-42.6	177	-177.3	62.7	0	0	0	111.4	V366 I370 T505 G512 V513	V366-L509 HydrophobicContact CG1-CD1 4.22Å; I370-L509 HydrophobicContact CD1-CD1 4.34Å; T505-L509 WeakPolarHBondContact O-CB 3.33Å; T505-L509 PolarHBondContact O-N 3.46Å; L509-G512 PolarHBondContact O-N 3.4Å; L509-V513 HydrophobicContact CD1-CG2 4.46Å; L509-V513 WeakPolarHBondContact O-CG2 3.37Å; L509-V513 PolarHBondContact O-N 3.4Å
510	G	92.4	Very high	91.8	Very high	10 Å²	10	35.4 Å²	35.4	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-48.9	178.1	0	0	0	0	0	112.5	S506 L507 F508 G512 V513 L514	S506-G510 PolarHBondContact O-N 3.37Å; L507-G510 PolarHBondContact O-N 3.47Å; F508-G510 VanDerWaalsContact C-N 3.34Å; F508-G510 PolarHBondContact O-N 3.07Å; G510-G512 PolarHBondContact O-N 2.9Å; G510-V513 PolarHBondContact O-N 3.27Å; G510-L514 WeakPolarHBondContact O-CG 3.31Å; G510-L514 PolarHBondContact O-N 2.88Å
511	N	92.9	Very high	91.6	Very high	36 Å²	36	33.8 Å²	33.8	19%	0.193	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-38.3	176.9	-75	-6.7	0	0	0	113	L377 L507 F508 L514 L515	L377-N511 WeakPolarHBondContact CB-ND2 3.2Å; L377-N511 WeakPolarHBondContact CD2-ND2 3.48Å; L507-N511 PolarHBondContact O-N 3.01Å; F508-N511 PolarHBondContact O-N 3.45Å; N511-L514 PolarHBondContact O-N 3Å; N511-L515 WeakPolarHBondContact O-CB 3.38Å; N511-L515 PolarHBondContact O-N 2.98Å
512	G	93.1	Very high	91.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-45.1	174.8	0	0	0	0	0	112.6	S369 F508 L509 G510 C516	S369-G512 WeakPolarHBondContact CB-O 3.49Å; F508-G512 PolarHBondContact O-N 3.04Å; L509-G512 PolarHBondContact O-N 3.4Å; G510-G512 PolarHBondContact O-N 2.9Å; G512-C516 WeakPolarHBondContact O-CB 3.34Å; G512-C516 PolarHBondContact O-N 3.49Å
513	V	93	Very high	91.1	Very high	30 Å²	30	31.7 Å²	31.7	18%	0.182	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-46.4	175.2	171.3	0	0	0	0	111.2	V366 V474 L509 G510 C516 F517	V366-V513 HydrophobicContact CG1-CG2 3.69Å; V366-V513 HydrophobicContact CG2-CG2 4.33Å; V474-V513 HydrophobicContact CG1-CG1 4.37Å; L509-V513 HydrophobicContact CD1-CG2 4.46Å; L509-V513 WeakPolarHBondContact O-CG2 3.37Å; L509-V513 PolarHBondContact O-N 3.4Å; G510-V513 PolarHBondContact O-N 3.27Å; V513-C516 PolarHBondContact O-N 2.96Å; V513-F517 HydrophobicContact CG1-CD1 4.43Å; V513-F517 HydrophobicContact CG1-CD2 3.9Å; V513-F517 HydrophobicContact CG1-CE1 4.39Å; V513-F517 HydrophobicContact CG1-CE2 3.86Å; V513-F517 HydrophobicContact CG1-CG 4.2Å; V513-F517 HydrophobicContact CG1-CZ 4.11Å; V513-F517 VanDerWaalsContact O-CB 3.29Å; V513-F517 WeakPolarHBondContact O-CB 3.37Å; V513-F517 WeakPolarHBondContact O-CG 3.36Å; V513-F517 PolarHBondContact O-N 2.85Å
514	L	92.9	Very high	90.8	Very high	27 Å²	27	31.6 Å²	31.6	14%	0.141	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-52.1	179.4	-68.7	166.7	0	0	0	111.4	V474 L475 L478 G510 N511 C516 F517 Y518	V474-L514 HydrophobicContact CG1-CD2 4.19Å; L475-L514 HydrophobicContact CB-CD2 3.81Å; L475-L514 HydrophobicContact CD1-CD1 3.84Å; L475-L514 HydrophobicContact CD1-CD2 3.8Å; L475-L514 HydrophobicContact CG-CD2 4.37Å; L478-L514 HydrophobicContact CD1-CD2 4.36Å; L478-L514 HydrophobicContact CD1-CG 4.2Å; G510-L514 WeakPolarHBondContact O-CG 3.31Å; G510-L514 PolarHBondContact O-N 2.88Å; N511-L514 PolarHBondContact O-N 3Å; L514-C516 VanDerWaalsContact C-N 3.33Å; L514-C516 PolarHBondContact O-N 3.4Å; L514-F517 PolarHBondContact O-N 3.35Å; L514-Y518 HydrophobicContact CD2-CD2 4.45Å; L514-Y518 HydrophobicContact CD2-CE2 3.87Å; L514-Y518 VanDerWaalsContact O-CD2 3.29Å; L514-Y518 WeakPolarHBondContact O-CD2 3.33Å; L514-Y518 PolarHBondContact O-N 3.14Å
515	L	92.9	Very high	90.4	Very high	26 Å²	26	31.4 Å²	31.4	14%	0.136	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-43.9	179.6	-176.6	65.2	0	0	0	111.3	F341 P372 I376 N511 S519	F341-L515 HydrophobicContact CE1-CD1 4.38Å; P372-L515 HydrophobicContact CB-CD2 3.96Å; P372-L515 HydrophobicContact CG-CD2 3.89Å; I376-L515 HydrophobicContact CD1-CD1 4.33Å; I376-L515 HydrophobicContact CD1-CD2 4.25Å; N511-L515 WeakPolarHBondContact O-CB 3.38Å; N511-L515 PolarHBondContact O-N 2.98Å; L515-S519 WeakPolarHBondContact O-CB 3.35Å; L515-S519 PolarHBondContact O-N 3.4Å; L515-S519 VanDerWaalsContact O-N 3.13Å; L515-S519 PolarHBondContact O-OG 3.5Å
516	C	91.4	Very high	89.9	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-60.5	-52	176.8	-179.4	0	0	0	0	111.9	V366 G512 V513 L514 Q520	V366-C516 HydrophobicContact CG2-CB 4.03Å; G512-C516 WeakPolarHBondContact O-CB 3.34Å; G512-C516 PolarHBondContact O-N 3.49Å; V513-C516 PolarHBondContact O-N 2.96Å; L514-C516 VanDerWaalsContact C-N 3.33Å; L514-C516 PolarHBondContact O-N 3.4Å; C516-Q520 WeakPolarHBondContact O-CB 3.42Å; C516-Q520 PolarHBondContact O-N 3.5Å
517	F	90.9	Very high	89.4	Confident	44 Å²	44	35 Å²	35	19%	0.193	17%	0.167	C	C	.	.	H	α-helix	trans	-73.3	-41.6	-170.1	-77.8	15.7	0	0	0	112.3	L362 V366 Y472 V474 V513 L514 E521	L362-F517 HydrophobicContact CD1-CD1 4.47Å; L362-F517 HydrophobicContact CD1-CE1 3.79Å; L362-F517 HydrophobicContact CD2-CE1 4.42Å; L362-F517 HydrophobicContact CD2-CZ 4.47Å; L362-F517 HydrophobicContact CG-CE1 4.26Å; V366-F517 HydrophobicContact CG2-CE1 4.03Å; Y472-F517 HydrophobicContact CE1-CB 3.91Å; V474-F517 HydrophobicContact CG1-CB 4.43Å; V474-F517 HydrophobicContact CG1-CD2 3.77Å; V474-F517 HydrophobicContact CG2-CB 4.33Å; V474-F517 HydrophobicContact CG2-CD2 3.9Å; V513-F517 HydrophobicContact CG1-CD1 4.43Å; V513-F517 HydrophobicContact CG1-CD2 3.9Å; V513-F517 HydrophobicContact CG1-CE1 4.39Å; V513-F517 HydrophobicContact CG1-CE2 3.86Å; V513-F517 HydrophobicContact CG1-CG 4.2Å; V513-F517 HydrophobicContact CG1-CZ 4.11Å; V513-F517 VanDerWaalsContact O-CB 3.29Å; V513-F517 WeakPolarHBondContact O-CB 3.37Å; V513-F517 WeakPolarHBondContact O-CG 3.36Å; V513-F517 PolarHBondContact O-N 2.85Å; L514-F517 PolarHBondContact O-N 3.35Å; F517-E521 WeakPolarHBondContact O-CB 3.49Å; F517-E521 PolarHBondContact O-N 3.02Å; F517-E521 VanDerWaalsContact O-N 3.08Å
518	Y	91.5	Very high	88.7	Confident	20 Å²	20	36.3 Å²	36.3	8%	0.078	18%	0.177	C	C	.	.	H	α-helix	trans	-69.9	-38.1	175.8	-74.6	-70.8	0	0	0	112.2	E461 L464 L468 F470 Y472 V474 L475 L514 W522	E461-Y518 PolarHBondContact OE1-OH 2.92Å; E461-Y518 VanDerWaalsContact OE1-OH 3.04Å; E461-Y518 PolarHBondContact OE2-OH 3.26Å; E461-Y518 VanDerWaalsContact OE2-OH 3.09Å; L464-Y518 HydrophobicContact CB-CE1 4.42Å; L464-Y518 HydrophobicContact CD1-CD2 4.16Å; L464-Y518 HydrophobicContact CD1-CE1 4.08Å; L464-Y518 HydrophobicContact CD1-CE2 3.57Å; L468-Y518 HydrophobicContact CD1-CD1 3.61Å; L468-Y518 HydrophobicContact CD1-CE1 4.39Å; L468-Y518 HydrophobicContact CD1-CG 4.15Å; F470-Y518 AromaticContact CE2-CD1 3.88Å; F470-Y518 HydrophobicContact CE2-CD1 3.88Å; F470-Y518 HydrophobicContact CE2-CE1 4.35Å; F470-Y518 HydrophobicContact CZ-CD1 4.24Å; Y472-Y518 WeakPolarHBondContact O-CE1 3.29Å; Y472-Y518 PolarHBondContact O-OH 3.44Å; Y472-Y518 VanDerWaalsContact O-OH 3.04Å; V474-Y518 HydrophobicContact CB-CE2 4.37Å; L475-Y518 HydrophobicContact CB-CE2 4.15Å; L475-Y518 WeakPolarHBondContact CB-OH 3.34Å; L475-Y518 PolarHBondContact N-OH 3.09Å; L475-Y518 VanDerWaalsContact N-OH 3.11Å; L514-Y518 HydrophobicContact CD2-CD2 4.45Å; L514-Y518 HydrophobicContact CD2-CE2 3.87Å; L514-Y518 VanDerWaalsContact O-CD2 3.29Å; L514-Y518 WeakPolarHBondContact O-CD2 3.33Å; L514-Y518 PolarHBondContact O-N 3.14Å; Y518-W522 VanDerWaalsContact O-CB 3.31Å; Y518-W522 WeakPolarHBondContact O-CB 3.5Å; Y518-W522 PolarHBondContact O-N 3.47Å
519	S	89.7	Confident	87.9	Confident	16 Å²	16	37.9 Å²	37.9	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-45.8	175.2	-56.8	0	0	0	0	111.3	L515 E521 W522 Y523	L515-S519 WeakPolarHBondContact O-CB 3.35Å; L515-S519 PolarHBondContact O-N 3.4Å; L515-S519 VanDerWaalsContact O-N 3.13Å; L515-S519 PolarHBondContact O-OG 3.5Å; S519-E521 PolarHBondContact O-N 3.23Å; S519-W522 PolarHBondContact O-N 2.89Å; S519-Y523 VanDerWaalsContact O-CD2 3.23Å; S519-Y523 WeakPolarHBondContact O-CD2 3.26Å; S519-Y523 PolarHBondContact O-N 3.48Å
520	Q	86.9	Confident	86.8	Confident	17 Å²	17	37.1 Å²	37.1	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-45.1	178.8	-173.8	65.2	11.7	0	0	112.1	C516 A524	C516-Q520 WeakPolarHBondContact O-CB 3.42Å; C516-Q520 PolarHBondContact O-N 3.5Å; Q520-A524 WeakPolarHBondContact O-CB 3.48Å; Q520-A524 PolarHBondContact O-N 2.99Å
521	E	87.9	Confident	85.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.2	-40.2	178	-176.6	63.9	-167.7	0	0	112	F470 Y472 F517 S519 A524 R525 P541 R542 S543	F470-E521 HydrophobicContact CD1-CG 4.37Å; F470-E521 HydrophobicContact CD2-CG 3.77Å; F470-E521 HydrophobicContact CE1-CB 4.47Å; F470-E521 HydrophobicContact CE1-CG 4.08Å; F470-E521 HydrophobicContact CE2-CB 3.94Å; F470-E521 HydrophobicContact CE2-CG 3.48Å; F470-E521 VanDerWaalsContact CE2-CG 3.48Å; F470-E521 HydrophobicContact CG-CG 4.21Å; F470-E521 HydrophobicContact CZ-CB 3.8Å; F470-E521 HydrophobicContact CZ-CG 3.64Å; Y472-E521 HydrophobicContact CD1-CB 3.92Å; Y472-E521 HydrophobicContact CD1-CG 4.04Å; Y472-E521 HydrophobicContact CE1-CB 4.2Å; Y472-E521 HydrophobicContact CG-CG 4.48Å; F517-E521 WeakPolarHBondContact O-CB 3.49Å; F517-E521 PolarHBondContact O-N 3.02Å; F517-E521 VanDerWaalsContact O-N 3.08Å; S519-E521 PolarHBondContact O-N 3.23Å; E521-A524 PolarHBondContact O-N 3.44Å; E521-R525 WeakPolarHBondContact O-CG 3.48Å; E521-R525 PolarHBondContact O-N 3.24Å; E521-R525 IonicContact OE1-CZ 3.84Å; E521-R525 VanDerWaalsContact OE1-CZ 3.23Å; E521-R525 IonicContact OE1-NE 3.86Å; E521-R525 PolarHBondContact OE1-NE 3.11Å; E521-R525 IonicContact OE1-NH2 2.67Å; E521-R525 PolarHBondContact OE1-NH2 3.2Å; E521-P541 WeakPolarHBondContact OE1-CA 3.44Å; E521-R542 PolarHBondContact OE1-N 3.16Å; E521-R542 PolarHBondContact OE2-N 2.97Å; E521-S543 WeakPolarHBondContact OE2-CB 3.15Å; E521-S543 PolarHBondContact OE2-N 3.19Å; E521-S543 PolarHBondContact OE2-OG 3.46Å
522	W	87.9	Confident	84.4	Confident	57 Å²	57	51.7 Å²	51.7	22%	0.216	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-51.4	175.1	176.1	-92	0	0	0	111.8	P250 L468 F470 Y518 S519 A524 R525 Q526	P250-W522 HydrophobicContact CB-CH2 4.09Å; P250-W522 HydrophobicContact CB-CZ3 4.48Å; P250-W522 HydrophobicContact CG-CH2 3.87Å; P250-W522 HydrophobicContact CG-CZ2 3.95Å; L468-W522 HydrophobicContact CB-CE3 4.21Å; L468-W522 HydrophobicContact CB-CZ3 4.45Å; L468-W522 HydrophobicContact CD2-CD2 4.46Å; L468-W522 HydrophobicContact CD2-CE3 3.79Å; L468-W522 HydrophobicContact CD2-CZ3 4.21Å; L468-W522 WeakPolarHBondContact O-CZ3 3.4Å; F470-W522 HydrophobicContact CE1-CB 4.03Å; F470-W522 HydrophobicContact CE1-CE3 4.06Å; F470-W522 HydrophobicContact CZ-CB 4.39Å; Y518-W522 VanDerWaalsContact O-CB 3.31Å; Y518-W522 WeakPolarHBondContact O-CB 3.5Å; Y518-W522 PolarHBondContact O-N 3.47Å; S519-W522 PolarHBondContact O-N 2.89Å; W522-A524 PolarHBondContact O-N 2.97Å; W522-R525 PolarHBondContact O-N 2.98Å; W522-Q526 PolarHBondContact O-N 3.37Å; W522-Q526 VanDerWaalsContact O-N 3.08Å
523	Y	85.1	Confident	83.3	Confident	57 Å²	57	54.7 Å²	54.7	22%	0.224	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-39.3	177.3	-77.7	-71.3	0	0	0	112	F349 R350 S519 R525 Q526 H527	F349-Y523 HydrophobicContact CB-CD2 3.38Å; F349-Y523 HydrophobicContact CB-CE2 3.41Å; F349-Y523 VanDerWaalsContact CB-CE2 3.41Å; F349-Y523 HydrophobicContact CB-CG 4.24Å; F349-Y523 HydrophobicContact CD2-CE2 4.28Å; F349-Y523 HydrophobicContact CG-CD2 4.11Å; F349-Y523 HydrophobicContact CG-CE2 4.11Å; R350-Y523 HydrophobicContact CG-CE1 4.28Å; S519-Y523 VanDerWaalsContact O-CD2 3.23Å; S519-Y523 WeakPolarHBondContact O-CD2 3.26Å; S519-Y523 PolarHBondContact O-N 3.48Å; Y523-R525 VanDerWaalsContact C-N 3.33Å; Y523-R525 PolarHBondContact O-N 2.96Å; Y523-Q526 PolarHBondContact O-N 3.34Å; Y523-H527 PolarHBondContact O-N 3Å; Y523-H527 VanDerWaalsContact O-N 3.08Å; Y523-H527 PolarHBondContact O-ND1 2.96Å
524	A	83.2	Confident	82.5	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-39.7	176.4	0	0	0	0	0	112.4	Q520 E521 W522 H527 C528 R542	Q520-A524 WeakPolarHBondContact O-CB 3.48Å; Q520-A524 PolarHBondContact O-N 2.99Å; E521-A524 PolarHBondContact O-N 3.44Å; W522-A524 PolarHBondContact O-N 2.97Å; A524-H527 PolarHBondContact O-N 3.01Å; A524-C528 PolarHBondContact O-N 3.45Å; A524-R542 HydrophobicContact CB-CB 4.43Å
525	R	83.7	Confident	81.5	Confident	42 Å²	42	63.9 Å²	63.9	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-68.4	-35.3	175.4	-74.3	180	-176.6	-97.6	-13.9	113.1	F470 E521 W522 Y523 H527 C528 D537 R540 R542	F470-R525 VanDerWaalsContact CB-CZ 3.45Å; F470-R525 VanDerWaalsContact CB-NE 3.32Å; E521-R525 WeakPolarHBondContact O-CG 3.48Å; E521-R525 PolarHBondContact O-N 3.24Å; E521-R525 IonicContact OE1-CZ 3.84Å; E521-R525 VanDerWaalsContact OE1-CZ 3.23Å; E521-R525 IonicContact OE1-NE 3.86Å; E521-R525 PolarHBondContact OE1-NE 3.11Å; E521-R525 IonicContact OE1-NH2 2.67Å; E521-R525 PolarHBondContact OE1-NH2 3.2Å; W522-R525 PolarHBondContact O-N 2.98Å; Y523-R525 VanDerWaalsContact C-N 3.33Å; Y523-R525 PolarHBondContact O-N 2.96Å; R525-H527 VanDerWaalsContact C-N 3.34Å; R525-C528 CarbonylContact O-C 3.57Å; R525-D537 PolarHBondContact NH1-O 2.96Å; R525-D537 PolarHBondContact NH2-O 2.7Å; R525-D537 VanDerWaalsContact NH2-O 3.12Å; R525-R540 PolarHBondContact NH2-O 3.43Å; R525-R542 HydrophobicContact CG-CB 4.01Å; R525-R542 HydrophobicContact CG-CG 4.07Å
526	Q	82.9	Confident	80.4	Confident	122 Å²	122	68.7 Å²	68.7	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-67.7	-33.4	175.7	-167.8	65.3	18.1	0	0	112.3	W522 Y523	W522-Q526 PolarHBondContact O-N 3.37Å; W522-Q526 VanDerWaalsContact O-N 3.08Å; Y523-Q526 PolarHBondContact O-N 3.34Å
527	H	79.3	Confident	79.4	Confident	67 Å²	67	69.8 Å²	69.8	31%	0.31	35%	0.35	S	S	.	.	H	α-helix	trans	-81.7	-35.2	177.9	-69.2	100.7	0	0	0	113.8	K353 Y523 A524 R525 P529 Y548	K353-H527 WeakPolarHBondContact CE-NE2 3.28Å; K353-H527 PolarHBondContact NZ-NE2 3.2Å; Y523-H527 PolarHBondContact O-N 3Å; Y523-H527 VanDerWaalsContact O-N 3.08Å; Y523-H527 PolarHBondContact O-ND1 2.96Å; A524-H527 PolarHBondContact O-N 3.01Å; R525-H527 VanDerWaalsContact C-N 3.34Å; H527-P529 WeakPolarHBondContact O-CD 3.23Å; H527-Y548 HydrophobicContact CB-CE1 4.42Å
528	C	78.1	Confident	78.6	Confident	40 Å²	40	72.1 Å²	72.1	27%	0.27	36%	0.358	S	S	.	.	S	Bend	trans	-112.1	68	178	-79.3	0	0	0	0	111.7	A524 R525 C546	A524-C528 PolarHBondContact O-N 3.45Å; R525-C528 CarbonylContact O-C 3.57Å; C528-C546 HydrophobicContact CB-CB 3.81Å; C528-C546 WeakPolarHBondContact CB-SG 3.33Å; C528-C546 WeakPolarHBondContact SG-CB 3.47Å; C528-C546 CovalentContact SG-SG 2.05Å; C528-C546 PolarHBondContact SG-SG 3.09Å
529	P	77.2	Confident	77.8	Confident	101 Å²	101	74 Å²	74	66%	0.656	37%	0.371	S	S	*	.			trans	-68.8	138	179.6	29.5	-35.4	0	0	0	111.7	H527	H527-P529 WeakPolarHBondContact O-CD 3.23Å
530	L	69.4	Low	77.1	Confident	66 Å²	66	80.9 Å²	80.9	35%	0.346	40%	0.395	S	S	.	.			trans	-90.6	126.1	179	-65.3	170.2	0	0	0	111	P533 D537	L530-P533 HydrophobicContact CB-CB 4.3Å; L530-P533 HydrophobicContact CD1-CB 4.4Å; L530-D537 HydrophobicContact CD1-CB 3.47Å; L530-D537 VanDerWaalsContact CD1-CB 3.47Å
531	K	65.8	Low	76.5	Confident	205 Å²	205	81.6 Å²	81.6	89%	0.891	40%	0.401	S	S	*	.	S	Bend	trans	-69.9	-32.7	177.9	-66.2	-174.9	177.6	-178.4	0	113
532	N	69	Low	76	Confident	146 Å²	146	83.6 Å²	83.6	78%	0.781	41%	0.409	S	S	*	.	S	Bend	trans	-137.7	91.2	176	-72.5	-35.5	0	0	0	109.1
533	P	69.9	Low	75.2	Confident	64 Å²	64	81.5 Å²	81.5	42%	0.416	40%	0.403	S	S	.	.			trans	-79	126	-177.3	30.8	-34	0	0	0	112.1	L530 Y538	L530-P533 HydrophobicContact CB-CB 4.3Å; L530-P533 HydrophobicContact CD1-CB 4.4Å; P533-Y538 HydrophobicContact CB-CE2 3.78Å; P533-Y538 HydrophobicContact CG-CE2 4.28Å
534	T	76.1	Confident	74.5	Confident	86 Å²	86	84.9 Å²	84.9	53%	0.528	42%	0.415	S	S	.	.			trans	-85.8	159.5	169.7	-28.7	0	0	0	0	109.6	L536 D537 Y538	T534-L536 PolarHBondContact O-N 3.04Å; T534-D537 WeakPolarHBondContact CA-OD2 3.3Å; T534-D537 VanDerWaalsContact CB-OD2 3.22Å; T534-D537 WeakPolarHBondContact CB-OD2 3.4Å; T534-D537 PolarHBondContact N-OD2 3.42Å; T534-D537 VanDerWaalsContact O-CB 3.31Å; T534-D537 WeakPolarHBondContact O-CB 3.38Å; T534-D537 PolarHBondContact O-N 2.83Å; T534-D537 PolarHBondContact OG1-OD2 2.91Å; T534-Y538 WeakPolarHBondContact O-CD2 3.49Å
535	F	72	Confident	73.5	Confident	163 Å²	163	88 Å²	88	72%	0.715	43%	0.434	S	S	*	.	H	α-helix	trans	-53.2	-39.7	173	177.7	-101.5	0	0	0	112.8	D537 Y538 V539	F535-D537 PolarHBondContact O-N 2.89Å; F535-Y538 PolarHBondContact O-N 2.82Å; F535-Y538 VanDerWaalsContact O-N 3.09Å; F535-V539 HydrophobicContact CE1-CG2 3.95Å; F535-V539 HydrophobicContact CZ-CG2 4.05Å
536	L	70.6	Confident	72.8	Confident	127 Å²	127	86.7 Å²	86.7	67%	0.665	43%	0.432	S	S	*	.	H	α-helix	trans	-60.6	-23.2	175.9	-72.8	169.1	0	0	0	113.8	T534 V539 R540	T534-L536 PolarHBondContact O-N 3.04Å; L536-V539 PolarHBondContact O-N 2.93Å; L536-R540 VanDerWaalsContact O-CB 3.25Å; L536-R540 WeakPolarHBondContact O-CB 3.28Å; L536-R540 PolarHBondContact O-N 2.68Å
537	D	71.3	Confident	71.8	Confident	25 Å²	25	91.6 Å²	91.6	13%	0.134	45%	0.445	C	S	.	.	H	α-helix	trans	-79.3	-18.6	177.5	-64.9	-60	0	0	0	113.8	R525 L530 T534 F535 R542	R525-D537 PolarHBondContact NH1-O 2.96Å; R525-D537 PolarHBondContact NH2-O 2.7Å; R525-D537 VanDerWaalsContact NH2-O 3.12Å; L530-D537 HydrophobicContact CD1-CB 3.47Å; L530-D537 VanDerWaalsContact CD1-CB 3.47Å; T534-D537 WeakPolarHBondContact CA-OD2 3.3Å; T534-D537 VanDerWaalsContact CB-OD2 3.22Å; T534-D537 WeakPolarHBondContact CB-OD2 3.4Å; T534-D537 PolarHBondContact N-OD2 3.42Å; T534-D537 VanDerWaalsContact O-CB 3.31Å; T534-D537 WeakPolarHBondContact O-CB 3.38Å; T534-D537 PolarHBondContact O-N 2.83Å; T534-D537 PolarHBondContact OG1-OD2 2.91Å; F535-D537 PolarHBondContact O-N 2.89Å; D537-R542 IonicContact OD1-CZ 3.89Å; D537-R542 IonicContact OD1-NH2 2.71Å; D537-R542 PolarHBondContact OD1-NH2 3.44Å
538	Y	72.2	Confident	70.8	Confident	93 Å²	93	91.1 Å²	91.1	37%	0.365	44%	0.441	S	S	.	.	H	α-helix	trans	-81.6	-25.2	171.1	-69.5	-78.4	0	0	0	112.5	S469 F471 P533 T534 F535	S469-Y538 VanDerWaalsContact O-CD1 3.27Å; S469-Y538 WeakPolarHBondContact O-CD1 3.49Å; S469-Y538 WeakPolarHBondContact O-CE1 3.37Å; F471-Y538 PolarHBondContact N-O 3.03Å; P533-Y538 HydrophobicContact CB-CE2 3.78Å; P533-Y538 HydrophobicContact CG-CE2 4.28Å; T534-Y538 WeakPolarHBondContact O-CD2 3.49Å; F535-Y538 PolarHBondContact O-N 2.82Å; F535-Y538 VanDerWaalsContact O-N 3.09Å
539	V	75.8	Confident	69.5	Low	58 Å²	58	96 Å²	96	35%	0.352	47%	0.469	S	S	.	.	H	α-helix	trans	-93	-34.1	177.6	-177.6	0	0	0	0	112	F471 F535 L536 P541	F471-V539 HydrophobicContact CD1-CG1 4.44Å; F471-V539 HydrophobicContact CD1-CG2 4.34Å; F535-V539 HydrophobicContact CE1-CG2 3.95Å; F535-V539 HydrophobicContact CZ-CG2 4.05Å; L536-V539 PolarHBondContact O-N 2.93Å; V539-P541 VanDerWaalsContact O-CD 3.29Å; V539-P541 WeakPolarHBondContact O-CD 3.32Å
540	R	74.6	Confident	68	Low	161 Å²	161	100.8 Å²	100.8	61%	0.608	48%	0.48	S	S	*	.	S	Bend	trans	-75.2	118.4	175.7	179.4	173.8	-87.6	-179.7	-5.7	109.7	R525 L536	R525-R540 PolarHBondContact NH2-O 3.43Å; L536-R540 VanDerWaalsContact O-CB 3.25Å; L536-R540 WeakPolarHBondContact O-CB 3.28Å; L536-R540 PolarHBondContact O-N 2.68Å
541	P	75.6	Confident	67.9	Low	33 Å²	33	102.6 Å²	102.6	21%	0.214	49%	0.486	C	S	.	.			trans	-69.8	137.5	179.5	29	-36.1	0	0	0	111.8	Y472 E521 V539 W544 T545	Y472-P541 HydrophobicContact CD2-CB 4.11Å; Y472-P541 HydrophobicContact CE2-CB 4.08Å; E521-P541 WeakPolarHBondContact OE1-CA 3.44Å; V539-P541 VanDerWaalsContact O-CD 3.29Å; V539-P541 WeakPolarHBondContact O-CD 3.32Å; P541-W544 HydrophobicContact CB-CE3 3.53Å; P541-W544 HydrophobicContact CB-CZ3 3.53Å; P541-W544 HydrophobicContact CG-CE3 3.32Å; P541-W544 HydrophobicContact CG-CZ3 3.34Å; P541-T545 PolarHBondContact O-OG1 2.93Å; P541-T545 VanDerWaalsContact O-OG1 3.1Å
542	R	75.5	Confident	68	Low	41 Å²	41	97.2 Å²	97.2	16%	0.155	47%	0.465	C	S	.	.	S	Bend	trans	-93	-24.7	-173	-71.6	-74	168.5	175.8	-2.1	113.2	E521 A524 R525 D537 W544 T545 C546	E521-R542 PolarHBondContact OE1-N 3.16Å; E521-R542 PolarHBondContact OE2-N 2.97Å; A524-R542 HydrophobicContact CB-CB 4.43Å; R525-R542 HydrophobicContact CG-CB 4.01Å; R525-R542 HydrophobicContact CG-CG 4.07Å; D537-R542 IonicContact OD1-CZ 3.89Å; D537-R542 IonicContact OD1-NH2 2.71Å; D537-R542 PolarHBondContact OD1-NH2 3.44Å; R542-W544 PolarHBondContact O-N 3.26Å; R542-W544 VanDerWaalsContact O-N 3.11Å; R542-T545 WeakPolarHBondContact CA-OG1 3.26Å; R542-T545 PolarHBondContact O-N 3.01Å; R542-C546 WeakPolarHBondContact O-CB 3.31Å; R542-C546 PolarHBondContact O-N 3.49Å
543	S	71.8	Confident	68	Low	14 Å²	14	94.4 Å²	94.4	10%	0.098	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-31	170.3	43	0	0	0	0	115	E521	E521-S543 WeakPolarHBondContact OE2-CB 3.15Å; E521-S543 PolarHBondContact OE2-N 3.19Å; E521-S543 PolarHBondContact OE2-OG 3.46Å
544	W	70.1	Confident	67.9	Low	128 Å²	128	96.2 Å²	96.2	49%	0.485	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-10.3	175.8	-68	-74.7	0	0	0	115.2	F357 Y472 P541 R542	F357-W544 AromaticContact CD1-CD1 3.93Å; F357-W544 AromaticContact CE1-CD1 3.4Å; F357-W544 VanDerWaalsContact CE1-CD1 3.4Å; F357-W544 AromaticContact CE1-NE1 3.36Å; F357-W544 AromaticContact CE2-CD1 3.94Å; F357-W544 AromaticContact CE2-NE1 3.96Å; F357-W544 AromaticContact CZ-CD1 3.42Å; F357-W544 VanDerWaalsContact CZ-CD1 3.42Å; F357-W544 AromaticContact CZ-NE1 3.14Å; Y472-W544 AromaticContact CE2-CH2 3.94Å; Y472-W544 HydrophobicContact CE2-CH2 3.94Å; Y472-W544 AromaticContact CE2-CZ3 3.66Å; Y472-W544 HydrophobicContact CE2-CZ3 3.66Å; Y472-W544 AromaticContact CZ-CH2 3.85Å; Y472-W544 AromaticContact CZ-CZ3 3.76Å; Y472-W544 WeakPolarHBondContact OH-CH2 3.34Å; Y472-W544 WeakPolarHBondContact OH-CZ3 3.36Å; P541-W544 HydrophobicContact CB-CE3 3.53Å; P541-W544 HydrophobicContact CB-CZ3 3.53Å; P541-W544 HydrophobicContact CG-CE3 3.32Å; P541-W544 HydrophobicContact CG-CZ3 3.34Å; R542-W544 PolarHBondContact O-N 3.26Å; R542-W544 VanDerWaalsContact O-N 3.11Å
545	T	62.8	Low	67.4	Low	66 Å²	66	96.9 Å²	96.9	41%	0.405	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-18.6	-169.8	54.2	0	0	0	0	114.8	P541 R542 R547	P541-T545 PolarHBondContact O-OG1 2.93Å; P541-T545 VanDerWaalsContact O-OG1 3.1Å; R542-T545 WeakPolarHBondContact CA-OG1 3.26Å; R542-T545 PolarHBondContact O-N 3.01Å; T545-R547 PolarHBondContact O-N 3.27Å; T545-R547 VanDerWaalsContact O-N 3.14Å
546	C	69.1	Low	67.1	Low	15 Å²	15	92.5 Å²	92.5	10%	0.101	43%	0.427	C	S	.	.			trans	-71	100.5	166.8	-179.2	0	0	0	0	108.3	C528 R542	C528-C546 HydrophobicContact CB-CB 3.81Å; C528-C546 WeakPolarHBondContact CB-SG 3.33Å; C528-C546 WeakPolarHBondContact SG-CB 3.47Å; C528-C546 CovalentContact SG-SG 2.05Å; C528-C546 PolarHBondContact SG-SG 3.09Å; R542-C546 WeakPolarHBondContact O-CB 3.31Å; R542-C546 PolarHBondContact O-N 3.49Å
547	R	60.9	Low	66.8	Low	224 Å²	224	90 Å²	90	85%	0.845	41%	0.41	S	S	*	.			trans	-76.6	118.5	163.7	-70.7	-173.7	178.5	-173.8	-0.7	107.2	T545 V549	T545-R547 PolarHBondContact O-N 3.27Å; T545-R547 VanDerWaalsContact O-N 3.14Å; R547-V549 PolarHBondContact O-N 3.05Å; R547-V549 VanDerWaalsContact O-N 3.1Å
548	Y	58.9	Low	66.5	Low	58 Å²	58	95 Å²	95	23%	0.227	43%	0.431	C	S	.	.			trans	-61.3	113.7	166.3	-58.5	-67.2	0	0	0	107.7	I352 K353 H527	I352-Y548 WeakPolarHBondContact O-CE2 3.42Å; K353-Y548 HydrophobicContact CB-CD1 4.46Å; K353-Y548 HydrophobicContact CB-CE1 4.47Å; K353-Y548 HydrophobicContact CG-CE1 4.43Å; H527-Y548 HydrophobicContact CB-CE1 4.42Å
549	V	50.3	Low	66	Low	142 Å²	142	95.2 Å²	95.2	86%	0.861	44%	0.436	S	S	*	.			trans	-83.3	113.7	166.9	-177.2	0	0	0	0	105.2	R547	R547-V549 PolarHBondContact O-N 3.05Å; R547-V549 VanDerWaalsContact O-N 3.1Å
550	F	46.7	Very low	65.1	Low	202 Å²	202	98.5 Å²	98.5	89%	0.886	44%	0.444	S	S	*	.			trans	-85.5	0	175.6	-67.2	-78.2	0	0	0	110.4	K353	K353-F550 WeakPolarHBondContact O-CE1 3.11Å; K353-F550 WeakPolarHBondContact O-CZ 3.28Å

Retrieved 550 of 550 residues in 264.7 ms (Link to these results)

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