A0A5K4F4A3_SCHMA Loading...

Transmembrane protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F4A3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 369 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	76.9	Confident	89.1	Confident	199 Å²	199	114.5 Å²	114.5	98%	0.98	60%	0.599	S	S	*	*				0	-46.2	0	-101.6	-164.1	-82.5	0	0	110.7	D3 F4 Q5	M1-D3 PolarHBondContact O-N 3.11Å; M1-F4 WeakPolarHBondContact O-CB 3.37Å; M1-F4 PolarHBondContact O-N 3.13Å; M1-F4 VanDerWaalsContact O-N 3.13Å; M1-Q5 PolarHBondContact O-N 3.03Å; M1-Q5 VanDerWaalsContact O-N 3.11Å
2	E	84	Confident	89.6	Confident	166 Å²	166	113.1 Å²	113.1	78%	0.776	59%	0.587	S	S	*	*	H	α-helix	trans	-56.8	-46.1	176	-64.8	177.2	173.2	0	0	113	F4 Q5 G6	E2-F4 PolarHBondContact O-N 3.05Å; E2-Q5 PolarHBondContact O-N 2.89Å; E2-Q5 VanDerWaalsContact O-N 3.16Å; E2-G6 PolarHBondContact O-N 3.16Å
3	D	85.9	Confident	90	Very high	145 Å²	145	115.2 Å²	115.2	78%	0.775	59%	0.589	S	S	*	*	H	α-helix	trans	-56.8	-36.1	175.9	-60.1	-29.4	0	0	0	113.1	M1 A7	M1-D3 PolarHBondContact O-N 3.11Å; D3-A7 WeakPolarHBondContact O-CB 3.45Å; D3-A7 PolarHBondContact O-N 3.2Å
4	F	89.4	Confident	90.4	Very high	147 Å²	147	113.3 Å²	113.3	65%	0.645	58%	0.581	S	S	*	*	H	α-helix	trans	-72.2	-42.5	178.8	175.6	-96	0	0	0	111.8	M1 E2 A7 F8	M1-F4 WeakPolarHBondContact O-CB 3.37Å; M1-F4 PolarHBondContact O-N 3.13Å; M1-F4 VanDerWaalsContact O-N 3.13Å; E2-F4 PolarHBondContact O-N 3.05Å; F4-A7 PolarHBondContact O-N 3.45Å; F4-F8 WeakPolarHBondContact O-CB 3.43Å; F4-F8 PolarHBondContact O-N 2.95Å
5	Q	88.8	Confident	90.6	Very high	122 Å²	122	115.2 Å²	115.2	57%	0.57	58%	0.578	S	S	*	*	H	α-helix	trans	-63.9	-43.4	176.4	-75	177.8	-33.4	0	0	111.2	M1 E2 A7 F8 D9	M1-Q5 PolarHBondContact O-N 3.03Å; M1-Q5 VanDerWaalsContact O-N 3.11Å; E2-Q5 PolarHBondContact O-N 2.89Å; E2-Q5 VanDerWaalsContact O-N 3.16Å; Q5-A7 VanDerWaalsContact C-N 3.35Å; Q5-A7 PolarHBondContact O-N 3.2Å; Q5-F8 PolarHBondContact O-N 3.44Å; Q5-D9 PolarHBondContact O-N 2.87Å
6	G	90.7	Very high	91	Very high	43 Å²	43	114.4 Å²	114.4	44%	0.443	58%	0.575	S	S	.	*	H	α-helix	trans	-60	-43.2	174.7	0	0	0	0	0	112.7	E2 S10	E2-G6 PolarHBondContact O-N 3.16Å; G6-S10 WeakPolarHBondContact O-CB 3.36Å; G6-S10 PolarHBondContact O-N 3.35Å
7	A	91.2	Very high	91.2	Very high	61 Å²	61	113.4 Å²	113.4	50%	0.504	57%	0.568	S	S	.	*	H	α-helix	trans	-64.5	-40	174.9	0	0	0	0	0	112.5	D3 F4 Q5 S10 F11	D3-A7 WeakPolarHBondContact O-CB 3.45Å; D3-A7 PolarHBondContact O-N 3.2Å; F4-A7 PolarHBondContact O-N 3.45Å; Q5-A7 VanDerWaalsContact C-N 3.35Å; Q5-A7 PolarHBondContact O-N 3.2Å; A7-S10 PolarHBondContact O-N 2.94Å; A7-F11 WeakPolarHBondContact O-CB 3.48Å; A7-F11 PolarHBondContact O-N 3.43Å
8	F	92.9	Very high	91.5	Very high	108 Å²	108	112.8 Å²	112.8	47%	0.474	57%	0.566	S	S	.	*	H	α-helix	trans	-66.5	-44.4	178.3	-173.2	-95.8	0	0	0	112.2	F4 Q5 S10 F11 Q12	F4-F8 WeakPolarHBondContact O-CB 3.43Å; F4-F8 PolarHBondContact O-N 2.95Å; Q5-F8 PolarHBondContact O-N 3.44Å; F8-S10 VanDerWaalsContact C-N 3.31Å; F8-S10 PolarHBondContact O-N 3.24Å; F8-F11 PolarHBondContact O-N 3.07Å; F8-Q12 PolarHBondContact O-N 2.98Å
9	D	93.3	Very high	91.7	Very high	86 Å²	86	113.4 Å²	113.4	46%	0.46	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-37.4	176.2	-73.4	-14.7	0	0	0	111.7	Q5 Q12 K13	Q5-D9 PolarHBondContact O-N 2.87Å; D9-Q12 PolarHBondContact O-N 3.26Å; D9-K13 WeakPolarHBondContact O-CG 3.35Å; D9-K13 PolarHBondContact O-N 3.21Å
10	S	92	Very high	91.9	Very high	61 Å²	61	115.1 Å²	115.1	43%	0.427	57%	0.573	S	S	.	*	H	α-helix	trans	-62.1	-47.6	172.4	-168	0	0	0	0	111.2	G6 A7 F8 Q12 K13 D14	G6-S10 WeakPolarHBondContact O-CB 3.36Å; G6-S10 PolarHBondContact O-N 3.35Å; A7-S10 PolarHBondContact O-N 2.94Å; F8-S10 VanDerWaalsContact C-N 3.31Å; F8-S10 PolarHBondContact O-N 3.24Å; S10-Q12 VanDerWaalsContact C-N 3.33Å; S10-Q12 PolarHBondContact O-N 3.42Å; S10-K13 PolarHBondContact O-N 3.45Å; S10-D14 PolarHBondContact O-N 3.45Å
11	F	94.6	Very high	92.1	Very high	121 Å²	121	116.3 Å²	116.3	53%	0.531	58%	0.575	S	S	.	*	H	α-helix	trans	-60.8	-40.8	177.1	174.8	-99.5	0	0	0	112.2	A7 F8 K13 D14 W15	A7-F11 WeakPolarHBondContact O-CB 3.48Å; A7-F11 PolarHBondContact O-N 3.43Å; F8-F11 PolarHBondContact O-N 3.07Å; F11-K13 VanDerWaalsContact C-N 3.34Å; F11-K13 PolarHBondContact O-N 3.32Å; F11-D14 PolarHBondContact O-N 3.08Å; F11-W15 HydrophobicContact CZ-CE3 4.04Å; F11-W15 WeakPolarHBondContact O-CB 3.31Å; F11-W15 PolarHBondContact O-N 3.24Å
12	Q	95	Very high	92.9	Very high	98 Å²	98	112.4 Å²	112.4	46%	0.458	55%	0.554	S	S	.	*	H	α-helix	trans	-65.4	-37.6	178.2	-173.5	172	-16.6	0	0	112	F8 D9 S10 W15 L16	F8-Q12 PolarHBondContact O-N 2.98Å; D9-Q12 PolarHBondContact O-N 3.26Å; S10-Q12 VanDerWaalsContact C-N 3.33Å; S10-Q12 PolarHBondContact O-N 3.42Å; Q12-W15 PolarHBondContact O-N 3.45Å; Q12-L16 WeakPolarHBondContact O-CG 3.45Å; Q12-L16 PolarHBondContact O-N 3.07Å; Q12-L16 VanDerWaalsContact O-N 3.08Å
13	K	95.1	Very high	93.5	Very high	140 Å²	140	107.5 Å²	107.5	61%	0.609	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-46.2	171.8	-72.1	171.5	-175.9	173.4	0	111.4	D9 S10 F11 W15 L16 Q17	D9-K13 WeakPolarHBondContact O-CG 3.35Å; D9-K13 PolarHBondContact O-N 3.21Å; S10-K13 PolarHBondContact O-N 3.45Å; F11-K13 VanDerWaalsContact C-N 3.34Å; F11-K13 PolarHBondContact O-N 3.32Å; K13-W15 VanDerWaalsContact C-N 3.3Å; K13-W15 PolarHBondContact O-N 3.42Å; K13-L16 PolarHBondContact O-N 2.87Å; K13-Q17 WeakPolarHBondContact O-CG 3.42Å; K13-Q17 PolarHBondContact O-N 3.47Å; K13-Q17 VanDerWaalsContact O-N 3.07Å
14	D	95.3	Very high	93.9	Very high	89 Å²	89	103.5 Å²	103.5	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-62.8	-37.2	177.4	-69.6	-18.9	0	0	0	112	S10 F11 Q17 L18	S10-D14 PolarHBondContact O-N 3.45Å; F11-D14 PolarHBondContact O-N 3.08Å; D14-Q17 PolarHBondContact O-N 2.92Å; D14-L18 WeakPolarHBondContact O-CB 3.5Å; D14-L18 PolarHBondContact O-N 3.48Å
15	W	94.5	Very high	94.2	Very high	142 Å²	142	101.3 Å²	101.3	54%	0.538	52%	0.516	S	S	.	.	H	α-helix	trans	-63	-45.9	175.9	-176.6	-93.9	0	0	0	112.3	F11 Q12 K13 Q17 L18 Q19	F11-W15 HydrophobicContact CZ-CE3 4.04Å; F11-W15 WeakPolarHBondContact O-CB 3.31Å; F11-W15 PolarHBondContact O-N 3.24Å; Q12-W15 PolarHBondContact O-N 3.45Å; K13-W15 VanDerWaalsContact C-N 3.3Å; K13-W15 PolarHBondContact O-N 3.42Å; W15-Q17 VanDerWaalsContact C-N 3.34Å; W15-Q17 PolarHBondContact O-N 3.46Å; W15-L18 WeakPolarHBondContact O-CB 3.47Å; W15-L18 PolarHBondContact O-N 2.82Å; W15-Q19 PolarHBondContact O-N 3.3Å
16	L	95.6	Very high	94.4	Very high	102 Å²	102	98.2 Å²	98.2	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-41.8	175.9	-71.9	170.8	0	0	0	111.3	Q12 K13 L18 Q19 E20	Q12-L16 WeakPolarHBondContact O-CG 3.45Å; Q12-L16 PolarHBondContact O-N 3.07Å; Q12-L16 VanDerWaalsContact O-N 3.08Å; K13-L16 PolarHBondContact O-N 2.87Å; L16-L18 VanDerWaalsContact C-N 3.35Å; L16-L18 PolarHBondContact O-N 3.02Å; L16-Q19 PolarHBondContact O-N 3.48Å; L16-E20 PolarHBondContact O-N 3.06Å
17	Q	95.6	Very high	94.6	Very high	98 Å²	98	101.9 Å²	101.9	46%	0.458	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-38.3	175	-70.4	-177.9	16.8	0	0	112.7	K13 D14 W15 E20 K21	K13-Q17 WeakPolarHBondContact O-CG 3.42Å; K13-Q17 PolarHBondContact O-N 3.47Å; K13-Q17 VanDerWaalsContact O-N 3.07Å; D14-Q17 PolarHBondContact O-N 2.92Å; W15-Q17 VanDerWaalsContact C-N 3.34Å; W15-Q17 PolarHBondContact O-N 3.46Å; Q17-E20 PolarHBondContact O-N 3.36Å; Q17-K21 WeakPolarHBondContact O-CB 3.35Å; Q17-K21 VanDerWaalsContact O-CG 3.31Å; Q17-K21 WeakPolarHBondContact O-CG 3.49Å; Q17-K21 PolarHBondContact O-N 3Å
18	L	95.3	Very high	94.8	Very high	103 Å²	103	102.1 Å²	102.1	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-43.7	175.8	176.8	64.1	0	0	0	111.3	D14 W15 L16 E20 K21 H22	D14-L18 WeakPolarHBondContact O-CB 3.5Å; D14-L18 PolarHBondContact O-N 3.48Å; W15-L18 WeakPolarHBondContact O-CB 3.47Å; W15-L18 PolarHBondContact O-N 2.82Å; L16-L18 VanDerWaalsContact C-N 3.35Å; L16-L18 PolarHBondContact O-N 3.02Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.49Å; L18-K21 PolarHBondContact O-N 2.98Å; L18-H22 WeakPolarHBondContact O-CB 3.46Å; L18-H22 PolarHBondContact O-N 3.24Å
19	Q	96	Very high	94.8	Very high	123 Å²	123	101.5 Å²	101.5	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-63.6	-40.5	179	-172	174.3	-11.3	0	0	111.7	W15 L16 H22 S23	W15-Q19 PolarHBondContact O-N 3.3Å; L16-Q19 PolarHBondContact O-N 3.48Å; Q19-H22 PolarHBondContact O-N 3.45Å; Q19-S23 WeakPolarHBondContact O-CB 3.43Å; Q19-S23 PolarHBondContact O-N 3.4Å
20	E	95.6	Very high	94.8	Very high	147 Å²	147	101.7 Å²	101.7	69%	0.687	51%	0.513	S	S	*	.	H	α-helix	trans	-63.5	-47.5	174.4	-172.6	177.9	-170.5	0	0	111.8	L16 Q17 L18 H22 S23 S24	L16-E20 PolarHBondContact O-N 3.06Å; Q17-E20 PolarHBondContact O-N 3.36Å; L18-E20 VanDerWaalsContact C-N 3.34Å; L18-E20 PolarHBondContact O-N 3.49Å; E20-H22 VanDerWaalsContact C-N 3.33Å; E20-H22 PolarHBondContact O-N 2.89Å; E20-S23 PolarHBondContact O-N 3.34Å; E20-S24 PolarHBondContact O-N 3.22Å
21	K	95.4	Very high	94.9	Very high	141 Å²	141	105 Å²	105	61%	0.613	52%	0.519	S	S	*	.	H	α-helix	trans	-58.7	-42.8	175.7	-74.9	172.4	-178.1	170.1	0	112.1	Q17 L18 S24 L25	Q17-K21 WeakPolarHBondContact O-CB 3.35Å; Q17-K21 VanDerWaalsContact O-CG 3.31Å; Q17-K21 WeakPolarHBondContact O-CG 3.49Å; Q17-K21 PolarHBondContact O-N 3Å; L18-K21 PolarHBondContact O-N 2.98Å; K21-S24 PolarHBondContact O-N 3Å; K21-L25 WeakPolarHBondContact O-CB 3.48Å; K21-L25 PolarHBondContact O-N 3.43Å
22	H	95.1	Very high	94.7	Very high	117 Å²	117	104.1 Å²	104.1	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-45.3	176.8	175.8	-89.9	0	0	0	111.8	L18 Q19 E20 S24 L25 V26	L18-H22 WeakPolarHBondContact O-CB 3.46Å; L18-H22 PolarHBondContact O-N 3.24Å; Q19-H22 PolarHBondContact O-N 3.45Å; E20-H22 VanDerWaalsContact C-N 3.33Å; E20-H22 PolarHBondContact O-N 2.89Å; H22-S24 VanDerWaalsContact C-N 3.32Å; H22-S24 PolarHBondContact O-N 3.48Å; H22-L25 WeakPolarHBondContact O-CB 3.34Å; H22-L25 PolarHBondContact O-N 3.31Å; H22-V26 WeakPolarHBondContact O-CG2 3.49Å; H22-V26 PolarHBondContact O-N 3.23Å
23	S	95.2	Very high	94.4	Very high	63 Å²	63	105.7 Å²	105.7	44%	0.441	53%	0.525	S	S	.	.	H	α-helix	trans	-58.9	-45	176.9	-169.3	0	0	0	0	111.5	Q19 E20 L25 V26 M27	Q19-S23 WeakPolarHBondContact O-CB 3.43Å; Q19-S23 PolarHBondContact O-N 3.4Å; E20-S23 PolarHBondContact O-N 3.34Å; S23-L25 PolarHBondContact O-N 3.06Å; S23-V26 PolarHBondContact O-N 3.46Å; S23-M27 WeakPolarHBondContact O-CG 3.42Å; S23-M27 PolarHBondContact O-N 2.97Å
24	S	95.5	Very high	94.3	Very high	62 Å²	62	105.4 Å²	105.4	43%	0.434	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-41	175.5	-173.8	0	0	0	0	113.3	E20 K21 H22 M27 S28	E20-S24 PolarHBondContact O-N 3.22Å; K21-S24 PolarHBondContact O-N 3Å; H22-S24 VanDerWaalsContact C-N 3.32Å; H22-S24 PolarHBondContact O-N 3.48Å; S24-M27 PolarHBondContact O-N 3.43Å; S24-S28 WeakPolarHBondContact O-CB 3.42Å; S24-S28 PolarHBondContact O-N 2.96Å; S24-S28 PolarHBondContact O-OG 3.47Å
25	L	94.6	Very high	94.2	Very high	101 Å²	101	106.2 Å²	106.2	53%	0.529	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-46.6	175.3	178.4	65.2	0	0	0	111.7	K21 H22 S23 M27 S28 L29	K21-L25 WeakPolarHBondContact O-CB 3.48Å; K21-L25 PolarHBondContact O-N 3.43Å; H22-L25 WeakPolarHBondContact O-CB 3.34Å; H22-L25 PolarHBondContact O-N 3.31Å; S23-L25 PolarHBondContact O-N 3.06Å; L25-M27 PolarHBondContact O-N 2.85Å; L25-S28 PolarHBondContact O-N 3Å; L25-L29 HydrophobicContact CD1-CD1 4.49Å; L25-L29 HydrophobicContact CD1-CG 4.41Å; L25-L29 HydrophobicContact CG-CD1 4.2Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 2.9Å
26	V	94.7	Very high	93.9	Very high	57 Å²	57	102.1 Å²	102.1	35%	0.345	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-43.3	179.8	172.7	0	0	0	0	111.5	H22 S23 S28 L29 N30	H22-V26 WeakPolarHBondContact O-CG2 3.49Å; H22-V26 PolarHBondContact O-N 3.23Å; S23-V26 PolarHBondContact O-N 3.46Å; V26-S28 VanDerWaalsContact C-N 3.33Å; V26-S28 PolarHBondContact O-N 3.33Å; V26-L29 PolarHBondContact O-N 3.35Å; V26-N30 PolarHBondContact O-N 2.98Å; V26-N30 PolarHBondContact O-ND2 3.16Å
27	M	95	Very high	93.7	Very high	119 Å²	119	100 Å²	100	59%	0.586	51%	0.505	S	S	*	.	H	α-helix	trans	-60.8	-43.7	175.1	-71.3	-172.9	-70.5	0	0	111.6	S23 S24 L25 L29 N30 K31	S23-M27 WeakPolarHBondContact O-CG 3.42Å; S23-M27 PolarHBondContact O-N 2.97Å; S24-M27 PolarHBondContact O-N 3.43Å; L25-M27 PolarHBondContact O-N 2.85Å; M27-L29 PolarHBondContact O-N 3.04Å; M27-N30 PolarHBondContact O-N 3.48Å; M27-K31 PolarHBondContact O-N 3.47Å
28	S	94.3	Very high	93.5	Very high	67 Å²	67	98.6 Å²	98.6	47%	0.469	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-39.2	178	-59.3	0	0	0	0	112.3	S24 L25 V26 K31 L32	S24-S28 WeakPolarHBondContact O-CB 3.42Å; S24-S28 PolarHBondContact O-N 2.96Å; S24-S28 PolarHBondContact O-OG 3.47Å; L25-S28 PolarHBondContact O-N 3Å; V26-S28 VanDerWaalsContact C-N 3.33Å; V26-S28 PolarHBondContact O-N 3.33Å; S28-K31 PolarHBondContact O-N 2.91Å; S28-L32 WeakPolarHBondContact O-CB 3.34Å; S28-L32 PolarHBondContact O-N 3.47Å
29	L	92.7	Very high	93.4	Very high	95 Å²	95	95.9 Å²	95.9	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-41.3	176.2	-73.7	173	0	0	0	112.7	L25 V26 M27 L32 K33	L25-L29 HydrophobicContact CD1-CD1 4.49Å; L25-L29 HydrophobicContact CD1-CG 4.41Å; L25-L29 HydrophobicContact CG-CD1 4.2Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 2.9Å; V26-L29 PolarHBondContact O-N 3.35Å; M27-L29 PolarHBondContact O-N 3.04Å; L29-L32 PolarHBondContact O-N 3.46Å; L29-K33 WeakPolarHBondContact O-CB 3.17Å; L29-K33 PolarHBondContact O-N 2.98Å
30	N	92.9	Very high	93.1	Very high	90 Å²	90	92.6 Å²	92.6	48%	0.481	48%	0.483	S	S	.	.	H	α-helix	trans	-64.5	-45.5	176.4	-74.9	-29.8	0	0	0	111.1	V26 M27 L32 K33 E34	V26-N30 PolarHBondContact O-N 2.98Å; V26-N30 PolarHBondContact O-ND2 3.16Å; M27-N30 PolarHBondContact O-N 3.48Å; N30-L32 PolarHBondContact O-N 3.06Å; N30-K33 PolarHBondContact O-N 3.43Å; N30-E34 WeakPolarHBondContact O-CG 3.5Å; N30-E34 PolarHBondContact O-N 3.38Å
31	K	94.9	Very high	92.9	Very high	129 Å²	129	94.2 Å²	94.2	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-59	-45.9	175.1	-173.2	-179.1	178.7	-173.1	0	111.8	M27 S28 K33 E34 E35	M27-K31 PolarHBondContact O-N 3.47Å; S28-K31 PolarHBondContact O-N 2.91Å; K31-K33 VanDerWaalsContact C-N 3.31Å; K31-K33 PolarHBondContact O-N 3.43Å; K31-E34 PolarHBondContact O-N 2.87Å; K31-E35 WeakPolarHBondContact CE-OE1 3.18Å; K31-E35 WeakPolarHBondContact O-CG 3.44Å; K31-E35 PolarHBondContact O-N 2.97Å
32	L	91.1	Very high	92.9	Very high	104 Å²	104	90.5 Å²	90.5	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-58.4	-43.5	176.9	-178.6	66.8	0	0	0	111.6	S28 L29 N30 E35 E36	S28-L32 WeakPolarHBondContact O-CB 3.34Å; S28-L32 PolarHBondContact O-N 3.47Å; L29-L32 PolarHBondContact O-N 3.46Å; N30-L32 PolarHBondContact O-N 3.06Å; L32-E35 PolarHBondContact O-N 2.87Å; L32-E36 WeakPolarHBondContact O-CB 3.49Å; L32-E36 PolarHBondContact O-N 2.99Å
33	K	88.9	Confident	92.7	Very high	131 Å²	131	85.6 Å²	85.6	57%	0.57	45%	0.453	S	S	*	.	H	α-helix	trans	-64.8	-38.9	178.1	-174.2	178.7	179.5	-179.1	0	112.3	L29 N30 K31 T37	L29-K33 WeakPolarHBondContact O-CB 3.17Å; L29-K33 PolarHBondContact O-N 2.98Å; N30-K33 PolarHBondContact O-N 3.43Å; K31-K33 VanDerWaalsContact C-N 3.31Å; K31-K33 PolarHBondContact O-N 3.43Å; K33-T37 VanDerWaalsContact O-CG2 3.29Å; K33-T37 WeakPolarHBondContact O-CG2 3.3Å; K33-T37 PolarHBondContact O-N 3.43Å; K33-T37 PolarHBondContact O-OG1 3.01Å
34	E	92.2	Very high	92.5	Very high	134 Å²	134	89.3 Å²	89.3	63%	0.626	46%	0.462	S	S	*	.	H	α-helix	trans	-63.1	-49.7	175.1	-73.1	176.3	-176.1	0	0	111.3	N30 K31 E36 T37 S38	N30-E34 WeakPolarHBondContact O-CG 3.5Å; N30-E34 PolarHBondContact O-N 3.38Å; K31-E34 PolarHBondContact O-N 2.87Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 3.22Å; E34-T37 PolarHBondContact O-N 2.85Å; E34-T37 PolarHBondContact O-OG1 3.46Å; E34-S38 WeakPolarHBondContact O-CB 3.47Å; E34-S38 PolarHBondContact O-N 3.21Å
35	E	92.3	Very high	92.4	Very high	106 Å²	106	92.4 Å²	92.4	50%	0.495	47%	0.469	S	S	.	.	H	α-helix	trans	-59.8	-42.6	176.2	-70.9	177.6	-176.1	0	0	111.9	K31 L32 S38 C39	K31-E35 WeakPolarHBondContact CE-OE1 3.18Å; K31-E35 WeakPolarHBondContact O-CG 3.44Å; K31-E35 PolarHBondContact O-N 2.97Å; L32-E35 PolarHBondContact O-N 2.87Å; E35-S38 WeakPolarHBondContact O-CB 3.48Å; E35-S38 PolarHBondContact O-N 3.01Å; E35-C39 WeakPolarHBondContact O-CB 3.28Å; E35-C39 PolarHBondContact O-N 3.28Å
36	E	89.5	Confident	92.4	Very high	55 Å²	55	90.4 Å²	90.4	26%	0.257	46%	0.462	S	S	.	.	H	α-helix	trans	-59.5	-50	176.1	-178.2	-175.3	-150.2	0	0	111.2	L32 E34 S38 C39 V40 P94	L32-E36 WeakPolarHBondContact O-CB 3.49Å; L32-E36 PolarHBondContact O-N 2.99Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 3.22Å; E36-S38 VanDerWaalsContact C-N 3.32Å; E36-S38 PolarHBondContact O-N 3.49Å; E36-C39 PolarHBondContact O-N 2.87Å; E36-V40 VanDerWaalsContact O-CG2 3.3Å; E36-V40 WeakPolarHBondContact O-CG2 3.04Å; E36-V40 PolarHBondContact O-N 3.3Å; E36-P94 VanDerWaalsContact CD-CG 3.5Å; E36-P94 VanDerWaalsContact CG-CD 3.48Å; E36-P94 HydrophobicContact CG-CG 3.6Å; E36-P94 VanDerWaalsContact OE1-CB 3.29Å; E36-P94 WeakPolarHBondContact OE1-CB 2.96Å; E36-P94 WeakPolarHBondContact OE1-CD 3.36Å; E36-P94 WeakPolarHBondContact OE1-CG 3.29Å
37	T	89.8	Confident	92.2	Very high	59 Å²	59	93 Å²	93	36%	0.362	47%	0.466	S	S	.	.	H	α-helix	trans	-64.9	-36.4	178.9	60.6	0	0	0	0	112.6	K33 E34 R41	K33-T37 VanDerWaalsContact O-CG2 3.29Å; K33-T37 WeakPolarHBondContact O-CG2 3.3Å; K33-T37 PolarHBondContact O-N 3.43Å; K33-T37 PolarHBondContact O-OG1 3.01Å; E34-T37 PolarHBondContact O-N 2.85Å; E34-T37 PolarHBondContact O-OG1 3.46Å; T37-R41 VanDerWaalsContact O-CG 3.28Å; T37-R41 WeakPolarHBondContact O-CG 3.5Å; T37-R41 PolarHBondContact O-N 3.34Å; T37-R41 VanDerWaalsContact O-N 3.15Å
38	S	93.1	Very high	92.1	Very high	67 Å²	67	91.4 Å²	91.4	47%	0.469	46%	0.46	S	S	.	.	H	α-helix	trans	-63	-48.7	173.9	-173.4	0	0	0	0	111	E34 E35 E36 V40 R41 S42	E34-S38 WeakPolarHBondContact O-CB 3.47Å; E34-S38 PolarHBondContact O-N 3.21Å; E35-S38 WeakPolarHBondContact O-CB 3.48Å; E35-S38 PolarHBondContact O-N 3.01Å; E36-S38 VanDerWaalsContact C-N 3.32Å; E36-S38 PolarHBondContact O-N 3.49Å; S38-V40 PolarHBondContact O-N 3.45Å; S38-R41 WeakPolarHBondContact O-CB 3.29Å; S38-R41 PolarHBondContact O-N 3.04Å; S38-S42 PolarHBondContact O-N 2.96Å; S38-S42 PolarHBondContact O-OG 3.47Å
39	C	92.3	Very high	92	Very high	46 Å²	46	94.5 Å²	94.5	31%	0.311	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-44.4	178.9	-166.2	0	0	0	0	112	E35 E36 R41 S42 V43 L93	E35-C39 WeakPolarHBondContact O-CB 3.28Å; E35-C39 PolarHBondContact O-N 3.28Å; E36-C39 PolarHBondContact O-N 2.87Å; C39-R41 VanDerWaalsContact C-N 3.31Å; C39-R41 PolarHBondContact O-N 2.92Å; C39-S42 PolarHBondContact O-N 3.2Å; C39-V43 WeakPolarHBondContact O-CB 3.04Å; C39-V43 WeakPolarHBondContact O-CG2 2.96Å; C39-V43 PolarHBondContact O-N 2.92Å; C39-L93 HydrophobicContact CB-CD1 4.48Å; C39-L93 HydrophobicContact CB-CD2 3.89Å
40	V	90.3	Very high	91.9	Very high	54 Å²	54	90.9 Å²	90.9	33%	0.327	44%	0.443	S	S	.	.	H	α-helix	trans	-59.3	-40.6	176.4	170.4	0	0	0	0	111.8	E36 S38 K44 L93 P94	E36-V40 VanDerWaalsContact O-CG2 3.3Å; E36-V40 WeakPolarHBondContact O-CG2 3.04Å; E36-V40 PolarHBondContact O-N 3.3Å; S38-V40 PolarHBondContact O-N 3.45Å; V40-K44 WeakPolarHBondContact O-CB 3.32Å; V40-K44 PolarHBondContact O-N 3.42Å; V40-L93 HydrophobicContact CG2-CB 4.29Å; V40-L93 HydrophobicContact CG2-CD1 4.21Å; V40-L93 HydrophobicContact CG2-CD2 4.17Å; V40-L93 HydrophobicContact CG2-CG 4.46Å; V40-P94 HydrophobicContact CG2-CG 3.87Å
41	R	92	Very high	91.9	Very high	181 Å²	181	92.5 Å²	92.5	68%	0.683	45%	0.446	S	S	*	.	H	α-helix	trans	-63.7	-46.8	175.9	-71.4	171.4	-169.4	170.8	5.4	111.1	T37 S38 C39 K44 H45	T37-R41 VanDerWaalsContact O-CG 3.28Å; T37-R41 WeakPolarHBondContact O-CG 3.5Å; T37-R41 PolarHBondContact O-N 3.34Å; T37-R41 VanDerWaalsContact O-N 3.15Å; S38-R41 WeakPolarHBondContact O-CB 3.29Å; S38-R41 PolarHBondContact O-N 3.04Å; C39-R41 VanDerWaalsContact C-N 3.31Å; C39-R41 PolarHBondContact O-N 2.92Å; R41-K44 PolarHBondContact O-N 3.26Å; R41-H45 PolarHBondContact O-N 3.03Å
42	S	93.5	Very high	91.8	Very high	64 Å²	64	90.4 Å²	90.4	45%	0.448	44%	0.44	S	S	.	.	H	α-helix	trans	-61.5	-44.4	177.9	-62.2	0	0	0	0	112.2	S38 C39 K44 H45 C46	S38-S42 PolarHBondContact O-N 2.96Å; S38-S42 PolarHBondContact O-OG 3.47Å; C39-S42 PolarHBondContact O-N 3.2Å; S42-K44 PolarHBondContact O-N 3.44Å; S42-H45 WeakPolarHBondContact O-CB 3.26Å; S42-H45 PolarHBondContact O-N 3.27Å; S42-C46 PolarHBondContact O-N 3Å; S42-C46 PolarHBondContact O-SG 3.46Å; S42-C46 VanDerWaalsContact O-SG 3.36Å
43	V	92.4	Very high	91.9	Very high	14 Å²	14	87.7 Å²	87.7	9%	0.085	43%	0.426	C	S	.	.	H	α-helix	trans	-60.6	-44.7	175.8	164.6	0	0	0	0	111.5	C39 H45 C46 R47 L86 I89 E90 L93	C39-V43 WeakPolarHBondContact O-CB 3.04Å; C39-V43 WeakPolarHBondContact O-CG2 2.96Å; C39-V43 PolarHBondContact O-N 2.92Å; V43-H45 VanDerWaalsContact C-N 3.32Å; V43-H45 PolarHBondContact O-N 2.87Å; V43-C46 PolarHBondContact O-N 3.03Å; V43-R47 VanDerWaalsContact O-CB 3.28Å; V43-R47 WeakPolarHBondContact O-CB 3.31Å; V43-R47 PolarHBondContact O-N 3.49Å; V43-L86 HydrophobicContact CB-CD1 4.2Å; V43-L86 HydrophobicContact CG1-CD1 3.9Å; V43-L86 HydrophobicContact CG1-CD2 4.4Å; V43-L86 HydrophobicContact CG1-CG 4.25Å; V43-L86 HydrophobicContact CG2-CD1 3.83Å; V43-I89 HydrophobicContact CG2-CG2 3.9Å; V43-E90 HydrophobicContact CG1-CG 3.49Å; V43-E90 VanDerWaalsContact CG1-CG 3.49Å; V43-E90 WeakPolarHBondContact CG1-OE1 3.46Å; V43-L93 HydrophobicContact CB-CD1 4.23Å; V43-L93 HydrophobicContact CG2-CD1 3.62Å
44	K	91.3	Very high	92	Very high	141 Å²	141	85 Å²	85	61%	0.613	41%	0.414	S	S	*	.	H	α-helix	trans	-61.4	-41.8	176.1	-174.9	-179.6	177.8	-175.6	0	111.5	V40 R41 S42 R47 N48	V40-K44 WeakPolarHBondContact O-CB 3.32Å; V40-K44 PolarHBondContact O-N 3.42Å; R41-K44 PolarHBondContact O-N 3.26Å; S42-K44 PolarHBondContact O-N 3.44Å; K44-R47 PolarHBondContact O-N 3.45Å; K44-N48 WeakPolarHBondContact O-CB 3.3Å; K44-N48 VanDerWaalsContact O-CG 3.29Å; K44-N48 PolarHBondContact O-N 3.18Å; K44-N48 PolarHBondContact O-ND2 3.49Å
45	H	93.2	Very high	91.9	Very high	126 Å²	126	85.1 Å²	85.1	58%	0.583	42%	0.415	S	S	*	.	H	α-helix	trans	-61	-55.4	175.8	176.7	-92.3	0	0	0	111.4	R41 S42 V43 R47 N48 Y49	R41-H45 PolarHBondContact O-N 3.03Å; S42-H45 WeakPolarHBondContact O-CB 3.26Å; S42-H45 PolarHBondContact O-N 3.27Å; V43-H45 VanDerWaalsContact C-N 3.32Å; V43-H45 PolarHBondContact O-N 2.87Å; H45-R47 VanDerWaalsContact C-N 3.27Å; H45-R47 PolarHBondContact O-N 2.9Å; H45-N48 PolarHBondContact O-N 3.26Å; H45-N48 VanDerWaalsContact O-N 3.14Å; H45-Y49 WeakPolarHBondContact O-CB 3.19Å; H45-Y49 PolarHBondContact O-N 3.36Å
46	C	93.5	Very high	91.8	Very high	59 Å²	59	84.3 Å²	84.3	40%	0.399	41%	0.411	S	S	.	.	H	α-helix	trans	-56.4	-41.4	177.8	-67.8	0	0	0	0	111.9	S42 V43 Y49 M50	S42-C46 PolarHBondContact O-N 3Å; S42-C46 PolarHBondContact O-SG 3.46Å; S42-C46 VanDerWaalsContact O-SG 3.36Å; V43-C46 PolarHBondContact O-N 3.03Å; C46-Y49 PolarHBondContact O-N 3.16Å; C46-M50 WeakPolarHBondContact O-CB 3.45Å; C46-M50 VanDerWaalsContact O-CG 3.29Å; C46-M50 WeakPolarHBondContact O-CG 3.49Å; C46-M50 PolarHBondContact O-N 2.86Å
47	R	91.3	Very high	91.8	Very high	113 Å²	113	82.6 Å²	82.6	43%	0.426	40%	0.403	S	S	.	.	H	α-helix	trans	-64.6	-41.1	178.3	-168.1	169.8	-170.6	149.9	4.3	113	V43 K44 H45 K51 L86 E90	V43-R47 VanDerWaalsContact O-CB 3.28Å; V43-R47 WeakPolarHBondContact O-CB 3.31Å; V43-R47 PolarHBondContact O-N 3.49Å; K44-R47 PolarHBondContact O-N 3.45Å; H45-R47 VanDerWaalsContact C-N 3.27Å; H45-R47 PolarHBondContact O-N 2.9Å; R47-K51 WeakPolarHBondContact O-CG 2.9Å; R47-K51 PolarHBondContact O-N 2.73Å; R47-L86 HydrophobicContact CB-CD2 3.98Å; R47-L86 HydrophobicContact CG-CD2 4.45Å; R47-E90 WeakPolarHBondContact CD-OE1 3.31Å; R47-E90 IonicContact CZ-OE1 3.5Å; R47-E90 IonicContact CZ-OE2 3.68Å; R47-E90 IonicContact NE-OE1 2.83Å; R47-E90 IonicContact NH1-OE1 3.72Å; R47-E90 PolarHBondContact NH1-OE1 3.09Å; R47-E90 IonicContact NH1-OE2 2.98Å; R47-E90 PolarHBondContact NH1-OE2 2.87Å
48	N	92.1	Very high	91.8	Very high	85 Å²	85	81.4 Å²	81.4	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-68.1	-41.8	176.3	-73.3	-15.3	0	0	0	111	K44 H45 K51 L52	K44-N48 WeakPolarHBondContact O-CB 3.3Å; K44-N48 VanDerWaalsContact O-CG 3.29Å; K44-N48 PolarHBondContact O-N 3.18Å; K44-N48 PolarHBondContact O-ND2 3.49Å; H45-N48 PolarHBondContact O-N 3.26Å; H45-N48 VanDerWaalsContact O-N 3.14Å; N48-K51 WeakPolarHBondContact O-CB 3.47Å; N48-K51 PolarHBondContact O-N 2.73Å; N48-L52 PolarHBondContact O-N 2.93Å
49	Y	92.7	Very high	91.5	Very high	131 Å²	131	81.1 Å²	81.1	51%	0.514	40%	0.401	S	S	.	.	H	α-helix	trans	-63.6	-44.4	177.4	-166.4	-106	0	0	0	112.2	H45 C46 K51 L52 L53	H45-Y49 WeakPolarHBondContact O-CB 3.19Å; H45-Y49 PolarHBondContact O-N 3.36Å; C46-Y49 PolarHBondContact O-N 3.16Å; Y49-K51 VanDerWaalsContact C-N 3.29Å; Y49-K51 PolarHBondContact O-N 3.23Å; Y49-L52 WeakPolarHBondContact O-CB 3.49Å; Y49-L52 PolarHBondContact O-N 2.83Å; Y49-L52 VanDerWaalsContact O-N 3.11Å; Y49-L53 HydrophobicContact CD1-CD1 3.79Å; Y49-L53 HydrophobicContact CD1-CG 4.18Å; Y49-L53 HydrophobicContact CE1-CD1 3.6Å; Y49-L53 HydrophobicContact CE1-CD2 4.27Å; Y49-L53 HydrophobicContact CE1-CG 3.96Å; Y49-L53 PolarHBondContact O-N 3.34Å
50	M	91.6	Very high	91.4	Very high	20 Å²	20	83.8 Å²	83.8	10%	0.099	41%	0.412	C	S	.	.	H	α-helix	trans	-61.1	-35.1	174.3	-73	-174.2	-59.5	0	0	113	C46 K54 I79 K82 E83 L86	C46-M50 WeakPolarHBondContact O-CB 3.45Å; C46-M50 VanDerWaalsContact O-CG 3.29Å; C46-M50 WeakPolarHBondContact O-CG 3.49Å; C46-M50 PolarHBondContact O-N 2.86Å; M50-K54 WeakPolarHBondContact O-CB 3.35Å; M50-K54 WeakPolarHBondContact O-CG 3.41Å; M50-K54 PolarHBondContact O-N 2.68Å; M50-I79 HydrophobicContact CB-CG2 4.26Å; M50-I79 HydrophobicContact CG-CG2 4.35Å; M50-I79 HydrophobicContact SD-CG2 4.45Å; M50-K82 HydrophobicContact SD-CB 4.24Å; M50-E83 HydrophobicContact CE-CG 3.99Å; M50-E83 HydrophobicContact SD-CG 3.84Å; M50-L86 HydrophobicContact CE-CB 4.41Å; M50-L86 HydrophobicContact CE-CD2 3.26Å; M50-L86 HydrophobicContact CE-CG 4.4Å
51	K	91.7	Very high	91.1	Very high	123 Å²	123	85.3 Å²	85.3	54%	0.535	42%	0.415	S	S	.	.	H	α-helix	trans	-65.9	-40.7	173.9	-74.8	174.3	-177.9	176.9	0	111.8	R47 N48 Y49 K54 H55	R47-K51 WeakPolarHBondContact O-CG 2.9Å; R47-K51 PolarHBondContact O-N 2.73Å; N48-K51 WeakPolarHBondContact O-CB 3.47Å; N48-K51 PolarHBondContact O-N 2.73Å; Y49-K51 VanDerWaalsContact C-N 3.29Å; Y49-K51 PolarHBondContact O-N 3.23Å; K51-K54 PolarHBondContact O-N 3.26Å; K51-H55 PolarHBondContact O-N 3.49Å
52	L	93.3	Very high	90.7	Very high	86 Å²	86	84.9 Å²	84.9	45%	0.45	42%	0.418	S	S	.	.	H	α-helix	trans	-61.2	-51.9	175.5	-178.5	68.2	0	0	0	110.3	N48 Y49 K54 H55 E56	N48-L52 PolarHBondContact O-N 2.93Å; Y49-L52 WeakPolarHBondContact O-CB 3.49Å; Y49-L52 PolarHBondContact O-N 2.83Å; Y49-L52 VanDerWaalsContact O-N 3.11Å; L52-K54 VanDerWaalsContact C-N 3.3Å; L52-K54 PolarHBondContact O-N 3.1Å; L52-H55 WeakPolarHBondContact O-CA 3.49Å; L52-H55 WeakPolarHBondContact O-CB 3.36Å; L52-H55 PolarHBondContact O-N 3.25Å; L52-E56 PolarHBondContact O-N 3.49Å
53	L	92	Very high	90.2	Very high	47 Å²	47	88.4 Å²	88.4	25%	0.246	43%	0.432	C	S	.	.	H	α-helix	trans	-56.9	-41.6	176.7	-70.5	176.6	0	0	0	112.3	Y49 H55 E56 I57 I79	Y49-L53 HydrophobicContact CD1-CD1 3.79Å; Y49-L53 HydrophobicContact CD1-CG 4.18Å; Y49-L53 HydrophobicContact CE1-CD1 3.6Å; Y49-L53 HydrophobicContact CE1-CD2 4.27Å; Y49-L53 HydrophobicContact CE1-CG 3.96Å; Y49-L53 PolarHBondContact O-N 3.34Å; L53-H55 VanDerWaalsContact C-N 3.32Å; L53-H55 PolarHBondContact O-N 3.04Å; L53-E56 PolarHBondContact O-N 3.35Å; L53-I57 WeakPolarHBondContact O-CB 3.47Å; L53-I57 WeakPolarHBondContact O-CG1 3.34Å; L53-I57 PolarHBondContact O-N 2.8Å; L53-I79 HydrophobicContact CB-CD1 3.77Å; L53-I79 HydrophobicContact CD1-CD1 4.28Å
54	K	91	Very high	89.6	Confident	74 Å²	74	88.4 Å²	88.4	32%	0.322	43%	0.433	S	S	.	.	H	α-helix	trans	-62.4	-38.6	175.2	-79.9	-177.2	173.7	-170	0	113	M50 K51 L52 G58 I79 E83	M50-K54 WeakPolarHBondContact O-CB 3.35Å; M50-K54 WeakPolarHBondContact O-CG 3.41Å; M50-K54 PolarHBondContact O-N 2.68Å; K51-K54 PolarHBondContact O-N 3.26Å; L52-K54 VanDerWaalsContact C-N 3.3Å; L52-K54 PolarHBondContact O-N 3.1Å; K54-G58 PolarHBondContact O-N 3.46Å; K54-I79 HydrophobicContact CD-CG2 4.3Å; K54-I79 VanDerWaalsContact CE-CG2 3.46Å; K54-I79 HydrophobicContact CG-CG2 4.04Å; K54-E83 VanDerWaalsContact CE-OE1 3.25Å; K54-E83 WeakPolarHBondContact CE-OE1 3.38Å; K54-E83 IonicContact NZ-OE1 2.75Å; K54-E83 PolarHBondContact NZ-OE1 2.83Å; K54-E83 IonicContact NZ-OE2 3.73Å; K54-E83 PolarHBondContact NZ-OE2 3.37Å
55	H	91	Very high	89.1	Confident	136 Å²	136	87 Å²	87	63%	0.63	44%	0.436	S	S	*	.	H	α-helix	trans	-67.8	-44	176.6	179.6	-85.4	0	0	0	111	K51 L52 L53 G58 S59	K51-H55 PolarHBondContact O-N 3.49Å; L52-H55 WeakPolarHBondContact O-CA 3.49Å; L52-H55 WeakPolarHBondContact O-CB 3.36Å; L52-H55 PolarHBondContact O-N 3.25Å; L53-H55 VanDerWaalsContact C-N 3.32Å; L53-H55 PolarHBondContact O-N 3.04Å; H55-G58 PolarHBondContact O-N 3.09Å; H55-S59 WeakPolarHBondContact O-CB 3.4Å; H55-S59 PolarHBondContact O-N 3.21Å
56	E	90.5	Very high	88.4	Confident	89 Å²	89	83.5 Å²	83.5	42%	0.416	44%	0.435	S	S	.	.	H	α-helix	trans	-61.6	-48.2	175.6	-71.8	176.4	178.8	0	0	111.7	L52 L53 G58 S59 L60	L52-E56 PolarHBondContact O-N 3.49Å; L53-E56 PolarHBondContact O-N 3.35Å; E56-G58 VanDerWaalsContact C-N 3.31Å; E56-G58 PolarHBondContact O-N 3.19Å; E56-S59 WeakPolarHBondContact O-CB 3.42Å; E56-S59 PolarHBondContact O-N 3.02Å; E56-S59 VanDerWaalsContact O-N 3.08Å; E56-L60 WeakPolarHBondContact O-CB 3.47Å; E56-L60 WeakPolarHBondContact O-CG 3.4Å; E56-L60 PolarHBondContact O-N 3.19Å
57	I	90	Very high	87.9	Confident	19 Å²	19	86.9 Å²	86.9	10%	0.097	45%	0.449	C	S	.	.	H	α-helix	trans	-57.3	-45.7	174	-69.6	166.3	0	0	0	110.3	L53 S59 L60 Q61 L72 A75 I79	L53-I57 WeakPolarHBondContact O-CB 3.47Å; L53-I57 WeakPolarHBondContact O-CG1 3.34Å; L53-I57 PolarHBondContact O-N 2.8Å; I57-S59 VanDerWaalsContact C-N 3.27Å; I57-S59 PolarHBondContact O-N 2.65Å; I57-L60 PolarHBondContact O-N 3.31Å; I57-Q61 WeakPolarHBondContact O-CB 3.47Å; I57-Q61 PolarHBondContact O-N 3.37Å; I57-L72 HydrophobicContact CG2-CB 4.26Å; I57-L72 HydrophobicContact CG2-CD2 4.21Å; I57-L72 HydrophobicContact CG2-CG 4.29Å; I57-L72 WeakPolarHBondContact O-CD2 3.29Å; I57-A75 HydrophobicContact CD1-CB 4.05Å; I57-I79 HydrophobicContact CD1-CD1 3.41Å; I57-I79 VanDerWaalsContact CD1-CD1 3.41Å
58	G	88.2	Confident	87.6	Confident	34 Å²	34	86.6 Å²	86.6	35%	0.351	45%	0.452	S	S	.	.	H	α-helix	trans	-65.6	-27.4	178	0	0	0	0	0	114.2	K54 H55 E56	K54-G58 PolarHBondContact O-N 3.46Å; H55-G58 PolarHBondContact O-N 3.09Å; E56-G58 VanDerWaalsContact C-N 3.31Å; E56-G58 PolarHBondContact O-N 3.19Å
59	S	88.6	Confident	87.2	Confident	62 Å²	62	85.5 Å²	85.5	43%	0.434	45%	0.446	S	S	.	.	H	α-helix	trans	-78	-47.7	174.7	-171.8	0	0	0	0	111.5	H55 E56 I57 Q61 K62	H55-S59 WeakPolarHBondContact O-CB 3.4Å; H55-S59 PolarHBondContact O-N 3.21Å; E56-S59 WeakPolarHBondContact O-CB 3.42Å; E56-S59 PolarHBondContact O-N 3.02Å; E56-S59 VanDerWaalsContact O-N 3.08Å; I57-S59 VanDerWaalsContact C-N 3.27Å; I57-S59 PolarHBondContact O-N 2.65Å; S59-Q61 VanDerWaalsContact C-N 3.34Å; S59-Q61 PolarHBondContact O-N 3.36Å; S59-K62 WeakPolarHBondContact O-CB 3.33Å; S59-K62 PolarHBondContact O-N 3.15Å
60	L	88.8	Confident	86.8	Confident	102 Å²	102	82.7 Å²	82.7	53%	0.534	44%	0.442	S	S	.	.	H	α-helix	trans	-65.3	-37.3	179.1	-69.8	172.5	0	0	0	111.5	E56 I57 K62 N63 A64 L72	E56-L60 WeakPolarHBondContact O-CB 3.47Å; E56-L60 WeakPolarHBondContact O-CG 3.4Å; E56-L60 PolarHBondContact O-N 3.19Å; I57-L60 PolarHBondContact O-N 3.31Å; L60-K62 PolarHBondContact O-N 3.49Å; L60-N63 PolarHBondContact O-N 3.41Å; L60-A64 WeakPolarHBondContact O-CB 3.43Å; L60-A64 PolarHBondContact O-N 3.31Å; L60-L72 HydrophobicContact CB-CD2 3.67Å
61	Q	85.1	Confident	86.6	Confident	85 Å²	85	87 Å²	87	40%	0.397	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.1	178.1	-170	171.4	5.8	0	0	113.3	I57 S59 L72	I57-Q61 WeakPolarHBondContact O-CB 3.47Å; I57-Q61 PolarHBondContact O-N 3.37Å; S59-Q61 VanDerWaalsContact C-N 3.34Å; S59-Q61 PolarHBondContact O-N 3.36Å; Q61-L72 HydrophobicContact CB-CD2 3.84Å; Q61-L72 VanDerWaalsContact N-CD2 3.34Å
62	K	83.2	Confident	86.4	Confident	172 Å²	172	82.2 Å²	82.2	75%	0.748	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-28.2	175.8	-65	178.4	-178	178.6	0	113.5	S59 L60	S59-K62 WeakPolarHBondContact O-CB 3.33Å; S59-K62 PolarHBondContact O-N 3.15Å; L60-K62 PolarHBondContact O-N 3.49Å
63	N	82.5	Confident	86	Confident	139 Å²	139	83.6 Å²	83.6	74%	0.743	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-11.6	-175.4	-62.6	-19.5	0	0	0	112.6	L60	L60-N63 PolarHBondContact O-N 3.41Å
64	A	79.3	Confident	85.8	Confident	13 Å²	13	88.8 Å²	88.8	11%	0.107	47%	0.47	C	S	.	.			trans	-70.6	143.3	-176.2	0	0	0	0	0	112.5	L60 E68 I69	L60-A64 WeakPolarHBondContact O-CB 3.43Å; L60-A64 PolarHBondContact O-N 3.31Å; A64-E68 WeakPolarHBondContact CA-OE2 3.38Å; A64-E68 HydrophobicContact CB-CB 3.83Å; A64-I69 HydrophobicContact CB-CG1 3.86Å
65	T	80.7	Confident	85.7	Confident	111 Å²	111	87.1 Å²	87.1	68%	0.681	47%	0.47	S	S	*	.			trans	-127.6	142.3	174.7	38.7	0	0	0	0	111.3	D67 E68	T65-D67 PolarHBondContact O-N 2.85Å; T65-E68 PolarHBondContact O-N 2.88Å
66	G	79.9	Confident	85.5	Confident	53 Å²	53	85.2 Å²	85.2	55%	0.546	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-117.2	172.7	0	0	0	0	0	114.2	E68 I69	G66-E68 VanDerWaalsContact C-N 3.28Å; G66-E68 PolarHBondContact O-N 3.36Å; G66-I69 WeakPolarHBondContact O-CB 3.35Å; G66-I69 PolarHBondContact O-N 3.01Å; G66-I69 VanDerWaalsContact O-N 3.15Å
67	D	83.5	Confident	85.3	Confident	131 Å²	131	85 Å²	85	70%	0.701	46%	0.46	S	S	*	.	H	α-helix	trans	-61.2	-34.2	-173.5	-63.8	-20.3	0	0	0	112.8	T65 I69 T70 I71	T65-D67 PolarHBondContact O-N 2.85Å; D67-I69 VanDerWaalsContact C-N 3.26Å; D67-I69 PolarHBondContact O-N 3.2Å; D67-T70 PolarHBondContact O-N 3.45Å; D67-T70 VanDerWaalsContact O-N 3.1Å; D67-T70 PolarHBondContact O-OG1 3.44Å; D67-I71 PolarHBondContact O-N 2.73Å; D67-I71 VanDerWaalsContact O-N 3.16Å
68	E	83.9	Confident	85.2	Confident	106 Å²	106	86.5 Å²	86.5	50%	0.495	47%	0.469	S	S	.	.	H	α-helix	trans	-58.2	-40.1	177.5	-66	-176.4	163.1	0	0	111.4	A64 T65 G66 T70 I71 L72	A64-E68 WeakPolarHBondContact CA-OE2 3.38Å; A64-E68 HydrophobicContact CB-CB 3.83Å; T65-E68 PolarHBondContact O-N 2.88Å; G66-E68 VanDerWaalsContact C-N 3.28Å; G66-E68 PolarHBondContact O-N 3.36Å; E68-T70 VanDerWaalsContact C-N 3.3Å; E68-T70 PolarHBondContact O-N 2.95Å; E68-I71 PolarHBondContact O-N 3.44Å; E68-L72 WeakPolarHBondContact O-CB 3.47Å; E68-L72 WeakPolarHBondContact O-CD1 3.07Å; E68-L72 PolarHBondContact O-N 2.94Å
69	I	84.5	Confident	85.2	Confident	63 Å²	63	85.4 Å²	85.4	32%	0.323	46%	0.455	S	S	.	.	H	α-helix	trans	-61.8	-41.4	179.2	-60	174.9	0	0	0	110.5	A64 G66 D67 L72 E73	A64-I69 HydrophobicContact CB-CG1 3.86Å; G66-I69 WeakPolarHBondContact O-CB 3.35Å; G66-I69 PolarHBondContact O-N 3.01Å; G66-I69 VanDerWaalsContact O-N 3.15Å; D67-I69 VanDerWaalsContact C-N 3.26Å; D67-I69 PolarHBondContact O-N 3.2Å; I69-L72 PolarHBondContact O-N 3.2Å; I69-E73 WeakPolarHBondContact O-CB 3.05Å; I69-E73 PolarHBondContact O-N 3.26Å
70	T	84.2	Confident	85	Confident	71 Å²	71	86.7 Å²	86.7	44%	0.436	46%	0.456	S	S	.	.	H	α-helix	trans	-67.1	-38.6	-179.5	70.9	0	0	0	0	112	D67 E68 E73 K74	D67-T70 PolarHBondContact O-N 3.45Å; D67-T70 VanDerWaalsContact O-N 3.1Å; D67-T70 PolarHBondContact O-OG1 3.44Å; E68-T70 VanDerWaalsContact C-N 3.3Å; E68-T70 PolarHBondContact O-N 2.95Å; T70-E73 PolarHBondContact O-N 3.3Å; T70-K74 WeakPolarHBondContact O-CG 3.41Å; T70-K74 PolarHBondContact O-N 3.16Å
71	I	87.2	Confident	84.8	Confident	110 Å²	110	88.4 Å²	88.4	56%	0.564	46%	0.459	S	S	*	.	H	α-helix	trans	-65.2	-46.2	175.6	-64	168.3	0	0	0	109.9	D67 E68 E73 K74 A75	D67-I71 PolarHBondContact O-N 2.73Å; D67-I71 VanDerWaalsContact O-N 3.16Å; E68-I71 PolarHBondContact O-N 3.44Å; I71-E73 VanDerWaalsContact C-N 3.3Å; I71-E73 PolarHBondContact O-N 3.39Å; I71-K74 PolarHBondContact O-N 3.23Å; I71-A75 WeakPolarHBondContact O-CB 3.11Å; I71-A75 PolarHBondContact O-N 3.02Å
72	L	87.3	Confident	84.9	Confident	23 Å²	23	88.5 Å²	88.5	12%	0.12	46%	0.458	C	S	.	.	H	α-helix	trans	-61.3	-38.2	176.4	-91	76.9	0	0	0	112.2	I57 L60 Q61 E68 I69 K76	I57-L72 HydrophobicContact CG2-CB 4.26Å; I57-L72 HydrophobicContact CG2-CD2 4.21Å; I57-L72 HydrophobicContact CG2-CG 4.29Å; I57-L72 WeakPolarHBondContact O-CD2 3.29Å; L60-L72 HydrophobicContact CB-CD2 3.67Å; Q61-L72 HydrophobicContact CB-CD2 3.84Å; Q61-L72 VanDerWaalsContact N-CD2 3.34Å; E68-L72 WeakPolarHBondContact O-CB 3.47Å; E68-L72 WeakPolarHBondContact O-CD1 3.07Å; E68-L72 PolarHBondContact O-N 2.94Å; I69-L72 PolarHBondContact O-N 3.2Å; L72-K76 VanDerWaalsContact O-CB 3.31Å; L72-K76 WeakPolarHBondContact O-CB 3.05Å; L72-K76 PolarHBondContact O-N 3.13Å
73	E	84.7	Confident	85	Confident	116 Å²	116	82.7 Å²	82.7	54%	0.542	43%	0.434	S	S	.	.	H	α-helix	trans	-68.7	-43.2	177.2	-172.7	166.4	-158.4	0	0	112	I69 T70 I71 A75 K76 I77	I69-E73 WeakPolarHBondContact O-CB 3.05Å; I69-E73 PolarHBondContact O-N 3.26Å; T70-E73 PolarHBondContact O-N 3.3Å; I71-E73 VanDerWaalsContact C-N 3.3Å; I71-E73 PolarHBondContact O-N 3.39Å; E73-A75 PolarHBondContact O-N 3.33Å; E73-K76 WeakPolarHBondContact O-CB 3.21Å; E73-K76 PolarHBondContact O-N 2.93Å; E73-I77 HydrophobicContact CG-CD1 4.32Å; E73-I77 WeakPolarHBondContact O-CG1 3.4Å; E73-I77 PolarHBondContact O-N 2.72Å
74	K	88.3	Confident	85	Confident	155 Å²	155	78 Å²	78	67%	0.674	41%	0.406	S	S	*	.	H	α-helix	trans	-58.3	-47.2	172.2	-75.1	-179.2	-180	-177.8	0	111.4	T70 I71 K76 I77 D78	T70-K74 WeakPolarHBondContact O-CG 3.41Å; T70-K74 PolarHBondContact O-N 3.16Å; I71-K74 PolarHBondContact O-N 3.23Å; K74-K76 VanDerWaalsContact C-N 3.31Å; K74-K76 PolarHBondContact O-N 3.44Å; K74-I77 PolarHBondContact O-N 3.01Å; K74-D78 PolarHBondContact O-N 3.41Å
75	A	88.7	Confident	85.2	Confident	39 Å²	39	81.1 Å²	81.1	32%	0.322	42%	0.424	S	S	.	.	H	α-helix	trans	-61	-39.5	176.5	0	0	0	0	0	112	I57 I71 E73 D78 I79	I57-A75 HydrophobicContact CD1-CB 4.05Å; I71-A75 WeakPolarHBondContact O-CB 3.11Å; I71-A75 PolarHBondContact O-N 3.02Å; E73-A75 PolarHBondContact O-N 3.33Å; A75-D78 PolarHBondContact O-N 3.11Å; A75-I79 VanDerWaalsContact O-CG1 3.29Å; A75-I79 WeakPolarHBondContact O-CG1 3.27Å; A75-I79 PolarHBondContact O-N 3.49Å
76	K	87	Confident	85.6	Confident	96 Å²	96	76.7 Å²	76.7	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-42.5	176	-174.1	179.6	-177.8	178	0	112.1	L72 E73 K74 I79 L80	L72-K76 VanDerWaalsContact O-CB 3.31Å; L72-K76 WeakPolarHBondContact O-CB 3.05Å; L72-K76 PolarHBondContact O-N 3.13Å; E73-K76 WeakPolarHBondContact O-CB 3.21Å; E73-K76 PolarHBondContact O-N 2.93Å; K74-K76 VanDerWaalsContact C-N 3.31Å; K74-K76 PolarHBondContact O-N 3.44Å; K76-I79 PolarHBondContact O-N 3.42Å; K76-L80 VanDerWaalsContact O-CG 3.28Å; K76-L80 WeakPolarHBondContact O-CG 3.29Å; K76-L80 PolarHBondContact O-N 3.5Å
77	I	85.4	Confident	85.7	Confident	84 Å²	84	78.8 Å²	78.8	43%	0.431	39%	0.387	S	S	.	.	H	α-helix	trans	-63.6	-43.3	175.7	-69	167.7	0	0	0	110.5	E73 K74 L80 K81	E73-I77 HydrophobicContact CG-CD1 4.32Å; E73-I77 WeakPolarHBondContact O-CG1 3.4Å; E73-I77 PolarHBondContact O-N 2.72Å; K74-I77 PolarHBondContact O-N 3.01Å; I77-L80 WeakPolarHBondContact O-CB 3.44Å; I77-L80 PolarHBondContact O-N 3.18Å; I77-L80 VanDerWaalsContact O-N 3.15Å; I77-K81 PolarHBondContact O-N 3.02Å
78	D	87.5	Confident	85.5	Confident	52 Å²	52	75.3 Å²	75.3	28%	0.278	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-45.9	177.5	-179.9	47.7	0	0	0	112.3	K74 A75 L80 K81 K82	K74-D78 PolarHBondContact O-N 3.41Å; A75-D78 PolarHBondContact O-N 3.11Å; D78-L80 PolarHBondContact O-N 3.47Å; D78-K81 WeakPolarHBondContact O-CB 3.32Å; D78-K81 PolarHBondContact O-N 2.96Å; D78-K81 VanDerWaalsContact O-N 3.08Å; D78-K82 PolarHBondContact O-N 3.5Å; D78-K82 IonicContact OD1-NZ 2.75Å; D78-K82 PolarHBondContact OD1-NZ 3.17Å; D78-K82 IonicContact OD2-NZ 2.8Å; D78-K82 PolarHBondContact OD2-NZ 3.28Å
79	I	88	Confident	85.6	Confident	11 Å²	11	73.7 Å²	73.7	6%	0.056	36%	0.363	C	S	.	.	H	α-helix	trans	-58	-39.2	173	-67.7	167	0	0	0	111	M50 L53 K54 I57 A75 K76 K82 E83	M50-I79 HydrophobicContact CB-CG2 4.26Å; M50-I79 HydrophobicContact CG-CG2 4.35Å; M50-I79 HydrophobicContact SD-CG2 4.45Å; L53-I79 HydrophobicContact CB-CD1 3.77Å; L53-I79 HydrophobicContact CD1-CD1 4.28Å; K54-I79 HydrophobicContact CD-CG2 4.3Å; K54-I79 VanDerWaalsContact CE-CG2 3.46Å; K54-I79 HydrophobicContact CG-CG2 4.04Å; I57-I79 HydrophobicContact CD1-CD1 3.41Å; I57-I79 VanDerWaalsContact CD1-CD1 3.41Å; A75-I79 VanDerWaalsContact O-CG1 3.29Å; A75-I79 WeakPolarHBondContact O-CG1 3.27Å; A75-I79 PolarHBondContact O-N 3.49Å; K76-I79 PolarHBondContact O-N 3.42Å; I79-K82 PolarHBondContact O-N 2.88Å; I79-E83 HydrophobicContact CG2-CG 4.39Å; I79-E83 WeakPolarHBondContact O-CB 3.32Å; I79-E83 WeakPolarHBondContact O-CG 3.36Å; I79-E83 PolarHBondContact O-N 3.46Å
80	L	85.4	Confident	85.6	Confident	89 Å²	89	72.1 Å²	72.1	47%	0.466	35%	0.354	S	S	.	.	H	α-helix	trans	-65.1	-38.1	176.6	-72.1	170.6	0	0	0	112.6	K76 I77 D78 Y84	K76-L80 VanDerWaalsContact O-CG 3.28Å; K76-L80 WeakPolarHBondContact O-CG 3.29Å; K76-L80 PolarHBondContact O-N 3.5Å; I77-L80 WeakPolarHBondContact O-CB 3.44Å; I77-L80 PolarHBondContact O-N 3.18Å; I77-L80 VanDerWaalsContact O-N 3.15Å; D78-L80 PolarHBondContact O-N 3.47Å; L80-Y84 PolarHBondContact O-N 2.97Å; L80-Y84 VanDerWaalsContact O-N 3.17Å
81	K	83.7	Confident	85.4	Confident	138 Å²	138	70 Å²	70	60%	0.6	34%	0.34	S	S	*	.	H	α-helix	trans	-64.7	-46.1	173	-69.1	177.9	-179.4	178.8	0	111	I77 D78 E83 Y84 V85	I77-K81 PolarHBondContact O-N 3.02Å; D78-K81 WeakPolarHBondContact O-CB 3.32Å; D78-K81 PolarHBondContact O-N 2.96Å; D78-K81 VanDerWaalsContact O-N 3.08Å; K81-E83 PolarHBondContact O-N 3.13Å; K81-Y84 VanDerWaalsContact O-CB 3.27Å; K81-Y84 WeakPolarHBondContact O-CB 3.42Å; K81-Y84 PolarHBondContact O-N 2.84Å; K81-Y84 VanDerWaalsContact O-N 3.14Å; K81-V85 PolarHBondContact O-N 3.35Å
82	K	87.9	Confident	85.1	Confident	86 Å²	86	68.3 Å²	68.3	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-64.5	-37.8	178.1	-70.6	179.5	166.2	84.1	0	112.2	M50 D78 I79 Y84 V85 L86 E355	M50-K82 HydrophobicContact SD-CB 4.24Å; D78-K82 PolarHBondContact O-N 3.5Å; D78-K82 IonicContact OD1-NZ 2.75Å; D78-K82 PolarHBondContact OD1-NZ 3.17Å; D78-K82 IonicContact OD2-NZ 2.8Å; D78-K82 PolarHBondContact OD2-NZ 3.28Å; I79-K82 PolarHBondContact O-N 2.88Å; K82-Y84 VanDerWaalsContact C-N 3.27Å; K82-Y84 PolarHBondContact O-N 3.25Å; K82-V85 PolarHBondContact O-N 3.18Å; K82-L86 WeakPolarHBondContact O-CB 3.48Å; K82-L86 PolarHBondContact O-N 3.46Å; K82-E355 IonicContact NZ-OE1 3.81Å; K82-E355 PolarHBondContact NZ-OE1 3.48Å; K82-E355 IonicContact NZ-OE2 2.62Å
83	E	85.7	Confident	84.9	Confident	50 Å²	50	68.2 Å²	68.2	23%	0.234	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-33.9	172.6	-82.8	-169.9	153.2	0	0	113.5	M50 K54 I79 K81 R87	M50-E83 HydrophobicContact CE-CG 3.99Å; M50-E83 HydrophobicContact SD-CG 3.84Å; K54-E83 VanDerWaalsContact CE-OE1 3.25Å; K54-E83 WeakPolarHBondContact CE-OE1 3.38Å; K54-E83 IonicContact NZ-OE1 2.75Å; K54-E83 PolarHBondContact NZ-OE1 2.83Å; K54-E83 IonicContact NZ-OE2 3.73Å; K54-E83 PolarHBondContact NZ-OE2 3.37Å; I79-E83 HydrophobicContact CG2-CG 4.39Å; I79-E83 WeakPolarHBondContact O-CB 3.32Å; I79-E83 WeakPolarHBondContact O-CG 3.36Å; I79-E83 PolarHBondContact O-N 3.46Å; K81-E83 PolarHBondContact O-N 3.13Å; E83-R87 PolarHBondContact O-N 3.14Å; E83-R87 VanDerWaalsContact O-N 3.09Å
84	Y	81.5	Confident	84.8	Confident	40 Å²	40	64.1 Å²	64.1	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-48.8	177	175.4	-86.5	0	0	0	111.2	L80 K81 K82 R87 D88 H336	L80-Y84 PolarHBondContact O-N 2.97Å; L80-Y84 VanDerWaalsContact O-N 3.17Å; K81-Y84 VanDerWaalsContact O-CB 3.27Å; K81-Y84 WeakPolarHBondContact O-CB 3.42Å; K81-Y84 PolarHBondContact O-N 2.84Å; K81-Y84 VanDerWaalsContact O-N 3.14Å; K82-Y84 VanDerWaalsContact C-N 3.27Å; K82-Y84 PolarHBondContact O-N 3.25Å; Y84-R87 WeakPolarHBondContact O-CB 3.45Å; Y84-R87 PolarHBondContact O-N 2.91Å; Y84-D88 PolarHBondContact O-N 3.5Å; Y84-H336 HydrophobicContact CE2-CB 3.5Å; Y84-H336 AromaticContact CE2-CD2 3.11Å; Y84-H336 WeakPolarHBondContact CE2-CD2 3.02Å; Y84-H336 AromaticContact CE2-CG 3.53Å; Y84-H336 AromaticContact CZ-CD2 3.52Å; Y84-H336 AromaticContact CZ-CG 3.95Å; Y84-H336 WeakPolarHBondContact OH-CA 3.43Å; Y84-H336 WeakPolarHBondContact OH-CB 3.5Å; Y84-H336 PolarHBondContact OH-CD2 3.02Å
85	V	85.2	Confident	84.2	Confident	80 Å²	80	59.9 Å²	59.9	49%	0.485	30%	0.297	S	S	.	.	H	α-helix	trans	-62.9	-43.9	176.3	178	0	0	0	0	110.6	K81 K82 R87 D88 I89	K81-V85 PolarHBondContact O-N 3.35Å; K82-V85 PolarHBondContact O-N 3.18Å; V85-R87 PolarHBondContact O-N 3.23Å; V85-D88 WeakPolarHBondContact O-CB 3.28Å; V85-D88 PolarHBondContact O-N 3.37Å; V85-I89 HydrophobicContact CG1-CD1 4.16Å; V85-I89 PolarHBondContact O-N 2.75Å; V85-I89 VanDerWaalsContact O-N 3.09Å
86	L	87.4	Confident	83.5	Confident	18 Å²	18	64.1 Å²	64.1	9%	0.094	32%	0.319	C	S	.	.	H	α-helix	trans	-57.9	-36.4	177.5	-168.9	69.1	0	0	0	111.9	V43 R47 M50 K82 D88 I89 E90	V43-L86 HydrophobicContact CB-CD1 4.2Å; V43-L86 HydrophobicContact CG1-CD1 3.9Å; V43-L86 HydrophobicContact CG1-CD2 4.4Å; V43-L86 HydrophobicContact CG1-CG 4.25Å; V43-L86 HydrophobicContact CG2-CD1 3.83Å; R47-L86 HydrophobicContact CB-CD2 3.98Å; R47-L86 HydrophobicContact CG-CD2 4.45Å; M50-L86 HydrophobicContact CE-CB 4.41Å; M50-L86 HydrophobicContact CE-CD2 3.26Å; M50-L86 HydrophobicContact CE-CG 4.4Å; K82-L86 WeakPolarHBondContact O-CB 3.48Å; K82-L86 PolarHBondContact O-N 3.46Å; L86-D88 VanDerWaalsContact C-N 3.34Å; L86-D88 PolarHBondContact O-N 2.98Å; L86-I89 PolarHBondContact O-N 3.18Å; L86-E90 HydrophobicContact CG-CG 4.46Å; L86-E90 WeakPolarHBondContact O-CB 3.29Å; L86-E90 VanDerWaalsContact O-CG 3.32Å; L86-E90 WeakPolarHBondContact O-CG 3.45Å; L86-E90 PolarHBondContact O-N 3.01Å
87	R	82.5	Confident	83	Confident	96 Å²	96	60.7 Å²	60.7	36%	0.362	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-36.3	177.2	-169.9	-175.9	-65.5	138.2	-0.9	112.6	E83 Y84 V85 E90 D91 R180	E83-R87 PolarHBondContact O-N 3.14Å; E83-R87 VanDerWaalsContact O-N 3.09Å; Y84-R87 WeakPolarHBondContact O-CB 3.45Å; Y84-R87 PolarHBondContact O-N 2.91Å; V85-R87 PolarHBondContact O-N 3.23Å; R87-E90 PolarHBondContact O-N 3.49Å; R87-D91 PolarHBondContact O-N 3.37Å; R87-R180 VanDerWaalsContact CD-NH2 3.35Å; R87-R180 VanDerWaalsContact NH1-NH2 3.17Å
88	D	80.4	Confident	82.9	Confident	58 Å²	58	58.9 Å²	58.9	31%	0.31	31%	0.309	S	S	.	.	H	α-helix	trans	-68.8	-40.8	176.7	-161.9	39.5	0	0	0	110.7	Y84 V85 L86 D91	Y84-D88 PolarHBondContact O-N 3.5Å; V85-D88 WeakPolarHBondContact O-CB 3.28Å; V85-D88 PolarHBondContact O-N 3.37Å; L86-D88 VanDerWaalsContact C-N 3.34Å; L86-D88 PolarHBondContact O-N 2.98Å; D88-D91 WeakPolarHBondContact O-CB 3.48Å; D88-D91 PolarHBondContact O-N 3.08Å
89	I	84.8	Confident	82.9	Confident	72 Å²	72	62 Å²	62	37%	0.369	33%	0.325	S	S	.	.	H	α-helix	trans	-60.6	-48.6	171.6	-60.8	170.2	0	0	0	110.5	V43 V85 L86 D91 V92 L93	V43-I89 HydrophobicContact CG2-CG2 3.9Å; V85-I89 HydrophobicContact CG1-CD1 4.16Å; V85-I89 PolarHBondContact O-N 2.75Å; V85-I89 VanDerWaalsContact O-N 3.09Å; L86-I89 PolarHBondContact O-N 3.18Å; I89-D91 PolarHBondContact O-N 2.6Å; I89-V92 PolarHBondContact O-N 3.37Å; I89-V92 VanDerWaalsContact O-N 3.1Å; I89-L93 HydrophobicContact CG2-CD1 4.03Å; I89-L93 WeakPolarHBondContact O-CG 3.49Å; I89-L93 PolarHBondContact O-N 2.67Å
90	E	85.1	Confident	82.8	Confident	31 Å²	31	64.5 Å²	64.5	15%	0.145	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-20.6	176.9	-79.7	-178.8	170.6	0	0	113.9	V43 R47 L86 R87 R95	V43-E90 HydrophobicContact CG1-CG 3.49Å; V43-E90 VanDerWaalsContact CG1-CG 3.49Å; V43-E90 WeakPolarHBondContact CG1-OE1 3.46Å; R47-E90 WeakPolarHBondContact CD-OE1 3.31Å; R47-E90 IonicContact CZ-OE1 3.5Å; R47-E90 IonicContact CZ-OE2 3.68Å; R47-E90 IonicContact NE-OE1 2.83Å; R47-E90 IonicContact NH1-OE1 3.72Å; R47-E90 PolarHBondContact NH1-OE1 3.09Å; R47-E90 IonicContact NH1-OE2 2.98Å; R47-E90 PolarHBondContact NH1-OE2 2.87Å; L86-E90 HydrophobicContact CG-CG 4.46Å; L86-E90 WeakPolarHBondContact O-CB 3.29Å; L86-E90 VanDerWaalsContact O-CG 3.32Å; L86-E90 WeakPolarHBondContact O-CG 3.45Å; L86-E90 PolarHBondContact O-N 3.01Å; R87-E90 PolarHBondContact O-N 3.49Å; E90-R95 VanDerWaalsContact C-NH2 3.34Å; E90-R95 PolarHBondContact O-NE 2.93Å; E90-R95 PolarHBondContact O-NH2 3.27Å
91	D	79.3	Confident	82.8	Confident	26 Å²	26	60.5 Å²	60.5	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-75.5	-26.5	176.7	-83.1	-11.2	0	0	0	110.8	R87 D88 I89 R95 K118	R87-D91 PolarHBondContact O-N 3.37Å; D88-D91 WeakPolarHBondContact O-CB 3.48Å; D88-D91 PolarHBondContact O-N 3.08Å; I89-D91 PolarHBondContact O-N 2.6Å; D91-R95 IonicContact OD1-CZ 3.49Å; D91-R95 IonicContact OD1-NH1 3.19Å; D91-R95 IonicContact OD1-NH2 3.67Å; D91-R95 PolarHBondContact OD1-NH2 2.84Å; D91-K118 PolarHBondContact O-NZ 3.11Å
92	V	80.9	Confident	83	Confident	75 Å²	75	60.7 Å²	60.7	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-86.3	-29.7	176.5	-176.1	0	0	0	0	111.9	I89	I89-V92 PolarHBondContact O-N 3.37Å; I89-V92 VanDerWaalsContact O-N 3.1Å
93	L	84.4	Confident	83.1	Confident	21 Å²	21	62.6 Å²	62.6	11%	0.11	32%	0.323	C	S	.	.	S	Bend	trans	-71.9	155	-177.3	-70.6	177.7	0	0	0	113.7	C39 V40 V43 I89 R95 S111	C39-L93 HydrophobicContact CB-CD1 4.48Å; C39-L93 HydrophobicContact CB-CD2 3.89Å; V40-L93 HydrophobicContact CG2-CB 4.29Å; V40-L93 HydrophobicContact CG2-CD1 4.21Å; V40-L93 HydrophobicContact CG2-CD2 4.17Å; V40-L93 HydrophobicContact CG2-CG 4.46Å; V43-L93 HydrophobicContact CB-CD1 4.23Å; V43-L93 HydrophobicContact CG2-CD1 3.62Å; I89-L93 HydrophobicContact CG2-CD1 4.03Å; I89-L93 WeakPolarHBondContact O-CG 3.49Å; I89-L93 PolarHBondContact O-N 2.67Å; L93-R95 PolarHBondContact O-N 2.9Å; L93-S111 PolarHBondContact O-OG 3.5Å
94	P	81.5	Confident	83.3	Confident	30 Å²	30	63.4 Å²	63.4	20%	0.195	33%	0.332	C	S	.	.			trans	-66.4	131.4	177.1	32.2	-39	0	0	0	109.8	E36 V40 S111	E36-P94 VanDerWaalsContact CD-CG 3.5Å; E36-P94 VanDerWaalsContact CG-CD 3.48Å; E36-P94 HydrophobicContact CG-CG 3.6Å; E36-P94 VanDerWaalsContact OE1-CB 3.29Å; E36-P94 WeakPolarHBondContact OE1-CB 2.96Å; E36-P94 WeakPolarHBondContact OE1-CD 3.36Å; E36-P94 WeakPolarHBondContact OE1-CG 3.29Å; V40-P94 HydrophobicContact CG2-CG 3.87Å; P94-S111 WeakPolarHBondContact CA-OG 3.26Å
95	R	76.4	Confident	83.6	Confident	65 Å²	65	64.7 Å²	64.7	25%	0.245	34%	0.341	C	S	.	.			trans	-104.4	138.9	175.8	-68.6	-178.1	176.1	-170.4	6.8	110.7	E90 D91 L93 S111 A176	E90-R95 VanDerWaalsContact C-NH2 3.34Å; E90-R95 PolarHBondContact O-NE 2.93Å; E90-R95 PolarHBondContact O-NH2 3.27Å; D91-R95 IonicContact OD1-CZ 3.49Å; D91-R95 IonicContact OD1-NH1 3.19Å; D91-R95 IonicContact OD1-NH2 3.67Å; D91-R95 PolarHBondContact OD1-NH2 2.84Å; L93-R95 PolarHBondContact O-N 2.9Å; R95-S111 PolarHBondContact N-OG 2.91Å; R95-A176 WeakPolarHBondContact CD-O 3.4Å
96	T	74.4	Confident	83.6	Confident	128 Å²	128	62.3 Å²	62.3	79%	0.785	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-71.3	132.1	175	49.2	0	0	0	0	109.7	G98	T96-G98 PolarHBondContact O-N 2.8Å
97	P	76.6	Confident	83.1	Confident	24 Å²	24	66 Å²	66	16%	0.156	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-62.2	138.3	178.1	25.3	-33.4	0	0	0	110.1	L101 R102	P97-L101 HydrophobicContact CB-CB 3.93Å; P97-L101 HydrophobicContact CB-CD2 3.81Å; P97-L101 HydrophobicContact CB-CG 4.04Å; P97-R102 HydrophobicContact CG-CB 4.45Å
98	G	82.4	Confident	82.7	Confident	46 Å²	46	66.5 Å²	66.5	47%	0.474	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-62	163.5	171.8	0	0	0	0	0	111.8	T96 Y100 L101 R102	T96-G98 PolarHBondContact O-N 2.8Å; G98-Y100 VanDerWaalsContact C-N 3.3Å; G98-Y100 PolarHBondContact O-N 2.91Å; G98-Y100 VanDerWaalsContact O-N 3.14Å; G98-L101 PolarHBondContact O-N 2.88Å; G98-R102 PolarHBondContact O-N 3.02Å
99	L	86.6	Confident	82.4	Confident	119 Å²	119	69.6 Å²	69.6	62%	0.623	39%	0.392	S	S	*	.	H	α-helix	trans	-45.6	-50.2	-175.2	-172.6	96.9	0	0	0	113.4	L101 R102 I103	L99-L101 PolarHBondContact O-N 3.45Å; L99-R102 PolarHBondContact O-N 2.93Å; L99-I103 HydrophobicContact CD2-CD1 4.07Å; L99-I103 HydrophobicContact CG-CD1 3.96Å; L99-I103 VanDerWaalsContact O-CG1 3.31Å; L99-I103 WeakPolarHBondContact O-CG1 3.39Å; L99-I103 PolarHBondContact O-N 2.65Å
100	Y	86.6	Confident	81.9	Confident	62 Å²	62	68.1 Å²	68.1	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-59.2	-47.5	-179.7	178.4	-95.5	0	0	0	112.4	G98 R102 I103 V104 T168 I169 R172 F190	G98-Y100 VanDerWaalsContact C-N 3.3Å; G98-Y100 PolarHBondContact O-N 2.91Å; G98-Y100 VanDerWaalsContact O-N 3.14Å; Y100-R102 VanDerWaalsContact C-N 3.3Å; Y100-R102 PolarHBondContact O-N 2.73Å; Y100-I103 PolarHBondContact O-N 3.05Å; Y100-V104 HydrophobicContact CD1-CG2 4.41Å; Y100-V104 HydrophobicContact CD2-CG2 4.47Å; Y100-V104 HydrophobicContact CE1-CG2 4.03Å; Y100-V104 HydrophobicContact CE2-CG2 4.08Å; Y100-V104 WeakPolarHBondContact O-CG2 3.29Å; Y100-V104 PolarHBondContact O-N 3.45Å; Y100-T168 HydrophobicContact CE1-CG2 4.03Å; Y100-I169 HydrophobicContact CE1-CG1 4.15Å; Y100-R172 HydrophobicContact CD1-CB 4.34Å; Y100-R172 HydrophobicContact CD1-CG 3.81Å; Y100-R172 HydrophobicContact CE1-CG 4.22Å; Y100-F190 HydrophobicContact CD2-CE1 4.26Å; Y100-F190 AromaticContact CD2-CZ 3.96Å; Y100-F190 HydrophobicContact CD2-CZ 3.96Å; Y100-F190 AromaticContact CE2-CE1 3.73Å; Y100-F190 HydrophobicContact CE2-CE1 3.73Å; Y100-F190 AromaticContact CE2-CZ 3.79Å; Y100-F190 HydrophobicContact CE2-CZ 3.79Å; Y100-F190 HydrophobicContact CG-CZ 4.47Å
101	L	86.5	Confident	81.6	Confident	5 Å²	5	67.8 Å²	67.8	3%	0.026	39%	0.385	C	S	.	.	H	α-helix	trans	-67.4	-35.8	-178.3	-164.2	66.1	0	0	0	111.2	P97 G98 L99 I103 V104 L105 I110 I173 A176	P97-L101 HydrophobicContact CB-CB 3.93Å; P97-L101 HydrophobicContact CB-CD2 3.81Å; P97-L101 HydrophobicContact CB-CG 4.04Å; G98-L101 PolarHBondContact O-N 2.88Å; L99-L101 PolarHBondContact O-N 3.45Å; L101-I103 VanDerWaalsContact C-N 3.34Å; L101-V104 PolarHBondContact O-N 3.09Å; L101-L105 HydrophobicContact CD1-CD1 3.32Å; L101-L105 HydrophobicContact CD1-CG 4.09Å; L101-L105 HydrophobicContact CG-CD1 3.99Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 PolarHBondContact O-N 3.48Å; L101-I110 HydrophobicContact CD1-CD1 4.36Å; L101-I110 HydrophobicContact CD2-CD1 3.86Å; L101-I110 HydrophobicContact CG-CD1 4.02Å; L101-I173 HydrophobicContact CD1-CG1 3.78Å; L101-I173 HydrophobicContact CD2-CG1 4.16Å; L101-A176 HydrophobicContact CD2-CB 4.26Å
102	R	87.7	Confident	81.6	Confident	143 Å²	143	68.8 Å²	68.8	54%	0.54	39%	0.388	S	S	.	.	H	α-helix	trans	-65.2	-35.4	174	-172.1	173.9	67.4	-175	2.8	112.7	P97 G98 L99 Y100 G106	P97-R102 HydrophobicContact CG-CB 4.45Å; G98-R102 PolarHBondContact O-N 3.02Å; L99-R102 PolarHBondContact O-N 2.93Å; Y100-R102 VanDerWaalsContact C-N 3.3Å; Y100-R102 PolarHBondContact O-N 2.73Å; R102-G106 CarbonylContact O-C 3.58Å; R102-G106 WeakPolarHBondContact O-CA 3.29Å; R102-G106 PolarHBondContact O-N 3.03Å; R102-G106 VanDerWaalsContact O-N 3.12Å
103	I	90	Very high	81.4	Confident	126 Å²	126	68.9 Å²	68.9	65%	0.646	39%	0.389	S	S	*	.	H	α-helix	trans	-70.8	-44	176.1	-69.2	164.5	0	0	0	110.7	L99 Y100 L101	L99-I103 HydrophobicContact CD2-CD1 4.07Å; L99-I103 HydrophobicContact CG-CD1 3.96Å; L99-I103 VanDerWaalsContact O-CG1 3.31Å; L99-I103 WeakPolarHBondContact O-CG1 3.39Å; L99-I103 PolarHBondContact O-N 2.65Å; Y100-I103 PolarHBondContact O-N 3.05Å; L101-I103 VanDerWaalsContact C-N 3.34Å
104	V	89.3	Confident	81.2	Confident	67 Å²	67	71.7 Å²	71.7	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-80.8	-43.2	-172.9	176.8	0	0	0	0	113	Y100 L101 I169	Y100-V104 HydrophobicContact CD1-CG2 4.41Å; Y100-V104 HydrophobicContact CD2-CG2 4.47Å; Y100-V104 HydrophobicContact CE1-CG2 4.03Å; Y100-V104 HydrophobicContact CE2-CG2 4.08Å; Y100-V104 WeakPolarHBondContact O-CG2 3.29Å; Y100-V104 PolarHBondContact O-N 3.45Å; L101-V104 PolarHBondContact O-N 3.09Å; V104-I169 HydrophobicContact CG1-CD1 3.95Å; V104-I169 HydrophobicContact CG1-CG1 4.3Å
105	L	86.8	Confident	81.2	Confident	66 Å²	66	73.2 Å²	73.2	35%	0.346	41%	0.408	S	S	.	.	H	α-helix	trans	-107	-7.4	-174.5	-63.4	175.1	0	0	0	113.4	L101 L108 I110 I169 I173	L101-L105 HydrophobicContact CD1-CD1 3.32Å; L101-L105 HydrophobicContact CD1-CG 4.09Å; L101-L105 HydrophobicContact CG-CD1 3.99Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 PolarHBondContact O-N 3.48Å; L105-L108 WeakPolarHBondContact O-CD1 3.4Å; L105-I110 HydrophobicContact CB-CD1 4.09Å; L105-I110 HydrophobicContact CD1-CD1 3.25Å; L105-I110 HydrophobicContact CG-CD1 4.3Å; L105-I169 HydrophobicContact CD1-CG2 4.47Å; L105-I173 HydrophobicContact CD1-CD1 4.17Å; L105-I173 HydrophobicContact CD1-CG1 4.48Å
106	G	85.1	Confident	81.7	Confident	30 Å²	30	72.8 Å²	72.8	31%	0.309	41%	0.409	S	S	.	.			trans	80.4	-163.3	-175.2	0	0	0	0	0	113.7	R102 L108	R102-G106 CarbonylContact O-C 3.58Å; R102-G106 WeakPolarHBondContact O-CA 3.29Å; R102-G106 PolarHBondContact O-N 3.03Å; R102-G106 VanDerWaalsContact O-N 3.12Å; G106-L108 PolarHBondContact O-N 3.5Å
107	A	78.2	Confident	82.3	Confident	96 Å²	96	68.6 Å²	68.6	79%	0.793	38%	0.382	S	S	*	.	S	Bend	trans	-83.2	45.1	-177.6	0	0	0	0	0	112.9
108	L	74.7	Confident	82.9	Confident	107 Å²	107	69.6 Å²	69.6	56%	0.56	38%	0.383	S	S	*	.			trans	-87	136.3	177	-67	174	0	0	0	111.1	L105 G106 I110	L105-L108 WeakPolarHBondContact O-CD1 3.4Å; G106-L108 PolarHBondContact O-N 3.5Å; L108-I110 HydrophobicContact CB-CD1 4.48Å; L108-I110 HydrophobicContact CB-CG1 4.09Å; L108-I110 PolarHBondContact O-N 2.89Å
109	N	72.5	Confident	83.2	Confident	123 Å²	123	68 Å²	68	66%	0.658	36%	0.363	S	S	*	.			trans	-77.7	86.2	171.4	-72.6	-21.9	0	0	0	109.7	S111	N109-S111 PolarHBondContact O-N 3.36Å; N109-S111 VanDerWaalsContact O-N 3.09Å
110	I	74.1	Confident	83.4	Confident	40 Å²	40	68.9 Å²	68.9	21%	0.205	36%	0.359	C	S	.	.			trans	-88.7	58.1	177.5	-49.6	156.9	0	0	0	108.9	L101 L105 L108 I173 N177	L101-I110 HydrophobicContact CD1-CD1 4.36Å; L101-I110 HydrophobicContact CD2-CD1 3.86Å; L101-I110 HydrophobicContact CG-CD1 4.02Å; L105-I110 HydrophobicContact CB-CD1 4.09Å; L105-I110 HydrophobicContact CD1-CD1 3.25Å; L105-I110 HydrophobicContact CG-CD1 4.3Å; L108-I110 HydrophobicContact CB-CD1 4.48Å; L108-I110 HydrophobicContact CB-CG1 4.09Å; L108-I110 PolarHBondContact O-N 2.89Å; I110-I173 HydrophobicContact CG2-CG1 4.39Å; I110-I173 HydrophobicContact CG2-CG2 3.79Å; I110-N177 PolarHBondContact O-ND2 3.02Å
111	S	79	Confident	83.7	Confident	25 Å²	25	67.9 Å²	67.9	18%	0.175	36%	0.355	C	S	.	.			trans	-109.1	124.6	175.7	-157.4	0	0	0	0	109.7	L93 P94 R95 N109 T113 N177	L93-S111 PolarHBondContact O-OG 3.5Å; P94-S111 WeakPolarHBondContact CA-OG 3.26Å; R95-S111 PolarHBondContact N-OG 2.91Å; N109-S111 PolarHBondContact O-N 3.36Å; N109-S111 VanDerWaalsContact O-N 3.09Å; S111-T113 PolarHBondContact O-N 3.14Å; S111-N177 WeakPolarHBondContact CA-OD1 3.36Å
112	F	79.1	Confident	84	Confident	46 Å²	46	70 Å²	70	20%	0.202	36%	0.364	C	S	.	.			trans	-85.4	107.1	169	-57.8	-60.8	0	0	0	107.7	D117 K118 Y121 I173 N177	F112-D117 HydrophobicContact CB-CB 4.14Å; F112-D117 HydrophobicContact CD1-CB 4.03Å; F112-D117 HydrophobicContact CG-CB 4.31Å; F112-K118 HydrophobicContact CB-CG 3.58Å; F112-K118 HydrophobicContact CD2-CG 4.3Å; F112-K118 HydrophobicContact CG-CG 4.34Å; F112-K118 WeakPolarHBondContact O-CE 3.31Å; F112-Y121 AromaticContact CE2-CD1 3.74Å; F112-Y121 HydrophobicContact CE2-CD1 3.74Å; F112-Y121 HydrophobicContact CE2-CD2 4.06Å; F112-Y121 HydrophobicContact CE2-CE1 4.31Å; F112-Y121 AromaticContact CE2-CG 3.6Å; F112-Y121 HydrophobicContact CE2-CG 3.6Å; F112-Y121 HydrophobicContact CZ-CD1 4.21Å; F112-Y121 AromaticContact CZ-CD2 3.65Å; F112-Y121 HydrophobicContact CZ-CD2 3.65Å; F112-Y121 HydrophobicContact CZ-CE2 4.21Å; F112-Y121 AromaticContact CZ-CG 3.66Å; F112-Y121 HydrophobicContact CZ-CG 3.66Å; F112-I173 HydrophobicContact CE2-CG2 4.1Å; F112-N177 HydrophobicContact CD2-CB 4.08Å; F112-N177 WeakPolarHBondContact CD2-OD1 3.32Å; F112-N177 PolarHBondContact N-OD1 3Å
113	T	76.8	Confident	84.3	Confident	77 Å²	77	64 Å²	64	47%	0.472	34%	0.342	S	S	.	.			trans	-72	-34.5	176.8	52.4	0	0	0	0	111.3	S111	S111-T113 PolarHBondContact O-N 3.14Å
114	N	81.3	Confident	84.5	Confident	81 Å²	81	61.6 Å²	61.6	43%	0.433	33%	0.33	S	S	.	.	S	Bend	trans	-85.7	133.3	-179.7	-170	-6.2	0	0	0	112.3	E116 D117 K118	N114-E116 VanDerWaalsContact C-N 3.25Å; N114-E116 PolarHBondContact O-N 3.08Å; N114-E116 PolarHBondContact OD1-N 2.87Å; N114-D117 HydrophobicContact CB-CB 4.29Å; N114-D117 PolarHBondContact O-N 3.38Å; N114-K118 PolarHBondContact O-N 3.28Å
115	K	82.1	Confident	84.7	Confident	61 Å²	61	58.9 Å²	58.9	27%	0.265	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-36.9	172.9	-68.4	-175.1	-179	-179.6	0	111.8	D117 K118 F119 K339 S342 F343	K115-D117 PolarHBondContact O-N 2.97Å; K115-K118 WeakPolarHBondContact O-CB 3.19Å; K115-K118 PolarHBondContact O-N 3.05Å; K115-F119 PolarHBondContact O-N 3.08Å; K115-K339 PolarHBondContact NZ-O 3.33Å; K115-K339 VanDerWaalsContact NZ-O 3.16Å; K115-S342 VanDerWaalsContact CD-O 3.3Å; K115-S342 WeakPolarHBondContact CD-O 3.35Å; K115-S342 PolarHBondContact NZ-O 3.46Å; K115-F343 HydrophobicContact CB-CD1 3.66Å; K115-F343 HydrophobicContact CB-CE1 3.69Å
116	E	85.7	Confident	85.1	Confident	56 Å²	56	56.2 Å²	56.2	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-65.8	-38.3	179.5	-172.6	60.8	-153.2	0	0	111.7	N114 K118 F119 R120 R241	N114-E116 VanDerWaalsContact C-N 3.25Å; N114-E116 PolarHBondContact O-N 3.08Å; N114-E116 PolarHBondContact OD1-N 2.87Å; E116-K118 VanDerWaalsContact C-N 3.35Å; E116-K118 PolarHBondContact O-N 2.97Å; E116-F119 PolarHBondContact O-N 3.2Å; E116-R120 WeakPolarHBondContact O-CB 3.44Å; E116-R120 PolarHBondContact O-N 3.09Å; E116-R241 VanDerWaalsContact CD-NH2 3.31Å; E116-R241 IonicContact OE1-CZ 3.39Å; E116-R241 IonicContact OE1-NH1 2.86Å; E116-R241 PolarHBondContact OE1-NH1 3.49Å; E116-R241 IonicContact OE1-NH2 3.03Å; E116-R241 PolarHBondContact OE1-NH2 2.79Å; E116-R241 IonicContact OE2-CZ 3.39Å; E116-R241 IonicContact OE2-NH1 3.51Å; E116-R241 IonicContact OE2-NH2 2.87Å; E116-R241 PolarHBondContact OE2-NH2 3.19Å
117	D	88	Confident	85.5	Confident	41 Å²	41	61 Å²	61	22%	0.219	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-39.7	177.8	-66.2	-18.7	0	0	0	111.2	F112 N114 K115 F119 R120 Y121	F112-D117 HydrophobicContact CB-CB 4.14Å; F112-D117 HydrophobicContact CD1-CB 4.03Å; F112-D117 HydrophobicContact CG-CB 4.31Å; N114-D117 HydrophobicContact CB-CB 4.29Å; N114-D117 PolarHBondContact O-N 3.38Å; K115-D117 PolarHBondContact O-N 2.97Å; D117-F119 PolarHBondContact O-N 2.87Å; D117-R120 PolarHBondContact O-N 2.84Å; D117-R120 IonicContact OD1-CZ 3.12Å; D117-R120 IonicContact OD1-NH1 2.73Å; D117-R120 PolarHBondContact OD1-NH1 3.31Å; D117-R120 IonicContact OD1-NH2 3.9Å; D117-R120 PolarHBondContact OD1-NH2 2.7Å; D117-Y121 VanDerWaalsContact O-CB 3.29Å; D117-Y121 WeakPolarHBondContact O-CB 3.49Å; D117-Y121 PolarHBondContact O-N 3.39Å
118	K	88.1	Confident	86.3	Confident	44 Å²	44	57.7 Å²	57.7	19%	0.191	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-44.9	172.6	-65.9	-176.9	-176.3	-164.1	0	111.9	D91 F112 N114 K115 E116 K122 N177	D91-K118 PolarHBondContact O-NZ 3.11Å; F112-K118 HydrophobicContact CB-CG 3.58Å; F112-K118 HydrophobicContact CD2-CG 4.3Å; F112-K118 HydrophobicContact CG-CG 4.34Å; F112-K118 WeakPolarHBondContact O-CE 3.31Å; N114-K118 PolarHBondContact O-N 3.28Å; K115-K118 WeakPolarHBondContact O-CB 3.19Å; K115-K118 PolarHBondContact O-N 3.05Å; E116-K118 VanDerWaalsContact C-N 3.35Å; E116-K118 PolarHBondContact O-N 2.97Å; K118-K122 WeakPolarHBondContact O-CB 3.32Å; K118-K122 PolarHBondContact O-N 3.46Å; K118-N177 PolarHBondContact NZ-O 2.99Å
119	F	88.7	Confident	87.2	Confident	13 Å²	13	54.3 Å²	54.3	6%	0.057	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-47.4	177.3	-179	-86	0	0	0	111.1	K115 E116 D117 Y121 K122 N123 L237 Y238 R241 F343	K115-F119 PolarHBondContact O-N 3.08Å; E116-F119 PolarHBondContact O-N 3.2Å; D117-F119 PolarHBondContact O-N 2.87Å; F119-Y121 PolarHBondContact O-N 2.79Å; F119-K122 PolarHBondContact O-N 3.29Å; F119-N123 WeakPolarHBondContact O-CB 3.31Å; F119-N123 PolarHBondContact O-N 2.91Å; F119-L237 HydrophobicContact CD2-CD1 3.84Å; F119-L237 HydrophobicContact CD2-CG 4.13Å; F119-L237 HydrophobicContact CE2-CD1 3.63Å; F119-L237 HydrophobicContact CE2-CD2 4.07Å; F119-L237 HydrophobicContact CE2-CG 3.46Å; F119-L237 VanDerWaalsContact CE2-CG 3.46Å; F119-L237 HydrophobicContact CZ-CD2 4.26Å; F119-L237 HydrophobicContact CZ-CG 3.97Å; F119-Y238 HydrophobicContact CE1-CE1 4.35Å; F119-Y238 HydrophobicContact CZ-CD1 4.16Å; F119-Y238 HydrophobicContact CZ-CE1 4.05Å; F119-R241 HydrophobicContact CD2-CB 4.31Å; F119-R241 HydrophobicContact CE2-CB 3.68Å; F119-R241 HydrophobicContact CE2-CG 4.17Å; F119-R241 HydrophobicContact CZ-CB 4.25Å; F119-R241 VanDerWaalsContact CZ-CD 3.45Å; F119-R241 HydrophobicContact CZ-CG 4.47Å; F119-F343 HydrophobicContact CB-CE1 4.31Å; F119-F343 HydrophobicContact CB-CZ 4.13Å; F119-F343 HydrophobicContact CD2-CZ 4.35Å; F119-F343 HydrophobicContact CG-CZ 4.41Å
120	R	91.1	Very high	88.3	Confident	138 Å²	138	50 Å²	50	52%	0.521	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-46.4	179.2	-174.4	171.7	68.3	-107.5	0.3	111.4	E116 D117 K122 N123 D124	E116-R120 WeakPolarHBondContact O-CB 3.44Å; E116-R120 PolarHBondContact O-N 3.09Å; D117-R120 PolarHBondContact O-N 2.84Å; D117-R120 IonicContact OD1-CZ 3.12Å; D117-R120 IonicContact OD1-NH1 2.73Å; D117-R120 PolarHBondContact OD1-NH1 3.31Å; D117-R120 IonicContact OD1-NH2 3.9Å; D117-R120 PolarHBondContact OD1-NH2 2.7Å; R120-K122 VanDerWaalsContact C-N 3.35Å; R120-K122 PolarHBondContact O-N 3.42Å; R120-N123 PolarHBondContact O-N 3.14Å; R120-D124 PolarHBondContact O-N 2.96Å
121	Y	93.3	Very high	89.3	Confident	41 Å²	41	53.2 Å²	53.2	16%	0.161	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-40.5	177.1	-176	-99.8	0	0	0	112	F112 D117 F119 D124 Y125 I173 L174	F112-Y121 AromaticContact CE2-CD1 3.74Å; F112-Y121 HydrophobicContact CE2-CD1 3.74Å; F112-Y121 HydrophobicContact CE2-CD2 4.06Å; F112-Y121 HydrophobicContact CE2-CE1 4.31Å; F112-Y121 AromaticContact CE2-CG 3.6Å; F112-Y121 HydrophobicContact CE2-CG 3.6Å; F112-Y121 HydrophobicContact CZ-CD1 4.21Å; F112-Y121 AromaticContact CZ-CD2 3.65Å; F112-Y121 HydrophobicContact CZ-CD2 3.65Å; F112-Y121 HydrophobicContact CZ-CE2 4.21Å; F112-Y121 AromaticContact CZ-CG 3.66Å; F112-Y121 HydrophobicContact CZ-CG 3.66Å; D117-Y121 VanDerWaalsContact O-CB 3.29Å; D117-Y121 WeakPolarHBondContact O-CB 3.49Å; D117-Y121 PolarHBondContact O-N 3.39Å; F119-Y121 PolarHBondContact O-N 2.79Å; Y121-D124 PolarHBondContact O-N 3.35Å; Y121-Y125 WeakPolarHBondContact O-CB 3.48Å; Y121-Y125 PolarHBondContact O-N 3.39Å; Y121-I173 HydrophobicContact CD1-CG2 4.46Å; Y121-I173 HydrophobicContact CE1-CB 4.14Å; Y121-I173 HydrophobicContact CE1-CG2 3.63Å; Y121-I173 HydrophobicContact CE2-CG2 4.4Å; Y121-I173 WeakPolarHBondContact OH-CB 3.48Å; Y121-I173 WeakPolarHBondContact OH-CD1 2.99Å; Y121-L174 HydrophobicContact CD1-CD2 3.59Å; Y121-L174 HydrophobicContact CD1-CG 4.24Å; Y121-L174 HydrophobicContact CE1-CD2 3.77Å; Y121-L174 HydrophobicContact CE1-CG 3.88Å
122	K	92.8	Very high	90.1	Very high	50 Å²	50	52.8 Å²	52.8	22%	0.217	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-41.6	175.4	-174.4	171.5	176.5	177.5	0	112.5	K118 F119 R120 Y125 E126 L174 L237	K118-K122 WeakPolarHBondContact O-CB 3.32Å; K118-K122 PolarHBondContact O-N 3.46Å; F119-K122 PolarHBondContact O-N 3.29Å; R120-K122 VanDerWaalsContact C-N 3.35Å; R120-K122 PolarHBondContact O-N 3.42Å; K122-Y125 PolarHBondContact O-N 3.17Å; K122-E126 PolarHBondContact O-N 3.23Å; K122-E126 VanDerWaalsContact O-N 3.1Å; K122-L174 HydrophobicContact CB-CD2 4.25Å; K122-L237 HydrophobicContact CB-CD2 4.48Å; K122-L237 HydrophobicContact CD-CD1 3.84Å; K122-L237 HydrophobicContact CD-CD2 4.29Å; K122-L237 HydrophobicContact CG-CD1 4.49Å; K122-L237 HydrophobicContact CG-CD2 4.07Å
123	N	93.3	Very high	90.8	Very high	17 Å²	17	50.7 Å²	50.7	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-40.7	174.9	-177.2	55.3	0	0	0	111.3	F119 R120 E126 R127 I234 L237 Y238	F119-N123 WeakPolarHBondContact O-CB 3.31Å; F119-N123 PolarHBondContact O-N 2.91Å; R120-N123 PolarHBondContact O-N 3.14Å; N123-E126 PolarHBondContact O-N 3.44Å; N123-R127 PolarHBondContact ND2-NE 2.88Å; N123-R127 WeakPolarHBondContact O-CB 3.36Å; N123-R127 VanDerWaalsContact O-CG 3.32Å; N123-R127 WeakPolarHBondContact O-CG 3.28Å; N123-R127 PolarHBondContact O-N 3.36Å; N123-I234 WeakPolarHBondContact OD1-CD1 3.38Å; N123-L237 HydrophobicContact CB-CD2 4.39Å; N123-Y238 PolarHBondContact ND2-OH 3.1Å; N123-Y238 PolarHBondContact OD1-OH 3.3Å
124	D	94.5	Very high	91.7	Very high	74 Å²	74	48.9 Å²	48.9	40%	0.396	23%	0.232	S	C	.	.	H	α-helix	trans	-63.2	-43.1	173.6	-174	74.4	0	0	0	112.3	R120 Y121 E126 R127 F128 R170	R120-D124 PolarHBondContact O-N 2.96Å; Y121-D124 PolarHBondContact O-N 3.35Å; D124-E126 PolarHBondContact O-N 3.43Å; D124-R127 PolarHBondContact O-N 2.99Å; D124-F128 WeakPolarHBondContact O-CB 3.2Å; D124-F128 PolarHBondContact O-N 3.1Å; D124-R170 IonicContact OD2-CZ 2.68Å; D124-R170 IonicContact OD2-NH1 3.11Å; D124-R170 PolarHBondContact OD2-NH1 2.83Å; D124-R170 IonicContact OD2-NH2 2.65Å
125	Y	94.6	Very high	92.4	Very high	10 Å²	10	48.7 Å²	48.7	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-46.6	175	161	-96.1	0	0	0	112.4	Y121 K122 F128 K129 L167 R170 E171 L174	Y121-Y125 WeakPolarHBondContact O-CB 3.48Å; Y121-Y125 PolarHBondContact O-N 3.39Å; K122-Y125 PolarHBondContact O-N 3.17Å; Y125-F128 PolarHBondContact O-N 2.94Å; Y125-K129 VanDerWaalsContact CE1-NZ 3.28Å; Y125-K129 VanDerWaalsContact CZ-CE 3.48Å; Y125-K129 PolarHBondContact O-N 3.22Å; Y125-K129 WeakPolarHBondContact OH-CE 3.43Å; Y125-K129 PolarHBondContact OH-NZ 3.33Å; Y125-L167 HydrophobicContact CE2-CD2 3.87Å; Y125-R170 HydrophobicContact CD2-CB 3.8Å; Y125-R170 HydrophobicContact CE2-CB 4.29Å; Y125-E171 HydrophobicContact CE2-CG 3.75Å; Y125-E171 PolarHBondContact OH-OE1 2.86Å; Y125-L174 HydrophobicContact CD1-CD1 3.72Å; Y125-L174 HydrophobicContact CD2-CD1 4.07Å; Y125-L174 HydrophobicContact CE1-CD1 3.98Å; Y125-L174 HydrophobicContact CE2-CD1 4.3Å; Y125-L174 HydrophobicContact CG-CD1 3.76Å
126	E	93.5	Very high	93	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.047	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-38	177.7	-63.6	-60.4	169.2	0	0	111.6	K122 N123 D124 K129 I130 F230 I234	K122-E126 PolarHBondContact O-N 3.23Å; K122-E126 VanDerWaalsContact O-N 3.1Å; N123-E126 PolarHBondContact O-N 3.44Å; D124-E126 PolarHBondContact O-N 3.43Å; E126-K129 WeakPolarHBondContact O-CB 3.48Å; E126-K129 PolarHBondContact O-N 2.93Å; E126-K129 IonicContact OE1-NZ 2.91Å; E126-K129 IonicContact OE2-NZ 3.66Å; E126-K129 PolarHBondContact OE2-NZ 3.36Å; E126-I130 PolarHBondContact O-N 2.96Å; E126-I130 VanDerWaalsContact O-N 3.15Å; E126-F230 HydrophobicContact CB-CD2 3.97Å; E126-F230 HydrophobicContact CB-CE2 3.85Å; E126-F230 WeakPolarHBondContact O-CD2 3.2Å; E126-F230 VanDerWaalsContact O-CE2 3.27Å; E126-F230 WeakPolarHBondContact O-CE2 3.34Å; E126-I234 HydrophobicContact CB-CD1 3.74Å; E126-I234 HydrophobicContact CB-CG1 4.09Å; E126-I234 HydrophobicContact CG-CD1 4.17Å
127	R	93.8	Very high	93.4	Very high	132 Å²	132	44.4 Å²	44.4	50%	0.498	22%	0.216	S	C	.	.	H	α-helix	trans	-62.4	-45.8	174.4	-76.6	177.8	179	-172.3	-1.1	112.2	N123 D124 K129 I130 I131	N123-R127 PolarHBondContact ND2-NE 2.88Å; N123-R127 WeakPolarHBondContact O-CB 3.36Å; N123-R127 VanDerWaalsContact O-CG 3.32Å; N123-R127 WeakPolarHBondContact O-CG 3.28Å; N123-R127 PolarHBondContact O-N 3.36Å; D124-R127 PolarHBondContact O-N 2.99Å; R127-K129 VanDerWaalsContact C-N 3.32Å; R127-K129 PolarHBondContact O-N 3.4Å; R127-I130 WeakPolarHBondContact O-CG2 3.43Å; R127-I130 PolarHBondContact O-N 3.21Å; R127-I131 WeakPolarHBondContact O-CD1 3.43Å; R127-I131 VanDerWaalsContact O-CG1 3.25Å; R127-I131 WeakPolarHBondContact O-CG1 3.47Å; R127-I131 PolarHBondContact O-N 3.28Å
128	F	94.9	Very high	93.7	Very high	25 Å²	25	48.5 Å²	48.5	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-57.2	-47.2	175.3	169.4	-97.8	0	0	0	111.3	D124 Y125 I130 I131 I132 W162 Y163 T166 L167	D124-F128 WeakPolarHBondContact O-CB 3.2Å; D124-F128 PolarHBondContact O-N 3.1Å; Y125-F128 PolarHBondContact O-N 2.94Å; F128-I130 VanDerWaalsContact C-N 3.33Å; F128-I130 PolarHBondContact O-N 3.49Å; F128-I131 PolarHBondContact O-N 3.16Å; F128-I132 HydrophobicContact CD2-CG1 4.03Å; F128-I132 HydrophobicContact CE1-CG1 4.3Å; F128-I132 HydrophobicContact CE2-CD1 4.14Å; F128-I132 HydrophobicContact CE2-CG1 3.61Å; F128-I132 HydrophobicContact CZ-CG1 3.76Å; F128-I132 WeakPolarHBondContact O-CG1 3.4Å; F128-I132 PolarHBondContact O-N 3.15Å; F128-W162 AromaticContact CE2-CH2 3.97Å; F128-W162 HydrophobicContact CE2-CH2 3.97Å; F128-W162 HydrophobicContact CZ-CH2 4.03Å; F128-W162 HydrophobicContact CZ-CZ3 4.36Å; F128-Y163 HydrophobicContact CE1-CD2 4.27Å; F128-Y163 HydrophobicContact CE1-CE2 4.28Å; F128-T166 HydrophobicContact CE1-CG2 3.89Å; F128-T166 HydrophobicContact CE2-CG2 4.33Å; F128-T166 HydrophobicContact CZ-CG2 3.52Å; F128-L167 HydrophobicContact CD1-CD2 4.44Å; F128-L167 HydrophobicContact CE1-CD2 4.3Å
129	K	94.2	Very high	94	Very high	37 Å²	37	48.7 Å²	48.7	16%	0.161	24%	0.235	C	C	.	.	H	α-helix	trans	-56.4	-46.3	179.2	-170.8	-171.4	-66.4	159.9	0	111.8	Y125 E126 R127 S133 Y163 L167	Y125-K129 VanDerWaalsContact CE1-NZ 3.28Å; Y125-K129 VanDerWaalsContact CZ-CE 3.48Å; Y125-K129 PolarHBondContact O-N 3.22Å; Y125-K129 WeakPolarHBondContact OH-CE 3.43Å; Y125-K129 PolarHBondContact OH-NZ 3.33Å; E126-K129 WeakPolarHBondContact O-CB 3.48Å; E126-K129 PolarHBondContact O-N 2.93Å; E126-K129 IonicContact OE1-NZ 2.91Å; E126-K129 IonicContact OE2-NZ 3.66Å; E126-K129 PolarHBondContact OE2-NZ 3.36Å; R127-K129 VanDerWaalsContact C-N 3.32Å; R127-K129 PolarHBondContact O-N 3.4Å; K129-S133 WeakPolarHBondContact O-CB 3.41Å; K129-S133 PolarHBondContact O-N 3.29Å; K129-S133 PolarHBondContact O-OG 2.93Å; K129-Y163 VanDerWaalsContact CG-OH 3.3Å; K129-Y163 WeakPolarHBondContact CG-OH 3.37Å; K129-L167 HydrophobicContact CG-CD2 4.43Å
130	I	94.8	Very high	94.2	Very high	33 Å²	33	48.1 Å²	48.1	17%	0.169	23%	0.233	C	C	.	.	H	α-helix	trans	-72.7	-36.2	-178.4	-165.7	58.7	0	0	0	112.9	E126 R127 F128 S133 G134 F227 F230	E126-I130 PolarHBondContact O-N 2.96Å; E126-I130 VanDerWaalsContact O-N 3.15Å; R127-I130 WeakPolarHBondContact O-CG2 3.43Å; R127-I130 PolarHBondContact O-N 3.21Å; F128-I130 VanDerWaalsContact C-N 3.33Å; F128-I130 PolarHBondContact O-N 3.49Å; I130-S133 PolarHBondContact O-N 3.1Å; I130-G134 PolarHBondContact O-N 3.47Å; I130-F227 HydrophobicContact CD1-CB 4.13Å; I130-F227 HydrophobicContact CD1-CD2 3.89Å; I130-F227 HydrophobicContact CD1-CG 4.44Å; I130-F227 HydrophobicContact CG1-CD2 4.47Å; I130-F230 HydrophobicContact CB-CB 4.46Å; I130-F230 HydrophobicContact CB-CD1 4.13Å; I130-F230 HydrophobicContact CB-CD2 3.86Å; I130-F230 HydrophobicContact CB-CE1 4.35Å; I130-F230 HydrophobicContact CB-CE2 4.08Å; I130-F230 HydrophobicContact CB-CG 3.87Å; I130-F230 HydrophobicContact CB-CZ 4.32Å; I130-F230 HydrophobicContact CD1-CB 4.17Å; I130-F230 HydrophobicContact CD1-CD1 4.33Å; I130-F230 HydrophobicContact CD1-CG 4.27Å; I130-F230 HydrophobicContact CG1-CB 4.49Å; I130-F230 HydrophobicContact CG1-CD1 3.92Å; I130-F230 HydrophobicContact CG1-CE1 4.27Å; I130-F230 HydrophobicContact CG1-CG 4.05Å; I130-F230 HydrophobicContact CG2-CD1 4.32Å; I130-F230 HydrophobicContact CG2-CD2 3.99Å; I130-F230 HydrophobicContact CG2-CE1 4.04Å; I130-F230 HydrophobicContact CG2-CE2 3.67Å; I130-F230 HydrophobicContact CG2-CG 4.3Å; I130-F230 HydrophobicContact CG2-CZ 3.7Å
131	I	96	Very high	94.3	Very high	107 Å²	107	45.8 Å²	45.8	55%	0.549	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-51.3	176.5	-69.1	164.9	0	0	0	109.8	R127 F128 G134 I135	R127-I131 WeakPolarHBondContact O-CD1 3.43Å; R127-I131 VanDerWaalsContact O-CG1 3.25Å; R127-I131 WeakPolarHBondContact O-CG1 3.47Å; R127-I131 PolarHBondContact O-N 3.28Å; F128-I131 PolarHBondContact O-N 3.16Å; I131-G134 PolarHBondContact O-N 3.49Å; I131-I135 HydrophobicContact CG2-CD1 4.27Å; I131-I135 WeakPolarHBondContact O-CG1 3.4Å; I131-I135 PolarHBondContact O-N 2.92Å
132	I	95.6	Very high	94.3	Very high	15 Å²	15	46.5 Å²	46.5	8%	0.077	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-39.8	-179.8	-56.7	-54.6	0	0	0	111.2	F128 G134 I135 C136 W162 Y163	F128-I132 HydrophobicContact CD2-CG1 4.03Å; F128-I132 HydrophobicContact CE1-CG1 4.3Å; F128-I132 HydrophobicContact CE2-CD1 4.14Å; F128-I132 HydrophobicContact CE2-CG1 3.61Å; F128-I132 HydrophobicContact CZ-CG1 3.76Å; F128-I132 WeakPolarHBondContact O-CG1 3.4Å; F128-I132 PolarHBondContact O-N 3.15Å; I132-G134 VanDerWaalsContact C-N 3.26Å; I132-G134 PolarHBondContact O-N 3.1Å; I132-I135 HydrophobicContact CD1-CD1 4.16Å; I132-I135 PolarHBondContact O-N 2.94Å; I132-I135 VanDerWaalsContact O-N 3.17Å; I132-C136 WeakPolarHBondContact O-CB 3.04Å; I132-C136 PolarHBondContact O-N 3.37Å; I132-C136 PolarHBondContact O-SG 2.7Å; I132-C136 VanDerWaalsContact O-SG 3.32Å; I132-W162 HydrophobicContact CD1-CH2 4.07Å; I132-W162 HydrophobicContact CD1-CZ3 3.87Å; I132-W162 HydrophobicContact CG1-CH2 4.49Å; I132-W162 HydrophobicContact CG1-CZ3 4.17Å; I132-W162 HydrophobicContact CG2-CZ3 4.29Å; I132-Y163 HydrophobicContact CB-CD2 3.79Å; I132-Y163 HydrophobicContact CB-CE2 3.8Å; I132-Y163 HydrophobicContact CG1-CD2 4.36Å; I132-Y163 HydrophobicContact CG2-CD2 3.31Å; I132-Y163 HydrophobicContact CG2-CE2 3.78Å; I132-Y163 HydrophobicContact CG2-CG 3.72Å
133	S	94.5	Very high	94.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-36.9	173.9	-60.8	0	0	0	0	111.9	K129 I130 C136 A137 Y163 N223 H226	K129-S133 WeakPolarHBondContact O-CB 3.41Å; K129-S133 PolarHBondContact O-N 3.29Å; K129-S133 PolarHBondContact O-OG 2.93Å; I130-S133 PolarHBondContact O-N 3.1Å; S133-C136 PolarHBondContact O-N 3.17Å; S133-A137 VanDerWaalsContact O-CB 3.31Å; S133-A137 WeakPolarHBondContact O-CB 3.37Å; S133-A137 PolarHBondContact O-N 3.47Å; S133-Y163 PolarHBondContact OG-OH 3.21Å; S133-Y163 VanDerWaalsContact OG-OH 3.14Å; S133-N223 WeakPolarHBondContact CA-OD1 3.35Å; S133-N223 WeakPolarHBondContact CB-OD1 3.29Å; S133-N223 PolarHBondContact O-OD1 2.8Å; S133-N223 VanDerWaalsContact O-OD1 3.08Å; S133-H226 PolarHBondContact OG-ND1 3.36Å
134	G	95.2	Very high	94.1	Very high	39 Å²	39	47 Å²	47	40%	0.402	23%	0.233	S	C	.	.	H	α-helix	trans	-64	-43.9	173.7	0	0	0	0	0	112.8	I130 I131 I132 A137 F138	I130-G134 PolarHBondContact O-N 3.47Å; I131-G134 PolarHBondContact O-N 3.49Å; I132-G134 VanDerWaalsContact C-N 3.26Å; I132-G134 PolarHBondContact O-N 3.1Å; G134-A137 PolarHBondContact O-N 2.66Å; G134-F138 WeakPolarHBondContact O-CB 3.47Å; G134-F138 PolarHBondContact O-N 3.04Å
135	I	95.7	Very high	93.9	Very high	78 Å²	78	49.2 Å²	49.2	40%	0.4	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-46	174.1	-64.7	168	0	0	0	110.4	I131 I132 A137 F138 L139 L159	I131-I135 HydrophobicContact CG2-CD1 4.27Å; I131-I135 WeakPolarHBondContact O-CG1 3.4Å; I131-I135 PolarHBondContact O-N 2.92Å; I132-I135 HydrophobicContact CD1-CD1 4.16Å; I132-I135 PolarHBondContact O-N 2.94Å; I132-I135 VanDerWaalsContact O-N 3.17Å; I135-A137 PolarHBondContact O-N 2.95Å; I135-F138 PolarHBondContact O-N 3.22Å; I135-L139 HydrophobicContact CG2-CD1 3.94Å; I135-L139 HydrophobicContact CG2-CG 4.45Å; I135-L139 WeakPolarHBondContact O-CG 3.31Å; I135-L139 PolarHBondContact O-N 2.94Å; I135-L159 HydrophobicContact CG2-CD2 4.09Å
136	C	95.1	Very high	93.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-41.2	177.5	-69.5	0	0	0	0	112.1	I132 S133 L139 A140 F156	I132-C136 WeakPolarHBondContact O-CB 3.04Å; I132-C136 PolarHBondContact O-N 3.37Å; I132-C136 PolarHBondContact O-SG 2.7Å; I132-C136 VanDerWaalsContact O-SG 3.32Å; S133-C136 PolarHBondContact O-N 3.17Å; C136-L139 PolarHBondContact O-N 3.49Å; C136-A140 VanDerWaalsContact O-CB 3.25Å; C136-A140 WeakPolarHBondContact O-CB 3.48Å; C136-A140 PolarHBondContact O-N 3.04Å; C136-F156 HydrophobicContact CB-CE2 4.13Å; C136-F156 WeakPolarHBondContact O-CE2 3.38Å
137	A	94.7	Very high	93.4	Very high	27 Å²	27	57.8 Å²	57.8	22%	0.223	28%	0.281	C	S	.	.	H	α-helix	trans	-62.3	-45.3	176.5	0	0	0	0	0	111.5	S133 G134 I135 A140 F141 L220 N223	S133-A137 VanDerWaalsContact O-CB 3.31Å; S133-A137 WeakPolarHBondContact O-CB 3.37Å; S133-A137 PolarHBondContact O-N 3.47Å; G134-A137 PolarHBondContact O-N 2.66Å; I135-A137 PolarHBondContact O-N 2.95Å; A137-A140 PolarHBondContact O-N 3.37Å; A137-F141 WeakPolarHBondContact O-CB 3.19Å; A137-F141 PolarHBondContact O-N 3.04Å; A137-L220 WeakPolarHBondContact O-CD2 3.37Å; A137-N223 HydrophobicContact CB-CB 3.69Å
138	F	94.5	Very high	93	Very high	127 Å²	127	59 Å²	59	56%	0.557	29%	0.292	S	S	*	.	H	α-helix	trans	-62.7	-46	177.9	179.2	-104.4	0	0	0	111.7	G134 I135 F141 L142	G134-F138 WeakPolarHBondContact O-CB 3.47Å; G134-F138 PolarHBondContact O-N 3.04Å; I135-F138 PolarHBondContact O-N 3.22Å; F138-F141 WeakPolarHBondContact O-CB 3.36Å; F138-F141 PolarHBondContact O-N 3.09Å; F138-L142 HydrophobicContact CD1-CD1 4.02Å; F138-L142 HydrophobicContact CE1-CD1 3.39Å; F138-L142 HydrophobicContact CE1-CG 4.21Å; F138-L142 HydrophobicContact CE2-CD1 4.35Å; F138-L142 HydrophobicContact CE2-CG 4.42Å; F138-L142 HydrophobicContact CZ-CD1 3.6Å; F138-L142 HydrophobicContact CZ-CD2 4.41Å; F138-L142 HydrophobicContact CZ-CG 4.14Å; F138-L142 WeakPolarHBondContact O-CG 3.37Å; F138-L142 PolarHBondContact O-N 3.36Å
139	L	93.2	Very high	92.5	Very high	48 Å²	48	61.2 Å²	61.2	25%	0.251	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-44.4	176.8	-71.4	172.6	0	0	0	112.1	I135 C136 F141 L142 L143 F156 L159	I135-L139 HydrophobicContact CG2-CD1 3.94Å; I135-L139 HydrophobicContact CG2-CG 4.45Å; I135-L139 WeakPolarHBondContact O-CG 3.31Å; I135-L139 PolarHBondContact O-N 2.94Å; C136-L139 PolarHBondContact O-N 3.49Å; L139-F141 VanDerWaalsContact C-N 3.27Å; L139-F141 PolarHBondContact O-N 3.3Å; L139-L142 PolarHBondContact O-N 3.34Å; L139-L143 WeakPolarHBondContact O-CB 3.25Å; L139-L143 VanDerWaalsContact O-CG 3.31Å; L139-L143 WeakPolarHBondContact O-CG 3.33Å; L139-L143 PolarHBondContact O-N 3.24Å; L139-F156 HydrophobicContact CB-CD2 3.86Å; L139-F156 HydrophobicContact CB-CE2 4.18Å; L139-F156 HydrophobicContact CD1-CD2 4.36Å; L139-L159 HydrophobicContact CD1-CD2 3.54Å
140	A	92.6	Very high	92.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-36.9	176.1	0	0	0	0	0	111.7	C136 A137 L143 Y144 F156 L220	C136-A140 VanDerWaalsContact O-CB 3.25Å; C136-A140 WeakPolarHBondContact O-CB 3.48Å; C136-A140 PolarHBondContact O-N 3.04Å; A137-A140 PolarHBondContact O-N 3.37Å; A140-L143 PolarHBondContact O-N 3.21Å; A140-Y144 VanDerWaalsContact O-CB 3.28Å; A140-Y144 WeakPolarHBondContact O-CB 3.45Å; A140-Y144 PolarHBondContact O-N 2.96Å; A140-F156 HydrophobicContact CB-CE2 4.34Å; A140-F156 HydrophobicContact CB-CZ 4.02Å; A140-L220 HydrophobicContact CB-CD2 3.9Å; A140-L220 HydrophobicContact CB-CG 3.97Å
141	F	93.3	Very high	92	Very high	90 Å²	90	65.2 Å²	65.2	40%	0.395	32%	0.324	S	S	.	.	H	α-helix	trans	-64.5	-47.7	176	-179.1	-96.7	0	0	0	111.1	A137 F138 L139 L143 Y144 F145 F146 L220	A137-F141 WeakPolarHBondContact O-CB 3.19Å; A137-F141 PolarHBondContact O-N 3.04Å; F138-F141 WeakPolarHBondContact O-CB 3.36Å; F138-F141 PolarHBondContact O-N 3.09Å; L139-F141 VanDerWaalsContact C-N 3.27Å; L139-F141 PolarHBondContact O-N 3.3Å; F141-L143 PolarHBondContact O-N 3.32Å; F141-Y144 PolarHBondContact O-N 3.43Å; F141-F145 HydrophobicContact CD1-CD2 4.44Å; F141-F145 AromaticContact CD2-CD2 3.51Å; F141-F145 HydrophobicContact CD2-CD2 3.51Å; F141-F145 AromaticContact CD2-CE2 3.46Å; F141-F145 HydrophobicContact CD2-CE2 3.46Å; F141-F145 VanDerWaalsContact CD2-CE2 3.46Å; F141-F145 HydrophobicContact CE1-CD2 4.33Å; F141-F145 AromaticContact CE2-CD2 3.37Å; F141-F145 HydrophobicContact CE2-CD2 3.37Å; F141-F145 AromaticContact CE2-CE2 3.26Å; F141-F145 HydrophobicContact CE2-CE2 3.26Å; F141-F145 HydrophobicContact CE2-CG 4.47Å; F141-F145 HydrophobicContact CE2-CZ 4.3Å; F141-F145 HydrophobicContact CG-CD2 4.05Å; F141-F145 HydrophobicContact CG-CE2 4.41Å; F141-F145 AromaticContact CZ-CD2 3.81Å; F141-F145 HydrophobicContact CZ-CD2 3.81Å; F141-F145 HydrophobicContact CZ-CE2 4.11Å; F141-F145 WeakPolarHBondContact O-CD2 3.39Å; F141-F145 PolarHBondContact O-N 2.83Å; F141-F145 VanDerWaalsContact O-N 3.09Å; F141-F146 HydrophobicContact CD1-CE2 4.48Å; F141-F146 AromaticContact CE1-CE2 3.88Å; F141-F146 HydrophobicContact CE1-CE2 3.88Å; F141-L220 HydrophobicContact CB-CD2 3.86Å
142	L	93.1	Very high	91.8	Very high	56 Å²	56	62.4 Å²	62.4	29%	0.293	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-42.4	177	-69.4	-177.9	0	0	0	112.5	F138 L139 Y144 F146 V147	F138-L142 HydrophobicContact CD1-CD1 4.02Å; F138-L142 HydrophobicContact CE1-CD1 3.39Å; F138-L142 HydrophobicContact CE1-CG 4.21Å; F138-L142 HydrophobicContact CE2-CD1 4.35Å; F138-L142 HydrophobicContact CE2-CG 4.42Å; F138-L142 HydrophobicContact CZ-CD1 3.6Å; F138-L142 HydrophobicContact CZ-CD2 4.41Å; F138-L142 HydrophobicContact CZ-CG 4.14Å; F138-L142 WeakPolarHBondContact O-CG 3.37Å; F138-L142 PolarHBondContact O-N 3.36Å; L139-L142 PolarHBondContact O-N 3.34Å; L142-Y144 VanDerWaalsContact C-N 3.34Å; L142-F146 HydrophobicContact CD2-CD2 3.98Å; L142-F146 HydrophobicContact CD2-CE2 4.42Å; L142-F146 PolarHBondContact O-N 3.43Å; L142-V147 PolarHBondContact O-N 3.48Å
143	L	91.5	Very high	91.6	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-68.2	-31.4	179.1	-76.7	176.5	0	0	0	113.5	L139 A140 F141 V147 V152 D153 F156 R212 M216	L139-L143 WeakPolarHBondContact O-CB 3.25Å; L139-L143 VanDerWaalsContact O-CG 3.31Å; L139-L143 WeakPolarHBondContact O-CG 3.33Å; L139-L143 PolarHBondContact O-N 3.24Å; A140-L143 PolarHBondContact O-N 3.21Å; F141-L143 PolarHBondContact O-N 3.32Å; L143-V147 HydrophobicContact CD2-CB 4.3Å; L143-V147 HydrophobicContact CD2-CG1 4.31Å; L143-V152 HydrophobicContact CD1-CG1 4.46Å; L143-V152 HydrophobicContact CD2-CB 3.61Å; L143-V152 HydrophobicContact CD2-CG1 3.36Å; L143-V152 HydrophobicContact CG-CG1 4.14Å; L143-D153 WeakPolarHBondContact CD2-OD1 3.45Å; L143-F156 HydrophobicContact CD1-CB 3.6Å; L143-F156 HydrophobicContact CD1-CD1 4.19Å; L143-F156 HydrophobicContact CD1-CD2 4.41Å; L143-F156 HydrophobicContact CD1-CG 3.83Å; L143-R212 PolarHBondContact O-NH1 3.07Å; L143-R212 PolarHBondContact O-NH2 2.92Å; L143-M216 HydrophobicContact CB-CE 4.13Å; L143-M216 HydrophobicContact CB-SD 4.01Å; L143-M216 HydrophobicContact CD1-CE 3.78Å; L143-M216 HydrophobicContact CD1-SD 4.18Å
144	Y	90.9	Very high	91.5	Very high	76 Å²	76	64 Å²	64	30%	0.298	32%	0.322	S	S	.	.	H	α-helix	trans	-77.3	-47.1	178.2	-173	-104.9	0	0	0	111.9	A140 F141 L142 D213 M216 L217	A140-Y144 VanDerWaalsContact O-CB 3.28Å; A140-Y144 WeakPolarHBondContact O-CB 3.45Å; A140-Y144 PolarHBondContact O-N 2.96Å; F141-Y144 PolarHBondContact O-N 3.43Å; L142-Y144 VanDerWaalsContact C-N 3.34Å; Y144-D213 HydrophobicContact CE2-CB 4.2Å; Y144-M216 HydrophobicContact CD2-CB 3.85Å; Y144-M216 HydrophobicContact CG-CB 4.45Å; Y144-L217 HydrophobicContact CE2-CB 4.43Å
145	F	91	Very high	91.4	Very high	120 Å²	120	67.2 Å²	67.2	53%	0.526	33%	0.329	S	S	.	.	H	α-helix	trans	-93.2	-32	-171.3	-70.9	-72.2	0	0	0	115.2	F141	F141-F145 HydrophobicContact CD1-CD2 4.44Å; F141-F145 AromaticContact CD2-CD2 3.51Å; F141-F145 HydrophobicContact CD2-CD2 3.51Å; F141-F145 AromaticContact CD2-CE2 3.46Å; F141-F145 HydrophobicContact CD2-CE2 3.46Å; F141-F145 VanDerWaalsContact CD2-CE2 3.46Å; F141-F145 HydrophobicContact CE1-CD2 4.33Å; F141-F145 AromaticContact CE2-CD2 3.37Å; F141-F145 HydrophobicContact CE2-CD2 3.37Å; F141-F145 AromaticContact CE2-CE2 3.26Å; F141-F145 HydrophobicContact CE2-CE2 3.26Å; F141-F145 HydrophobicContact CE2-CG 4.47Å; F141-F145 HydrophobicContact CE2-CZ 4.3Å; F141-F145 HydrophobicContact CG-CD2 4.05Å; F141-F145 HydrophobicContact CG-CE2 4.41Å; F141-F145 AromaticContact CZ-CD2 3.81Å; F141-F145 HydrophobicContact CZ-CD2 3.81Å; F141-F145 HydrophobicContact CZ-CE2 4.11Å; F141-F145 WeakPolarHBondContact O-CD2 3.39Å; F141-F145 PolarHBondContact O-N 2.83Å; F141-F145 VanDerWaalsContact O-N 3.09Å
146	F	91	Very high	91.4	Very high	147 Å²	147	63.6 Å²	63.6	65%	0.645	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	-33	-167.3	-60.3	-82.3	0	0	0	114.1	F141 L142	F141-F146 HydrophobicContact CD1-CE2 4.48Å; F141-F146 AromaticContact CE1-CE2 3.88Å; F141-F146 HydrophobicContact CE1-CE2 3.88Å; L142-F146 HydrophobicContact CD2-CD2 3.98Å; L142-F146 HydrophobicContact CD2-CE2 4.42Å; L142-F146 PolarHBondContact O-N 3.43Å
147	V	86.2	Confident	91.3	Very high	52 Å²	52	63.6 Å²	63.6	32%	0.315	31%	0.31	S	S	.	.			trans	-124.4	104.7	-167.7	-176.2	0	0	0	0	111.9	L142 L143 N149 V152 R212	L142-V147 PolarHBondContact O-N 3.48Å; L143-V147 HydrophobicContact CD2-CB 4.3Å; L143-V147 HydrophobicContact CD2-CG1 4.31Å; V147-N149 HydrophobicContact CG1-CB 3.84Å; V147-N149 PolarHBondContact O-N 3Å; V147-V152 HydrophobicContact CG1-CB 4.28Å; V147-V152 HydrophobicContact CG1-CG2 3.98Å; V147-R212 PolarHBondContact O-NH2 3.46Å
148	Q	84.7	Confident	91.4	Very high	159 Å²	159	68.7 Å²	68.7	74%	0.743	33%	0.328	S	S	*	.			trans	-97.7	66.5	170.2	-67.8	-176.8	-19.7	0	0	110.7
149	N	86	Confident	91.4	Very high	70 Å²	70	64.2 Å²	64.2	37%	0.374	31%	0.31	S	S	.	.			trans	-127.8	122	179.8	-173.9	-6.5	0	0	0	111.6	V147 I151 V152 D153	V147-N149 HydrophobicContact CG1-CB 3.84Å; V147-N149 PolarHBondContact O-N 3Å; N149-I151 PolarHBondContact O-N 2.87Å; N149-I151 VanDerWaalsContact O-N 3.16Å; N149-I151 PolarHBondContact OD1-N 2.89Å; N149-V152 HydrophobicContact CB-CG2 4.2Å; N149-V152 PolarHBondContact O-N 3.3Å; N149-D153 PolarHBondContact O-N 2.98Å; N149-D153 VanDerWaalsContact O-N 3.13Å
150	R	87.3	Confident	91.5	Very high	41 Å²	41	62.4 Å²	62.4	16%	0.155	30%	0.3	C	S	.	.	H	α-helix	trans	-55.5	-33.9	179.1	-176.9	65.9	-178	97.8	0.9	113.1	V152 D153 T154 L200 W202 Y208	R150-V152 VanDerWaalsContact C-N 3.33Å; R150-D153 PolarHBondContact O-N 3.43Å; R150-T154 PolarHBondContact NH1-OG1 3.47Å; R150-T154 PolarHBondContact O-N 2.85Å; R150-T154 PolarHBondContact O-OG1 3.11Å; R150-L200 PolarHBondContact NH2-O 3.05Å; R150-L200 VanDerWaalsContact NH2-O 3.12Å; R150-W202 PolarHBondContact NH2-O 2.87Å; R150-Y208 PolarHBondContact NH1-OH 3.2Å
151	I	89.9	Confident	91.7	Very high	114 Å²	114	63.9 Å²	63.9	59%	0.585	31%	0.309	S	S	*	.	H	α-helix	trans	-63	-43.9	179.5	-61.1	174.6	0	0	0	110.2	N149 T154 I155	N149-I151 PolarHBondContact O-N 2.87Å; N149-I151 VanDerWaalsContact O-N 3.16Å; N149-I151 PolarHBondContact OD1-N 2.89Å; I151-T154 WeakPolarHBondContact O-CB 3.48Å; I151-T154 PolarHBondContact O-N 3.12Å; I151-I155 HydrophobicContact CG2-CD1 4.46Å; I151-I155 WeakPolarHBondContact O-CG1 3.15Å; I151-I155 PolarHBondContact O-N 3.43Å; I151-I155 VanDerWaalsContact O-N 3.11Å
152	V	91.3	Very high	91.9	Very high	47 Å²	47	65 Å²	65	29%	0.285	31%	0.311	S	S	.	.	H	α-helix	trans	-71.4	-36.3	-179.8	-168.9	0	0	0	0	110.3	L143 V147 N149 R150 T154 I155 F156	L143-V152 HydrophobicContact CD1-CG1 4.46Å; L143-V152 HydrophobicContact CD2-CB 3.61Å; L143-V152 HydrophobicContact CD2-CG1 3.36Å; L143-V152 HydrophobicContact CG-CG1 4.14Å; V147-V152 HydrophobicContact CG1-CB 4.28Å; V147-V152 HydrophobicContact CG1-CG2 3.98Å; N149-V152 HydrophobicContact CB-CG2 4.2Å; N149-V152 PolarHBondContact O-N 3.3Å; R150-V152 VanDerWaalsContact C-N 3.33Å; V152-T154 VanDerWaalsContact C-N 3.32Å; V152-T154 PolarHBondContact O-N 3.26Å; V152-I155 PolarHBondContact O-N 3.12Å; V152-F156 PolarHBondContact O-N 2.71Å
153	D	91.6	Very high	92	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.011	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-42	171.6	-61.3	-19.2	0	0	0	111.3	L143 N149 R150 I155 F156 H157 Y208 R212 M216	L143-D153 WeakPolarHBondContact CD2-OD1 3.45Å; N149-D153 PolarHBondContact O-N 2.98Å; N149-D153 VanDerWaalsContact O-N 3.13Å; R150-D153 PolarHBondContact O-N 3.43Å; D153-I155 PolarHBondContact O-N 2.84Å; D153-F156 WeakPolarHBondContact O-CB 3.35Å; D153-F156 PolarHBondContact O-N 3.06Å; D153-H157 PolarHBondContact O-CD2 3.41Å; D153-H157 PolarHBondContact O-N 3.13Å; D153-Y208 WeakPolarHBondContact CB-OH 3.49Å; D153-R212 IonicContact OD1-CZ 3.98Å; D153-R212 IonicContact OD1-NE 3.78Å; D153-R212 PolarHBondContact OD1-NE 3.2Å; D153-R212 IonicContact OD1-NH2 3.64Å; D153-R212 PolarHBondContact OD1-NH2 3.17Å; D153-R212 IonicContact OD2-CZ 3.73Å; D153-R212 IonicContact OD2-NE 2.8Å; D153-R212 PolarHBondContact OD2-NE 3.08Å; D153-R212 IonicContact OD2-NH2 2.65Å; D153-M216 HydrophobicContact CB-CE 4.42Å; D153-M216 WeakPolarHBondContact OD1-CE 3.46Å
154	T	92.3	Very high	92.2	Very high	49 Å²	49	63.1 Å²	63.1	30%	0.301	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-42.6	175.6	-59.7	0	0	0	0	112	R150 I151 V152 F156 H157 F158 L200	R150-T154 PolarHBondContact NH1-OG1 3.47Å; R150-T154 PolarHBondContact O-N 2.85Å; R150-T154 PolarHBondContact O-OG1 3.11Å; I151-T154 WeakPolarHBondContact O-CB 3.48Å; I151-T154 PolarHBondContact O-N 3.12Å; V152-T154 VanDerWaalsContact C-N 3.32Å; V152-T154 PolarHBondContact O-N 3.26Å; T154-F156 VanDerWaalsContact C-N 3.3Å; T154-F156 PolarHBondContact O-N 2.9Å; T154-H157 PolarHBondContact O-N 3.41Å; T154-F158 WeakPolarHBondContact O-CB 3.37Å; T154-F158 PolarHBondContact O-N 3.42Å; T154-L200 HydrophobicContact CG2-CD1 3.6Å; T154-L200 WeakPolarHBondContact O-CD1 3.47Å
155	I	94	Very high	92.4	Very high	106 Å²	106	61.8 Å²	61.8	54%	0.544	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-41.8	176	-66.2	168.1	0	0	0	110.3	I151 V152 D153 F158 L159	I151-I155 HydrophobicContact CG2-CD1 4.46Å; I151-I155 WeakPolarHBondContact O-CG1 3.15Å; I151-I155 PolarHBondContact O-N 3.43Å; I151-I155 VanDerWaalsContact O-N 3.11Å; V152-I155 PolarHBondContact O-N 3.12Å; D153-I155 PolarHBondContact O-N 2.84Å; I155-F158 PolarHBondContact O-N 3.35Å; I155-L159 PolarHBondContact O-N 3.4Å
156	F	94.5	Very high	92.7	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-46	176.7	-179.4	-111.8	0	0	0	112.4	C136 L139 A140 L143 V152 D153 T154 F158 L159 L160 F215 M216	C136-F156 HydrophobicContact CB-CE2 4.13Å; C136-F156 WeakPolarHBondContact O-CE2 3.38Å; L139-F156 HydrophobicContact CB-CD2 3.86Å; L139-F156 HydrophobicContact CB-CE2 4.18Å; L139-F156 HydrophobicContact CD1-CD2 4.36Å; A140-F156 HydrophobicContact CB-CE2 4.34Å; A140-F156 HydrophobicContact CB-CZ 4.02Å; L143-F156 HydrophobicContact CD1-CB 3.6Å; L143-F156 HydrophobicContact CD1-CD1 4.19Å; L143-F156 HydrophobicContact CD1-CD2 4.41Å; L143-F156 HydrophobicContact CD1-CG 3.83Å; V152-F156 PolarHBondContact O-N 2.71Å; D153-F156 WeakPolarHBondContact O-CB 3.35Å; D153-F156 PolarHBondContact O-N 3.06Å; T154-F156 VanDerWaalsContact C-N 3.3Å; T154-F156 PolarHBondContact O-N 2.9Å; F156-F158 VanDerWaalsContact C-N 3.31Å; F156-F158 PolarHBondContact O-N 2.87Å; F156-L159 WeakPolarHBondContact O-CB 3.34Å; F156-L159 PolarHBondContact O-N 2.91Å; F156-L160 HydrophobicContact CD1-CD1 4.1Å; F156-L160 HydrophobicContact CE1-CD1 3.64Å; F156-L160 HydrophobicContact CE1-CG 4.25Å; F156-L160 HydrophobicContact CZ-CD1 3.99Å; F156-L160 HydrophobicContact CZ-CD2 4.23Å; F156-L160 HydrophobicContact CZ-CG 4.21Å; F156-L160 WeakPolarHBondContact O-CG 3.44Å; F156-L160 PolarHBondContact O-N 3.37Å; F156-F215 HydrophobicContact CD1-CE1 4.28Å; F156-F215 AromaticContact CE1-CE1 3.82Å; F156-F215 HydrophobicContact CE1-CE1 3.82Å; F156-F215 HydrophobicContact CE1-CZ 4.45Å; F156-M216 HydrophobicContact CD1-CE 4.24Å; F156-M216 HydrophobicContact CD1-SD 4.29Å; F156-M216 HydrophobicContact CE1-SD 4.17Å
157	H	94.6	Very high	92.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-39.8	175.3	-70	-54	0	0	0	112	D153 T154 L159 L160 V161 L200 Y208 F215	D153-H157 PolarHBondContact O-CD2 3.41Å; D153-H157 PolarHBondContact O-N 3.13Å; T154-H157 PolarHBondContact O-N 3.41Å; H157-L159 PolarHBondContact O-N 3.3Å; H157-L160 PolarHBondContact O-N 3.32Å; H157-V161 WeakPolarHBondContact O-CG2 3.39Å; H157-V161 PolarHBondContact O-N 3.35Å; H157-L200 HydrophobicContact CB-CB 4.23Å; H157-L200 HydrophobicContact CB-CD1 3.81Å; H157-Y208 PolarHBondContact NE2-OH 3.08Å; H157-F215 AromaticContact CE1-CD1 3.91Å; H157-F215 AromaticContact CE1-CE1 3.32Å; H157-F215 WeakPolarHBondContact CE1-CE1 3.3Å; H157-F215 AromaticContact CE1-CZ 3.85Å; H157-F215 AromaticContact ND1-CE1 3.89Å
158	F	95.2	Very high	93.2	Very high	134 Å²	134	48.1 Å²	48.1	59%	0.588	24%	0.239	S	C	*	.	H	α-helix	trans	-62.4	-42.2	175	-174.5	-96.3	0	0	0	111.9	T154 I155 F156 L160 V161 W162 L200	T154-F158 WeakPolarHBondContact O-CB 3.37Å; T154-F158 PolarHBondContact O-N 3.42Å; I155-F158 PolarHBondContact O-N 3.35Å; F156-F158 VanDerWaalsContact C-N 3.31Å; F156-F158 PolarHBondContact O-N 2.87Å; F158-L160 VanDerWaalsContact C-N 3.34Å; F158-L160 PolarHBondContact O-N 3.15Å; F158-V161 PolarHBondContact O-N 3.16Å; F158-W162 PolarHBondContact O-N 3.48Å; F158-L200 HydrophobicContact CB-CD1 4.19Å
159	L	96	Very high	93.6	Very high	34 Å²	34	42.6 Å²	42.6	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-41.9	174	179.2	66.8	0	0	0	111.7	I135 L139 I155 F156 H157 W162 Y163	I135-L159 HydrophobicContact CG2-CD2 4.09Å; L139-L159 HydrophobicContact CD1-CD2 3.54Å; I155-L159 PolarHBondContact O-N 3.4Å; F156-L159 WeakPolarHBondContact O-CB 3.34Å; F156-L159 PolarHBondContact O-N 2.91Å; H157-L159 PolarHBondContact O-N 3.3Å; L159-W162 HydrophobicContact CD1-CE3 3.9Å; L159-W162 HydrophobicContact CD1-CZ3 4.22Å; L159-W162 PolarHBondContact O-N 3.02Å; L159-Y163 VanDerWaalsContact O-CB 3.23Å; L159-Y163 WeakPolarHBondContact O-CB 3.23Å; L159-Y163 PolarHBondContact O-N 3.05Å
160	L	95.3	Very high	94	Very high	9 Å²	9	41.7 Å²	41.7	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-45	177.1	-70.3	177.6	0	0	0	112.2	F156 H157 F158 W162 Y163 Y164 F215	F156-L160 HydrophobicContact CD1-CD1 4.1Å; F156-L160 HydrophobicContact CE1-CD1 3.64Å; F156-L160 HydrophobicContact CE1-CG 4.25Å; F156-L160 HydrophobicContact CZ-CD1 3.99Å; F156-L160 HydrophobicContact CZ-CD2 4.23Å; F156-L160 HydrophobicContact CZ-CG 4.21Å; F156-L160 WeakPolarHBondContact O-CG 3.44Å; F156-L160 PolarHBondContact O-N 3.37Å; H157-L160 PolarHBondContact O-N 3.32Å; F158-L160 VanDerWaalsContact C-N 3.34Å; F158-L160 PolarHBondContact O-N 3.15Å; L160-W162 VanDerWaalsContact C-N 3.35Å; L160-W162 PolarHBondContact O-N 3.37Å; L160-Y163 PolarHBondContact O-N 3.02Å; L160-Y164 HydrophobicContact CB-CD2 4.47Å; L160-Y164 HydrophobicContact CB-CE2 4.39Å; L160-Y164 HydrophobicContact CD2-CE2 4.33Å; L160-Y164 WeakPolarHBondContact O-CD2 3.48Å; L160-Y164 PolarHBondContact O-N 3.41Å; L160-F215 HydrophobicContact CD1-CE1 4.24Å; L160-F215 HydrophobicContact CD1-CZ 3.7Å
161	V	96.4	Very high	94.2	Very high	32 Å²	32	40.2 Å²	40.2	19%	0.194	20%	0.201	C	C	.	.	H	α-helix	trans	-57.6	-49.7	175	173.4	0	0	0	0	110.3	H157 F158 Y163 C165 T193	H157-V161 WeakPolarHBondContact O-CG2 3.39Å; H157-V161 PolarHBondContact O-N 3.35Å; F158-V161 PolarHBondContact O-N 3.16Å; V161-Y163 VanDerWaalsContact C-N 3.33Å; V161-Y163 PolarHBondContact O-N 3.46Å; V161-C165 VanDerWaalsContact O-CB 3.32Å; V161-C165 WeakPolarHBondContact O-CB 3.18Å; V161-C165 PolarHBondContact O-N 2.88Å; V161-C165 PolarHBondContact O-SG 3.43Å; V161-C165 VanDerWaalsContact O-SG 3.35Å; V161-T193 HydrophobicContact CG1-CG2 4.21Å
162	W	96.8	Very high	94.3	Very high	113 Å²	113	38.5 Å²	38.5	43%	0.428	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-42.4	177.4	172.3	83.7	0	0	0	112.3	F128 I132 F158 L159 L160 T166	F128-W162 AromaticContact CE2-CH2 3.97Å; F128-W162 HydrophobicContact CE2-CH2 3.97Å; F128-W162 HydrophobicContact CZ-CH2 4.03Å; F128-W162 HydrophobicContact CZ-CZ3 4.36Å; I132-W162 HydrophobicContact CD1-CH2 4.07Å; I132-W162 HydrophobicContact CD1-CZ3 3.87Å; I132-W162 HydrophobicContact CG1-CH2 4.49Å; I132-W162 HydrophobicContact CG1-CZ3 4.17Å; I132-W162 HydrophobicContact CG2-CZ3 4.29Å; F158-W162 PolarHBondContact O-N 3.48Å; L159-W162 HydrophobicContact CD1-CE3 3.9Å; L159-W162 HydrophobicContact CD1-CZ3 4.22Å; L159-W162 PolarHBondContact O-N 3.02Å; L160-W162 VanDerWaalsContact C-N 3.35Å; L160-W162 PolarHBondContact O-N 3.37Å; W162-T166 WeakPolarHBondContact O-CB 3.18Å; W162-T166 PolarHBondContact O-N 3.37Å; W162-T166 PolarHBondContact O-OG1 3.15Å
163	Y	96.4	Very high	94.2	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-51.7	-179.8	171.9	-125.4	0	0	0	111.9	F128 K129 I132 S133 L159 L160 V161 T166 L167	F128-Y163 HydrophobicContact CE1-CD2 4.27Å; F128-Y163 HydrophobicContact CE1-CE2 4.28Å; K129-Y163 VanDerWaalsContact CG-OH 3.3Å; K129-Y163 WeakPolarHBondContact CG-OH 3.37Å; I132-Y163 HydrophobicContact CB-CD2 3.79Å; I132-Y163 HydrophobicContact CB-CE2 3.8Å; I132-Y163 HydrophobicContact CG1-CD2 4.36Å; I132-Y163 HydrophobicContact CG2-CD2 3.31Å; I132-Y163 HydrophobicContact CG2-CE2 3.78Å; I132-Y163 HydrophobicContact CG2-CG 3.72Å; S133-Y163 PolarHBondContact OG-OH 3.21Å; S133-Y163 VanDerWaalsContact OG-OH 3.14Å; L159-Y163 VanDerWaalsContact O-CB 3.23Å; L159-Y163 WeakPolarHBondContact O-CB 3.23Å; L159-Y163 PolarHBondContact O-N 3.05Å; L160-Y163 PolarHBondContact O-N 3.02Å; V161-Y163 VanDerWaalsContact C-N 3.33Å; V161-Y163 PolarHBondContact O-N 3.46Å; Y163-T166 PolarHBondContact O-N 3.37Å; Y163-L167 HydrophobicContact CD1-CD1 4.2Å; Y163-L167 HydrophobicContact CD2-CD1 4.14Å; Y163-L167 HydrophobicContact CD2-CG 4.06Å; Y163-L167 HydrophobicContact CE1-CD1 3.68Å; Y163-L167 HydrophobicContact CE2-CD1 3.6Å; Y163-L167 HydrophobicContact CE2-CD2 4.03Å; Y163-L167 HydrophobicContact CE2-CG 3.69Å; Y163-L167 HydrophobicContact CG-CD1 4.44Å; Y163-L167 WeakPolarHBondContact O-CG 3.27Å; Y163-L167 PolarHBondContact O-N 2.86Å
164	Y	95.9	Very high	94.2	Very high	15 Å²	15	37.6 Å²	37.6	6%	0.059	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-35.1	-179.5	-70.4	-60.5	0	0	0	112.9	L160 L167 T168 H189 T193	L160-Y164 HydrophobicContact CB-CD2 4.47Å; L160-Y164 HydrophobicContact CB-CE2 4.39Å; L160-Y164 HydrophobicContact CD2-CE2 4.33Å; L160-Y164 WeakPolarHBondContact O-CD2 3.48Å; L160-Y164 PolarHBondContact O-N 3.41Å; Y164-L167 HydrophobicContact CD1-CD1 4.12Å; Y164-T168 WeakPolarHBondContact O-CB 3.34Å; Y164-T168 PolarHBondContact O-N 2.62Å; Y164-T168 PolarHBondContact O-OG1 2.8Å; Y164-H189 AromaticContact CD1-ND1 3.86Å; Y164-T193 VanDerWaalsContact CB-OG1 3.27Å; Y164-T193 WeakPolarHBondContact CB-OG1 3.44Å
165	C	94.9	Very high	94	Very high	47 Å²	47	37.8 Å²	37.8	32%	0.318	18%	0.179	S	C	.	.	H	α-helix	trans	-58.2	-49.2	168.9	-80.9	0	0	0	0	111.4	V161 L167 T168 I169 T193	V161-C165 VanDerWaalsContact O-CB 3.32Å; V161-C165 WeakPolarHBondContact O-CB 3.18Å; V161-C165 PolarHBondContact O-N 2.88Å; V161-C165 PolarHBondContact O-SG 3.43Å; V161-C165 VanDerWaalsContact O-SG 3.35Å; C165-L167 PolarHBondContact O-N 3.31Å; C165-T168 WeakPolarHBondContact O-CB 3.25Å; C165-T168 PolarHBondContact O-N 3.38Å; C165-I169 PolarHBondContact O-N 3.26Å; C165-I169 VanDerWaalsContact O-N 3.11Å; C165-T193 WeakPolarHBondContact SG-CG2 3.14Å
166	T	95.8	Very high	93.7	Very high	28 Å²	28	33.8 Å²	33.8	17%	0.172	16%	0.161	C	C	.	.	H	α-helix	trans	-66.1	-40.4	-178.4	-57.5	0	0	0	0	111.9	F128 W162 Y163 T168 I169 R170	F128-T166 HydrophobicContact CE1-CG2 3.89Å; F128-T166 HydrophobicContact CE2-CG2 4.33Å; F128-T166 HydrophobicContact CZ-CG2 3.52Å; W162-T166 WeakPolarHBondContact O-CB 3.18Å; W162-T166 PolarHBondContact O-N 3.37Å; W162-T166 PolarHBondContact O-OG1 3.15Å; Y163-T166 PolarHBondContact O-N 3.37Å; T166-T168 VanDerWaalsContact C-N 3.31Å; T166-T168 PolarHBondContact O-N 3.21Å; T166-I169 PolarHBondContact O-N 2.96Å; T166-R170 WeakPolarHBondContact O-CG 3.4Å; T166-R170 PolarHBondContact O-N 3.31Å
167	L	94.4	Very high	93.3	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-58.6	-44	173.1	-79.5	178.9	0	0	0	111.6	Y125 F128 K129 Y163 Y164 C165 I169 R170 E171	Y125-L167 HydrophobicContact CE2-CD2 3.87Å; F128-L167 HydrophobicContact CD1-CD2 4.44Å; F128-L167 HydrophobicContact CE1-CD2 4.3Å; K129-L167 HydrophobicContact CG-CD2 4.43Å; Y163-L167 HydrophobicContact CD1-CD1 4.2Å; Y163-L167 HydrophobicContact CD2-CD1 4.14Å; Y163-L167 HydrophobicContact CD2-CG 4.06Å; Y163-L167 HydrophobicContact CE1-CD1 3.68Å; Y163-L167 HydrophobicContact CE2-CD1 3.6Å; Y163-L167 HydrophobicContact CE2-CD2 4.03Å; Y163-L167 HydrophobicContact CE2-CG 3.69Å; Y163-L167 HydrophobicContact CG-CD1 4.44Å; Y163-L167 WeakPolarHBondContact O-CG 3.27Å; Y163-L167 PolarHBondContact O-N 2.86Å; Y164-L167 HydrophobicContact CD1-CD1 4.12Å; C165-L167 PolarHBondContact O-N 3.31Å; L167-I169 VanDerWaalsContact C-N 3.35Å; L167-I169 PolarHBondContact O-N 3.44Å; L167-R170 PolarHBondContact O-N 3.11Å; L167-E171 WeakPolarHBondContact O-CB 3.44Å; L167-E171 WeakPolarHBondContact O-CG 3.42Å; L167-E171 PolarHBondContact O-N 3.17Å
168	T	94	Very high	92.7	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-58.2	-47.8	177.7	-58.6	0	0	0	0	110.9	Y100 Y164 C165 T166 E171 R172 H189 F190	Y100-T168 HydrophobicContact CE1-CG2 4.03Å; Y164-T168 WeakPolarHBondContact O-CB 3.34Å; Y164-T168 PolarHBondContact O-N 2.62Å; Y164-T168 PolarHBondContact O-OG1 2.8Å; C165-T168 WeakPolarHBondContact O-CB 3.25Å; C165-T168 PolarHBondContact O-N 3.38Å; T166-T168 VanDerWaalsContact C-N 3.31Å; T166-T168 PolarHBondContact O-N 3.21Å; T168-E171 PolarHBondContact O-N 3.45Å; T168-R172 HydrophobicContact CG2-CG 4.47Å; T168-R172 WeakPolarHBondContact O-CB 3.42Å; T168-R172 WeakPolarHBondContact O-CG 3.46Å; T168-R172 PolarHBondContact O-N 3.4Å; T168-H189 WeakPolarHBondContact OG1-CB 3.5Å; T168-F190 HydrophobicContact CG2-CD1 4.38Å; T168-F190 HydrophobicContact CG2-CD2 4.36Å; T168-F190 HydrophobicContact CG2-CE1 3.73Å; T168-F190 HydrophobicContact CG2-CE2 3.67Å; T168-F190 HydrophobicContact CG2-CZ 3.32Å
169	I	92.9	Very high	92.2	Very high	44 Å²	44	30 Å²	30	23%	0.226	15%	0.153	C	C	.	.	H	α-helix	trans	-60.5	-49.7	177.2	-63.2	168	0	0	0	110.5	Y100 V104 L105 C165 T166 L167 E171 R172 I173	Y100-I169 HydrophobicContact CE1-CG1 4.15Å; V104-I169 HydrophobicContact CG1-CD1 3.95Å; V104-I169 HydrophobicContact CG1-CG1 4.3Å; L105-I169 HydrophobicContact CD1-CG2 4.47Å; C165-I169 PolarHBondContact O-N 3.26Å; C165-I169 VanDerWaalsContact O-N 3.11Å; T166-I169 PolarHBondContact O-N 2.96Å; L167-I169 VanDerWaalsContact C-N 3.35Å; L167-I169 PolarHBondContact O-N 3.44Å; I169-E171 PolarHBondContact O-N 3.24Å; I169-R172 PolarHBondContact O-N 3.44Å; I169-I173 HydrophobicContact CG2-CD1 4.07Å; I169-I173 WeakPolarHBondContact O-CG1 3.47Å; I169-I173 PolarHBondContact O-N 3.44Å
170	R	93.7	Very high	91.6	Very high	51 Å²	51	35.5 Å²	35.5	19%	0.192	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-40.8	-178.9	-72	-177.2	174.2	-125.7	1.7	112.4	D124 Y125 T166 L167 I173 L174	D124-R170 IonicContact OD2-CZ 2.68Å; D124-R170 IonicContact OD2-NH1 3.11Å; D124-R170 PolarHBondContact OD2-NH1 2.83Å; D124-R170 IonicContact OD2-NH2 2.65Å; Y125-R170 HydrophobicContact CD2-CB 3.8Å; Y125-R170 HydrophobicContact CE2-CB 4.29Å; T166-R170 WeakPolarHBondContact O-CG 3.4Å; T166-R170 PolarHBondContact O-N 3.31Å; L167-R170 PolarHBondContact O-N 3.11Å; R170-I173 PolarHBondContact O-N 2.96Å; R170-L174 PolarHBondContact O-N 2.91Å
171	E	92.4	Very high	91.2	Very high	9 Å²	9	37.2 Å²	37.2	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-69	-36.5	176.8	-76.4	-170	-171.8	0	0	112.9	Y125 L167 T168 I169 I173 L174 I175 I181 H189	Y125-E171 HydrophobicContact CE2-CG 3.75Å; Y125-E171 PolarHBondContact OH-OE1 2.86Å; L167-E171 WeakPolarHBondContact O-CB 3.44Å; L167-E171 WeakPolarHBondContact O-CG 3.42Å; L167-E171 PolarHBondContact O-N 3.17Å; T168-E171 PolarHBondContact O-N 3.45Å; I169-E171 PolarHBondContact O-N 3.24Å; E171-I173 VanDerWaalsContact C-N 3.3Å; E171-I173 PolarHBondContact O-N 3.35Å; E171-L174 WeakPolarHBondContact O-CB 3.48Å; E171-L174 PolarHBondContact O-N 3.38Å; E171-I175 WeakPolarHBondContact O-CG1 3.45Å; E171-I175 PolarHBondContact O-N 2.96Å; E171-I181 HydrophobicContact CB-CD1 4.38Å; E171-I181 HydrophobicContact CG-CD1 4.19Å; E171-H189 VanDerWaalsContact CD-CD2 3.45Å; E171-H189 IonicContact OE1-CD2 3.81Å; E171-H189 PolarHBondContact OE1-CD2 3.38Å; E171-H189 IonicContact OE1-CE1 3.86Å; E171-H189 IonicContact OE1-NE2 2.67Å; E171-H189 PolarHBondContact OE1-NE2 3.25Å; E171-H189 IonicContact OE2-CD2 2.73Å; E171-H189 PolarHBondContact OE2-CD2 2.99Å; E171-H189 IonicContact OE2-NE2 3.5Å; E171-H189 PolarHBondContact OE2-NE2 2.85Å
172	R	91.2	Very high	90.7	Very high	79 Å²	79	38.3 Å²	38.3	30%	0.298	18%	0.183	S	C	.	.	H	α-helix	trans	-64.3	-37.1	173.9	-70.1	-65.2	-167.1	173.5	11.6	111.8	Y100 T168 I169 I175 A176 N186	Y100-R172 HydrophobicContact CD1-CB 4.34Å; Y100-R172 HydrophobicContact CD1-CG 3.81Å; Y100-R172 HydrophobicContact CE1-CG 4.22Å; T168-R172 HydrophobicContact CG2-CG 4.47Å; T168-R172 WeakPolarHBondContact O-CB 3.42Å; T168-R172 WeakPolarHBondContact O-CG 3.46Å; T168-R172 PolarHBondContact O-N 3.4Å; I169-R172 PolarHBondContact O-N 3.44Å; R172-I175 PolarHBondContact O-N 3.43Å; R172-A176 WeakPolarHBondContact O-CB 3.33Å; R172-A176 PolarHBondContact O-N 2.83Å; R172-N186 VanDerWaalsContact CZ-CG 3.43Å; R172-N186 VanDerWaalsContact CZ-OD1 3.25Å; R172-N186 PolarHBondContact NE-OD1 3.49Å; R172-N186 PolarHBondContact NH1-ND2 3.46Å; R172-N186 PolarHBondContact NH2-ND2 3.12Å
173	I	90.9	Very high	90.3	Very high	17 Å²	17	35.2 Å²	35.2	9%	0.087	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-43.1	171.3	-64.9	166.2	0	0	0	110.7	L101 L105 I110 F112 Y121 I169 R170 E171 I175 A176 N177	L101-I173 HydrophobicContact CD1-CG1 3.78Å; L101-I173 HydrophobicContact CD2-CG1 4.16Å; L105-I173 HydrophobicContact CD1-CD1 4.17Å; L105-I173 HydrophobicContact CD1-CG1 4.48Å; I110-I173 HydrophobicContact CG2-CG1 4.39Å; I110-I173 HydrophobicContact CG2-CG2 3.79Å; F112-I173 HydrophobicContact CE2-CG2 4.1Å; Y121-I173 HydrophobicContact CD1-CG2 4.46Å; Y121-I173 HydrophobicContact CE1-CB 4.14Å; Y121-I173 HydrophobicContact CE1-CG2 3.63Å; Y121-I173 HydrophobicContact CE2-CG2 4.4Å; Y121-I173 WeakPolarHBondContact OH-CB 3.48Å; Y121-I173 WeakPolarHBondContact OH-CD1 2.99Å; I169-I173 HydrophobicContact CG2-CD1 4.07Å; I169-I173 WeakPolarHBondContact O-CG1 3.47Å; I169-I173 PolarHBondContact O-N 3.44Å; R170-I173 PolarHBondContact O-N 2.96Å; E171-I173 VanDerWaalsContact C-N 3.3Å; E171-I173 PolarHBondContact O-N 3.35Å; I173-I175 PolarHBondContact O-N 3.08Å; I173-A176 PolarHBondContact O-N 3.49Å; I173-N177 PolarHBondContact O-N 3.04Å; I173-N177 VanDerWaalsContact O-N 3.09Å; I173-N177 PolarHBondContact O-ND2 3.19Å
174	L	91	Very high	90.2	Very high	12 Å²	12	37.2 Å²	37.2	6%	0.063	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-45.2	175.7	-74.2	172.6	0	0	0	112.1	Y121 K122 Y125 R170 E171 N177 G178 S179 I181	Y121-L174 HydrophobicContact CD1-CD2 3.59Å; Y121-L174 HydrophobicContact CD1-CG 4.24Å; Y121-L174 HydrophobicContact CE1-CD2 3.77Å; Y121-L174 HydrophobicContact CE1-CG 3.88Å; K122-L174 HydrophobicContact CB-CD2 4.25Å; Y125-L174 HydrophobicContact CD1-CD1 3.72Å; Y125-L174 HydrophobicContact CD2-CD1 4.07Å; Y125-L174 HydrophobicContact CE1-CD1 3.98Å; Y125-L174 HydrophobicContact CE2-CD1 4.3Å; Y125-L174 HydrophobicContact CG-CD1 3.76Å; R170-L174 PolarHBondContact O-N 2.91Å; E171-L174 WeakPolarHBondContact O-CB 3.48Å; E171-L174 PolarHBondContact O-N 3.38Å; L174-N177 CarbonylContact O-C 3.54Å; L174-N177 PolarHBondContact O-N 3.28Å; L174-G178 PolarHBondContact O-N 2.86Å; L174-S179 VanDerWaalsContact C-CB 3.46Å; L174-S179 WeakPolarHBondContact O-CB 3.46Å; L174-S179 PolarHBondContact O-N 2.87Å; L174-I181 HydrophobicContact CB-CD1 4.17Å; L174-I181 HydrophobicContact CD1-CD1 4.17Å
175	I	88.7	Confident	90	Very high	54 Å²	54	40 Å²	40	28%	0.277	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-44.1	178.4	-68.2	165.7	0	0	0	110.4	E171 R172 I173 N177 G178 I181	E171-I175 WeakPolarHBondContact O-CG1 3.45Å; E171-I175 PolarHBondContact O-N 2.96Å; R172-I175 PolarHBondContact O-N 3.43Å; I173-I175 PolarHBondContact O-N 3.08Å; I175-N177 PolarHBondContact O-N 2.93Å; I175-G178 PolarHBondContact O-N 3.47Å; I175-G178 VanDerWaalsContact O-N 3.1Å; I175-I181 HydrophobicContact CD1-CB 4.25Å; I175-I181 HydrophobicContact CG1-CB 4.07Å; I175-I181 HydrophobicContact CG1-CD1 4.36Å; I175-I181 HydrophobicContact CG1-CG1 4.46Å
176	A	86.4	Confident	89.8	Confident	21 Å²	21	38 Å²	38	17%	0.174	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-34.1	175.9	0	0	0	0	0	111.9	R95 L101 R172 I173 G178	R95-A176 WeakPolarHBondContact CD-O 3.4Å; L101-A176 HydrophobicContact CD2-CB 4.26Å; R172-A176 WeakPolarHBondContact O-CB 3.33Å; R172-A176 PolarHBondContact O-N 2.83Å; I173-A176 PolarHBondContact O-N 3.49Å; A176-G178 PolarHBondContact O-N 3Å
177	N	86.3	Confident	89.7	Confident	11 Å²	11	40.8 Å²	40.8	6%	0.059	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	11.5	-179.7	-77.7	-81.7	0	0	0	115.3	I110 S111 F112 K118 I173 L174 I175	I110-N177 PolarHBondContact O-ND2 3.02Å; S111-N177 WeakPolarHBondContact CA-OD1 3.36Å; F112-N177 HydrophobicContact CD2-CB 4.08Å; F112-N177 WeakPolarHBondContact CD2-OD1 3.32Å; F112-N177 PolarHBondContact N-OD1 3Å; K118-N177 PolarHBondContact NZ-O 2.99Å; I173-N177 PolarHBondContact O-N 3.04Å; I173-N177 VanDerWaalsContact O-N 3.09Å; I173-N177 PolarHBondContact O-ND2 3.19Å; L174-N177 CarbonylContact O-C 3.54Å; L174-N177 PolarHBondContact O-N 3.28Å; I175-N177 PolarHBondContact O-N 2.93Å
178	G	81.4	Confident	89.8	Confident	15 Å²	15	41.2 Å²	41.2	16%	0.155	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.8	9.3	173.3	0	0	0	0	0	115.6	L174 I175 A176 R180	L174-G178 PolarHBondContact O-N 2.86Å; I175-G178 PolarHBondContact O-N 3.47Å; I175-G178 VanDerWaalsContact O-N 3.1Å; A176-G178 PolarHBondContact O-N 3Å; G178-R180 PolarHBondContact O-N 3.14Å
179	S	86	Confident	89.8	Confident	31 Å²	31	42.3 Å²	42.3	22%	0.217	21%	0.211	C	C	.	.			trans	-69.8	128.5	171.4	-163.9	0	0	0	0	111	L174 I181	L174-S179 VanDerWaalsContact C-CB 3.46Å; L174-S179 WeakPolarHBondContact O-CB 3.46Å; L174-S179 PolarHBondContact O-N 2.87Å; S179-I181 VanDerWaalsContact C-N 3.26Å; S179-I181 PolarHBondContact O-N 3.16Å; S179-I181 VanDerWaalsContact O-N 3.17Å; S179-I181 WeakPolarHBondContact OG-CG1 3.42Å
180	R	84.1	Confident	89.8	Confident	150 Å²	150	43.8 Å²	43.8	57%	0.566	22%	0.216	S	C	*	.			trans	-89.8	52.9	179.4	-61.2	-172.4	-171.8	168	9.1	111.6	R87 G178 H336	R87-R180 VanDerWaalsContact CD-NH2 3.35Å; R87-R180 VanDerWaalsContact NH1-NH2 3.17Å; G178-R180 PolarHBondContact O-N 3.14Å; R180-H336 PolarHBondContact NH2-NE2 3.4Å
181	I	85.2	Confident	89.9	Confident	45 Å²	45	43.4 Å²	43.4	23%	0.231	22%	0.217	C	C	.	.			trans	-70.4	132.1	174.8	-59.1	175.2	0	0	0	107.9	E171 L174 I175 S179 W185	E171-I181 HydrophobicContact CB-CD1 4.38Å; E171-I181 HydrophobicContact CG-CD1 4.19Å; L174-I181 HydrophobicContact CB-CD1 4.17Å; L174-I181 HydrophobicContact CD1-CD1 4.17Å; I175-I181 HydrophobicContact CD1-CB 4.25Å; I175-I181 HydrophobicContact CG1-CB 4.07Å; I175-I181 HydrophobicContact CG1-CD1 4.36Å; I175-I181 HydrophobicContact CG1-CG1 4.46Å; S179-I181 VanDerWaalsContact C-N 3.26Å; S179-I181 PolarHBondContact O-N 3.16Å; S179-I181 VanDerWaalsContact O-N 3.17Å; S179-I181 WeakPolarHBondContact OG-CG1 3.42Å; I181-W185 HydrophobicContact CG2-CB 4.13Å
182	K	86.8	Confident	90.1	Very high	55 Å²	55	43.5 Å²	43.5	24%	0.239	22%	0.219	C	C	.	.			trans	-63.1	138.5	177.1	-67	-169.6	168.2	-165	0	109.7	W184 W185 T316 V320	K182-W184 PolarHBondContact O-N 3.26Å; K182-W184 VanDerWaalsContact O-N 3.13Å; K182-W185 PolarHBondContact O-N 3.09Å; K182-W185 VanDerWaalsContact O-N 3.16Å; K182-T316 HydrophobicContact CD-CG2 3.92Å; K182-V320 HydrophobicContact CD-CG2 3.85Å; K182-V320 VanDerWaalsContact CE-CG2 3.44Å
183	G	88.8	Confident	90.3	Very high	47 Å²	47	41 Å²	41	49%	0.485	21%	0.212	S	C	.	.	H	α-helix	trans	-56.7	-31.1	-177.2	0	0	0	0	0	114.3	W185 N186 I187	G183-W185 PolarHBondContact O-N 2.84Å; G183-N186 PolarHBondContact O-N 3.24Å; G183-I187 WeakPolarHBondContact O-CG1 3.41Å; G183-I187 PolarHBondContact O-N 3.32Å; G183-I187 VanDerWaalsContact O-N 3.1Å
184	W	93.6	Very high	90.6	Very high	47 Å²	47	42.3 Å²	42.3	18%	0.178	23%	0.225	C	C	.	.	H	α-helix	trans	-54.5	-47.2	176.1	176.8	-105.5	0	0	0	113	K182 N186 I187 S188 I308 G312 S313 T316	K182-W184 PolarHBondContact O-N 3.26Å; K182-W184 VanDerWaalsContact O-N 3.13Å; W184-N186 PolarHBondContact O-N 3.26Å; W184-I187 CarbonylContact O-C 3.59Å; W184-I187 WeakPolarHBondContact O-CA 3.16Å; W184-I187 WeakPolarHBondContact O-CB 3.47Å; W184-I187 PolarHBondContact O-N 3.02Å; W184-S188 PolarHBondContact O-N 3.49Å; W184-I308 HydrophobicContact CH2-CG2 4.21Å; W184-I308 WeakPolarHBondContact CH2-O 3.34Å; W184-G312 VanDerWaalsContact CH2-CA 3.48Å; W184-G312 PolarHBondContact NE1-O 3.27Å; W184-S313 PolarHBondContact NE1-OG 3.36Å; W184-T316 HydrophobicContact CB-CG2 4.07Å; W184-T316 WeakPolarHBondContact CB-OG1 3.32Å; W184-T316 VanDerWaalsContact CD1-OG1 3.23Å; W184-T316 HydrophobicContact CG-CG2 4.2Å
185	W	92.8	Very high	90.8	Very high	73 Å²	73	42.1 Å²	42.1	28%	0.277	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-34.8	-176.4	-59.5	120.9	0	0	0	112.8	I181 K182 G183 S188 H189 T316 V317	I181-W185 HydrophobicContact CG2-CB 4.13Å; K182-W185 PolarHBondContact O-N 3.09Å; K182-W185 VanDerWaalsContact O-N 3.16Å; G183-W185 PolarHBondContact O-N 2.84Å; W185-S188 VanDerWaalsContact C-OG 3.32Å; W185-S188 WeakPolarHBondContact CA-OG 3.3Å; W185-S188 PolarHBondContact O-N 3.23Å; W185-S188 PolarHBondContact O-OG 2.88Å; W185-H189 PolarHBondContact O-CD2 3.34Å; W185-H189 PolarHBondContact O-N 3.28Å; W185-T316 HydrophobicContact CZ2-CG2 3.96Å; W185-V317 HydrophobicContact CH2-CG2 4.01Å; W185-V317 HydrophobicContact CZ2-CG2 4.25Å
186	N	90.3	Very high	91.1	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.032	21%	0.211	C	C	.	.	H	α-helix	trans	-72.4	-37.1	174.3	161.9	83.1	0	0	0	111.5	R172 G183 W184 S188 H189 F190	R172-N186 VanDerWaalsContact CZ-CG 3.43Å; R172-N186 VanDerWaalsContact CZ-OD1 3.25Å; R172-N186 PolarHBondContact NE-OD1 3.49Å; R172-N186 PolarHBondContact NH1-ND2 3.46Å; R172-N186 PolarHBondContact NH2-ND2 3.12Å; G183-N186 PolarHBondContact O-N 3.24Å; W184-N186 PolarHBondContact O-N 3.26Å; N186-S188 VanDerWaalsContact C-N 3.34Å; N186-H189 PolarHBondContact O-N 2.63Å; N186-F190 WeakPolarHBondContact O-CD2 3.43Å; N186-F190 PolarHBondContact O-N 3.49Å; N186-F190 WeakPolarHBondContact OD1-CE2 3.48Å
187	I	93.8	Very high	91.6	Very high	85 Å²	85	39.6 Å²	39.6	44%	0.436	21%	0.214	S	C	.	.	H	α-helix	trans	-64.1	-40	172.7	-65.7	168.6	0	0	0	110.7	G183 W184 H189 F190 M191	G183-I187 WeakPolarHBondContact O-CG1 3.41Å; G183-I187 PolarHBondContact O-N 3.32Å; G183-I187 VanDerWaalsContact O-N 3.1Å; W184-I187 CarbonylContact O-C 3.59Å; W184-I187 WeakPolarHBondContact O-CA 3.16Å; W184-I187 WeakPolarHBondContact O-CB 3.47Å; W184-I187 PolarHBondContact O-N 3.02Å; I187-H189 VanDerWaalsContact C-N 3.28Å; I187-H189 PolarHBondContact O-N 3.17Å; I187-F190 WeakPolarHBondContact O-CB 3.41Å; I187-F190 PolarHBondContact O-N 2.91Å; I187-F190 VanDerWaalsContact O-N 3.13Å; I187-M191 HydrophobicContact CG2-CG 4.27Å; I187-M191 WeakPolarHBondContact O-CG 3.31Å; I187-M191 PolarHBondContact O-N 3.48Å
188	S	94.9	Very high	92	Very high	12 Å²	12	40.2 Å²	40.2	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-32.9	179	61.2	0	0	0	0	112.4	W184 W185 N186 M191 S192	W184-S188 PolarHBondContact O-N 3.49Å; W185-S188 VanDerWaalsContact C-OG 3.32Å; W185-S188 WeakPolarHBondContact CA-OG 3.3Å; W185-S188 PolarHBondContact O-N 3.23Å; W185-S188 PolarHBondContact O-OG 2.88Å; N186-S188 VanDerWaalsContact C-N 3.34Å; S188-M191 PolarHBondContact O-N 2.83Å; S188-S192 VanDerWaalsContact O-CB 3.28Å; S188-S192 WeakPolarHBondContact O-CB 3.37Å; S188-S192 PolarHBondContact O-N 3.35Å; S188-S192 PolarHBondContact O-OG 3.14Å
189	H	94.6	Very high	92.6	Very high	25 Å²	25	39.5 Å²	39.5	12%	0.116	21%	0.209	C	C	.	.	H	α-helix	trans	-67.4	-38.9	173.2	-66.5	-47.1	0	0	0	112.7	Y164 T168 E171 W185 N186 I187 S192 T193	Y164-H189 AromaticContact CD1-ND1 3.86Å; T168-H189 WeakPolarHBondContact OG1-CB 3.5Å; E171-H189 VanDerWaalsContact CD-CD2 3.45Å; E171-H189 IonicContact OE1-CD2 3.81Å; E171-H189 PolarHBondContact OE1-CD2 3.38Å; E171-H189 IonicContact OE1-CE1 3.86Å; E171-H189 IonicContact OE1-NE2 2.67Å; E171-H189 PolarHBondContact OE1-NE2 3.25Å; E171-H189 IonicContact OE2-CD2 2.73Å; E171-H189 PolarHBondContact OE2-CD2 2.99Å; E171-H189 IonicContact OE2-NE2 3.5Å; E171-H189 PolarHBondContact OE2-NE2 2.85Å; W185-H189 PolarHBondContact O-CD2 3.34Å; W185-H189 PolarHBondContact O-N 3.28Å; N186-H189 PolarHBondContact O-N 2.63Å; I187-H189 VanDerWaalsContact C-N 3.28Å; I187-H189 PolarHBondContact O-N 3.17Å; H189-S192 PolarHBondContact O-N 3.05Å; H189-T193 WeakPolarHBondContact O-CB 3.21Å; H189-T193 PolarHBondContact O-N 2.95Å; H189-T193 PolarHBondContact O-OG1 2.75Å
190	F	94.3	Very high	92.9	Very high	74 Å²	74	40.3 Å²	40.3	33%	0.325	21%	0.211	S	C	.	.	H	α-helix	trans	-62.5	-46.3	172.8	-75.8	-70	0	0	0	111.5	Y100 T168 N186 I187 S192 T193 A194	Y100-F190 HydrophobicContact CD2-CE1 4.26Å; Y100-F190 AromaticContact CD2-CZ 3.96Å; Y100-F190 HydrophobicContact CD2-CZ 3.96Å; Y100-F190 AromaticContact CE2-CE1 3.73Å; Y100-F190 HydrophobicContact CE2-CE1 3.73Å; Y100-F190 AromaticContact CE2-CZ 3.79Å; Y100-F190 HydrophobicContact CE2-CZ 3.79Å; Y100-F190 HydrophobicContact CG-CZ 4.47Å; T168-F190 HydrophobicContact CG2-CD1 4.38Å; T168-F190 HydrophobicContact CG2-CD2 4.36Å; T168-F190 HydrophobicContact CG2-CE1 3.73Å; T168-F190 HydrophobicContact CG2-CE2 3.67Å; T168-F190 HydrophobicContact CG2-CZ 3.32Å; N186-F190 WeakPolarHBondContact O-CD2 3.43Å; N186-F190 PolarHBondContact O-N 3.49Å; N186-F190 WeakPolarHBondContact OD1-CE2 3.48Å; I187-F190 WeakPolarHBondContact O-CB 3.41Å; I187-F190 PolarHBondContact O-N 2.91Å; I187-F190 VanDerWaalsContact O-N 3.13Å; F190-S192 VanDerWaalsContact C-N 3.26Å; F190-S192 PolarHBondContact O-N 3.39Å; F190-T193 WeakPolarHBondContact O-CB 3.5Å; F190-T193 PolarHBondContact O-N 3.28Å; F190-A194 PolarHBondContact O-N 2.84Å
191	M	95.5	Very high	93.4	Very high	43 Å²	43	37.8 Å²	37.8	21%	0.212	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-35.9	175.4	-66.2	-63.4	-77	0	0	111.4	I187 S188 A194 Y195 I305 I308 L309	I187-M191 HydrophobicContact CG2-CG 4.27Å; I187-M191 WeakPolarHBondContact O-CG 3.31Å; I187-M191 PolarHBondContact O-N 3.48Å; S188-M191 PolarHBondContact O-N 2.83Å; M191-A194 PolarHBondContact O-N 3.32Å; M191-Y195 WeakPolarHBondContact O-CD1 3.31Å; M191-Y195 PolarHBondContact O-N 2.71Å; M191-I305 HydrophobicContact CB-CG2 4.26Å; M191-I305 HydrophobicContact CE-CB 4.15Å; M191-I305 HydrophobicContact CE-CG1 3.85Å; M191-I305 HydrophobicContact CE-CG2 3.91Å; M191-I308 HydrophobicContact CE-CB 4.42Å; M191-I308 HydrophobicContact CE-CD1 4.38Å; M191-I308 HydrophobicContact CE-CG2 4.27Å; M191-L309 HydrophobicContact CB-CD1 4.28Å; M191-L309 HydrophobicContact CB-CD2 3.75Å; M191-L309 HydrophobicContact CB-CG 4.04Å; M191-L309 HydrophobicContact CG-CD2 4.48Å
192	S	95.8	Very high	93.8	Very high	12 Å²	12	35.7 Å²	35.7	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-68.3	-39.6	178	-58.8	0	0	0	0	113.2	S188 H189 F190 A194 Y195 S196	S188-S192 VanDerWaalsContact O-CB 3.28Å; S188-S192 WeakPolarHBondContact O-CB 3.37Å; S188-S192 PolarHBondContact O-N 3.35Å; S188-S192 PolarHBondContact O-OG 3.14Å; H189-S192 PolarHBondContact O-N 3.05Å; F190-S192 VanDerWaalsContact C-N 3.26Å; F190-S192 PolarHBondContact O-N 3.39Å; S192-A194 VanDerWaalsContact C-N 3.34Å; S192-Y195 VanDerWaalsContact CA-CD1 3.45Å; S192-S196 VanDerWaalsContact O-CB 3.26Å; S192-S196 WeakPolarHBondContact O-CB 3.23Å; S192-S196 PolarHBondContact O-N 3.19Å; S192-S196 PolarHBondContact O-OG 3.16Å
193	T	96.2	Very high	94	Very high	25 Å²	25	36 Å²	36	15%	0.153	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-44.5	171.4	-53.4	0	0	0	0	110.6	V161 Y164 C165 H189 F190 S196 G197	V161-T193 HydrophobicContact CG1-CG2 4.21Å; Y164-T193 VanDerWaalsContact CB-OG1 3.27Å; Y164-T193 WeakPolarHBondContact CB-OG1 3.44Å; C165-T193 WeakPolarHBondContact SG-CG2 3.14Å; H189-T193 WeakPolarHBondContact O-CB 3.21Å; H189-T193 PolarHBondContact O-N 2.95Å; H189-T193 PolarHBondContact O-OG1 2.75Å; F190-T193 WeakPolarHBondContact O-CB 3.5Å; F190-T193 PolarHBondContact O-N 3.28Å; T193-S196 PolarHBondContact O-N 3.49Å; T193-G197 PolarHBondContact O-N 3.13Å
194	A	95.9	Very high	94	Very high	45 Å²	45	42.5 Å²	42.5	37%	0.372	21%	0.214	S	C	.	.	H	α-helix	trans	-62.9	-51.1	-179.4	0	0	0	0	0	112.2	F190 M191 S192 S196 G197 I198 I305	F190-A194 PolarHBondContact O-N 2.84Å; M191-A194 PolarHBondContact O-N 3.32Å; S192-A194 VanDerWaalsContact C-N 3.34Å; A194-S196 VanDerWaalsContact C-N 3.33Å; A194-S196 PolarHBondContact O-N 3.09Å; A194-G197 PolarHBondContact O-N 3.22Å; A194-I198 WeakPolarHBondContact O-CG1 3.45Å; A194-I198 PolarHBondContact O-N 2.94Å; A194-I305 HydrophobicContact CB-CD1 4.47Å
195	Y	95.4	Very high	93.8	Very high	8 Å²	8	41.4 Å²	41.4	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-66.1	-36.9	178.3	82.6	-111.4	0	0	0	111.6	M191 S192 G197 I198 M199 F215 I305 Y306 L309	M191-Y195 WeakPolarHBondContact O-CD1 3.31Å; M191-Y195 PolarHBondContact O-N 2.71Å; S192-Y195 VanDerWaalsContact CA-CD1 3.45Å; Y195-G197 VanDerWaalsContact C-N 3.26Å; Y195-G197 PolarHBondContact O-N 2.94Å; Y195-I198 PolarHBondContact O-N 2.86Å; Y195-I198 VanDerWaalsContact O-N 3.16Å; Y195-M199 HydrophobicContact CD2-CG 4.34Å; Y195-M199 WeakPolarHBondContact O-CB 3.31Å; Y195-M199 VanDerWaalsContact O-CG 3.23Å; Y195-M199 WeakPolarHBondContact O-CG 3.04Å; Y195-M199 PolarHBondContact O-N 3.43Å; Y195-F215 HydrophobicContact CE2-CE2 4.07Å; Y195-I305 HydrophobicContact CD1-CG2 3.95Å; Y195-I305 HydrophobicContact CG-CG2 4.35Å; Y195-Y306 HydrophobicContact CD2-CE2 4.46Å; Y195-Y306 HydrophobicContact CE1-CE1 4.33Å; Y195-Y306 WeakPolarHBondContact CE2-OH 3.31Å; Y195-L309 HydrophobicContact CD1-CD1 3.83Å; Y195-L309 HydrophobicContact CE1-CD1 3.88Å
196	S	95	Very high	93.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-37.1	177	-59.6	0	0	0	0	111	S192 T193 A194 M199 L200	S192-S196 VanDerWaalsContact O-CB 3.26Å; S192-S196 WeakPolarHBondContact O-CB 3.23Å; S192-S196 PolarHBondContact O-N 3.19Å; S192-S196 PolarHBondContact O-OG 3.16Å; T193-S196 PolarHBondContact O-N 3.49Å; A194-S196 VanDerWaalsContact C-N 3.33Å; A194-S196 PolarHBondContact O-N 3.09Å; S196-M199 PolarHBondContact O-N 2.68Å; S196-L200 PolarHBondContact O-N 3.23Å
197	G	96.1	Very high	93.9	Very high	23 Å²	23	45.6 Å²	45.6	24%	0.237	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-40	172.6	0	0	0	0	0	112.9	T193 A194 Y195 L200 I201	T193-G197 PolarHBondContact O-N 3.13Å; A194-G197 PolarHBondContact O-N 3.22Å; Y195-G197 VanDerWaalsContact C-N 3.26Å; Y195-G197 PolarHBondContact O-N 2.94Å; G197-L200 WeakPolarHBondContact O-CB 3.32Å; G197-L200 PolarHBondContact O-N 2.83Å; G197-I201 PolarHBondContact O-N 3.03Å
198	I	95.5	Very high	93.8	Very high	24 Å²	24	41.6 Å²	41.6	12%	0.123	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-41.4	175.3	-63.4	163.8	0	0	0	110.7	A194 Y195 L200 I201 W202 Q298 A301 V302 I305	A194-I198 WeakPolarHBondContact O-CG1 3.45Å; A194-I198 PolarHBondContact O-N 2.94Å; Y195-I198 PolarHBondContact O-N 2.86Å; Y195-I198 VanDerWaalsContact O-N 3.16Å; I198-L200 VanDerWaalsContact C-N 3.28Å; I198-L200 PolarHBondContact O-N 2.79Å; I198-I201 WeakPolarHBondContact O-CG1 3.46Å; I198-I201 PolarHBondContact O-N 3.22Å; I198-W202 PolarHBondContact O-N 3Å; I198-Q298 HydrophobicContact CG2-CB 3.68Å; I198-Q298 HydrophobicContact CG2-CG 3.8Å; I198-A301 HydrophobicContact CD1-CB 4.23Å; I198-V302 HydrophobicContact CB-CG2 3.86Å; I198-V302 HydrophobicContact CD1-CG2 4.49Å; I198-V302 HydrophobicContact CG2-CG2 3.48Å; I198-V302 VanDerWaalsContact CG2-CG2 3.48Å; I198-I305 HydrophobicContact CD1-CD1 3.64Å
199	M	93.4	Very high	93.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-34.9	174.5	-70.5	-69	-73.1	0	0	112.3	Y195 S196 W202 Y208 F211 F215 V302	Y195-M199 HydrophobicContact CD2-CG 4.34Å; Y195-M199 WeakPolarHBondContact O-CB 3.31Å; Y195-M199 VanDerWaalsContact O-CG 3.23Å; Y195-M199 WeakPolarHBondContact O-CG 3.04Å; Y195-M199 PolarHBondContact O-N 3.43Å; S196-M199 PolarHBondContact O-N 2.68Å; M199-W202 WeakPolarHBondContact O-CB 3.37Å; M199-W202 PolarHBondContact O-N 3.5Å; M199-W202 HydrophobicContact SD-CE3 3.46Å; M199-W202 HydrophobicContact SD-CZ3 3.56Å; M199-W202 VanDerWaalsContact SD-CZ3 3.56Å; M199-Y208 HydrophobicContact CE-CE2 4.45Å; M199-F211 HydrophobicContact CE-CD1 3.73Å; M199-F211 HydrophobicContact CE-CE1 3.52Å; M199-F211 HydrophobicContact SD-CD1 4.13Å; M199-F211 HydrophobicContact SD-CE1 3.82Å; M199-F215 HydrophobicContact CE-CB 4.45Å; M199-F215 HydrophobicContact CE-CD1 4.21Å; M199-F215 HydrophobicContact CE-CD2 4.16Å; M199-F215 HydrophobicContact CE-CG 3.99Å; M199-V302 HydrophobicContact SD-CG1 4.4Å
200	L	93.4	Very high	93.5	Very high	47 Å²	47	47.1 Å²	47.1	25%	0.246	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-47.6	175.7	-173.3	74.7	0	0	0	111.6	R150 T154 H157 F158 S196 G197 I198 W202	R150-L200 PolarHBondContact NH2-O 3.05Å; R150-L200 VanDerWaalsContact NH2-O 3.12Å; T154-L200 HydrophobicContact CG2-CD1 3.6Å; T154-L200 WeakPolarHBondContact O-CD1 3.47Å; H157-L200 HydrophobicContact CB-CB 4.23Å; H157-L200 HydrophobicContact CB-CD1 3.81Å; F158-L200 HydrophobicContact CB-CD1 4.19Å; S196-L200 PolarHBondContact O-N 3.23Å; G197-L200 WeakPolarHBondContact O-CB 3.32Å; G197-L200 PolarHBondContact O-N 2.83Å; I198-L200 VanDerWaalsContact C-N 3.28Å; I198-L200 PolarHBondContact O-N 2.79Å; L200-W202 VanDerWaalsContact C-N 3.31Å; L200-W202 PolarHBondContact O-N 2.85Å
201	I	93.9	Very high	93.4	Very high	98 Å²	98	43.7 Å²	43.7	50%	0.503	22%	0.221	S	C	.	.	H	α-helix	trans	-82.3	-4.6	-178.1	65.5	172	0	0	0	113.9	G197 I198 P203 W297	G197-I201 PolarHBondContact O-N 3.03Å; I198-I201 WeakPolarHBondContact O-CG1 3.46Å; I198-I201 PolarHBondContact O-N 3.22Å; I201-P203 WeakPolarHBondContact O-CD 3.31Å; I201-W297 HydrophobicContact CD1-CH2 4.04Å; I201-W297 HydrophobicContact CD1-CZ2 3.82Å
202	W	93.1	Very high	93.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.214	C	C	.	.			trans	-65.2	115.8	-179.6	-161.3	-35	0	0	0	109.6	R150 I198 M199 L200 Y208 F211 L285 E296 Q298 V299 V302	R150-W202 PolarHBondContact NH2-O 2.87Å; I198-W202 PolarHBondContact O-N 3Å; M199-W202 WeakPolarHBondContact O-CB 3.37Å; M199-W202 PolarHBondContact O-N 3.5Å; M199-W202 HydrophobicContact SD-CE3 3.46Å; M199-W202 HydrophobicContact SD-CZ3 3.56Å; M199-W202 VanDerWaalsContact SD-CZ3 3.56Å; L200-W202 VanDerWaalsContact C-N 3.31Å; L200-W202 PolarHBondContact O-N 2.85Å; W202-Y208 HydrophobicContact CB-CD2 4.17Å; W202-Y208 HydrophobicContact CD2-CD2 4.17Å; W202-Y208 AromaticContact CG-CD2 3.93Å; W202-Y208 HydrophobicContact CG-CD2 3.93Å; W202-F211 HydrophobicContact CH2-CD1 4.46Å; W202-F211 HydrophobicContact CZ3-CD1 4.42Å; W202-L285 HydrophobicContact CH2-CD2 3.61Å; W202-L285 HydrophobicContact CZ3-CD2 4.18Å; W202-E296 VanDerWaalsContact NE1-CD 3.33Å; W202-E296 PolarHBondContact NE1-OE2 3.49Å; W202-Q298 HydrophobicContact CB-CB 4.49Å; W202-Q298 HydrophobicContact CB-CG 4.44Å; W202-Q298 HydrophobicContact CD2-CB 3.83Å; W202-Q298 HydrophobicContact CE3-CB 4.02Å; W202-Q298 HydrophobicContact CG-CB 4.02Å; W202-Q298 HydrophobicContact CG-CG 4.38Å; W202-V299 HydrophobicContact CH2-CB 3.93Å; W202-V299 HydrophobicContact CH2-CG1 3.84Å; W202-V299 HydrophobicContact CH2-CG2 3.78Å; W202-V299 HydrophobicContact CZ2-CB 3.92Å; W202-V299 HydrophobicContact CZ2-CG1 4.05Å; W202-V299 HydrophobicContact CZ2-CG2 3.23Å; W202-V302 HydrophobicContact CE3-CG2 4.43Å; W202-V302 HydrophobicContact CZ3-CB 4.33Å; W202-V302 HydrophobicContact CZ3-CG2 4.17Å
203	P	91.5	Very high	93.1	Very high	62 Å²	62	45.1 Å²	45.1	40%	0.403	23%	0.227	S	C	.	.			trans	-66.5	161.9	-177.4	25.7	-30.6	0	0	0	111.2	I201 S205 E296	I201-P203 WeakPolarHBondContact O-CD 3.31Å; P203-S205 PolarHBondContact O-N 3.28Å; P203-E296 HydrophobicContact CG-CG 4.44Å; P203-E296 WeakPolarHBondContact CG-OE1 3.4Å
204	R	88.8	Confident	93	Very high	183 Å²	183	46.2 Å²	46.2	69%	0.691	23%	0.231	S	C	*	.	S	Bend	trans	-68	117.1	175.7	-177.7	-179	177	132.3	8.1	108.9
205	S	90.1	Very high	92.9	Very high	24 Å²	24	44.1 Å²	44.1	17%	0.168	21%	0.213	C	C	.	.			trans	-152.5	170	-178.5	60.5	0	0	0	0	111.3	P203 S207 Y208 D209 E296	P203-S205 PolarHBondContact O-N 3.28Å; S205-S207 VanDerWaalsContact C-N 3.3Å; S205-S207 PolarHBondContact O-N 3.15Å; S205-S207 PolarHBondContact OG-OG 3.27Å; S205-Y208 WeakPolarHBondContact O-CB 3.48Å; S205-Y208 PolarHBondContact O-N 3.26Å; S205-Y208 PolarHBondContact OG-N 3.18Å; S205-D209 PolarHBondContact O-N 3Å; S205-D209 VanDerWaalsContact O-N 3.11Å; S205-E296 WeakPolarHBondContact CB-OE1 3.18Å; S205-E296 PolarHBondContact OG-OE1 3.25Å; S205-E296 PolarHBondContact OG-OE2 3.05Å
206	R	91.8	Very high	92.8	Very high	164 Å²	164	43.7 Å²	43.7	62%	0.619	21%	0.212	S	C	*	.	H	α-helix	trans	-60.5	-39.6	176.3	-178.9	175.6	176.4	160.5	2.9	112.4	Y208 D209 E210 Y293	R206-Y208 VanDerWaalsContact C-N 3.32Å; R206-Y208 PolarHBondContact O-N 2.93Å; R206-D209 PolarHBondContact O-N 2.87Å; R206-E210 HydrophobicContact CG-CG 4.48Å; R206-E210 WeakPolarHBondContact CG-OE1 3.44Å; R206-E210 IonicContact CZ-OE1 2.66Å; R206-E210 IonicContact NE-OE1 3.67Å; R206-E210 PolarHBondContact NE-OE1 3.22Å; R206-E210 IonicContact NH2-OE1 2.86Å; R206-E210 WeakPolarHBondContact O-CG 3.2Å; R206-E210 PolarHBondContact O-N 3.39Å; R206-Y293 HydrophobicContact CB-CD2 4.12Å; R206-Y293 HydrophobicContact CB-CE2 4.07Å; R206-Y293 HydrophobicContact CG-CD2 4.3Å; R206-Y293 HydrophobicContact CG-CE2 3.97Å
207	S	92.5	Very high	92.8	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-38.8	176	25.6	0	0	0	0	112.2	S205 F211 E296	S205-S207 VanDerWaalsContact C-N 3.3Å; S205-S207 PolarHBondContact O-N 3.15Å; S205-S207 PolarHBondContact OG-OG 3.27Å; S207-F211 PolarHBondContact O-N 3.18Å; S207-E296 PolarHBondContact OG-OE2 3.07Å
208	Y	92.1	Very high	92.7	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-49.2	174	-175.8	-92.9	0	0	0	111.7	R150 D153 H157 M199 W202 S205 R206 E210 F211 R212	R150-Y208 PolarHBondContact NH1-OH 3.2Å; D153-Y208 WeakPolarHBondContact CB-OH 3.49Å; H157-Y208 PolarHBondContact NE2-OH 3.08Å; M199-Y208 HydrophobicContact CE-CE2 4.45Å; W202-Y208 HydrophobicContact CB-CD2 4.17Å; W202-Y208 HydrophobicContact CD2-CD2 4.17Å; W202-Y208 AromaticContact CG-CD2 3.93Å; W202-Y208 HydrophobicContact CG-CD2 3.93Å; S205-Y208 WeakPolarHBondContact O-CB 3.48Å; S205-Y208 PolarHBondContact O-N 3.26Å; S205-Y208 PolarHBondContact OG-N 3.18Å; R206-Y208 VanDerWaalsContact C-N 3.32Å; R206-Y208 PolarHBondContact O-N 2.93Å; Y208-E210 VanDerWaalsContact C-N 3.3Å; Y208-E210 PolarHBondContact O-N 3.04Å; Y208-F211 PolarHBondContact O-N 2.83Å; Y208-F211 VanDerWaalsContact O-N 3.15Å; Y208-R212 HydrophobicContact CE1-CB 4.37Å; Y208-R212 HydrophobicContact CE1-CG 4.35Å; Y208-R212 WeakPolarHBondContact O-CB 3.33Å; Y208-R212 PolarHBondContact O-N 3.04Å
209	D	90.8	Very high	92.7	Very high	75 Å²	75	45.5 Å²	45.5	40%	0.401	22%	0.216	S	C	.	.	H	α-helix	trans	-62.1	-37.8	-178.1	-69.7	-21.1	0	0	0	111.5	S205 R206	S205-D209 PolarHBondContact O-N 3Å; S205-D209 VanDerWaalsContact O-N 3.11Å; R206-D209 PolarHBondContact O-N 2.87Å
210	E	92.1	Very high	92.7	Very high	78 Å²	78	47.3 Å²	47.3	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-34.3	175.5	-73.9	-177.4	-159.8	0	0	113.1	R206 Y208 I288 Y293	R206-E210 HydrophobicContact CG-CG 4.48Å; R206-E210 WeakPolarHBondContact CG-OE1 3.44Å; R206-E210 IonicContact CZ-OE1 2.66Å; R206-E210 IonicContact NE-OE1 3.67Å; R206-E210 PolarHBondContact NE-OE1 3.22Å; R206-E210 IonicContact NH2-OE1 2.86Å; R206-E210 WeakPolarHBondContact O-CG 3.2Å; R206-E210 PolarHBondContact O-N 3.39Å; Y208-E210 VanDerWaalsContact C-N 3.3Å; Y208-E210 PolarHBondContact O-N 3.04Å; E210-I288 HydrophobicContact CB-CD1 4.23Å; E210-Y293 PolarHBondContact OE1-OH 2.91Å; E210-Y293 PolarHBondContact OE2-OH 3.35Å
211	F	93.6	Very high	92.8	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-86.6	-27.8	-180	-178.2	-115.5	0	0	0	113.7	M199 W202 S207 Y208 D213 Q214 F215 M281 L285 I288 Y306	M199-F211 HydrophobicContact CE-CD1 3.73Å; M199-F211 HydrophobicContact CE-CE1 3.52Å; M199-F211 HydrophobicContact SD-CD1 4.13Å; M199-F211 HydrophobicContact SD-CE1 3.82Å; W202-F211 HydrophobicContact CH2-CD1 4.46Å; W202-F211 HydrophobicContact CZ3-CD1 4.42Å; S207-F211 PolarHBondContact O-N 3.18Å; Y208-F211 PolarHBondContact O-N 2.83Å; Y208-F211 VanDerWaalsContact O-N 3.15Å; F211-D213 PolarHBondContact O-N 3.16Å; F211-Q214 WeakPolarHBondContact O-CB 3.36Å; F211-Q214 PolarHBondContact O-N 3.37Å; F211-Q214 VanDerWaalsContact O-N 3.14Å; F211-F215 HydrophobicContact CD1-CB 4.21Å; F211-F215 HydrophobicContact CE1-CB 3.77Å; F211-F215 HydrophobicContact CE1-CD2 4.13Å; F211-F215 HydrophobicContact CE1-CG 4.23Å; F211-F215 HydrophobicContact CZ-CB 4.06Å; F211-F215 HydrophobicContact CZ-CD2 4.33Å; F211-F215 PolarHBondContact O-N 3.12Å; F211-M281 HydrophobicContact CE2-CB 4.12Å; F211-M281 HydrophobicContact CE2-CG 4.19Å; F211-M281 HydrophobicContact CE2-SD 4.02Å; F211-M281 HydrophobicContact CZ-SD 3.95Å; F211-L285 HydrophobicContact CB-CD2 4.25Å; F211-L285 HydrophobicContact CD1-CD2 4.01Å; F211-L285 HydrophobicContact CD2-CD1 4.27Å; F211-L285 HydrophobicContact CD2-CD2 3.59Å; F211-L285 HydrophobicContact CD2-CG 3.72Å; F211-L285 HydrophobicContact CE1-CD1 4.3Å; F211-L285 HydrophobicContact CE1-CD2 4.27Å; F211-L285 HydrophobicContact CE2-CD1 3.69Å; F211-L285 HydrophobicContact CE2-CD2 3.89Å; F211-L285 HydrophobicContact CE2-CG 3.61Å; F211-L285 HydrophobicContact CG-CD2 3.67Å; F211-L285 HydrophobicContact CG-CG 4.31Å; F211-L285 HydrophobicContact CZ-CD1 3.71Å; F211-L285 HydrophobicContact CZ-CD2 4.22Å; F211-L285 HydrophobicContact CZ-CG 4.1Å; F211-I288 HydrophobicContact CB-CD1 4.35Å; F211-Y306 AromaticContact CZ-CE2 3.99Å; F211-Y306 HydrophobicContact CZ-CE2 3.99Å
212	R	92.8	Very high	92.9	Very high	15 Å²	15	43.8 Å²	43.8	6%	0.057	21%	0.205	C	C	.	.	H	α-helix	trans	-50.6	-51.7	-171.2	-179.4	-172.2	179.5	-83.7	-4.9	113.1	L143 V147 D153 Y208 Q214 F215 M216	L143-R212 PolarHBondContact O-NH1 3.07Å; L143-R212 PolarHBondContact O-NH2 2.92Å; V147-R212 PolarHBondContact O-NH2 3.46Å; D153-R212 IonicContact OD1-CZ 3.98Å; D153-R212 IonicContact OD1-NE 3.78Å; D153-R212 PolarHBondContact OD1-NE 3.2Å; D153-R212 IonicContact OD1-NH2 3.64Å; D153-R212 PolarHBondContact OD1-NH2 3.17Å; D153-R212 IonicContact OD2-CZ 3.73Å; D153-R212 IonicContact OD2-NE 2.8Å; D153-R212 PolarHBondContact OD2-NE 3.08Å; D153-R212 IonicContact OD2-NH2 2.65Å; Y208-R212 HydrophobicContact CE1-CB 4.37Å; Y208-R212 HydrophobicContact CE1-CG 4.35Å; Y208-R212 WeakPolarHBondContact O-CB 3.33Å; Y208-R212 PolarHBondContact O-N 3.04Å; R212-Q214 VanDerWaalsContact C-N 3.3Å; R212-Q214 PolarHBondContact O-N 3.4Å; R212-F215 PolarHBondContact O-N 3.39Å; R212-M216 WeakPolarHBondContact O-CG 3.23Å; R212-M216 PolarHBondContact O-N 2.85Å
213	D	91.8	Very high	93	Very high	70 Å²	70	44.6 Å²	44.6	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-66.7	-35.1	-174.2	-71.7	-12.3	0	0	0	111.8	Y144 F211 L217	Y144-D213 HydrophobicContact CE2-CB 4.2Å; F211-D213 PolarHBondContact O-N 3.16Å; D213-L217 WeakPolarHBondContact O-CB 3.16Å; D213-L217 PolarHBondContact O-N 2.88Å
214	Q	93.7	Very high	93.1	Very high	48 Å²	48	46.2 Å²	46.2	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-43.3	174.8	-56.7	-177	4.8	0	0	111.1	F211 R212 L217 F218 N284	F211-Q214 WeakPolarHBondContact O-CB 3.36Å; F211-Q214 PolarHBondContact O-N 3.37Å; F211-Q214 VanDerWaalsContact O-N 3.14Å; R212-Q214 VanDerWaalsContact C-N 3.3Å; R212-Q214 PolarHBondContact O-N 3.4Å; Q214-L217 PolarHBondContact O-N 3.36Å; Q214-F218 VanDerWaalsContact O-CB 3.3Å; Q214-F218 WeakPolarHBondContact O-CB 3.16Å; Q214-F218 PolarHBondContact O-N 3.36Å; Q214-N284 VanDerWaalsContact CD-ND2 3.29Å; Q214-N284 PolarHBondContact NE2-ND2 2.83Å; Q214-N284 VanDerWaalsContact NE2-ND2 3.17Å; Q214-N284 PolarHBondContact OE1-ND2 3.39Å
215	F	93.8	Very high	93.4	Very high	1 Å²	1	37.6 Å²	37.6	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-64.5	-41.9	178.2	177.1	-100.6	0	0	0	112.7	F156 H157 L160 Y195 M199 F211 R212 F218 S219 Y306	F156-F215 HydrophobicContact CD1-CE1 4.28Å; F156-F215 AromaticContact CE1-CE1 3.82Å; F156-F215 HydrophobicContact CE1-CE1 3.82Å; F156-F215 HydrophobicContact CE1-CZ 4.45Å; H157-F215 AromaticContact CE1-CD1 3.91Å; H157-F215 AromaticContact CE1-CE1 3.32Å; H157-F215 WeakPolarHBondContact CE1-CE1 3.3Å; H157-F215 AromaticContact CE1-CZ 3.85Å; H157-F215 AromaticContact ND1-CE1 3.89Å; L160-F215 HydrophobicContact CD1-CE1 4.24Å; L160-F215 HydrophobicContact CD1-CZ 3.7Å; Y195-F215 HydrophobicContact CE2-CE2 4.07Å; M199-F215 HydrophobicContact CE-CB 4.45Å; M199-F215 HydrophobicContact CE-CD1 4.21Å; M199-F215 HydrophobicContact CE-CD2 4.16Å; M199-F215 HydrophobicContact CE-CG 3.99Å; F211-F215 HydrophobicContact CD1-CB 4.21Å; F211-F215 HydrophobicContact CE1-CB 3.77Å; F211-F215 HydrophobicContact CE1-CD2 4.13Å; F211-F215 HydrophobicContact CE1-CG 4.23Å; F211-F215 HydrophobicContact CZ-CB 4.06Å; F211-F215 HydrophobicContact CZ-CD2 4.33Å; F211-F215 PolarHBondContact O-N 3.12Å; R212-F215 PolarHBondContact O-N 3.39Å; F215-F218 PolarHBondContact O-N 2.88Å; F215-S219 WeakPolarHBondContact O-CB 3.35Å; F215-S219 PolarHBondContact O-N 3.46Å; F215-S219 PolarHBondContact O-OG 3.37Å; F215-Y306 WeakPolarHBondContact CD2-OH 3.4Å; F215-Y306 VanDerWaalsContact CE2-OH 3.3Å; F215-Y306 WeakPolarHBondContact CE2-OH 3.4Å
216	M	93.4	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.4	-43.5	177.6	-67.3	-59.5	174.7	0	0	111.3	L143 Y144 D153 F156 R212 S219 L220	L143-M216 HydrophobicContact CB-CE 4.13Å; L143-M216 HydrophobicContact CB-SD 4.01Å; L143-M216 HydrophobicContact CD1-CE 3.78Å; L143-M216 HydrophobicContact CD1-SD 4.18Å; Y144-M216 HydrophobicContact CD2-CB 3.85Å; Y144-M216 HydrophobicContact CG-CB 4.45Å; D153-M216 HydrophobicContact CB-CE 4.42Å; D153-M216 WeakPolarHBondContact OD1-CE 3.46Å; F156-M216 HydrophobicContact CD1-CE 4.24Å; F156-M216 HydrophobicContact CD1-SD 4.29Å; F156-M216 HydrophobicContact CE1-SD 4.17Å; R212-M216 WeakPolarHBondContact O-CG 3.23Å; R212-M216 PolarHBondContact O-N 2.85Å; M216-S219 WeakPolarHBondContact O-CB 3.34Å; M216-S219 PolarHBondContact O-N 2.9Å; M216-L220 PolarHBondContact O-N 2.94Å
217	L	94.1	Very high	93.8	Very high	77 Å²	77	35.5 Å²	35.5	40%	0.403	17%	0.174	S	C	.	.	H	α-helix	trans	-62.1	-44.4	175.3	-178.1	63.4	0	0	0	111.7	Y144 D213 Q214 S219 L220 Y221 F277	Y144-L217 HydrophobicContact CE2-CB 4.43Å; D213-L217 WeakPolarHBondContact O-CB 3.16Å; D213-L217 PolarHBondContact O-N 2.88Å; Q214-L217 PolarHBondContact O-N 3.36Å; L217-S219 VanDerWaalsContact C-N 3.34Å; L217-S219 PolarHBondContact O-N 3.06Å; L217-L220 PolarHBondContact O-N 2.9Å; L217-Y221 PolarHBondContact O-N 3.3Å; L217-F277 HydrophobicContact CB-CZ 4.42Å; L217-F277 HydrophobicContact CD2-CE1 4.35Å; L217-F277 HydrophobicContact CD2-CZ 4.1Å; L217-F277 HydrophobicContact CG-CE1 4.24Å; L217-F277 HydrophobicContact CG-CZ 4.14Å
218	F	95.5	Very high	93.9	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-45.1	174.2	172.9	-102.6	0	0	0	111.5	Q214 F215 L220 Y221 L222 V274 F277 E278 M281 Y306	Q214-F218 VanDerWaalsContact O-CB 3.3Å; Q214-F218 WeakPolarHBondContact O-CB 3.16Å; Q214-F218 PolarHBondContact O-N 3.36Å; F215-F218 PolarHBondContact O-N 2.88Å; F218-L220 VanDerWaalsContact C-N 3.32Å; F218-L220 PolarHBondContact O-N 3.46Å; F218-Y221 PolarHBondContact O-N 3.01Å; F218-L222 HydrophobicContact CE1-CB 4.45Å; F218-L222 HydrophobicContact CE1-CD2 3.98Å; F218-L222 HydrophobicContact CZ-CB 4.45Å; F218-L222 HydrophobicContact CZ-CD1 4.44Å; F218-L222 HydrophobicContact CZ-CD2 4.23Å; F218-L222 WeakPolarHBondContact O-CB 3.48Å; F218-L222 PolarHBondContact O-N 2.91Å; F218-V274 HydrophobicContact CE2-CG1 3.96Å; F218-V274 HydrophobicContact CZ-CG1 4.22Å; F218-F277 HydrophobicContact CB-CD2 4.27Å; F218-F277 HydrophobicContact CB-CE1 4.41Å; F218-F277 HydrophobicContact CB-CE2 3.95Å; F218-F277 HydrophobicContact CB-CZ 4.02Å; F218-F277 HydrophobicContact CD2-CB 4.01Å; F218-F277 HydrophobicContact CD2-CD1 4.21Å; F218-F277 AromaticContact CD2-CD2 3.94Å; F218-F277 HydrophobicContact CD2-CD2 3.94Å; F218-F277 HydrophobicContact CD2-CE2 4.46Å; F218-F277 AromaticContact CD2-CG 3.8Å; F218-F277 HydrophobicContact CD2-CG 3.8Å; F218-F277 HydrophobicContact CE2-CB 4.32Å; F218-E278 HydrophobicContact CE2-CG 3.55Å; F218-E278 HydrophobicContact CZ-CG 3.44Å; F218-E278 VanDerWaalsContact CZ-CG 3.44Å; F218-M281 HydrophobicContact CB-CE 3.94Å; F218-M281 HydrophobicContact CB-SD 3.64Å; F218-M281 HydrophobicContact CD1-CE 3.31Å; F218-M281 HydrophobicContact CD1-SD 4.07Å; F218-M281 HydrophobicContact CD2-CE 3.63Å; F218-M281 HydrophobicContact CD2-SD 4.33Å; F218-M281 HydrophobicContact CE1-CE 3.6Å; F218-M281 HydrophobicContact CE2-CE 3.91Å; F218-M281 HydrophobicContact CG-CE 3.31Å; F218-M281 HydrophobicContact CG-SD 3.75Å; F218-M281 HydrophobicContact CZ-CE 3.89Å; F218-Y306 HydrophobicContact CE1-CE1 4.36Å
219	S	94.5	Very high	94	Very high	7 Å²	7	39.5 Å²	39.5	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-41.3	178.8	-64.7	0	0	0	0	111.9	F215 M216 L217 N223	F215-S219 WeakPolarHBondContact O-CB 3.35Å; F215-S219 PolarHBondContact O-N 3.46Å; F215-S219 PolarHBondContact O-OG 3.37Å; M216-S219 WeakPolarHBondContact O-CB 3.34Å; M216-S219 PolarHBondContact O-N 2.9Å; L217-S219 VanDerWaalsContact C-N 3.34Å; L217-S219 PolarHBondContact O-N 3.06Å; S219-N223 PolarHBondContact O-N 2.75Å; S219-N223 VanDerWaalsContact O-N 3.12Å; S219-N223 PolarHBondContact O-ND2 3.08Å
220	L	94.7	Very high	94.1	Very high	37 Å²	37	37.3 Å²	37.3	19%	0.194	18%	0.18	C	C	.	.	H	α-helix	trans	-60.9	-49	173.7	-76.5	173.1	0	0	0	111.9	A137 A140 F141 M216 L217 F218 L222 N223 L224	A137-L220 WeakPolarHBondContact O-CD2 3.37Å; A140-L220 HydrophobicContact CB-CD2 3.9Å; A140-L220 HydrophobicContact CB-CG 3.97Å; F141-L220 HydrophobicContact CB-CD2 3.86Å; M216-L220 PolarHBondContact O-N 2.94Å; L217-L220 PolarHBondContact O-N 2.9Å; F218-L220 VanDerWaalsContact C-N 3.32Å; F218-L220 PolarHBondContact O-N 3.46Å; L220-L222 PolarHBondContact O-N 3.45Å; L220-N223 PolarHBondContact O-N 2.84Å; L220-L224 PolarHBondContact O-N 2.74Å; L220-L224 VanDerWaalsContact O-N 3.16Å
221	Y	95.4	Very high	94.2	Very high	51 Å²	51	37.7 Å²	37.7	20%	0.2	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-42.9	179.5	-174.2	-105.5	0	0	0	112.2	L217 F218 N223 L224 V225 F270 V273 V274	L217-Y221 PolarHBondContact O-N 3.3Å; F218-Y221 PolarHBondContact O-N 3.01Å; Y221-N223 VanDerWaalsContact C-N 3.33Å; Y221-N223 PolarHBondContact O-N 2.86Å; Y221-L224 HydrophobicContact CE2-CD2 4.39Å; Y221-L224 WeakPolarHBondContact O-CB 3.48Å; Y221-L224 PolarHBondContact O-N 3.24Å; Y221-V225 HydrophobicContact CD1-CG2 4.4Å; Y221-V225 HydrophobicContact CE1-CG2 3.91Å; Y221-V225 PolarHBondContact O-N 3.26Å; Y221-V225 VanDerWaalsContact O-N 3.08Å; Y221-F270 PolarHBondContact OH-O 3.32Å; Y221-V273 HydrophobicContact CE1-CB 4.04Å; Y221-V273 HydrophobicContact CE1-CG1 3.59Å; Y221-V273 HydrophobicContact CE2-CG1 4.39Å; Y221-V273 VanDerWaalsContact OH-CB 3.26Å; Y221-V273 WeakPolarHBondContact OH-CB 3.45Å; Y221-V273 VanDerWaalsContact OH-CG1 3.25Å; Y221-V273 WeakPolarHBondContact OH-CG1 3.37Å; Y221-V274 HydrophobicContact CD1-CG2 3.76Å; Y221-V274 HydrophobicContact CE1-CB 4.35Å; Y221-V274 HydrophobicContact CE1-CG2 3.43Å; Y221-V274 VanDerWaalsContact CE1-CG2 3.43Å
222	L	95.2	Very high	94.2	Very high	21 Å²	21	39.1 Å²	39.1	11%	0.11	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-43.3	178	-177.5	65.4	0	0	0	111.5	F218 L220 L224 V225 H226 V274	F218-L222 HydrophobicContact CE1-CB 4.45Å; F218-L222 HydrophobicContact CE1-CD2 3.98Å; F218-L222 HydrophobicContact CZ-CB 4.45Å; F218-L222 HydrophobicContact CZ-CD1 4.44Å; F218-L222 HydrophobicContact CZ-CD2 4.23Å; F218-L222 WeakPolarHBondContact O-CB 3.48Å; F218-L222 PolarHBondContact O-N 2.91Å; L220-L222 PolarHBondContact O-N 3.45Å; L222-L224 VanDerWaalsContact C-N 3.34Å; L222-L224 PolarHBondContact O-N 3.47Å; L222-V225 PolarHBondContact O-N 2.8Å; L222-H226 PolarHBondContact O-N 3.47Å; L222-V274 HydrophobicContact CD1-CG1 3.75Å; L222-V274 HydrophobicContact CD1-CG2 4.47Å
223	N	94.6	Very high	94.1	Very high	16 Å²	16	42 Å²	42	9%	0.086	20%	0.202	C	C	.	.	H	α-helix	trans	-67.4	-32.8	177.9	-74.9	-62.8	0	0	0	113	S133 A137 S219 L220 Y221 V225 H226 F227	S133-N223 WeakPolarHBondContact CA-OD1 3.35Å; S133-N223 WeakPolarHBondContact CB-OD1 3.29Å; S133-N223 PolarHBondContact O-OD1 2.8Å; S133-N223 VanDerWaalsContact O-OD1 3.08Å; A137-N223 HydrophobicContact CB-CB 3.69Å; S219-N223 PolarHBondContact O-N 2.75Å; S219-N223 VanDerWaalsContact O-N 3.12Å; S219-N223 PolarHBondContact O-ND2 3.08Å; L220-N223 PolarHBondContact O-N 2.84Å; Y221-N223 VanDerWaalsContact C-N 3.33Å; Y221-N223 PolarHBondContact O-N 2.86Å; N223-V225 VanDerWaalsContact C-N 3.35Å; N223-H226 PolarHBondContact O-N 3.42Å; N223-F227 PolarHBondContact O-N 3.46Å
224	L	94.3	Very high	94.1	Very high	97 Å²	97	39.7 Å²	39.7	51%	0.508	19%	0.189	S	C	.	.	H	α-helix	trans	-61.5	-44.8	170.8	-175.5	108.3	0	0	0	110.9	L220 Y221 L222 F227 I228	L220-L224 PolarHBondContact O-N 2.74Å; L220-L224 VanDerWaalsContact O-N 3.16Å; Y221-L224 HydrophobicContact CE2-CD2 4.39Å; Y221-L224 WeakPolarHBondContact O-CB 3.48Å; Y221-L224 PolarHBondContact O-N 3.24Å; L222-L224 VanDerWaalsContact C-N 3.34Å; L222-L224 PolarHBondContact O-N 3.47Å; L224-F227 WeakPolarHBondContact O-CB 3.47Å; L224-F227 PolarHBondContact O-N 3.42Å; L224-I228 HydrophobicContact CD2-CD1 4.46Å; L224-I228 PolarHBondContact O-N 2.98Å
225	V	95.6	Very high	94	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-37.8	177.1	177.8	0	0	0	0	111.6	Y221 L222 N223 F227 I228 Q229 F270 L271 V274	Y221-V225 HydrophobicContact CD1-CG2 4.4Å; Y221-V225 HydrophobicContact CE1-CG2 3.91Å; Y221-V225 PolarHBondContact O-N 3.26Å; Y221-V225 VanDerWaalsContact O-N 3.08Å; L222-V225 PolarHBondContact O-N 2.8Å; N223-V225 VanDerWaalsContact C-N 3.35Å; V225-F227 VanDerWaalsContact C-N 3.3Å; V225-F227 PolarHBondContact O-N 3.21Å; V225-I228 PolarHBondContact O-N 3.38Å; V225-Q229 HydrophobicContact CG1-CG 4.34Å; V225-Q229 WeakPolarHBondContact O-CG 3.38Å; V225-Q229 PolarHBondContact O-N 3.47Å; V225-F270 HydrophobicContact CG2-CB 4.06Å; V225-L271 HydrophobicContact CG1-CD2 4.07Å; V225-L271 HydrophobicContact CG1-CG 4.42Å; V225-V274 HydrophobicContact CB-CG2 3.96Å; V225-V274 HydrophobicContact CG1-CG2 4.09Å; V225-V274 HydrophobicContact CG2-CG2 3.59Å
226	H	94.2	Very high	93.9	Very high	30 Å²	30	40 Å²	40	14%	0.139	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-40.8	171.7	-75.5	172.1	0	0	0	112.4	S133 L222 N223 Q229 F230	S133-H226 PolarHBondContact OG-ND1 3.36Å; L222-H226 PolarHBondContact O-N 3.47Å; N223-H226 PolarHBondContact O-N 3.42Å; H226-Q229 PolarHBondContact O-N 3.24Å; H226-F230 WeakPolarHBondContact O-CB 3.47Å; H226-F230 PolarHBondContact O-N 2.98Å
227	F	94.8	Very high	93.6	Very high	113 Å²	113	40.3 Å²	40.3	50%	0.496	20%	0.198	S	C	.	.	H	α-helix	trans	-60.7	-46.1	175.3	179.9	-88.4	0	0	0	111.7	I130 N223 L224 V225 Q229 F230 Q231	I130-F227 HydrophobicContact CD1-CB 4.13Å; I130-F227 HydrophobicContact CD1-CD2 3.89Å; I130-F227 HydrophobicContact CD1-CG 4.44Å; I130-F227 HydrophobicContact CG1-CD2 4.47Å; N223-F227 PolarHBondContact O-N 3.46Å; L224-F227 WeakPolarHBondContact O-CB 3.47Å; L224-F227 PolarHBondContact O-N 3.42Å; V225-F227 VanDerWaalsContact C-N 3.3Å; V225-F227 PolarHBondContact O-N 3.21Å; F227-Q229 PolarHBondContact O-N 2.98Å; F227-F230 PolarHBondContact O-N 2.97Å; F227-Q231 HydrophobicContact CD1-CG 4.4Å; F227-Q231 HydrophobicContact CE1-CG 4.02Å; F227-Q231 HydrophobicContact CZ-CG 4.26Å; F227-Q231 WeakPolarHBondContact O-CG 3.31Å; F227-Q231 PolarHBondContact O-N 3.49Å; F227-Q231 VanDerWaalsContact O-N 3.12Å
228	I	94.6	Very high	93.4	Very high	33 Å²	33	41 Å²	41	17%	0.169	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-45.8	176.9	-65.4	171.4	0	0	0	110.8	L224 V225 Q231 Y232 I267 F270	L224-I228 HydrophobicContact CD2-CD1 4.46Å; L224-I228 PolarHBondContact O-N 2.98Å; V225-I228 PolarHBondContact O-N 3.38Å; I228-Q231 PolarHBondContact O-N 3.17Å; I228-Y232 PolarHBondContact O-N 2.91Å; I228-I267 HydrophobicContact CG2-CB 4.43Å; I228-I267 HydrophobicContact CG2-CG1 3.82Å; I228-I267 HydrophobicContact CG2-CG2 4.13Å; I228-F270 HydrophobicContact CD1-CD1 4.16Å; I228-F270 HydrophobicContact CD1-CD2 4.27Å; I228-F270 HydrophobicContact CD1-CE1 4.38Å; I228-F270 HydrophobicContact CD1-CE2 4.48Å; I228-F270 HydrophobicContact CD1-CG 4.1Å
229	Q	94.1	Very high	93	Very high	57 Å²	57	44.4 Å²	44.4	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-63	-42.1	177.5	-73.7	-176.6	-38.2	0	0	112.1	V225 H226 F227 Q231 Y232 Q233 I267	V225-Q229 HydrophobicContact CG1-CG 4.34Å; V225-Q229 WeakPolarHBondContact O-CG 3.38Å; V225-Q229 PolarHBondContact O-N 3.47Å; H226-Q229 PolarHBondContact O-N 3.24Å; F227-Q229 PolarHBondContact O-N 2.98Å; Q229-Q231 PolarHBondContact O-N 2.99Å; Q229-Y232 WeakPolarHBondContact O-CB 3.45Å; Q229-Y232 PolarHBondContact O-N 2.99Å; Q229-Q233 VanDerWaalsContact O-CG 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.21Å; Q229-Q233 PolarHBondContact O-N 3.35Å; Q229-I267 HydrophobicContact CG-CG2 4.27Å
230	F	93.8	Very high	92.5	Very high	28 Å²	28	44.9 Å²	44.9	12%	0.123	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-49.3	177.9	167.4	-100.2	0	0	0	111.2	E126 I130 H226 F227 Y232 Q233 I234	E126-F230 HydrophobicContact CB-CD2 3.97Å; E126-F230 HydrophobicContact CB-CE2 3.85Å; E126-F230 WeakPolarHBondContact O-CD2 3.2Å; E126-F230 VanDerWaalsContact O-CE2 3.27Å; E126-F230 WeakPolarHBondContact O-CE2 3.34Å; I130-F230 HydrophobicContact CB-CB 4.46Å; I130-F230 HydrophobicContact CB-CD1 4.13Å; I130-F230 HydrophobicContact CB-CD2 3.86Å; I130-F230 HydrophobicContact CB-CE1 4.35Å; I130-F230 HydrophobicContact CB-CE2 4.08Å; I130-F230 HydrophobicContact CB-CG 3.87Å; I130-F230 HydrophobicContact CB-CZ 4.32Å; I130-F230 HydrophobicContact CD1-CB 4.17Å; I130-F230 HydrophobicContact CD1-CD1 4.33Å; I130-F230 HydrophobicContact CD1-CG 4.27Å; I130-F230 HydrophobicContact CG1-CB 4.49Å; I130-F230 HydrophobicContact CG1-CD1 3.92Å; I130-F230 HydrophobicContact CG1-CE1 4.27Å; I130-F230 HydrophobicContact CG1-CG 4.05Å; I130-F230 HydrophobicContact CG2-CD1 4.32Å; I130-F230 HydrophobicContact CG2-CD2 3.99Å; I130-F230 HydrophobicContact CG2-CE1 4.04Å; I130-F230 HydrophobicContact CG2-CE2 3.67Å; I130-F230 HydrophobicContact CG2-CG 4.3Å; I130-F230 HydrophobicContact CG2-CZ 3.7Å; H226-F230 WeakPolarHBondContact O-CB 3.47Å; H226-F230 PolarHBondContact O-N 2.98Å; F227-F230 PolarHBondContact O-N 2.97Å; F230-Y232 PolarHBondContact O-N 3.47Å; F230-Q233 PolarHBondContact O-N 2.8Å; F230-Q233 VanDerWaalsContact O-N 3.16Å; F230-I234 HydrophobicContact CD2-CG1 3.9Å; F230-I234 HydrophobicContact CE1-CG1 4.34Å; F230-I234 HydrophobicContact CE2-CD1 4.16Å; F230-I234 HydrophobicContact CE2-CG1 3.37Å; F230-I234 HydrophobicContact CZ-CG1 3.63Å; F230-I234 WeakPolarHBondContact O-CB 3.31Å; F230-I234 PolarHBondContact O-N 3.4Å
231	Q	93.4	Very high	92	Very high	86 Å²	86	46.5 Å²	46.5	40%	0.402	22%	0.217	S	C	.	.	H	α-helix	trans	-57.2	-41	178.2	-69.4	-63.4	-12.9	0	0	111.9	F227 I228 Q229 S235	F227-Q231 HydrophobicContact CD1-CG 4.4Å; F227-Q231 HydrophobicContact CE1-CG 4.02Å; F227-Q231 HydrophobicContact CZ-CG 4.26Å; F227-Q231 WeakPolarHBondContact O-CG 3.31Å; F227-Q231 PolarHBondContact O-N 3.49Å; F227-Q231 VanDerWaalsContact O-N 3.12Å; I228-Q231 PolarHBondContact O-N 3.17Å; Q229-Q231 PolarHBondContact O-N 2.99Å; Q231-S235 WeakPolarHBondContact O-CB 3.43Å; Q231-S235 PolarHBondContact O-N 3.37Å; Q231-S235 PolarHBondContact O-OG 3.4Å
232	Y	93.1	Very high	91.3	Very high	32 Å²	32	47 Å²	47	13%	0.125	23%	0.225	C	C	.	.	H	α-helix	trans	-65.5	-48.7	175	167.6	-100.2	0	0	0	113.2	I228 Q229 F230 S235 C236 M260 R263 I264 I267	I228-Y232 PolarHBondContact O-N 2.91Å; Q229-Y232 WeakPolarHBondContact O-CB 3.45Å; Q229-Y232 PolarHBondContact O-N 2.99Å; F230-Y232 PolarHBondContact O-N 3.47Å; Y232-S235 PolarHBondContact O-N 3.32Å; Y232-C236 VanDerWaalsContact O-CB 3.23Å; Y232-C236 WeakPolarHBondContact O-CB 3.37Å; Y232-C236 PolarHBondContact O-N 3.27Å; Y232-M260 HydrophobicContact CE2-CG 4.38Å; Y232-M260 WeakPolarHBondContact OH-CG 3.44Å; Y232-R263 HydrophobicContact CD2-CB 3.74Å; Y232-R263 HydrophobicContact CE2-CB 4Å; Y232-I264 HydrophobicContact CE2-CG1 3.78Å; Y232-I264 VanDerWaalsContact OH-CD1 3.31Å; Y232-I264 WeakPolarHBondContact OH-CD1 3.17Å; Y232-I264 VanDerWaalsContact OH-CG1 3.23Å; Y232-I264 WeakPolarHBondContact OH-CG1 3.32Å; Y232-I267 HydrophobicContact CD1-CD1 3.92Å; Y232-I267 HydrophobicContact CD2-CD1 3.56Å; Y232-I267 HydrophobicContact CE2-CD1 4.39Å; Y232-I267 HydrophobicContact CG-CD1 3.28Å
233	Q	92.1	Very high	90.5	Very high	74 Å²	74	47.3 Å²	47.3	35%	0.346	23%	0.227	S	C	.	.	H	α-helix	trans	-64.8	-45.6	-177	-69.3	-64.5	-12.5	0	0	111.7	Q229 F230 C236 L237	Q229-Q233 VanDerWaalsContact O-CG 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.21Å; Q229-Q233 PolarHBondContact O-N 3.35Å; F230-Q233 PolarHBondContact O-N 2.8Å; F230-Q233 VanDerWaalsContact O-N 3.16Å; Q233-C236 PolarHBondContact O-N 3.13Å; Q233-L237 VanDerWaalsContact O-CB 3.31Å; Q233-L237 WeakPolarHBondContact O-CB 3.47Å; Q233-L237 PolarHBondContact O-N 3.38Å
234	I	91.8	Very high	89.6	Confident	22 Å²	22	46.9 Å²	46.9	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-48.4	176.1	-80	-57.8	0	0	0	110.7	N123 E126 F230 C236 L237 Y238	N123-I234 WeakPolarHBondContact OD1-CD1 3.38Å; E126-I234 HydrophobicContact CB-CD1 3.74Å; E126-I234 HydrophobicContact CB-CG1 4.09Å; E126-I234 HydrophobicContact CG-CD1 4.17Å; F230-I234 HydrophobicContact CD2-CG1 3.9Å; F230-I234 HydrophobicContact CE1-CG1 4.34Å; F230-I234 HydrophobicContact CE2-CD1 4.16Å; F230-I234 HydrophobicContact CE2-CG1 3.37Å; F230-I234 HydrophobicContact CZ-CG1 3.63Å; F230-I234 WeakPolarHBondContact O-CB 3.31Å; F230-I234 PolarHBondContact O-N 3.4Å; I234-C236 VanDerWaalsContact C-N 3.26Å; I234-C236 PolarHBondContact O-N 2.89Å; I234-L237 HydrophobicContact CD1-CD2 4.4Å; I234-L237 WeakPolarHBondContact O-CB 3.39Å; I234-L237 PolarHBondContact O-N 3.33Å; I234-L237 VanDerWaalsContact O-N 3.11Å; I234-Y238 HydrophobicContact CD1-CE2 4.4Å; I234-Y238 HydrophobicContact CG2-CD2 3.76Å; I234-Y238 HydrophobicContact CG2-CE2 3.78Å; I234-Y238 VanDerWaalsContact O-CD2 3.29Å; I234-Y238 WeakPolarHBondContact O-CD2 3.18Å; I234-Y238 PolarHBondContact O-N 3.44Å
235	S	92	Very high	88.4	Confident	44 Å²	44	46 Å²	46	31%	0.308	23%	0.227	S	C	.	.	H	α-helix	trans	-58.9	-40.4	177.9	-63.7	0	0	0	0	112.1	Q231 Y232 K239	Q231-S235 WeakPolarHBondContact O-CB 3.43Å; Q231-S235 PolarHBondContact O-N 3.37Å; Q231-S235 PolarHBondContact O-OG 3.4Å; Y232-S235 PolarHBondContact O-N 3.32Å; S235-K239 WeakPolarHBondContact O-CB 3.43Å; S235-K239 VanDerWaalsContact O-CG 3.31Å; S235-K239 WeakPolarHBondContact O-CG 3.39Å; S235-K239 PolarHBondContact O-N 2.95Å; S235-K239 VanDerWaalsContact O-N 3.09Å
236	C	90.5	Very high	86.9	Confident	13 Å²	13	52.2 Å²	52.2	9%	0.088	25%	0.25	C	S	.	.	H	α-helix	trans	-64.3	-45.3	176.2	-175.4	0	0	0	0	111.1	Y232 Q233 I234 K239 L240 W259	Y232-C236 VanDerWaalsContact O-CB 3.23Å; Y232-C236 WeakPolarHBondContact O-CB 3.37Å; Y232-C236 PolarHBondContact O-N 3.27Å; Q233-C236 PolarHBondContact O-N 3.13Å; I234-C236 VanDerWaalsContact C-N 3.26Å; I234-C236 PolarHBondContact O-N 2.89Å; C236-K239 PolarHBondContact O-N 3.4Å; C236-L240 WeakPolarHBondContact O-CB 3.25Å; C236-L240 VanDerWaalsContact O-CG 3.29Å; C236-L240 WeakPolarHBondContact O-CG 3.35Å; C236-L240 PolarHBondContact O-N 3.12Å; C236-W259 HydrophobicContact CB-CH2 4.3Å; C236-W259 HydrophobicContact CB-CZ3 4.2Å
237	L	88	Confident	85.4	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-48	179.9	-178.8	61.6	0	0	0	112.3	F119 K122 N123 Q233 I234 L240 R241	F119-L237 HydrophobicContact CD2-CD1 3.84Å; F119-L237 HydrophobicContact CD2-CG 4.13Å; F119-L237 HydrophobicContact CE2-CD1 3.63Å; F119-L237 HydrophobicContact CE2-CD2 4.07Å; F119-L237 HydrophobicContact CE2-CG 3.46Å; F119-L237 VanDerWaalsContact CE2-CG 3.46Å; F119-L237 HydrophobicContact CZ-CD2 4.26Å; F119-L237 HydrophobicContact CZ-CG 3.97Å; K122-L237 HydrophobicContact CB-CD2 4.48Å; K122-L237 HydrophobicContact CD-CD1 3.84Å; K122-L237 HydrophobicContact CD-CD2 4.29Å; K122-L237 HydrophobicContact CG-CD1 4.49Å; K122-L237 HydrophobicContact CG-CD2 4.07Å; N123-L237 HydrophobicContact CB-CD2 4.39Å; Q233-L237 VanDerWaalsContact O-CB 3.31Å; Q233-L237 WeakPolarHBondContact O-CB 3.47Å; Q233-L237 PolarHBondContact O-N 3.38Å; I234-L237 HydrophobicContact CD1-CD2 4.4Å; I234-L237 WeakPolarHBondContact O-CB 3.39Å; I234-L237 PolarHBondContact O-N 3.33Å; I234-L237 VanDerWaalsContact O-N 3.11Å; L237-L240 PolarHBondContact O-N 3.4Å; L237-R241 PolarHBondContact O-N 3.21Å
238	Y	88.7	Confident	83.6	Confident	91 Å²	91	55.4 Å²	55.4	36%	0.357	27%	0.274	S	S	.	.	H	α-helix	trans	-67	-40.2	178	-79.5	-81.7	0	0	0	112.2	F119 N123 I234 R241 T242	F119-Y238 HydrophobicContact CE1-CE1 4.35Å; F119-Y238 HydrophobicContact CZ-CD1 4.16Å; F119-Y238 HydrophobicContact CZ-CE1 4.05Å; N123-Y238 PolarHBondContact ND2-OH 3.1Å; N123-Y238 PolarHBondContact OD1-OH 3.3Å; I234-Y238 HydrophobicContact CD1-CE2 4.4Å; I234-Y238 HydrophobicContact CG2-CD2 3.76Å; I234-Y238 HydrophobicContact CG2-CE2 3.78Å; I234-Y238 VanDerWaalsContact O-CD2 3.29Å; I234-Y238 WeakPolarHBondContact O-CD2 3.18Å; I234-Y238 PolarHBondContact O-N 3.44Å; Y238-R241 WeakPolarHBondContact O-CB 3.29Å; Y238-R241 PolarHBondContact O-N 2.79Å; Y238-T242 WeakPolarHBondContact O-CG2 3.49Å; Y238-T242 PolarHBondContact O-N 2.96Å; Y238-T242 PolarHBondContact O-OG1 3.13Å
239	K	88.4	Confident	81.9	Confident	74 Å²	74	61.6 Å²	61.6	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-43.6	175.5	-76.5	-175.9	177.7	-150.8	0	112.3	S235 C236 R241 T242 L243 F256 W259	S235-K239 WeakPolarHBondContact O-CB 3.43Å; S235-K239 VanDerWaalsContact O-CG 3.31Å; S235-K239 WeakPolarHBondContact O-CG 3.39Å; S235-K239 PolarHBondContact O-N 2.95Å; S235-K239 VanDerWaalsContact O-N 3.09Å; C236-K239 PolarHBondContact O-N 3.4Å; K239-R241 VanDerWaalsContact C-N 3.31Å; K239-R241 PolarHBondContact O-N 3.19Å; K239-T242 WeakPolarHBondContact CA-OG1 3.33Å; K239-T242 PolarHBondContact O-N 3.04Å; K239-T242 VanDerWaalsContact O-N 3.16Å; K239-T242 PolarHBondContact O-OG1 3.4Å; K239-L243 WeakPolarHBondContact O-CG 3.45Å; K239-L243 PolarHBondContact O-N 3.42Å; K239-F256 HydrophobicContact CB-CD2 3.78Å; K239-F256 HydrophobicContact CB-CE2 3.73Å; K239-F256 HydrophobicContact CD-CD2 4.19Å; K239-F256 HydrophobicContact CD-CE2 4.46Å; K239-W259 HydrophobicContact CD-CD2 3.79Å; K239-W259 HydrophobicContact CD-CE3 3.7Å; K239-W259 HydrophobicContact CD-CG 4.48Å; K239-W259 HydrophobicContact CD-CH2 4.04Å; K239-W259 HydrophobicContact CD-CZ2 4.08Å; K239-W259 HydrophobicContact CD-CZ3 3.84Å
240	L	83.5	Confident	80.3	Confident	17 Å²	17	63.7 Å²	63.7	9%	0.089	32%	0.318	C	S	.	.	H	α-helix	trans	-60.5	-40.9	174.9	-75.2	169.2	0	0	0	111.9	C236 L237 L243 G244 F256 Y341	C236-L240 WeakPolarHBondContact O-CB 3.25Å; C236-L240 VanDerWaalsContact O-CG 3.29Å; C236-L240 WeakPolarHBondContact O-CG 3.35Å; C236-L240 PolarHBondContact O-N 3.12Å; L237-L240 PolarHBondContact O-N 3.4Å; L240-L243 HydrophobicContact CD2-CD1 4.44Å; L240-L243 PolarHBondContact O-N 3.06Å; L240-G244 PolarHBondContact O-N 3.02Å; L240-G244 VanDerWaalsContact O-N 3.13Å; L240-F256 HydrophobicContact CD1-CZ 4.16Å; L240-F256 HydrophobicContact CD2-CD1 4.46Å; L240-F256 HydrophobicContact CD2-CE1 3.69Å; L240-F256 HydrophobicContact CD2-CE2 4.19Å; L240-F256 HydrophobicContact CD2-CZ 3.53Å; L240-F256 HydrophobicContact CG-CE1 4.27Å; L240-F256 HydrophobicContact CG-CE2 4Å; L240-F256 HydrophobicContact CG-CZ 3.58Å; L240-Y341 HydrophobicContact CB-CD1 4.23Å; L240-Y341 HydrophobicContact CB-CD2 3.99Å; L240-Y341 HydrophobicContact CB-CE1 4.21Å; L240-Y341 HydrophobicContact CB-CE2 3.96Å; L240-Y341 HydrophobicContact CB-CG 4.13Å; L240-Y341 HydrophobicContact CD1-CE2 3.93Å; L240-Y341 HydrophobicContact CD2-CD2 4.24Å; L240-Y341 HydrophobicContact CD2-CE2 4.03Å; L240-Y341 HydrophobicContact CG-CE2 4.2Å; L240-Y341 WeakPolarHBondContact O-CB 3.47Å
241	R	83.8	Confident	78.7	Confident	70 Å²	70	66 Å²	66	26%	0.264	33%	0.33	S	S	.	.	H	α-helix	trans	-59.5	-46.6	172.1	174.9	171.7	-177	155.2	8.9	111.7	E116 F119 L237 Y238 K239 L243 G244 C245 F343	E116-R241 VanDerWaalsContact CD-NH2 3.31Å; E116-R241 IonicContact OE1-CZ 3.39Å; E116-R241 IonicContact OE1-NH1 2.86Å; E116-R241 PolarHBondContact OE1-NH1 3.49Å; E116-R241 IonicContact OE1-NH2 3.03Å; E116-R241 PolarHBondContact OE1-NH2 2.79Å; E116-R241 IonicContact OE2-CZ 3.39Å; E116-R241 IonicContact OE2-NH1 3.51Å; E116-R241 IonicContact OE2-NH2 2.87Å; E116-R241 PolarHBondContact OE2-NH2 3.19Å; F119-R241 HydrophobicContact CD2-CB 4.31Å; F119-R241 HydrophobicContact CE2-CB 3.68Å; F119-R241 HydrophobicContact CE2-CG 4.17Å; F119-R241 HydrophobicContact CZ-CB 4.25Å; F119-R241 VanDerWaalsContact CZ-CD 3.45Å; F119-R241 HydrophobicContact CZ-CG 4.47Å; L237-R241 PolarHBondContact O-N 3.21Å; Y238-R241 WeakPolarHBondContact O-CB 3.29Å; Y238-R241 PolarHBondContact O-N 2.79Å; K239-R241 VanDerWaalsContact C-N 3.31Å; K239-R241 PolarHBondContact O-N 3.19Å; R241-L243 VanDerWaalsContact C-N 3.31Å; R241-L243 PolarHBondContact O-N 3.16Å; R241-G244 PolarHBondContact O-N 3.33Å; R241-C245 PolarHBondContact O-N 3.44Å; R241-C245 PolarHBondContact O-SG 2.92Å; R241-F343 HydrophobicContact CB-CE2 4.43Å; R241-F343 HydrophobicContact CG-CE2 3.84Å; R241-F343 HydrophobicContact CG-CZ 4.46Å
242	T	81.1	Confident	77.5	Confident	61 Å²	61	66.3 Å²	66.3	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-66.3	-30.4	179	57.2	0	0	0	0	113.8	Y238 K239 R246	Y238-T242 WeakPolarHBondContact O-CG2 3.49Å; Y238-T242 PolarHBondContact O-N 2.96Å; Y238-T242 PolarHBondContact O-OG1 3.13Å; K239-T242 WeakPolarHBondContact CA-OG1 3.33Å; K239-T242 PolarHBondContact O-N 3.04Å; K239-T242 VanDerWaalsContact O-N 3.16Å; K239-T242 PolarHBondContact O-OG1 3.4Å; T242-R246 PolarHBondContact O-N 3.35Å
243	L	77.4	Confident	76.4	Confident	29 Å²	29	65.7 Å²	65.7	15%	0.152	34%	0.338	C	S	.	.	H	α-helix	trans	-70.9	-32.8	175.2	-72.1	166.9	0	0	0	112.2	K239 L240 R241 I251 F256	K239-L243 WeakPolarHBondContact O-CG 3.45Å; K239-L243 PolarHBondContact O-N 3.42Å; L240-L243 HydrophobicContact CD2-CD1 4.44Å; L240-L243 PolarHBondContact O-N 3.06Å; R241-L243 VanDerWaalsContact C-N 3.31Å; R241-L243 PolarHBondContact O-N 3.16Å; L243-I251 HydrophobicContact CD2-CB 4.15Å; L243-I251 HydrophobicContact CD2-CG2 3.56Å; L243-F256 HydrophobicContact CD1-CB 3.63Å; L243-F256 HydrophobicContact CD1-CD1 4.02Å; L243-F256 HydrophobicContact CD1-CD2 3.78Å; L243-F256 HydrophobicContact CD1-CE2 4.46Å; L243-F256 HydrophobicContact CD1-CG 3.52Å
244	G	76	Confident	75.5	Confident	6 Å²	6	67.3 Å²	67.3	6%	0.062	35%	0.349	C	S	.	.	H	α-helix	trans	-77.3	-30.2	178.1	0	0	0	0	0	114.1	L240 R241 Y341 S342	L240-G244 PolarHBondContact O-N 3.02Å; L240-G244 VanDerWaalsContact O-N 3.13Å; R241-G244 PolarHBondContact O-N 3.33Å; G244-Y341 WeakPolarHBondContact CA-O 3.44Å; G244-S342 VanDerWaalsContact O-CA 3.26Å; G244-S342 WeakPolarHBondContact O-CA 3.41Å; G244-S342 VanDerWaalsContact O-CB 3.32Å; G244-S342 WeakPolarHBondContact O-CB 3.45Å; G244-S342 PolarHBondContact O-OG 2.86Å
245	C	69.4	Low	75	Confident	80 Å²	80	68.3 Å²	68.3	54%	0.541	37%	0.365	S	S	.	.	H	α-helix	trans	-85.3	-10.7	-179.7	-63.3	0	0	0	0	114.8	R241	R241-C245 PolarHBondContact O-N 3.44Å; R241-C245 PolarHBondContact O-SG 2.92Å
246	R	64.7	Low	74.5	Confident	132 Å²	132	66.9 Å²	66.9	50%	0.498	35%	0.353	S	S	.	.	S	Bend	trans	-92.1	156.2	-175.2	-86.6	-164.5	161.4	101.7	1.9	112.6	T242	T242-R246 PolarHBondContact O-N 3.35Å
247	H	61.2	Low	74	Confident	122 Å²	122	67.7 Å²	67.7	57%	0.565	36%	0.356	S	S	*	.			trans	-59.7	135.9	169.9	-166.6	68.2	0	0	0	108.6	M249 D250	H247-M249 PolarHBondContact O-N 3.49Å; H247-D250 PolarHBondContact O-N 2.9Å
248	P	58.9	Low	73.8	Confident	88 Å²	88	71.3 Å²	71.3	57%	0.571	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-18.3	-171.4	19	-33.2	0	0	0	114.8
249	M	58.3	Low	73.8	Confident	162 Å²	162	68.3 Å²	68.3	80%	0.798	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.5	176.8	-76	178	57.1	0	0	115.5	H247 I251	H247-M249 PolarHBondContact O-N 3.49Å; M249-I251 PolarHBondContact O-N 3.49Å
250	D	59.8	Low	73.7	Confident	102 Å²	102	65.6 Å²	65.6	55%	0.545	36%	0.358	S	S	.	.	S	Bend	trans	-78.9	-24	-164.4	-74	-17.2	0	0	0	114.6	H247	H247-D250 PolarHBondContact O-N 2.9Å
251	I	60.5	Low	73.8	Confident	75 Å²	75	68.6 Å²	68.6	39%	0.385	37%	0.371	S	S	.	.	S	Bend	trans	-147.5	126	-178.3	-68.7	178.1	0	0	0	109.9	L243 M249	L243-I251 HydrophobicContact CD2-CB 4.15Å; L243-I251 HydrophobicContact CD2-CG2 3.56Å; M249-I251 PolarHBondContact O-N 3.49Å
252	T	67.5	Low	74	Confident	93 Å²	93	73.4 Å²	73.4	57%	0.571	39%	0.389	S	S	*	.			trans	-69.4	133.9	170.8	59.6	0	0	0	0	110.4	D254 G255	T252-D254 PolarHBondContact O-N 3.03Å; T252-D254 VanDerWaalsContact O-N 3.08Å; T252-G255 PolarHBondContact O-N 2.97Å; T252-G255 VanDerWaalsContact O-N 3.08Å
253	V	70.1	Confident	74.5	Confident	20 Å²	20	76 Å²	76	12%	0.121	39%	0.392	C	S	.	.	H	α-helix	trans	-55.1	-26.5	173.4	175.4	0	0	0	0	111.2	G255 F256 M257 H334	V253-G255 VanDerWaalsContact C-N 3.35Å; V253-G255 PolarHBondContact O-N 2.98Å; V253-F256 PolarHBondContact O-N 3.26Å; V253-M257 HydrophobicContact CG1-CE 3.92Å; V253-M257 HydrophobicContact CG1-CG 4.13Å; V253-M257 WeakPolarHBondContact O-CG 3.4Å; V253-M257 PolarHBondContact O-N 3.09Å; V253-H334 VanDerWaalsContact CG2-CD2 3.4Å; V253-H334 WeakPolarHBondContact CG2-CD2 3.46Å
254	D	74.5	Confident	75.1	Confident	108 Å²	108	76.1 Å²	76.1	58%	0.578	39%	0.392	S	S	*	.	H	α-helix	trans	-59.5	-40.1	176.8	-59.6	-37	0	0	0	113.1	T252 F256 M257 S258	T252-D254 PolarHBondContact O-N 3.03Å; T252-D254 VanDerWaalsContact O-N 3.08Å; D254-F256 VanDerWaalsContact C-N 3.31Å; D254-F256 PolarHBondContact O-N 3.37Å; D254-M257 PolarHBondContact O-N 3.38Å; D254-S258 WeakPolarHBondContact O-CB 3.49Å; D254-S258 PolarHBondContact O-N 2.95Å
255	G	80.6	Confident	75.8	Confident	43 Å²	43	80.3 Å²	80.3	44%	0.443	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-38.7	177.3	0	0	0	0	0	112.3	T252 V253 W259	T252-G255 PolarHBondContact O-N 2.97Å; T252-G255 VanDerWaalsContact O-N 3.08Å; V253-G255 VanDerWaalsContact C-N 3.35Å; V253-G255 PolarHBondContact O-N 2.98Å; G255-W259 WeakPolarHBondContact O-CB 3.39Å; G255-W259 PolarHBondContact O-N 3.4Å; G255-W259 VanDerWaalsContact O-N 3.13Å
256	F	81.6	Confident	76.9	Confident	13 Å²	13	81.9 Å²	81.9	6%	0.057	41%	0.414	C	S	.	.	H	α-helix	trans	-68.5	-44.2	174	171.3	-98.8	0	0	0	112	K239 L240 L243 V253 D254 W259 M260	K239-F256 HydrophobicContact CB-CD2 3.78Å; K239-F256 HydrophobicContact CB-CE2 3.73Å; K239-F256 HydrophobicContact CD-CD2 4.19Å; K239-F256 HydrophobicContact CD-CE2 4.46Å; L240-F256 HydrophobicContact CD1-CZ 4.16Å; L240-F256 HydrophobicContact CD2-CD1 4.46Å; L240-F256 HydrophobicContact CD2-CE1 3.69Å; L240-F256 HydrophobicContact CD2-CE2 4.19Å; L240-F256 HydrophobicContact CD2-CZ 3.53Å; L240-F256 HydrophobicContact CG-CE1 4.27Å; L240-F256 HydrophobicContact CG-CE2 4Å; L240-F256 HydrophobicContact CG-CZ 3.58Å; L243-F256 HydrophobicContact CD1-CB 3.63Å; L243-F256 HydrophobicContact CD1-CD1 4.02Å; L243-F256 HydrophobicContact CD1-CD2 3.78Å; L243-F256 HydrophobicContact CD1-CE2 4.46Å; L243-F256 HydrophobicContact CD1-CG 3.52Å; V253-F256 PolarHBondContact O-N 3.26Å; D254-F256 VanDerWaalsContact C-N 3.31Å; D254-F256 PolarHBondContact O-N 3.37Å; F256-W259 HydrophobicContact CD2-CE3 4.25Å; F256-W259 HydrophobicContact CE2-CE3 4.18Å; F256-W259 HydrophobicContact CE2-CZ3 4.1Å; F256-W259 PolarHBondContact O-N 3.26Å; F256-M260 HydrophobicContact CE1-SD 4.36Å; F256-M260 WeakPolarHBondContact O-CB 3.16Å; F256-M260 PolarHBondContact O-N 2.91Å
257	M	80	Confident	78.3	Confident	30 Å²	30	76.1 Å²	76.1	15%	0.148	39%	0.393	C	S	.	.	H	α-helix	trans	-62.7	-47.8	179.4	-68.7	-60.6	162.9	0	0	111.2	V253 D254 W259 M260 F261 L333 L337	V253-M257 HydrophobicContact CG1-CE 3.92Å; V253-M257 HydrophobicContact CG1-CG 4.13Å; V253-M257 WeakPolarHBondContact O-CG 3.4Å; V253-M257 PolarHBondContact O-N 3.09Å; D254-M257 PolarHBondContact O-N 3.38Å; M257-W259 VanDerWaalsContact C-N 3.34Å; M257-W259 PolarHBondContact O-N 2.86Å; M257-M260 WeakPolarHBondContact O-CB 3.32Å; M257-M260 PolarHBondContact O-N 3.35Å; M257-M260 VanDerWaalsContact O-N 3.12Å; M257-M260 HydrophobicContact SD-CE 3.48Å; M257-M260 WeakPolarHBondContact SD-CE 3.27Å; M257-F261 WeakPolarHBondContact O-CD2 3.46Å; M257-F261 PolarHBondContact O-N 3.33Å; M257-L333 HydrophobicContact CE-CD2 4.03Å; M257-L337 HydrophobicContact CE-CD1 3.37Å
258	S	83.9	Confident	79.8	Confident	81 Å²	81	72.5 Å²	72.5	57%	0.566	38%	0.378	S	S	*	.	H	α-helix	trans	-56.5	-46.2	175.5	176.5	0	0	0	0	111.9	D254 M260 F261 R262	D254-S258 WeakPolarHBondContact O-CB 3.49Å; D254-S258 PolarHBondContact O-N 2.95Å; S258-M260 PolarHBondContact O-N 3.34Å; S258-F261 PolarHBondContact O-N 3.39Å; S258-R262 WeakPolarHBondContact O-CB 3.13Å; S258-R262 PolarHBondContact O-N 2.9Å
259	W	87.9	Confident	81.5	Confident	29 Å²	29	71.7 Å²	71.7	11%	0.11	37%	0.372	C	S	.	.	H	α-helix	trans	-60.8	-44.6	174.5	172	89.1	0	0	0	112.5	C236 K239 G255 F256 M257 R263	C236-W259 HydrophobicContact CB-CH2 4.3Å; C236-W259 HydrophobicContact CB-CZ3 4.2Å; K239-W259 HydrophobicContact CD-CD2 3.79Å; K239-W259 HydrophobicContact CD-CE3 3.7Å; K239-W259 HydrophobicContact CD-CG 4.48Å; K239-W259 HydrophobicContact CD-CH2 4.04Å; K239-W259 HydrophobicContact CD-CZ2 4.08Å; K239-W259 HydrophobicContact CD-CZ3 3.84Å; G255-W259 WeakPolarHBondContact O-CB 3.39Å; G255-W259 PolarHBondContact O-N 3.4Å; G255-W259 VanDerWaalsContact O-N 3.13Å; F256-W259 HydrophobicContact CD2-CE3 4.25Å; F256-W259 HydrophobicContact CE2-CE3 4.18Å; F256-W259 HydrophobicContact CE2-CZ3 4.1Å; F256-W259 PolarHBondContact O-N 3.26Å; M257-W259 VanDerWaalsContact C-N 3.34Å; M257-W259 PolarHBondContact O-N 2.86Å; W259-R263 HydrophobicContact CD2-CG 4.34Å; W259-R263 HydrophobicContact CZ2-CG 4Å; W259-R263 WeakPolarHBondContact O-CG 3.35Å; W259-R263 PolarHBondContact O-N 2.71Å; W259-R263 VanDerWaalsContact O-N 3.09Å
260	M	87	Confident	83.3	Confident	16 Å²	16	67 Å²	67	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-63.1	-48.4	-179.6	179.5	-169.3	60.5	0	0	110.5	Y232 F256 M257 S258 R263 I264 K324	Y232-M260 HydrophobicContact CE2-CG 4.38Å; Y232-M260 WeakPolarHBondContact OH-CG 3.44Å; F256-M260 HydrophobicContact CE1-SD 4.36Å; F256-M260 WeakPolarHBondContact O-CB 3.16Å; F256-M260 PolarHBondContact O-N 2.91Å; M257-M260 WeakPolarHBondContact O-CB 3.32Å; M257-M260 PolarHBondContact O-N 3.35Å; M257-M260 VanDerWaalsContact O-N 3.12Å; M257-M260 HydrophobicContact SD-CE 3.48Å; M257-M260 WeakPolarHBondContact SD-CE 3.27Å; S258-M260 PolarHBondContact O-N 3.34Å; M260-R263 PolarHBondContact O-N 2.79Å; M260-I264 HydrophobicContact CG-CD1 3.76Å; M260-I264 HydrophobicContact CG-CG1 4.36Å; M260-I264 VanDerWaalsContact O-CG1 3.3Å; M260-I264 WeakPolarHBondContact O-CG1 3.28Å; M260-I264 PolarHBondContact O-N 3.46Å; M260-I264 HydrophobicContact SD-CD1 4.26Å; M260-K324 PolarHBondContact SD-NZ 2.91Å
261	F	85.1	Confident	85	Confident	81 Å²	81	63.3 Å²	63.3	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-60	-48.3	178.4	-85.6	-72.4	0	0	0	111.7	M257 S258 R263 I264 T265 K324	M257-F261 WeakPolarHBondContact O-CD2 3.46Å; M257-F261 PolarHBondContact O-N 3.33Å; S258-F261 PolarHBondContact O-N 3.39Å; F261-R263 VanDerWaalsContact C-N 3.26Å; F261-R263 PolarHBondContact O-N 3.31Å; F261-I264 PolarHBondContact O-N 2.76Å; F261-I264 VanDerWaalsContact O-N 3.16Å; F261-T265 PolarHBondContact O-N 3.13Å; F261-T265 PolarHBondContact O-OG1 3.06Å; F261-T265 VanDerWaalsContact O-OG1 3.05Å; F261-K324 HydrophobicContact CE1-CB 3.84Å; F261-K324 HydrophobicContact CZ-CB 4.11Å; F261-K324 VanDerWaalsContact CZ-O 3.31Å; F261-K324 WeakPolarHBondContact CZ-O 3.35Å
262	R	89.6	Confident	86.7	Confident	171 Å²	171	62.9 Å²	62.9	65%	0.645	32%	0.324	S	S	*	.	H	α-helix	trans	-56.5	-40.8	177.4	-175.5	171.3	63.5	150.5	-3.8	112.2	S258 F266	S258-R262 WeakPolarHBondContact O-CB 3.13Å; S258-R262 PolarHBondContact O-N 2.9Å; R262-F266 PolarHBondContact O-N 3.11Å
263	R	90	Very high	88	Confident	116 Å²	116	62.2 Å²	62.2	44%	0.438	32%	0.319	S	S	.	.	H	α-helix	trans	-73.4	-38.4	177.8	-68.5	-64.9	-171.6	-175.2	1.8	112.8	Y232 W259 M260 F261 F266 I267	Y232-R263 HydrophobicContact CD2-CB 3.74Å; Y232-R263 HydrophobicContact CE2-CB 4Å; W259-R263 HydrophobicContact CD2-CG 4.34Å; W259-R263 HydrophobicContact CZ2-CG 4Å; W259-R263 WeakPolarHBondContact O-CG 3.35Å; W259-R263 PolarHBondContact O-N 2.71Å; W259-R263 VanDerWaalsContact O-N 3.09Å; M260-R263 PolarHBondContact O-N 2.79Å; F261-R263 VanDerWaalsContact C-N 3.26Å; F261-R263 PolarHBondContact O-N 3.31Å; R263-F266 WeakPolarHBondContact O-CB 3.44Å; R263-F266 PolarHBondContact O-N 3.44Å; R263-I267 WeakPolarHBondContact O-CD1 3.46Å; R263-I267 WeakPolarHBondContact O-CG1 3.49Å; R263-I267 PolarHBondContact O-N 2.97Å; R263-I267 VanDerWaalsContact O-N 3.15Å
264	I	89.9	Confident	89.3	Confident	30 Å²	30	61.4 Å²	61.4	15%	0.154	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-47.6	174.6	-70.5	169.2	0	0	0	110.4	Y232 M260 F261 F266 I267 L268 K324	Y232-I264 HydrophobicContact CE2-CG1 3.78Å; Y232-I264 VanDerWaalsContact OH-CD1 3.31Å; Y232-I264 WeakPolarHBondContact OH-CD1 3.17Å; Y232-I264 VanDerWaalsContact OH-CG1 3.23Å; Y232-I264 WeakPolarHBondContact OH-CG1 3.32Å; M260-I264 HydrophobicContact CG-CD1 3.76Å; M260-I264 HydrophobicContact CG-CG1 4.36Å; M260-I264 VanDerWaalsContact O-CG1 3.3Å; M260-I264 WeakPolarHBondContact O-CG1 3.28Å; M260-I264 PolarHBondContact O-N 3.46Å; M260-I264 HydrophobicContact SD-CD1 4.26Å; F261-I264 PolarHBondContact O-N 2.76Å; F261-I264 VanDerWaalsContact O-N 3.16Å; I264-F266 PolarHBondContact O-N 3.27Å; I264-I267 PolarHBondContact O-N 3.47Å; I264-I267 VanDerWaalsContact O-N 3.08Å; I264-L268 VanDerWaalsContact O-CB 3.31Å; I264-L268 WeakPolarHBondContact O-CB 3.49Å; I264-L268 PolarHBondContact O-N 3.36Å; I264-K324 HydrophobicContact CD1-CD 3.66Å
265	T	91.2	Very high	90.3	Very high	94 Å²	94	56.8 Å²	56.8	58%	0.577	29%	0.289	S	S	*	.	H	α-helix	trans	-58.9	-34.2	178.6	-55.6	0	0	0	0	111.8	F261 P269	F261-T265 PolarHBondContact O-N 3.13Å; F261-T265 PolarHBondContact O-OG1 3.06Å; F261-T265 VanDerWaalsContact O-OG1 3.05Å; T265-P269 WeakPolarHBondContact O-CD 3.48Å
266	F	92.7	Very high	91.1	Very high	114 Å²	114	56.5 Å²	56.5	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-69.4	-37.2	175	176.3	-99	0	0	0	113.8	R262 R263 I264 P269 F270	R262-F266 PolarHBondContact O-N 3.11Å; R263-F266 WeakPolarHBondContact O-CB 3.44Å; R263-F266 PolarHBondContact O-N 3.44Å; I264-F266 PolarHBondContact O-N 3.27Å; F266-P269 WeakPolarHBondContact O-CD 3.29Å; F266-F270 HydrophobicContact CE1-CE2 4.1Å; F266-F270 HydrophobicContact CE2-CE2 4.3Å; F266-F270 AromaticContact CZ-CE2 3.96Å; F266-F270 HydrophobicContact CZ-CE2 3.96Å; F266-F270 HydrophobicContact CZ-CZ 4.37Å; F266-F270 WeakPolarHBondContact O-CD2 3.46Å; F266-F270 WeakPolarHBondContact O-CE2 3.49Å
267	I	93.8	Very high	91.8	Very high	11 Å²	11	57.7 Å²	57.7	6%	0.056	29%	0.291	C	S	.	.	H	α-helix	trans	-81	-30.9	-175.5	-60.2	161.3	0	0	0	111.5	I228 Q229 Y232 R263 I264 F270 L271	I228-I267 HydrophobicContact CG2-CB 4.43Å; I228-I267 HydrophobicContact CG2-CG1 3.82Å; I228-I267 HydrophobicContact CG2-CG2 4.13Å; Q229-I267 HydrophobicContact CG-CG2 4.27Å; Y232-I267 HydrophobicContact CD1-CD1 3.92Å; Y232-I267 HydrophobicContact CD2-CD1 3.56Å; Y232-I267 HydrophobicContact CE2-CD1 4.39Å; Y232-I267 HydrophobicContact CG-CD1 3.28Å; R263-I267 WeakPolarHBondContact O-CD1 3.46Å; R263-I267 WeakPolarHBondContact O-CG1 3.49Å; R263-I267 PolarHBondContact O-N 2.97Å; R263-I267 VanDerWaalsContact O-N 3.15Å; I264-I267 PolarHBondContact O-N 3.47Å; I264-I267 VanDerWaalsContact O-N 3.08Å; I267-F270 WeakPolarHBondContact O-CB 3.35Å; I267-F270 PolarHBondContact O-N 2.74Å; I267-F270 VanDerWaalsContact O-N 3.12Å; I267-L271 HydrophobicContact CG2-CD1 3.7Å; I267-L271 HydrophobicContact CG2-CG 4.16Å; I267-L271 PolarHBondContact O-N 3.23Å
268	L	93.4	Very high	92.6	Very high	45 Å²	45	57.2 Å²	57.2	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-54.7	-43.5	-173.1	178	154.8	0	0	0	114.2	I264 F270 L271 F272 I321	I264-L268 VanDerWaalsContact O-CB 3.31Å; I264-L268 WeakPolarHBondContact O-CB 3.49Å; I264-L268 PolarHBondContact O-N 3.36Å; L268-F270 PolarHBondContact O-N 3.44Å; L268-L271 WeakPolarHBondContact O-CB 3.33Å; L268-L271 PolarHBondContact O-N 3.37Å; L268-F272 HydrophobicContact CD1-CE2 4.24Å; L268-F272 HydrophobicContact CD2-CD2 3.49Å; L268-F272 VanDerWaalsContact CD2-CD2 3.49Å; L268-F272 HydrophobicContact CD2-CE2 3.45Å; L268-F272 VanDerWaalsContact CD2-CE2 3.45Å; L268-F272 HydrophobicContact CG-CD2 3.82Å; L268-F272 HydrophobicContact CG-CE2 3.6Å; L268-F272 VanDerWaalsContact O-CD2 3.29Å; L268-F272 WeakPolarHBondContact O-CD2 3.32Å; L268-F272 PolarHBondContact O-N 3.43Å; L268-I321 HydrophobicContact CD1-CD1 3.36Å; L268-I321 HydrophobicContact CD1-CG1 3.85Å; L268-I321 HydrophobicContact CG-CD1 4.33Å
269	P	95.1	Very high	93.2	Very high	71 Å²	71	56 Å²	56	46%	0.461	28%	0.275	S	S	.	.	H	α-helix	trans	-57.3	-44.4	174.9	-26.8	34.6	0	0	0	113.3	T265 F266 L271 F272 V273	T265-P269 WeakPolarHBondContact O-CD 3.48Å; F266-P269 WeakPolarHBondContact O-CD 3.29Å; P269-L271 VanDerWaalsContact C-N 3.3Å; P269-L271 PolarHBondContact O-N 2.92Å; P269-F272 PolarHBondContact O-N 2.97Å; P269-V273 WeakPolarHBondContact O-CG2 3.46Å; P269-V273 PolarHBondContact O-N 2.88Å
270	F	95.9	Very high	93.6	Very high	63 Å²	63	60.5 Å²	60.5	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-38	178.6	-59.3	-81.4	0	0	0	111.8	Y221 V225 I228 F266 I267 L268 V273 V274	Y221-F270 PolarHBondContact OH-O 3.32Å; V225-F270 HydrophobicContact CG2-CB 4.06Å; I228-F270 HydrophobicContact CD1-CD1 4.16Å; I228-F270 HydrophobicContact CD1-CD2 4.27Å; I228-F270 HydrophobicContact CD1-CE1 4.38Å; I228-F270 HydrophobicContact CD1-CE2 4.48Å; I228-F270 HydrophobicContact CD1-CG 4.1Å; F266-F270 HydrophobicContact CE1-CE2 4.1Å; F266-F270 HydrophobicContact CE2-CE2 4.3Å; F266-F270 AromaticContact CZ-CE2 3.96Å; F266-F270 HydrophobicContact CZ-CE2 3.96Å; F266-F270 HydrophobicContact CZ-CZ 4.37Å; F266-F270 WeakPolarHBondContact O-CD2 3.46Å; F266-F270 WeakPolarHBondContact O-CE2 3.49Å; I267-F270 WeakPolarHBondContact O-CB 3.35Å; I267-F270 PolarHBondContact O-N 2.74Å; I267-F270 VanDerWaalsContact O-N 3.12Å; L268-F270 PolarHBondContact O-N 3.44Å; F270-V273 PolarHBondContact O-N 3.42Å; F270-V274 WeakPolarHBondContact O-CG2 3.45Å; F270-V274 PolarHBondContact O-N 3.02Å; F270-V274 VanDerWaalsContact O-N 3.13Å
271	L	95.2	Very high	94.1	Very high	25 Å²	25	59.7 Å²	59.7	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-44.7	174.7	-76.1	161.4	0	0	0	112.3	V225 I267 L268 P269 V273 V274 Y275	V225-L271 HydrophobicContact CG1-CD2 4.07Å; V225-L271 HydrophobicContact CG1-CG 4.42Å; I267-L271 HydrophobicContact CG2-CD1 3.7Å; I267-L271 HydrophobicContact CG2-CG 4.16Å; I267-L271 PolarHBondContact O-N 3.23Å; L268-L271 WeakPolarHBondContact O-CB 3.33Å; L268-L271 PolarHBondContact O-N 3.37Å; P269-L271 VanDerWaalsContact C-N 3.3Å; P269-L271 PolarHBondContact O-N 2.92Å; L271-V273 VanDerWaalsContact C-N 3.29Å; L271-V273 PolarHBondContact O-N 3.4Å; L271-V274 WeakPolarHBondContact O-CB 3.41Å; L271-V274 PolarHBondContact O-N 2.96Å; L271-V274 VanDerWaalsContact O-N 3.16Å; L271-Y275 HydrophobicContact CB-CE2 3.95Å; L271-Y275 WeakPolarHBondContact CD2-OH 3.43Å; L271-Y275 WeakPolarHBondContact O-CD2 3.27Å; L271-Y275 WeakPolarHBondContact O-CE2 3.35Å; L271-Y275 VanDerWaalsContact O-CG 3.28Å; L271-Y275 PolarHBondContact O-N 3.27Å
272	F	95	Very high	94.6	Very high	67 Å²	67	56 Å²	56	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-34.4	177.7	-84.3	-69.7	0	0	0	112.7	L268 P269 Y275 G276 V317 L318 I321	L268-F272 HydrophobicContact CD1-CE2 4.24Å; L268-F272 HydrophobicContact CD2-CD2 3.49Å; L268-F272 VanDerWaalsContact CD2-CD2 3.49Å; L268-F272 HydrophobicContact CD2-CE2 3.45Å; L268-F272 VanDerWaalsContact CD2-CE2 3.45Å; L268-F272 HydrophobicContact CG-CD2 3.82Å; L268-F272 HydrophobicContact CG-CE2 3.6Å; L268-F272 VanDerWaalsContact O-CD2 3.29Å; L268-F272 WeakPolarHBondContact O-CD2 3.32Å; L268-F272 PolarHBondContact O-N 3.43Å; P269-F272 PolarHBondContact O-N 2.97Å; F272-Y275 HydrophobicContact CD1-CD2 4.42Å; F272-Y275 PolarHBondContact O-N 2.86Å; F272-G276 PolarHBondContact O-N 3.16Å; F272-V317 HydrophobicContact CE2-CG1 4.44Å; F272-V317 HydrophobicContact CZ-CG1 4.31Å; F272-L318 HydrophobicContact CZ-CD2 4.09Å; F272-I321 HydrophobicContact CE2-CD1 4.38Å; F272-I321 HydrophobicContact CZ-CD1 4.47Å
273	V	96.5	Very high	95	Very high	78 Å²	78	55 Å²	55	47%	0.473	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-40.7	172.8	175.2	0	0	0	0	111	Y221 P269 F270 L271 Y275 G276 F277	Y221-V273 HydrophobicContact CE1-CB 4.04Å; Y221-V273 HydrophobicContact CE1-CG1 3.59Å; Y221-V273 HydrophobicContact CE2-CG1 4.39Å; Y221-V273 VanDerWaalsContact OH-CB 3.26Å; Y221-V273 WeakPolarHBondContact OH-CB 3.45Å; Y221-V273 VanDerWaalsContact OH-CG1 3.25Å; Y221-V273 WeakPolarHBondContact OH-CG1 3.37Å; P269-V273 WeakPolarHBondContact O-CG2 3.46Å; P269-V273 PolarHBondContact O-N 2.88Å; F270-V273 PolarHBondContact O-N 3.42Å; L271-V273 VanDerWaalsContact C-N 3.29Å; L271-V273 PolarHBondContact O-N 3.4Å; V273-Y275 PolarHBondContact O-N 3.4Å; V273-G276 PolarHBondContact O-N 3.3Å; V273-F277 WeakPolarHBondContact O-CB 3.15Å; V273-F277 PolarHBondContact O-N 2.99Å
274	V	96.9	Very high	95.3	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.024	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-50.6	173.8	174.1	0	0	0	0	110.4	F218 Y221 L222 V225 F270 L271 G276 F277 E278	F218-V274 HydrophobicContact CE2-CG1 3.96Å; F218-V274 HydrophobicContact CZ-CG1 4.22Å; Y221-V274 HydrophobicContact CD1-CG2 3.76Å; Y221-V274 HydrophobicContact CE1-CB 4.35Å; Y221-V274 HydrophobicContact CE1-CG2 3.43Å; Y221-V274 VanDerWaalsContact CE1-CG2 3.43Å; L222-V274 HydrophobicContact CD1-CG1 3.75Å; L222-V274 HydrophobicContact CD1-CG2 4.47Å; V225-V274 HydrophobicContact CB-CG2 3.96Å; V225-V274 HydrophobicContact CG1-CG2 4.09Å; V225-V274 HydrophobicContact CG2-CG2 3.59Å; F270-V274 WeakPolarHBondContact O-CG2 3.45Å; F270-V274 PolarHBondContact O-N 3.02Å; F270-V274 VanDerWaalsContact O-N 3.13Å; L271-V274 WeakPolarHBondContact O-CB 3.41Å; L271-V274 PolarHBondContact O-N 2.96Å; L271-V274 VanDerWaalsContact O-N 3.16Å; V274-G276 VanDerWaalsContact C-N 3.32Å; V274-G276 PolarHBondContact O-N 3.26Å; V274-F277 CarbonylContact O-C 3.58Å; V274-F277 WeakPolarHBondContact O-CB 3.43Å; V274-F277 PolarHBondContact O-N 2.91Å; V274-F277 VanDerWaalsContact O-N 3.12Å; V274-E278 HydrophobicContact CG1-CG 4.41Å; V274-E278 WeakPolarHBondContact O-CG 3.28Å; V274-E278 PolarHBondContact O-N 3.48Å
275	Y	96	Very high	95.5	Very high	10 Å²	10	49 Å²	49	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-35	-177.7	-50.9	-36.9	0	0	0	112.6	L271 F272 V273 F277 E278 L279 S313 I314 V317	L271-Y275 HydrophobicContact CB-CE2 3.95Å; L271-Y275 WeakPolarHBondContact CD2-OH 3.43Å; L271-Y275 WeakPolarHBondContact O-CD2 3.27Å; L271-Y275 WeakPolarHBondContact O-CE2 3.35Å; L271-Y275 VanDerWaalsContact O-CG 3.28Å; L271-Y275 PolarHBondContact O-N 3.27Å; F272-Y275 HydrophobicContact CD1-CD2 4.42Å; F272-Y275 PolarHBondContact O-N 2.86Å; V273-Y275 PolarHBondContact O-N 3.4Å; Y275-F277 VanDerWaalsContact C-N 3.35Å; Y275-E278 PolarHBondContact O-N 3.4Å; Y275-L279 PolarHBondContact O-N 2.94Å; Y275-S313 VanDerWaalsContact CE1-CB 3.43Å; Y275-I314 HydrophobicContact CD2-CG1 4.07Å; Y275-I314 HydrophobicContact CG-CG1 4.16Å; Y275-V317 HydrophobicContact CE2-CB 4.33Å; Y275-V317 HydrophobicContact CE2-CG2 3.79Å; Y275-V317 WeakPolarHBondContact OH-CG2 3.2Å
276	G	96.7	Very high	95.8	Very high	37 Å²	37	50.7 Å²	50.7	38%	0.381	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-41.1	171.4	0	0	0	0	0	112.1	F272 V273 V274 L279 Y280	F272-G276 PolarHBondContact O-N 3.16Å; V273-G276 PolarHBondContact O-N 3.3Å; V274-G276 VanDerWaalsContact C-N 3.32Å; V274-G276 PolarHBondContact O-N 3.26Å; G276-L279 PolarHBondContact O-N 3.23Å; G276-Y280 WeakPolarHBondContact O-CB 3.49Å; G276-Y280 PolarHBondContact O-N 3.23Å
277	F	96.5	Very high	95.9	Very high	39 Å²	39	47.7 Å²	47.7	17%	0.171	24%	0.236	C	C	.	.	H	α-helix	trans	-65.5	-43.7	174	-154.5	148.4	0	0	0	110.7	L217 F218 V273 V274 Y275 L279 Y280 M281	L217-F277 HydrophobicContact CB-CZ 4.42Å; L217-F277 HydrophobicContact CD2-CE1 4.35Å; L217-F277 HydrophobicContact CD2-CZ 4.1Å; L217-F277 HydrophobicContact CG-CE1 4.24Å; L217-F277 HydrophobicContact CG-CZ 4.14Å; F218-F277 HydrophobicContact CB-CD2 4.27Å; F218-F277 HydrophobicContact CB-CE1 4.41Å; F218-F277 HydrophobicContact CB-CE2 3.95Å; F218-F277 HydrophobicContact CB-CZ 4.02Å; F218-F277 HydrophobicContact CD2-CB 4.01Å; F218-F277 HydrophobicContact CD2-CD1 4.21Å; F218-F277 AromaticContact CD2-CD2 3.94Å; F218-F277 HydrophobicContact CD2-CD2 3.94Å; F218-F277 HydrophobicContact CD2-CE2 4.46Å; F218-F277 AromaticContact CD2-CG 3.8Å; F218-F277 HydrophobicContact CD2-CG 3.8Å; F218-F277 HydrophobicContact CE2-CB 4.32Å; V273-F277 WeakPolarHBondContact O-CB 3.15Å; V273-F277 PolarHBondContact O-N 2.99Å; V274-F277 CarbonylContact O-C 3.58Å; V274-F277 WeakPolarHBondContact O-CB 3.43Å; V274-F277 PolarHBondContact O-N 2.91Å; V274-F277 VanDerWaalsContact O-N 3.12Å; Y275-F277 VanDerWaalsContact C-N 3.35Å; F277-L279 VanDerWaalsContact C-N 3.31Å; F277-L279 PolarHBondContact O-N 3.39Å; F277-Y280 HydrophobicContact CD2-CD1 4.29Å; F277-Y280 HydrophobicContact CE2-CD1 4.3Å; F277-Y280 CarbonylContact O-C 3.59Å; F277-Y280 WeakPolarHBondContact O-CA 3.36Å; F277-Y280 WeakPolarHBondContact O-CB 3.34Å; F277-Y280 PolarHBondContact O-N 3.4Å; F277-M281 HydrophobicContact CD2-CG 3.86Å; F277-M281 HydrophobicContact CE2-CG 3.93Å; F277-M281 HydrophobicContact CE2-SD 4.39Å; F277-M281 PolarHBondContact O-N 2.88Å
278	E	96.6	Very high	95.9	Very high	20 Å²	20	47.8 Å²	47.8	9%	0.093	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-42.4	174.8	-70.3	178.1	158.1	0	0	112.1	F218 V274 Y275 M281 A282 Y306 A310	F218-E278 HydrophobicContact CE2-CG 3.55Å; F218-E278 HydrophobicContact CZ-CG 3.44Å; F218-E278 VanDerWaalsContact CZ-CG 3.44Å; V274-E278 HydrophobicContact CG1-CG 4.41Å; V274-E278 WeakPolarHBondContact O-CG 3.28Å; V274-E278 PolarHBondContact O-N 3.48Å; Y275-E278 PolarHBondContact O-N 3.4Å; E278-M281 PolarHBondContact O-N 3.49Å; E278-A282 WeakPolarHBondContact O-CB 3.21Å; E278-A282 PolarHBondContact O-N 3.39Å; E278-Y306 HydrophobicContact CB-CD1 4.5Å; E278-Y306 HydrophobicContact CG-CD1 4.47Å; E278-A310 HydrophobicContact CB-CB 3.64Å; E278-A310 WeakPolarHBondContact OE2-CA 3.31Å
279	L	96.8	Very high	96	Very high	54 Å²	54	46.9 Å²	46.9	28%	0.283	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-42	173	-76.5	174.8	0	0	0	112.2	Y275 G276 F277 A282 Y283 F307 A310 M311 I314	Y275-L279 PolarHBondContact O-N 2.94Å; G276-L279 PolarHBondContact O-N 3.23Å; F277-L279 VanDerWaalsContact C-N 3.31Å; F277-L279 PolarHBondContact O-N 3.39Å; L279-A282 WeakPolarHBondContact O-CB 3.28Å; L279-A282 PolarHBondContact O-N 2.88Å; L279-Y283 PolarHBondContact O-N 3.03Å; L279-F307 HydrophobicContact CD2-CD2 4.01Å; L279-F307 HydrophobicContact CD2-CE2 4.27Å; L279-A310 HydrophobicContact CB-CB 4.47Å; L279-A310 HydrophobicContact CD2-CB 3.66Å; L279-A310 HydrophobicContact CG-CB 3.58Å; L279-M311 HydrophobicContact CD2-CG 4.32Å; L279-M311 HydrophobicContact CD2-SD 4.3Å; L279-I314 HydrophobicContact CD1-CD1 3.84Å
280	Y	96.5	Very high	95.9	Very high	124 Å²	124	49.4 Å²	49.4	49%	0.486	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-43	176.8	177	-110.5	0	0	0	111.8	G276 F277 Y283 N284	G276-Y280 WeakPolarHBondContact O-CB 3.49Å; G276-Y280 PolarHBondContact O-N 3.23Å; F277-Y280 HydrophobicContact CD2-CD1 4.29Å; F277-Y280 HydrophobicContact CE2-CD1 4.3Å; F277-Y280 CarbonylContact O-C 3.59Å; F277-Y280 WeakPolarHBondContact O-CA 3.36Å; F277-Y280 WeakPolarHBondContact O-CB 3.34Å; F277-Y280 PolarHBondContact O-N 3.4Å; Y280-Y283 PolarHBondContact O-N 3.35Å; Y280-N284 WeakPolarHBondContact CE1-ND2 3.43Å; Y280-N284 WeakPolarHBondContact O-CB 3.32Å; Y280-N284 PolarHBondContact O-N 3.49Å; Y280-N284 PolarHBondContact OH-ND2 3Å
281	M	96.3	Very high	95.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-42.5	173.4	-72.2	-160.1	-59.3	0	0	111.9	F211 F218 F277 E278 Y283 N284 L285 Y306	F211-M281 HydrophobicContact CE2-CB 4.12Å; F211-M281 HydrophobicContact CE2-CG 4.19Å; F211-M281 HydrophobicContact CE2-SD 4.02Å; F211-M281 HydrophobicContact CZ-SD 3.95Å; F218-M281 HydrophobicContact CB-CE 3.94Å; F218-M281 HydrophobicContact CB-SD 3.64Å; F218-M281 HydrophobicContact CD1-CE 3.31Å; F218-M281 HydrophobicContact CD1-SD 4.07Å; F218-M281 HydrophobicContact CD2-CE 3.63Å; F218-M281 HydrophobicContact CD2-SD 4.33Å; F218-M281 HydrophobicContact CE1-CE 3.6Å; F218-M281 HydrophobicContact CE2-CE 3.91Å; F218-M281 HydrophobicContact CG-CE 3.31Å; F218-M281 HydrophobicContact CG-SD 3.75Å; F218-M281 HydrophobicContact CZ-CE 3.89Å; F277-M281 HydrophobicContact CD2-CG 3.86Å; F277-M281 HydrophobicContact CE2-CG 3.93Å; F277-M281 HydrophobicContact CE2-SD 4.39Å; F277-M281 PolarHBondContact O-N 2.88Å; E278-M281 PolarHBondContact O-N 3.49Å; M281-Y283 VanDerWaalsContact C-N 3.3Å; M281-Y283 PolarHBondContact O-N 3.37Å; M281-N284 PolarHBondContact O-N 2.87Å; M281-L285 WeakPolarHBondContact O-CB 3.22Å; M281-L285 WeakPolarHBondContact O-CG 3.5Å; M281-L285 PolarHBondContact O-N 3.41Å; M281-Y306 HydrophobicContact CE-CD1 3.78Å; M281-Y306 HydrophobicContact CE-CE1 3.28Å; M281-Y306 HydrophobicContact CE-CE2 4.2Å; M281-Y306 HydrophobicContact CE-CG 4.43Å
282	A	97.2	Very high	95.6	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.033	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-43.6	176.2	0	0	0	0	0	111.7	E278 L279 Y286 S303 F307	E278-A282 WeakPolarHBondContact O-CB 3.21Å; E278-A282 PolarHBondContact O-N 3.39Å; L279-A282 WeakPolarHBondContact O-CB 3.28Å; L279-A282 PolarHBondContact O-N 2.88Å; A282-Y286 WeakPolarHBondContact O-CB 3.46Å; A282-Y286 PolarHBondContact O-N 3.43Å; A282-S303 PolarHBondContact O-OG 3.46Å; A282-F307 HydrophobicContact CB-CB 3.96Å
283	Y	96.7	Very high	95.5	Very high	148 Å²	148	54.8 Å²	54.8	58%	0.58	28%	0.276	S	S	*	.	H	α-helix	trans	-65.3	-47.4	176.7	176.6	-100.8	0	0	0	112.2	L279 Y280 M281 L285 Y286 V287	L279-Y283 PolarHBondContact O-N 3.03Å; Y280-Y283 PolarHBondContact O-N 3.35Å; M281-Y283 VanDerWaalsContact C-N 3.3Å; M281-Y283 PolarHBondContact O-N 3.37Å; Y283-L285 PolarHBondContact O-N 2.94Å; Y283-Y286 WeakPolarHBondContact O-CB 3.34Å; Y283-Y286 PolarHBondContact O-N 3.03Å; Y283-Y286 VanDerWaalsContact O-N 3.15Å; Y283-V287 HydrophobicContact CD1-CG2 4.33Å; Y283-V287 HydrophobicContact CE1-CG2 3.86Å; Y283-V287 HydrophobicContact CE2-CG2 4.16Å; Y283-V287 WeakPolarHBondContact O-CG2 3.47Å; Y283-V287 PolarHBondContact O-N 2.98Å
284	N	95.6	Very high	95.1	Very high	21 Å²	21	51.9 Å²	51.9	11%	0.112	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-44.3	178.6	-75.5	-13.9	0	0	0	111.8	Q214 Y280 M281 Y286 V287 I288	Q214-N284 VanDerWaalsContact CD-ND2 3.29Å; Q214-N284 PolarHBondContact NE2-ND2 2.83Å; Q214-N284 VanDerWaalsContact NE2-ND2 3.17Å; Q214-N284 PolarHBondContact OE1-ND2 3.39Å; Y280-N284 WeakPolarHBondContact CE1-ND2 3.43Å; Y280-N284 WeakPolarHBondContact O-CB 3.32Å; Y280-N284 PolarHBondContact O-N 3.49Å; Y280-N284 PolarHBondContact OH-ND2 3Å; M281-N284 PolarHBondContact O-N 2.87Å; N284-Y286 VanDerWaalsContact C-N 3.29Å; N284-Y286 PolarHBondContact O-N 2.83Å; N284-V287 PolarHBondContact O-N 3.46Å; N284-V287 VanDerWaalsContact O-N 3.15Å; N284-I288 VanDerWaalsContact O-CG1 3.31Å; N284-I288 WeakPolarHBondContact O-CG1 3.39Å; N284-I288 PolarHBondContact O-N 2.88Å
285	L	96	Very high	94.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-38.6	174.9	-76.4	167.7	0	0	0	112	W202 F211 M281 Y283 I288 S289 V299 V302 Y306	W202-L285 HydrophobicContact CH2-CD2 3.61Å; W202-L285 HydrophobicContact CZ3-CD2 4.18Å; F211-L285 HydrophobicContact CB-CD2 4.25Å; F211-L285 HydrophobicContact CD1-CD2 4.01Å; F211-L285 HydrophobicContact CD2-CD1 4.27Å; F211-L285 HydrophobicContact CD2-CD2 3.59Å; F211-L285 HydrophobicContact CD2-CG 3.72Å; F211-L285 HydrophobicContact CE1-CD1 4.3Å; F211-L285 HydrophobicContact CE1-CD2 4.27Å; F211-L285 HydrophobicContact CE2-CD1 3.69Å; F211-L285 HydrophobicContact CE2-CD2 3.89Å; F211-L285 HydrophobicContact CE2-CG 3.61Å; F211-L285 HydrophobicContact CG-CD2 3.67Å; F211-L285 HydrophobicContact CG-CG 4.31Å; F211-L285 HydrophobicContact CZ-CD1 3.71Å; F211-L285 HydrophobicContact CZ-CD2 4.22Å; F211-L285 HydrophobicContact CZ-CG 4.1Å; M281-L285 WeakPolarHBondContact O-CB 3.22Å; M281-L285 WeakPolarHBondContact O-CG 3.5Å; M281-L285 PolarHBondContact O-N 3.41Å; Y283-L285 PolarHBondContact O-N 2.94Å; L285-I288 PolarHBondContact O-N 3.39Å; L285-S289 WeakPolarHBondContact O-CB 3.41Å; L285-S289 PolarHBondContact O-N 3.48Å; L285-V299 HydrophobicContact CB-CG1 4.39Å; L285-V299 HydrophobicContact CD2-CG1 3.75Å; L285-V299 WeakPolarHBondContact O-CG1 3.25Å; L285-V302 HydrophobicContact CD1-CB 4.22Å; L285-V302 HydrophobicContact CD1-CG1 3.66Å; L285-Y306 HydrophobicContact CD1-CD2 3.77Å; L285-Y306 HydrophobicContact CD1-CE2 4.18Å
286	Y	95.8	Very high	94.6	Very high	129 Å²	129	60.7 Å²	60.7	51%	0.506	30%	0.3	S	S	.	.	H	α-helix	trans	-60.4	-46.6	172.8	176.5	-101.2	0	0	0	111.1	A282 Y283 N284 I288 S289 Q290 S303	A282-Y286 WeakPolarHBondContact O-CB 3.46Å; A282-Y286 PolarHBondContact O-N 3.43Å; Y283-Y286 WeakPolarHBondContact O-CB 3.34Å; Y283-Y286 PolarHBondContact O-N 3.03Å; Y283-Y286 VanDerWaalsContact O-N 3.15Å; N284-Y286 VanDerWaalsContact C-N 3.29Å; N284-Y286 PolarHBondContact O-N 2.83Å; Y286-I288 PolarHBondContact O-N 2.98Å; Y286-S289 PolarHBondContact O-N 3.02Å; Y286-S289 PolarHBondContact O-OG 3.29Å; Y286-Q290 HydrophobicContact CE1-CG 4.44Å; Y286-Q290 WeakPolarHBondContact O-CG 3.26Å; Y286-Q290 PolarHBondContact O-N 3.44Å; Y286-S303 PolarHBondContact N-OG 3.27Å
287	V	96.1	Very high	94.5	Very high	52 Å²	52	66.2 Å²	66.2	32%	0.315	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-42.9	176.8	173.5	0	0	0	0	111.9	Y283 N284 S289 Q290	Y283-V287 HydrophobicContact CD1-CG2 4.33Å; Y283-V287 HydrophobicContact CE1-CG2 3.86Å; Y283-V287 HydrophobicContact CE2-CG2 4.16Å; Y283-V287 WeakPolarHBondContact O-CG2 3.47Å; Y283-V287 PolarHBondContact O-N 2.98Å; N284-V287 PolarHBondContact O-N 3.46Å; N284-V287 VanDerWaalsContact O-N 3.15Å; V287-S289 VanDerWaalsContact C-N 3.3Å; V287-S289 PolarHBondContact O-N 2.98Å; V287-Q290 PolarHBondContact O-N 3.5Å
288	I	94.2	Very high	94.5	Very high	12 Å²	12	65.2 Å²	65.2	6%	0.062	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-40.5	175.5	-67	167.1	0	0	0	110.2	E210 F211 N284 L285 Y286 Q290 Q291 C294 V299	E210-I288 HydrophobicContact CB-CD1 4.23Å; F211-I288 HydrophobicContact CB-CD1 4.35Å; N284-I288 VanDerWaalsContact O-CG1 3.31Å; N284-I288 WeakPolarHBondContact O-CG1 3.39Å; N284-I288 PolarHBondContact O-N 2.88Å; L285-I288 PolarHBondContact O-N 3.39Å; Y286-I288 PolarHBondContact O-N 2.98Å; I288-Q290 PolarHBondContact O-N 2.83Å; I288-Q291 WeakPolarHBondContact O-CB 3.4Å; I288-Q291 WeakPolarHBondContact O-CG 3.36Å; I288-Q291 PolarHBondContact O-N 3.2Å; I288-C294 WeakPolarHBondContact O-CB 3.34Å; I288-V299 HydrophobicContact CB-CG1 4.16Å; I288-V299 HydrophobicContact CG2-CG1 3.9Å
289	S	94	Very high	94.4	Very high	26 Å²	26	64.2 Å²	64.2	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-21.6	179.6	77.1	0	0	0	0	114.1	L285 Y286 V287	L285-S289 WeakPolarHBondContact O-CB 3.41Å; L285-S289 PolarHBondContact O-N 3.48Å; Y286-S289 PolarHBondContact O-N 3.02Å; Y286-S289 PolarHBondContact O-OG 3.29Å; V287-S289 VanDerWaalsContact C-N 3.3Å; V287-S289 PolarHBondContact O-N 2.98Å
290	Q	94.2	Very high	94.4	Very high	124 Å²	124	64 Å²	64	58%	0.579	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-6.7	177	-61.2	-62.4	-25.5	0	0	113.1	Y286 V287 I288	Y286-Q290 HydrophobicContact CE1-CG 4.44Å; Y286-Q290 WeakPolarHBondContact O-CG 3.26Å; Y286-Q290 PolarHBondContact O-N 3.44Å; V287-Q290 PolarHBondContact O-N 3.5Å; I288-Q290 PolarHBondContact O-N 2.83Å
291	Q	93.6	Very high	94.4	Very high	85 Å²	85	59.3 Å²	59.3	40%	0.397	29%	0.289	S	S	.	.	S	Bend	trans	-74.1	141.9	-179.4	-61.5	-60.5	-30.7	0	0	111.3	I288 Y293 C294	I288-Q291 WeakPolarHBondContact O-CB 3.4Å; I288-Q291 WeakPolarHBondContact O-CG 3.36Å; I288-Q291 PolarHBondContact O-N 3.2Å; Q291-Y293 HydrophobicContact CB-CD1 3.76Å; Q291-Y293 HydrophobicContact CB-CE1 3.42Å; Q291-Y293 VanDerWaalsContact CB-CE1 3.42Å; Q291-Y293 HydrophobicContact CB-CE2 4.38Å; Q291-Y293 HydrophobicContact CB-CG 4.39Å; Q291-Y293 HydrophobicContact CG-CE1 3.77Å; Q291-Y293 PolarHBondContact O-N 3.45Å; Q291-Y293 VanDerWaalsContact O-N 3.1Å; Q291-C294 WeakPolarHBondContact O-CB 3.35Å; Q291-C294 PolarHBondContact O-N 3.02Å
292	S	91.3	Very high	94.4	Very high	116 Å²	116	59.3 Å²	59.3	81%	0.811	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.2	-175.8	-50.1	0	0	0	0	114.5	H295	S292-H295 PolarHBondContact O-CE1 2.91Å
293	Y	91.4	Very high	94.3	Very high	68 Å²	68	59.5 Å²	59.5	27%	0.267	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-14.3	177.8	67.1	-104.3	0	0	0	113.1	R206 E210 Q291 H295	R206-Y293 HydrophobicContact CB-CD2 4.12Å; R206-Y293 HydrophobicContact CB-CE2 4.07Å; R206-Y293 HydrophobicContact CG-CD2 4.3Å; R206-Y293 HydrophobicContact CG-CE2 3.97Å; E210-Y293 PolarHBondContact OE1-OH 2.91Å; E210-Y293 PolarHBondContact OE2-OH 3.35Å; Q291-Y293 HydrophobicContact CB-CD1 3.76Å; Q291-Y293 HydrophobicContact CB-CE1 3.42Å; Q291-Y293 VanDerWaalsContact CB-CE1 3.42Å; Q291-Y293 HydrophobicContact CB-CE2 4.38Å; Q291-Y293 HydrophobicContact CB-CG 4.39Å; Q291-Y293 HydrophobicContact CG-CE1 3.77Å; Q291-Y293 PolarHBondContact O-N 3.45Å; Q291-Y293 VanDerWaalsContact O-N 3.1Å; Y293-H295 PolarHBondContact O-N 3.36Å
294	C	89.9	Confident	94.3	Very high	17 Å²	17	57.3 Å²	57.3	12%	0.115	29%	0.288	C	S	.	.			trans	-87.9	100.5	-174.5	-178.2	0	0	0	0	110.2	I288 Q291 V299	I288-C294 WeakPolarHBondContact O-CB 3.34Å; Q291-C294 WeakPolarHBondContact O-CB 3.35Å; Q291-C294 PolarHBondContact O-N 3.02Å; C294-V299 WeakPolarHBondContact SG-CG2 3.26Å
295	H	88.8	Confident	94.4	Very high	172 Å²	172	57.2 Å²	57.2	80%	0.796	29%	0.287	S	S	*	.			trans	-102.5	5.2	175	-59.3	-59.9	0	0	0	113.3	S292 Y293	S292-H295 PolarHBondContact O-CE1 2.91Å; Y293-H295 PolarHBondContact O-N 3.36Å
296	E	92.9	Very high	94.4	Very high	27 Å²	27	57.2 Å²	57.2	13%	0.126	29%	0.287	C	S	.	.			trans	-90.5	124.5	-171.7	-67.4	169.5	155.2	0	0	111.1	W202 P203 S205 S207 Q298 V299 P300	W202-E296 VanDerWaalsContact NE1-CD 3.33Å; W202-E296 PolarHBondContact NE1-OE2 3.49Å; P203-E296 HydrophobicContact CG-CG 4.44Å; P203-E296 WeakPolarHBondContact CG-OE1 3.4Å; S205-E296 WeakPolarHBondContact CB-OE1 3.18Å; S205-E296 PolarHBondContact OG-OE1 3.25Å; S205-E296 PolarHBondContact OG-OE2 3.05Å; S207-E296 PolarHBondContact OG-OE2 3.07Å; E296-Q298 PolarHBondContact O-N 2.93Å; E296-V299 HydrophobicContact CB-CG2 3.9Å; E296-P300 VanDerWaalsContact O-CD 3.3Å; E296-P300 WeakPolarHBondContact O-CD 3.34Å
297	W	94.6	Very high	94.5	Very high	152 Å²	152	56.4 Å²	56.4	58%	0.576	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-18.2	176.6	69.5	-91.9	0	0	0	112.5	I201 V299 P300 A301	I201-W297 HydrophobicContact CD1-CH2 4.04Å; I201-W297 HydrophobicContact CD1-CZ2 3.82Å; W297-V299 VanDerWaalsContact C-N 3.33Å; W297-V299 PolarHBondContact O-N 3.48Å; W297-P300 VanDerWaalsContact O-CD 3.3Å; W297-P300 WeakPolarHBondContact O-CD 3.26Å; W297-P300 WeakPolarHBondContact O-CG 3.4Å; W297-A301 HydrophobicContact CE3-CB 4.08Å; W297-A301 HydrophobicContact CZ3-CB 4.13Å; W297-A301 WeakPolarHBondContact O-CB 3.36Å; W297-A301 PolarHBondContact O-N 3.22Å
298	Q	96.1	Very high	94.6	Very high	18 Å²	18	57.5 Å²	57.5	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-40.2	179.4	-65.7	88.1	-24.7	0	0	111.6	I198 W202 E296 A301 V302	I198-Q298 HydrophobicContact CG2-CB 3.68Å; I198-Q298 HydrophobicContact CG2-CG 3.8Å; W202-Q298 HydrophobicContact CB-CB 4.49Å; W202-Q298 HydrophobicContact CB-CG 4.44Å; W202-Q298 HydrophobicContact CD2-CB 3.83Å; W202-Q298 HydrophobicContact CE3-CB 4.02Å; W202-Q298 HydrophobicContact CG-CB 4.02Å; W202-Q298 HydrophobicContact CG-CG 4.38Å; E296-Q298 PolarHBondContact O-N 2.93Å; Q298-A301 PolarHBondContact O-N 3.16Å; Q298-V302 VanDerWaalsContact O-CG2 3.31Å; Q298-V302 WeakPolarHBondContact O-CG2 3.3Å; Q298-V302 PolarHBondContact O-N 3.01Å
299	V	95	Very high	94.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-56.7	-176.3	-161.5	0	0	0	0	112.2	W202 L285 I288 C294 E296 W297 A301 V302 S303	W202-V299 HydrophobicContact CH2-CB 3.93Å; W202-V299 HydrophobicContact CH2-CG1 3.84Å; W202-V299 HydrophobicContact CH2-CG2 3.78Å; W202-V299 HydrophobicContact CZ2-CB 3.92Å; W202-V299 HydrophobicContact CZ2-CG1 4.05Å; W202-V299 HydrophobicContact CZ2-CG2 3.23Å; L285-V299 HydrophobicContact CB-CG1 4.39Å; L285-V299 HydrophobicContact CD2-CG1 3.75Å; L285-V299 WeakPolarHBondContact O-CG1 3.25Å; I288-V299 HydrophobicContact CB-CG1 4.16Å; I288-V299 HydrophobicContact CG2-CG1 3.9Å; C294-V299 WeakPolarHBondContact SG-CG2 3.26Å; E296-V299 HydrophobicContact CB-CG2 3.9Å; W297-V299 VanDerWaalsContact C-N 3.33Å; W297-V299 PolarHBondContact O-N 3.48Å; V299-A301 VanDerWaalsContact C-N 3.28Å; V299-A301 PolarHBondContact O-N 2.97Å; V299-V302 PolarHBondContact O-N 3.35Å; V299-S303 WeakPolarHBondContact O-CB 3.45Å; V299-S303 PolarHBondContact O-N 3.02Å
300	P	95.4	Very high	94.8	Very high	48 Å²	48	55.9 Å²	55.9	31%	0.312	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-32.3	178	26.4	-35.1	0	0	0	112.2	E296 W297 S303 I304	E296-P300 VanDerWaalsContact O-CD 3.3Å; E296-P300 WeakPolarHBondContact O-CD 3.34Å; W297-P300 VanDerWaalsContact O-CD 3.3Å; W297-P300 WeakPolarHBondContact O-CD 3.26Å; W297-P300 WeakPolarHBondContact O-CG 3.4Å; P300-S303 WeakPolarHBondContact O-CB 3.43Å; P300-S303 PolarHBondContact O-N 3.42Å; P300-I304 VanDerWaalsContact O-CG1 3.31Å; P300-I304 WeakPolarHBondContact O-CG1 3.38Å; P300-I304 PolarHBondContact O-N 3.15Å; P300-I304 VanDerWaalsContact O-N 3.08Å
301	A	96.3	Very high	94.9	Very high	26 Å²	26	53.9 Å²	53.9	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-47.6	176.9	0	0	0	0	0	112.1	I198 W297 Q298 V299 I304 I305	I198-A301 HydrophobicContact CD1-CB 4.23Å; W297-A301 HydrophobicContact CE3-CB 4.08Å; W297-A301 HydrophobicContact CZ3-CB 4.13Å; W297-A301 WeakPolarHBondContact O-CB 3.36Å; W297-A301 PolarHBondContact O-N 3.22Å; Q298-A301 PolarHBondContact O-N 3.16Å; V299-A301 VanDerWaalsContact C-N 3.28Å; V299-A301 PolarHBondContact O-N 2.97Å; A301-I304 PolarHBondContact O-N 2.71Å; A301-I305 WeakPolarHBondContact O-CG1 3.49Å; A301-I305 PolarHBondContact O-N 3.12Å; A301-I305 VanDerWaalsContact O-N 3.15Å
302	V	96.3	Very high	95	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.5	-36.7	177.6	177.8	0	0	0	0	111	I198 M199 W202 L285 Q298 V299 I304 I305 Y306	I198-V302 HydrophobicContact CB-CG2 3.86Å; I198-V302 HydrophobicContact CD1-CG2 4.49Å; I198-V302 HydrophobicContact CG2-CG2 3.48Å; I198-V302 VanDerWaalsContact CG2-CG2 3.48Å; M199-V302 HydrophobicContact SD-CG1 4.4Å; W202-V302 HydrophobicContact CE3-CG2 4.43Å; W202-V302 HydrophobicContact CZ3-CB 4.33Å; W202-V302 HydrophobicContact CZ3-CG2 4.17Å; L285-V302 HydrophobicContact CD1-CB 4.22Å; L285-V302 HydrophobicContact CD1-CG1 3.66Å; Q298-V302 VanDerWaalsContact O-CG2 3.31Å; Q298-V302 WeakPolarHBondContact O-CG2 3.3Å; Q298-V302 PolarHBondContact O-N 3.01Å; V299-V302 PolarHBondContact O-N 3.35Å; V302-I304 PolarHBondContact O-N 3.32Å; V302-I305 PolarHBondContact O-N 3.49Å; V302-Y306 HydrophobicContact CG1-CD2 3.54Å; V302-Y306 HydrophobicContact CG1-CE2 3.42Å; V302-Y306 VanDerWaalsContact CG1-CE2 3.42Å; V302-Y306 WeakPolarHBondContact O-CD2 3.27Å; V302-Y306 PolarHBondContact O-N 3.06Å
303	S	96.4	Very high	95.2	Very high	9 Å²	9	45.1 Å²	45.1	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-54.8	-50.8	173.2	176.3	0	0	0	0	111.7	A282 Y286 V299 P300 I305 Y306 F307	A282-S303 PolarHBondContact O-OG 3.46Å; Y286-S303 PolarHBondContact N-OG 3.27Å; V299-S303 WeakPolarHBondContact O-CB 3.45Å; V299-S303 PolarHBondContact O-N 3.02Å; P300-S303 WeakPolarHBondContact O-CB 3.43Å; P300-S303 PolarHBondContact O-N 3.42Å; S303-I305 VanDerWaalsContact C-N 3.33Å; S303-I305 PolarHBondContact O-N 3.46Å; S303-Y306 PolarHBondContact O-N 3.3Å; S303-F307 PolarHBondContact O-N 2.83Å
304	I	97	Very high	95.3	Very high	102 Å²	102	43.6 Å²	43.6	52%	0.523	22%	0.217	S	C	.	.	H	α-helix	trans	-62.5	-41.8	-179.7	-67.7	165.1	0	0	0	110.7	P300 A301 V302 F307 I308	P300-I304 VanDerWaalsContact O-CG1 3.31Å; P300-I304 WeakPolarHBondContact O-CG1 3.38Å; P300-I304 PolarHBondContact O-N 3.15Å; P300-I304 VanDerWaalsContact O-N 3.08Å; A301-I304 PolarHBondContact O-N 2.71Å; V302-I304 PolarHBondContact O-N 3.32Å; I304-F307 PolarHBondContact O-N 3.12Å; I304-I308 HydrophobicContact CG2-CD1 3.78Å; I304-I308 HydrophobicContact CG2-CG1 4.46Å; I304-I308 WeakPolarHBondContact O-CG1 3.4Å; I304-I308 PolarHBondContact O-N 2.83Å
305	I	97.4	Very high	95.6	Very high	18 Å²	18	46 Å²	46	9%	0.092	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-48.3	178.7	-68.4	166.2	0	0	0	111.2	M191 A194 Y195 I198 A301 V302 S303 F307 I308 L309	M191-I305 HydrophobicContact CB-CG2 4.26Å; M191-I305 HydrophobicContact CE-CB 4.15Å; M191-I305 HydrophobicContact CE-CG1 3.85Å; M191-I305 HydrophobicContact CE-CG2 3.91Å; A194-I305 HydrophobicContact CB-CD1 4.47Å; Y195-I305 HydrophobicContact CD1-CG2 3.95Å; Y195-I305 HydrophobicContact CG-CG2 4.35Å; I198-I305 HydrophobicContact CD1-CD1 3.64Å; A301-I305 WeakPolarHBondContact O-CG1 3.49Å; A301-I305 PolarHBondContact O-N 3.12Å; A301-I305 VanDerWaalsContact O-N 3.15Å; V302-I305 PolarHBondContact O-N 3.49Å; S303-I305 VanDerWaalsContact C-N 3.33Å; S303-I305 PolarHBondContact O-N 3.46Å; I305-F307 VanDerWaalsContact C-N 3.32Å; I305-F307 PolarHBondContact O-N 3.14Å; I305-I308 PolarHBondContact O-N 3.42Å; I305-L309 HydrophobicContact CG2-CD1 3.77Å; I305-L309 HydrophobicContact CG2-CG 4.29Å; I305-L309 WeakPolarHBondContact O-CB 3.38Å; I305-L309 WeakPolarHBondContact O-CG 3.39Å; I305-L309 PolarHBondContact O-N 3.06Å
306	Y	96.5	Very high	95.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-39.5	177.4	-85	-63.8	0	0	0	112.3	Y195 F211 F215 F218 E278 M281 L285 V302 S303 L309 A310	Y195-Y306 HydrophobicContact CD2-CE2 4.46Å; Y195-Y306 HydrophobicContact CE1-CE1 4.33Å; Y195-Y306 WeakPolarHBondContact CE2-OH 3.31Å; F211-Y306 AromaticContact CZ-CE2 3.99Å; F211-Y306 HydrophobicContact CZ-CE2 3.99Å; F215-Y306 WeakPolarHBondContact CD2-OH 3.4Å; F215-Y306 VanDerWaalsContact CE2-OH 3.3Å; F215-Y306 WeakPolarHBondContact CE2-OH 3.4Å; F218-Y306 HydrophobicContact CE1-CE1 4.36Å; E278-Y306 HydrophobicContact CB-CD1 4.5Å; E278-Y306 HydrophobicContact CG-CD1 4.47Å; M281-Y306 HydrophobicContact CE-CD1 3.78Å; M281-Y306 HydrophobicContact CE-CE1 3.28Å; M281-Y306 HydrophobicContact CE-CE2 4.2Å; M281-Y306 HydrophobicContact CE-CG 4.43Å; L285-Y306 HydrophobicContact CD1-CD2 3.77Å; L285-Y306 HydrophobicContact CD1-CE2 4.18Å; V302-Y306 HydrophobicContact CG1-CD2 3.54Å; V302-Y306 HydrophobicContact CG1-CE2 3.42Å; V302-Y306 VanDerWaalsContact CG1-CE2 3.42Å; V302-Y306 WeakPolarHBondContact O-CD2 3.27Å; V302-Y306 PolarHBondContact O-N 3.06Å; S303-Y306 PolarHBondContact O-N 3.3Å; Y306-L309 PolarHBondContact O-N 2.95Å; Y306-A310 WeakPolarHBondContact O-CB 3.38Å; Y306-A310 PolarHBondContact O-N 3.34Å
307	F	97.3	Very high	95.8	Very high	112 Å²	112	37.6 Å²	37.6	49%	0.491	19%	0.193	S	C	.	.	H	α-helix	trans	-60.2	-48.2	176.5	-179.4	-101.8	0	0	0	111.8	L279 A282 S303 I304 I305 A310 M311	L279-F307 HydrophobicContact CD2-CD2 4.01Å; L279-F307 HydrophobicContact CD2-CE2 4.27Å; A282-F307 HydrophobicContact CB-CB 3.96Å; S303-F307 PolarHBondContact O-N 2.83Å; I304-F307 PolarHBondContact O-N 3.12Å; I305-F307 VanDerWaalsContact C-N 3.32Å; I305-F307 PolarHBondContact O-N 3.14Å; F307-A310 PolarHBondContact O-N 3.39Å; F307-M311 HydrophobicContact CD1-CG 4.49Å; F307-M311 HydrophobicContact CD2-CG 4.4Å; F307-M311 HydrophobicContact CE1-CG 4.11Å; F307-M311 HydrophobicContact CE2-CG 4.01Å; F307-M311 HydrophobicContact CZ-CG 3.85Å; F307-M311 WeakPolarHBondContact O-CB 3.32Å; F307-M311 WeakPolarHBondContact O-CG 3.3Å; F307-M311 PolarHBondContact O-N 3.4Å
308	I	97.4	Very high	95.8	Very high	75 Å²	75	34.7 Å²	34.7	39%	0.385	19%	0.189	S	C	.	.	H	α-helix	trans	-63.3	-43.6	178.2	-67.3	169.2	0	0	0	110.9	W184 M191 I304 I305 G312	W184-I308 HydrophobicContact CH2-CG2 4.21Å; W184-I308 WeakPolarHBondContact CH2-O 3.34Å; M191-I308 HydrophobicContact CE-CB 4.42Å; M191-I308 HydrophobicContact CE-CD1 4.38Å; M191-I308 HydrophobicContact CE-CG2 4.27Å; I304-I308 HydrophobicContact CG2-CD1 3.78Å; I304-I308 HydrophobicContact CG2-CG1 4.46Å; I304-I308 WeakPolarHBondContact O-CG1 3.4Å; I304-I308 PolarHBondContact O-N 2.83Å; I305-I308 PolarHBondContact O-N 3.42Å; I308-G312 PolarHBondContact O-N 2.85Å
309	L	96.6	Very high	95.6	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-48.5	178.1	-82.3	172.4	0	0	0	111.9	M191 Y195 I305 Y306 S313	M191-L309 HydrophobicContact CB-CD1 4.28Å; M191-L309 HydrophobicContact CB-CD2 3.75Å; M191-L309 HydrophobicContact CB-CG 4.04Å; M191-L309 HydrophobicContact CG-CD2 4.48Å; Y195-L309 HydrophobicContact CD1-CD1 3.83Å; Y195-L309 HydrophobicContact CE1-CD1 3.88Å; I305-L309 HydrophobicContact CG2-CD1 3.77Å; I305-L309 HydrophobicContact CG2-CG 4.29Å; I305-L309 WeakPolarHBondContact O-CB 3.38Å; I305-L309 WeakPolarHBondContact O-CG 3.39Å; I305-L309 PolarHBondContact O-N 3.06Å; Y306-L309 PolarHBondContact O-N 2.95Å; L309-S313 VanDerWaalsContact O-CB 3.22Å; L309-S313 WeakPolarHBondContact O-CB 3.39Å; L309-S313 PolarHBondContact O-N 3.36Å; L309-S313 PolarHBondContact O-OG 3Å
310	A	96	Very high	95.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-48.2	-177.8	0	0	0	0	0	111.3	E278 L279 Y306 F307 G312 S313 I314	E278-A310 HydrophobicContact CB-CB 3.64Å; E278-A310 WeakPolarHBondContact OE2-CA 3.31Å; L279-A310 HydrophobicContact CB-CB 4.47Å; L279-A310 HydrophobicContact CD2-CB 3.66Å; L279-A310 HydrophobicContact CG-CB 3.58Å; Y306-A310 WeakPolarHBondContact O-CB 3.38Å; Y306-A310 PolarHBondContact O-N 3.34Å; F307-A310 PolarHBondContact O-N 3.39Å; A310-G312 PolarHBondContact O-N 3.06Å; A310-S313 PolarHBondContact O-N 3.27Å; A310-I314 VanDerWaalsContact O-CG1 3.27Å; A310-I314 WeakPolarHBondContact O-CG1 3.35Å; A310-I314 PolarHBondContact O-N 3.43Å
311	M	96.1	Very high	94.9	Very high	82 Å²	82	39.7 Å²	39.7	40%	0.404	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-47.9	179.1	-74	-58.8	-64	0	0	112.1	L279 F307 S313 I314 V315	L279-M311 HydrophobicContact CD2-CG 4.32Å; L279-M311 HydrophobicContact CD2-SD 4.3Å; F307-M311 HydrophobicContact CD1-CG 4.49Å; F307-M311 HydrophobicContact CD2-CG 4.4Å; F307-M311 HydrophobicContact CE1-CG 4.11Å; F307-M311 HydrophobicContact CE2-CG 4.01Å; F307-M311 HydrophobicContact CZ-CG 3.85Å; F307-M311 WeakPolarHBondContact O-CB 3.32Å; F307-M311 WeakPolarHBondContact O-CG 3.3Å; F307-M311 PolarHBondContact O-N 3.4Å; M311-S313 VanDerWaalsContact C-N 3.32Å; M311-S313 PolarHBondContact O-N 3.42Å; M311-I314 PolarHBondContact O-N 3.32Å; M311-V315 VanDerWaalsContact O-CG2 3.31Å; M311-V315 WeakPolarHBondContact O-CG2 3.46Å; M311-V315 PolarHBondContact O-N 3.11Å
312	G	95.9	Very high	94.5	Very high	12 Å²	12	46.3 Å²	46.3	12%	0.124	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-28.9	-179.8	0	0	0	0	0	113.2	W184 I308 A310 T316	W184-G312 VanDerWaalsContact CH2-CA 3.48Å; W184-G312 PolarHBondContact NE1-O 3.27Å; I308-G312 PolarHBondContact O-N 2.85Å; A310-G312 PolarHBondContact O-N 3.06Å; G312-T316 WeakPolarHBondContact O-CB 3.23Å; G312-T316 PolarHBondContact O-N 3.43Å; G312-T316 PolarHBondContact O-OG1 2.94Å
313	S	95.3	Very high	94	Very high	6 Å²	6	51 Å²	51	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-44.3	172.9	-63.7	0	0	0	0	111.8	W184 Y275 L309 A310 M311 T316 V317	W184-S313 PolarHBondContact NE1-OG 3.36Å; Y275-S313 VanDerWaalsContact CE1-CB 3.43Å; L309-S313 VanDerWaalsContact O-CB 3.22Å; L309-S313 WeakPolarHBondContact O-CB 3.39Å; L309-S313 PolarHBondContact O-N 3.36Å; L309-S313 PolarHBondContact O-OG 3Å; A310-S313 PolarHBondContact O-N 3.27Å; M311-S313 VanDerWaalsContact C-N 3.32Å; M311-S313 PolarHBondContact O-N 3.42Å; S313-T316 PolarHBondContact O-N 2.93Å; S313-V317 WeakPolarHBondContact O-CB 3.46Å; S313-V317 WeakPolarHBondContact O-CG2 3.31Å; S313-V317 PolarHBondContact O-N 2.94Å
314	I	95	Very high	93.3	Very high	35 Å²	35	53.7 Å²	53.7	18%	0.179	26%	0.263	C	S	.	.	H	α-helix	trans	-57.7	-52.6	173.6	-69.1	164.9	0	0	0	110.3	Y275 L279 A310 M311 T316 V317 L318	Y275-I314 HydrophobicContact CD2-CG1 4.07Å; Y275-I314 HydrophobicContact CG-CG1 4.16Å; L279-I314 HydrophobicContact CD1-CD1 3.84Å; A310-I314 VanDerWaalsContact O-CG1 3.27Å; A310-I314 WeakPolarHBondContact O-CG1 3.35Å; A310-I314 PolarHBondContact O-N 3.43Å; M311-I314 PolarHBondContact O-N 3.32Å; I314-T316 VanDerWaalsContact C-N 3.34Å; I314-T316 PolarHBondContact O-N 2.98Å; I314-V317 PolarHBondContact O-N 3.46Å; I314-L318 HydrophobicContact CG2-CD1 3.81Å; I314-L318 HydrophobicContact CG2-CG 4.38Å; I314-L318 WeakPolarHBondContact O-CB 3.37Å; I314-L318 VanDerWaalsContact O-CG 3.26Å; I314-L318 WeakPolarHBondContact O-CG 3.46Å; I314-L318 PolarHBondContact O-N 3.08Å
315	V	95.4	Very high	92.5	Very high	68 Å²	68	54.8 Å²	54.8	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-59.3	-45.2	179.7	171.6	0	0	0	0	111.2	M311 L318 Q319	M311-V315 VanDerWaalsContact O-CG2 3.31Å; M311-V315 WeakPolarHBondContact O-CG2 3.46Å; M311-V315 PolarHBondContact O-N 3.11Å; V315-L318 PolarHBondContact O-N 3.17Å; V315-Q319 HydrophobicContact CG1-CG 4.49Å; V315-Q319 WeakPolarHBondContact O-CB 3.39Å; V315-Q319 VanDerWaalsContact O-CG 3.28Å; V315-Q319 WeakPolarHBondContact O-CG 3.39Å; V315-Q319 PolarHBondContact O-N 3.44Å
316	T	94.1	Very high	91.4	Very high	9 Å²	9	57.9 Å²	57.9	6%	0.055	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-42.9	-178.8	-63.1	0	0	0	0	111.8	K182 W184 W185 G312 S313 I314 Q319 V320	K182-T316 HydrophobicContact CD-CG2 3.92Å; W184-T316 HydrophobicContact CB-CG2 4.07Å; W184-T316 WeakPolarHBondContact CB-OG1 3.32Å; W184-T316 VanDerWaalsContact CD1-OG1 3.23Å; W184-T316 HydrophobicContact CG-CG2 4.2Å; W185-T316 HydrophobicContact CZ2-CG2 3.96Å; G312-T316 WeakPolarHBondContact O-CB 3.23Å; G312-T316 PolarHBondContact O-N 3.43Å; G312-T316 PolarHBondContact O-OG1 2.94Å; S313-T316 PolarHBondContact O-N 2.93Å; I314-T316 VanDerWaalsContact C-N 3.34Å; I314-T316 PolarHBondContact O-N 2.98Å; T316-Q319 WeakPolarHBondContact O-CB 3.33Å; T316-Q319 PolarHBondContact O-N 2.94Å; T316-V320 WeakPolarHBondContact O-CG2 3.49Å; T316-V320 PolarHBondContact O-N 3.35Å
317	V	92.4	Very high	89.7	Confident	14 Å²	14	61.9 Å²	61.9	9%	0.085	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-44.8	177.8	168	0	0	0	0	110.9	W185 F272 Y275 S313 I314 Q319 V320 I321	W185-V317 HydrophobicContact CH2-CG2 4.01Å; W185-V317 HydrophobicContact CZ2-CG2 4.25Å; F272-V317 HydrophobicContact CE2-CG1 4.44Å; F272-V317 HydrophobicContact CZ-CG1 4.31Å; Y275-V317 HydrophobicContact CE2-CB 4.33Å; Y275-V317 HydrophobicContact CE2-CG2 3.79Å; Y275-V317 WeakPolarHBondContact OH-CG2 3.2Å; S313-V317 WeakPolarHBondContact O-CB 3.46Å; S313-V317 WeakPolarHBondContact O-CG2 3.31Å; S313-V317 PolarHBondContact O-N 2.94Å; I314-V317 PolarHBondContact O-N 3.46Å; V317-Q319 VanDerWaalsContact C-N 3.28Å; V317-Q319 PolarHBondContact O-N 3.39Å; V317-V320 WeakPolarHBondContact O-CB 3.48Å; V317-V320 PolarHBondContact O-N 3.39Å; V317-I321 HydrophobicContact CG1-CD1 3.62Å; V317-I321 HydrophobicContact CG1-CG1 4.31Å; V317-I321 WeakPolarHBondContact O-CD1 3.45Å; V317-I321 VanDerWaalsContact O-CG1 3.27Å; V317-I321 WeakPolarHBondContact O-CG1 3.36Å; V317-I321 PolarHBondContact O-N 3.21Å
318	L	93.1	Very high	87.6	Confident	91 Å²	91	61.3 Å²	61.3	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-58.2	-41.2	173.7	-70.4	174.2	0	0	0	111.8	F272 I314 V315 I321 R322	F272-L318 HydrophobicContact CZ-CD2 4.09Å; I314-L318 HydrophobicContact CG2-CD1 3.81Å; I314-L318 HydrophobicContact CG2-CG 4.38Å; I314-L318 WeakPolarHBondContact O-CB 3.37Å; I314-L318 VanDerWaalsContact O-CG 3.26Å; I314-L318 WeakPolarHBondContact O-CG 3.46Å; I314-L318 PolarHBondContact O-N 3.08Å; V315-L318 PolarHBondContact O-N 3.17Å; L318-I321 PolarHBondContact O-N 3.17Å; L318-R322 WeakPolarHBondContact O-CB 3.33Å; L318-R322 PolarHBondContact O-N 2.67Å
319	Q	92	Very high	85.4	Confident	93 Å²	93	61.7 Å²	61.7	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-40.7	173.5	-74	178.7	1.1	0	0	112.7	V315 T316 V317 Q323	V315-Q319 HydrophobicContact CG1-CG 4.49Å; V315-Q319 WeakPolarHBondContact O-CB 3.39Å; V315-Q319 VanDerWaalsContact O-CG 3.28Å; V315-Q319 WeakPolarHBondContact O-CG 3.39Å; V315-Q319 PolarHBondContact O-N 3.44Å; T316-Q319 WeakPolarHBondContact O-CB 3.33Å; T316-Q319 PolarHBondContact O-N 2.94Å; V317-Q319 VanDerWaalsContact C-N 3.28Å; V317-Q319 PolarHBondContact O-N 3.39Å; Q319-Q323 VanDerWaalsContact O-CB 3.29Å; Q319-Q323 WeakPolarHBondContact O-CB 3.49Å; Q319-Q323 WeakPolarHBondContact O-CG 3.41Å; Q319-Q323 PolarHBondContact O-N 3.31Å
320	V	88.2	Confident	83.2	Confident	39 Å²	39	64.7 Å²	64.7	24%	0.236	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-44.6	174.6	173.9	0	0	0	0	110.5	K182 T316 V317 Q323 K324	K182-V320 HydrophobicContact CD-CG2 3.85Å; K182-V320 VanDerWaalsContact CE-CG2 3.44Å; T316-V320 WeakPolarHBondContact O-CG2 3.49Å; T316-V320 PolarHBondContact O-N 3.35Å; V317-V320 WeakPolarHBondContact O-CB 3.48Å; V317-V320 PolarHBondContact O-N 3.39Å; V320-Q323 PolarHBondContact O-N 3.37Å; V320-K324 HydrophobicContact CG1-CD 4.01Å; V320-K324 HydrophobicContact CG1-CG 4.4Å; V320-K324 WeakPolarHBondContact O-CB 3.37Å; V320-K324 WeakPolarHBondContact O-CG 3.47Å; V320-K324 PolarHBondContact O-N 3.3Å
321	I	88.4	Confident	81	Confident	38 Å²	38	72.3 Å²	72.3	20%	0.195	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-50.4	179.6	-66.9	158.4	0	0	0	109.6	L268 F272 V317 L318 Q323 K324 I325	L268-I321 HydrophobicContact CD1-CD1 3.36Å; L268-I321 HydrophobicContact CD1-CG1 3.85Å; L268-I321 HydrophobicContact CG-CD1 4.33Å; F272-I321 HydrophobicContact CE2-CD1 4.38Å; F272-I321 HydrophobicContact CZ-CD1 4.47Å; V317-I321 HydrophobicContact CG1-CD1 3.62Å; V317-I321 HydrophobicContact CG1-CG1 4.31Å; V317-I321 WeakPolarHBondContact O-CD1 3.45Å; V317-I321 VanDerWaalsContact O-CG1 3.27Å; V317-I321 WeakPolarHBondContact O-CG1 3.36Å; V317-I321 PolarHBondContact O-N 3.21Å; L318-I321 PolarHBondContact O-N 3.17Å; I321-Q323 VanDerWaalsContact C-N 3.3Å; I321-Q323 PolarHBondContact O-N 2.78Å; I321-K324 PolarHBondContact O-N 2.88Å; I321-I325 HydrophobicContact CG2-CD1 3.57Å; I321-I325 HydrophobicContact CG2-CG1 4.31Å; I321-I325 WeakPolarHBondContact O-CG1 3.47Å; I321-I325 PolarHBondContact O-N 3.38Å
322	R	88.7	Confident	78.8	Confident	166 Å²	166	72.7 Å²	72.7	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-57.8	-43.7	176.7	-167.5	178.6	75.4	101.7	-2.7	111.6	L318 K324 I325 C326	L318-R322 WeakPolarHBondContact O-CB 3.33Å; L318-R322 PolarHBondContact O-N 2.67Å; R322-K324 VanDerWaalsContact C-N 3.34Å; R322-K324 PolarHBondContact O-N 2.98Å; R322-I325 PolarHBondContact O-N 3.26Å; R322-C326 WeakPolarHBondContact O-CB 3.49Å; R322-C326 PolarHBondContact O-N 3.15Å; R322-C326 PolarHBondContact O-SG 3.45Å; R322-C326 VanDerWaalsContact O-SG 3.33Å
323	Q	85.5	Confident	76.7	Confident	97 Å²	97	74.4 Å²	74.4	45%	0.453	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-41.2	175.1	-77.5	171.7	-16.9	0	0	112	Q319 V320 I321 T327	Q319-Q323 VanDerWaalsContact O-CB 3.29Å; Q319-Q323 WeakPolarHBondContact O-CB 3.49Å; Q319-Q323 WeakPolarHBondContact O-CG 3.41Å; Q319-Q323 PolarHBondContact O-N 3.31Å; V320-Q323 PolarHBondContact O-N 3.37Å; I321-Q323 VanDerWaalsContact C-N 3.3Å; I321-Q323 PolarHBondContact O-N 2.78Å; Q323-T327 WeakPolarHBondContact O-CB 3.41Å; Q323-T327 PolarHBondContact O-N 2.86Å; Q323-T327 PolarHBondContact O-OG1 3.15Å
324	K	81.1	Confident	74.8	Confident	67 Å²	67	78 Å²	78	29%	0.291	42%	0.418	S	S	.	.	H	α-helix	trans	-71.7	-32.7	179.6	-76.2	-179.2	173.5	-75.6	0	112.8	M260 F261 I264 V320 I321 R322	M260-K324 PolarHBondContact SD-NZ 2.91Å; F261-K324 HydrophobicContact CE1-CB 3.84Å; F261-K324 HydrophobicContact CZ-CB 4.11Å; F261-K324 VanDerWaalsContact CZ-O 3.31Å; F261-K324 WeakPolarHBondContact CZ-O 3.35Å; I264-K324 HydrophobicContact CD1-CD 3.66Å; V320-K324 HydrophobicContact CG1-CD 4.01Å; V320-K324 HydrophobicContact CG1-CG 4.4Å; V320-K324 WeakPolarHBondContact O-CB 3.37Å; V320-K324 WeakPolarHBondContact O-CG 3.47Å; V320-K324 PolarHBondContact O-N 3.3Å; I321-K324 PolarHBondContact O-N 2.88Å; R322-K324 VanDerWaalsContact C-N 3.34Å; R322-K324 PolarHBondContact O-N 2.98Å
325	I	80.3	Confident	73	Confident	124 Å²	124	79.6 Å²	79.6	64%	0.636	43%	0.427	S	S	*	.	H	α-helix	trans	-80.7	-46.2	178.3	-64.4	171.9	0	0	0	111.3	I321 R322	I321-I325 HydrophobicContact CG2-CD1 3.57Å; I321-I325 HydrophobicContact CG2-CG1 4.31Å; I321-I325 WeakPolarHBondContact O-CG1 3.47Å; I321-I325 PolarHBondContact O-N 3.38Å; R322-I325 PolarHBondContact O-N 3.26Å
326	C	73.9	Confident	71.3	Confident	83 Å²	83	77.7 Å²	77.7	56%	0.561	41%	0.414	S	S	*	.	H	α-helix	trans	-84	-10.9	-172.7	-60.1	0	0	0	0	114.4	R322 P328	R322-C326 WeakPolarHBondContact O-CB 3.49Å; R322-C326 PolarHBondContact O-N 3.15Å; R322-C326 PolarHBondContact O-SG 3.45Å; R322-C326 VanDerWaalsContact O-SG 3.33Å; C326-P328 WeakPolarHBondContact O-CD 3.31Å
327	T	61	Low	69.7	Low	84 Å²	84	78.7 Å²	78.7	52%	0.515	42%	0.418	S	S	.	.			trans	-97.8	95.7	176.7	-43.4	0	0	0	0	108.3	Q323	Q323-T327 WeakPolarHBondContact O-CB 3.41Å; Q323-T327 PolarHBondContact O-N 2.86Å; Q323-T327 PolarHBondContact O-OG1 3.15Å
328	P	52.6	Low	68.2	Low	101 Å²	101	79.6 Å²	79.6	66%	0.656	42%	0.424	S	S	*	.			trans	-55.2	139.3	162.5	25.1	-32	0	0	0	107.3	C326 P330	C326-P328 WeakPolarHBondContact O-CD 3.31Å; P328-P330 WeakPolarHBondContact O-CD 3.03Å
329	P	52.4	Low	66.7	Low	83 Å²	83	79.7 Å²	79.7	54%	0.539	42%	0.42	S	S	.	.			trans	-57.9	115.7	-178.9	25.5	-32	0	0	0	106.9	I331 L333	P329-I331 PolarHBondContact O-N 2.91Å; P329-L333 HydrophobicContact CB-CB 4.45Å; P329-L333 HydrophobicContact CB-CD2 3.81Å
330	P	50.3	Low	65.3	Low	67 Å²	67	77.8 Å²	77.8	44%	0.435	41%	0.411	S	S	.	.			trans	-58.1	144.6	170.5	24.1	-30.6	0	0	0	106.1	P328 V332 L333	P328-P330 WeakPolarHBondContact O-CD 3.03Å; P330-V332 HydrophobicContact CB-CB 4.04Å; P330-V332 HydrophobicContact CB-CG2 4.18Å; P330-V332 HydrophobicContact CG-CB 4.38Å; P330-V332 PolarHBondContact O-N 2.78Å; P330-L333 HydrophobicContact CG-CB 3.97Å; P330-L333 WeakPolarHBondContact O-CA 3.5Å; P330-L333 WeakPolarHBondContact O-CB 3.41Å; P330-L333 PolarHBondContact O-N 3.42Å
331	I	48.4	Very low	64	Low	159 Å²	159	77.8 Å²	77.8	82%	0.815	41%	0.407	S	S	*	.	H	α-helix	trans	-50.9	-27.7	170.9	-65	157.3	0	0	0	109.9	P329 L333 H334	P329-I331 PolarHBondContact O-N 2.91Å; I331-L333 VanDerWaalsContact C-N 3.29Å; I331-L333 PolarHBondContact O-N 3.15Å; I331-H334 WeakPolarHBondContact O-CB 3.31Å; I331-H334 PolarHBondContact O-N 3.21Å; I331-H334 VanDerWaalsContact O-N 3.14Å
332	V	49.8	Very low	62.8	Low	91 Å²	91	77.5 Å²	77.5	55%	0.552	41%	0.408	S	S	*	.	H	α-helix	trans	-59.8	-27.2	170.4	-164.7	0	0	0	0	114.4	P330 H336	P330-V332 HydrophobicContact CB-CB 4.04Å; P330-V332 HydrophobicContact CB-CG2 4.18Å; P330-V332 HydrophobicContact CG-CB 4.38Å; P330-V332 PolarHBondContact O-N 2.78Å; V332-H336 WeakPolarHBondContact O-CB 3.41Å; V332-H336 PolarHBondContact O-N 2.87Å
333	L	53.8	Low	61.5	Low	47 Å²	47	72.2 Å²	72.2	25%	0.246	39%	0.39	C	S	.	.	H	α-helix	trans	-70.2	-33.7	175	-171.4	68.7	0	0	0	111.5	M257 P329 P330 I331 H336 L337	M257-L333 HydrophobicContact CE-CD2 4.03Å; P329-L333 HydrophobicContact CB-CB 4.45Å; P329-L333 HydrophobicContact CB-CD2 3.81Å; P330-L333 HydrophobicContact CG-CB 3.97Å; P330-L333 WeakPolarHBondContact O-CA 3.5Å; P330-L333 WeakPolarHBondContact O-CB 3.41Å; P330-L333 PolarHBondContact O-N 3.42Å; I331-L333 VanDerWaalsContact C-N 3.29Å; I331-L333 PolarHBondContact O-N 3.15Å; L333-H336 PolarHBondContact O-N 3Å; L333-L337 HydrophobicContact CD1-CD1 3.84Å; L333-L337 HydrophobicContact CD1-CD2 4.14Å; L333-L337 HydrophobicContact CD1-CG 3.73Å; L333-L337 HydrophobicContact CD2-CD1 4.02Å; L333-L337 HydrophobicContact CG-CD1 3.59Å; L333-L337 HydrophobicContact CG-CG 3.87Å; L333-L337 VanDerWaalsContact O-CB 3.31Å; L333-L337 WeakPolarHBondContact O-CB 3.38Å; L333-L337 VanDerWaalsContact O-CG 3.26Å; L333-L337 WeakPolarHBondContact O-CG 2.89Å; L333-L337 PolarHBondContact O-N 3.46Å
334	H	55	Low	60.2	Low	83 Å²	83	71.1 Å²	71.1	38%	0.384	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-54.3	175.7	-176.4	-79.7	0	0	0	110.1	V253 I331 H336 T338	V253-H334 VanDerWaalsContact CG2-CD2 3.4Å; V253-H334 WeakPolarHBondContact CG2-CD2 3.46Å; I331-H334 WeakPolarHBondContact O-CB 3.31Å; I331-H334 PolarHBondContact O-N 3.21Å; I331-H334 VanDerWaalsContact O-N 3.14Å; H334-H336 VanDerWaalsContact C-N 3.31Å; H334-H336 PolarHBondContact O-N 3.43Å; H334-T338 WeakPolarHBondContact O-CB 3.4Å; H334-T338 WeakPolarHBondContact O-CG2 3.4Å; H334-T338 PolarHBondContact O-N 3.46Å; H334-T338 PolarHBondContact O-OG1 2.6Å
335	D	56.5	Low	58.9	Low	67 Å²	67	73.7 Å²	73.7	36%	0.358	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-34.6	179	-166	45.4	0	0	0	111.8	T338 K339	D335-T338 WeakPolarHBondContact CA-OG1 3.3Å; D335-T338 PolarHBondContact O-OG1 2.97Å; D335-K339 VanDerWaalsContact CG-NZ 3.31Å; D335-K339 VanDerWaalsContact O-CB 3.29Å; D335-K339 WeakPolarHBondContact O-CB 3.3Å; D335-K339 VanDerWaalsContact O-CG 3.31Å; D335-K339 WeakPolarHBondContact O-CG 3.34Å; D335-K339 PolarHBondContact O-N 2.57Å; D335-K339 WeakPolarHBondContact OD1-CE 3.34Å; D335-K339 IonicContact OD1-NZ 3.28Å; D335-K339 PolarHBondContact OD1-NZ 3.37Å; D335-K339 VanDerWaalsContact OD1-NZ 3.11Å; D335-K339 WeakPolarHBondContact OD2-CE 3.49Å; D335-K339 IonicContact OD2-NZ 2.73Å; D335-K339 PolarHBondContact OD2-NZ 2.91Å
336	H	60.5	Low	57.5	Low	29 Å²	29	73.6 Å²	73.6	13%	0.134	43%	0.425	C	S	.	.	H	α-helix	trans	-75.2	-40.4	179.1	175.3	-104.5	0	0	0	115.5	Y84 R180 V332 L333 H334 K340	Y84-H336 HydrophobicContact CE2-CB 3.5Å; Y84-H336 AromaticContact CE2-CD2 3.11Å; Y84-H336 WeakPolarHBondContact CE2-CD2 3.02Å; Y84-H336 AromaticContact CE2-CG 3.53Å; Y84-H336 AromaticContact CZ-CD2 3.52Å; Y84-H336 AromaticContact CZ-CG 3.95Å; Y84-H336 WeakPolarHBondContact OH-CA 3.43Å; Y84-H336 WeakPolarHBondContact OH-CB 3.5Å; Y84-H336 PolarHBondContact OH-CD2 3.02Å; R180-H336 PolarHBondContact NH2-NE2 3.4Å; V332-H336 WeakPolarHBondContact O-CB 3.41Å; V332-H336 PolarHBondContact O-N 2.87Å; L333-H336 PolarHBondContact O-N 3Å; H334-H336 VanDerWaalsContact C-N 3.31Å; H334-H336 PolarHBondContact O-N 3.43Å; H336-K340 WeakPolarHBondContact O-CB 3.47Å; H336-K340 PolarHBondContact O-N 3.19Å
337	L	60	Low	55.8	Low	30 Å²	30	77.1 Å²	77.1	16%	0.157	44%	0.439	C	S	.	.	H	α-helix	trans	-69.7	-38.4	178.3	-69.5	178.1	0	0	0	111.1	M257 L333 Y341	M257-L337 HydrophobicContact CE-CD1 3.37Å; L333-L337 HydrophobicContact CD1-CD1 3.84Å; L333-L337 HydrophobicContact CD1-CD2 4.14Å; L333-L337 HydrophobicContact CD1-CG 3.73Å; L333-L337 HydrophobicContact CD2-CD1 4.02Å; L333-L337 HydrophobicContact CG-CD1 3.59Å; L333-L337 HydrophobicContact CG-CG 3.87Å; L333-L337 VanDerWaalsContact O-CB 3.31Å; L333-L337 WeakPolarHBondContact O-CB 3.38Å; L333-L337 VanDerWaalsContact O-CG 3.26Å; L333-L337 WeakPolarHBondContact O-CG 2.89Å; L333-L337 PolarHBondContact O-N 3.46Å; L337-Y341 PolarHBondContact O-N 3.05Å
338	T	60	Low	54.6	Low	32 Å²	32	81.9 Å²	81.9	20%	0.196	46%	0.455	C	S	.	.	H	α-helix	trans	-65.3	-51.6	176	49.2	0	0	0	0	111	H334 D335 K340 S342	H334-T338 WeakPolarHBondContact O-CB 3.4Å; H334-T338 WeakPolarHBondContact O-CG2 3.4Å; H334-T338 PolarHBondContact O-N 3.46Å; H334-T338 PolarHBondContact O-OG1 2.6Å; D335-T338 WeakPolarHBondContact CA-OG1 3.3Å; D335-T338 PolarHBondContact O-OG1 2.97Å; T338-K340 PolarHBondContact O-N 2.91Å; T338-S342 WeakPolarHBondContact O-CB 3.35Å; T338-S342 PolarHBondContact O-N 3.23Å
339	K	61.8	Low	53.4	Low	93 Å²	93	85.4 Å²	85.4	40%	0.404	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-40.6	179.4	-72.8	176.1	176.9	163.7	0	114	K115 D335 Y341 S342	K115-K339 PolarHBondContact NZ-O 3.33Å; K115-K339 VanDerWaalsContact NZ-O 3.16Å; D335-K339 VanDerWaalsContact CG-NZ 3.31Å; D335-K339 VanDerWaalsContact O-CB 3.29Å; D335-K339 WeakPolarHBondContact O-CB 3.3Å; D335-K339 VanDerWaalsContact O-CG 3.31Å; D335-K339 WeakPolarHBondContact O-CG 3.34Å; D335-K339 PolarHBondContact O-N 2.57Å; D335-K339 WeakPolarHBondContact OD1-CE 3.34Å; D335-K339 IonicContact OD1-NZ 3.28Å; D335-K339 PolarHBondContact OD1-NZ 3.37Å; D335-K339 VanDerWaalsContact OD1-NZ 3.11Å; D335-K339 WeakPolarHBondContact OD2-CE 3.49Å; D335-K339 IonicContact OD2-NZ 2.73Å; D335-K339 PolarHBondContact OD2-NZ 2.91Å; K339-Y341 VanDerWaalsContact C-N 3.32Å; K339-Y341 PolarHBondContact O-N 2.74Å; K339-S342 PolarHBondContact O-N 3.31Å
340	K	63.9	Low	52.6	Low	53 Å²	53	89.4 Å²	89.4	23%	0.23	48%	0.475	C	S	.	.	H	α-helix	trans	-63.7	-36.9	-176.8	-176.9	170	-174.4	169.9	0	113.1	H336 T338	H336-K340 WeakPolarHBondContact O-CB 3.47Å; H336-K340 PolarHBondContact O-N 3.19Å; T338-K340 PolarHBondContact O-N 2.91Å
341	Y	59.5	Low	51.5	Low	40 Å²	40	91.5 Å²	91.5	16%	0.157	48%	0.483	C	S	.	.	H	α-helix	trans	-103.1	4.2	178.5	-66.4	-78.5	0	0	0	113	L240 G244 L337 K339 F343	L240-Y341 HydrophobicContact CB-CD1 4.23Å; L240-Y341 HydrophobicContact CB-CD2 3.99Å; L240-Y341 HydrophobicContact CB-CE1 4.21Å; L240-Y341 HydrophobicContact CB-CE2 3.96Å; L240-Y341 HydrophobicContact CB-CG 4.13Å; L240-Y341 HydrophobicContact CD1-CE2 3.93Å; L240-Y341 HydrophobicContact CD2-CD2 4.24Å; L240-Y341 HydrophobicContact CD2-CE2 4.03Å; L240-Y341 HydrophobicContact CG-CE2 4.2Å; L240-Y341 WeakPolarHBondContact O-CB 3.47Å; G244-Y341 WeakPolarHBondContact CA-O 3.44Å; L337-Y341 PolarHBondContact O-N 3.05Å; K339-Y341 VanDerWaalsContact C-N 3.32Å; K339-Y341 PolarHBondContact O-N 2.74Å; Y341-F343 WeakPolarHBondContact O-CD2 3.45Å; Y341-F343 WeakPolarHBondContact O-CE2 3.43Å; Y341-F343 PolarHBondContact O-N 3.19Å
342	S	62.8	Low	50.7	Low	32 Å²	32	88.7 Å²	88.7	22%	0.224	48%	0.483	C	S	.	.			trans	-74.8	122.4	169.3	178.7	0	0	0	0	109.7	K115 G244 T338 K339 A344	K115-S342 VanDerWaalsContact CD-O 3.3Å; K115-S342 WeakPolarHBondContact CD-O 3.35Å; K115-S342 PolarHBondContact NZ-O 3.46Å; G244-S342 VanDerWaalsContact O-CA 3.26Å; G244-S342 WeakPolarHBondContact O-CA 3.41Å; G244-S342 VanDerWaalsContact O-CB 3.32Å; G244-S342 WeakPolarHBondContact O-CB 3.45Å; G244-S342 PolarHBondContact O-OG 2.86Å; T338-S342 WeakPolarHBondContact O-CB 3.35Å; T338-S342 PolarHBondContact O-N 3.23Å; K339-S342 PolarHBondContact O-N 3.31Å; S342-A344 PolarHBondContact OG-N 3.48Å
343	F	62.1	Low	49.9	Very low	55 Å²	55	89 Å²	89	24%	0.241	49%	0.488	C	S	.	.			trans	-97.8	4.7	176.8	-61.9	-95	0	0	0	111.9	K115 F119 R241 Y341 V345	K115-F343 HydrophobicContact CB-CD1 3.66Å; K115-F343 HydrophobicContact CB-CE1 3.69Å; F119-F343 HydrophobicContact CB-CE1 4.31Å; F119-F343 HydrophobicContact CB-CZ 4.13Å; F119-F343 HydrophobicContact CD2-CZ 4.35Å; F119-F343 HydrophobicContact CG-CZ 4.41Å; R241-F343 HydrophobicContact CB-CE2 4.43Å; R241-F343 HydrophobicContact CG-CE2 3.84Å; R241-F343 HydrophobicContact CG-CZ 4.46Å; Y341-F343 WeakPolarHBondContact O-CD2 3.45Å; Y341-F343 WeakPolarHBondContact O-CE2 3.43Å; Y341-F343 PolarHBondContact O-N 3.19Å; F343-V345 PolarHBondContact O-N 3.19Å
344	A	59.1	Low	48.9	Very low	73 Å²	73	94.8 Å²	94.8	60%	0.603	52%	0.52	S	S	*	.			trans	-64.4	135.3	174.8	0	0	0	0	0	109.7	S342	S342-A344 PolarHBondContact OG-N 3.48Å
345	V	53.4	Low	47.8	Very low	122 Å²	122	95.8 Å²	95.8	74%	0.739	53%	0.525	S	S	*	.			trans	-60.9	132.5	171	-178.8	0	0	0	0	107.5	F343 N347	F343-V345 PolarHBondContact O-N 3.19Å; V345-N347 PolarHBondContact O-N 2.63Å
346	P	51	Low	46.7	Very low	121 Å²	121	101.8 Å²	101.8	79%	0.786	55%	0.548	S	S	*	.			trans	-58.6	111.4	171.3	-16.9	28.8	0	0	0	108.3
347	N	38.7	Very low	45.2	Very low	157 Å²	157	107.6 Å²	107.6	84%	0.84	58%	0.58	S	S	*	*			trans	-65.6	141.1	168.8	-103	-5	0	0	0	108.8	V345	V345-N347 PolarHBondContact O-N 2.63Å
348	E	34.1	Very low	43.9	Very low	184 Å²	184	113.8 Å²	113.8	86%	0.86	61%	0.613	S	S	*	*	S	Bend	trans	-49.9	144.7	-172.5	-67.5	175	136.5	0	0	114.3
349	K	28.8	Very low	42.5	Very low	175 Å²	175	119.6 Å²	119.6	76%	0.761	64%	0.643	S	S	*	*			trans	86	83.8	175.1	-54.2	-178.6	-177.4	178.9	0	115.8	N351	K349-N351 PolarHBondContact O-N 2.99Å
350	I	34.3	Very low	41.1	Very low	167 Å²	167	122.7 Å²	122.7	86%	0.856	66%	0.664	S	S	*	*			trans	-66.4	90.1	141.2	-61	173.3	0	0	0	105.1	A352	I350-A352 PolarHBondContact O-N 3.1Å; I350-A352 VanDerWaalsContact O-N 3.16Å
351	N	27.8	Very low	39.7	Very low	112 Å²	112	126.9 Å²	126.9	60%	0.599	69%	0.689	S	S	*	*			trans	-63.6	113.9	165.1	-80.4	-17.3	0	0	0	106.5	K349 C353	K349-N351 PolarHBondContact O-N 2.99Å; N351-C353 PolarHBondContact O-N 3.36Å
352	A	32.4	Very low	38.5	Very low	99 Å²	99	130.4 Å²	130.4	82%	0.818	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	43.1	176.3	0	0	0	0	0	112.1	I350	I350-A352 PolarHBondContact O-N 3.1Å; I350-A352 VanDerWaalsContact O-N 3.16Å
353	C	32	Very low	37	Very low	98 Å²	98	134.9 Å²	134.9	66%	0.662	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	6.1	-169.8	-67.6	0	0	0	0	116	N351	N351-C353 PolarHBondContact O-N 3.36Å
354	D	32.3	Very low	35.8	Very low	168 Å²	168	139.4 Å²	139.4	90%	0.898	77%	0.773	S	S	*	*	S	Bend	trans	-98.5	21.3	175.8	-68.9	-10.5	0	0	0	113.3
355	E	32.6	Very low	34.5	Very low	105 Å²	105	144.4 Å²	144.4	49%	0.491	78%	0.784	S	S	.	*	S	Bend	trans	-103.3	134	154.7	-80.8	179.1	169.8	0	0	106.9	K82	K82-E355 IonicContact NZ-OE1 3.81Å; K82-E355 PolarHBondContact NZ-OE1 3.48Å; K82-E355 IonicContact NZ-OE2 2.62Å
356	F	32.7	Very low	33.8	Very low	193 Å²	193	148.2 Å²	148.2	85%	0.846	79%	0.791	S	S	*	*			trans	86.9	72.8	174.4	-47.5	-76.2	0	0	0	117.3
357	D	29.6	Very low	33	Very low	151 Å²	151	148.6 Å²	148.6	81%	0.807	79%	0.79	S	S	*	*			trans	-142.7	81.1	143.5	-151.6	9.7	0	0	0	109.4
358	D	32.4	Very low	33	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	79%	0.788	S	S	*	*	S	Bend	trans	-148.9	60.9	170.2	-133.4	7.4	0	0	0	105.5
359	N	31.5	Very low	33.4	Very low	154 Å²	154	149.4 Å²	149.4	82%	0.824	81%	0.807	S	S	*	*			trans	175.7	89.6	164.3	-90	-18.5	0	0	0	108.8
360	D	32.8	Very low	33.6	Very low	158 Å²	158	148.2 Å²	148.2	85%	0.845	81%	0.809	S	S	*	*				-150.4	122.8	128.8	-134.6	-5.8	0	0	0	111.2
361	D	33.6	Very low	33.5	Very low	141 Å²	141	147.2 Å²	147.2	75%	0.754	81%	0.807	S	S	*	*			trans	-69.2	168.2	169.5	-130.9	-28.9	0	0	0	108.4
362	T	35.2	Very low	33.9	Very low	115 Å²	115	149.1 Å²	149.1	71%	0.706	82%	0.818	S	S	*	*			trans	87.6	113.2	159.6	67.3	0	0	0	0	120.4
363	T	31.4	Very low	34	Very low	126 Å²	126	152.1 Å²	152.1	77%	0.773	82%	0.818	S	S	*	*			trans	76.3	97	138.4	43.4	0	0	0	0	119.6
364	T	35.5	Very low	34.1	Very low	149 Å²	149	155.4 Å²	155.4	91%	0.914	83%	0.828	S	S	*	*			trans	-141.3	76.9	142	-10.2	0	0	0	0	110.2
365	E	32.7	Very low	34.2	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	82%	0.823	S	S	*	*			trans	-86.7	102.7	157	-171	-179.8	-155.8	0	0	107.4
366	K	37.6	Very low	34.3	Very low	202 Å²	202	158.1 Å²	158.1	88%	0.878	85%	0.847	S	S	*	*			trans	-147.3	100.3	155.7	-89.3	-166.5	-179.4	172.9	0	110.2
367	V	35.5	Very low	34.4	Very low	128 Å²	128	155.5 Å²	155.5	78%	0.776	85%	0.847	S	S	*	*			trans	-48.1	127.9	159	174	0	0	0	0	110.9
368	I	39.2	Very low	34.8	Very low	153 Å²	153	155.8 Å²	155.8	79%	0.785	85%	0.85	S	S	*	*			trans	-150	119.2	139.7	-55.2	-173.3	0	0	0	109
369	T	40.5	Very low	35.1	Very low	206 Å²	206	155.5 Å²	155.5	100%	1.264	85%	0.85	S	S	*	*			trans	65.8	0	168.3	40.9	0	0	0	0	120.5

Retrieved 369 of 369 residues in 405.3 ms (Link to these results)

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