A0A3Q0KMB0_SCHMA Loading...

Acyl-CoA: cholesterol acyltransferase protein isotype 1.1; O-acyltransferase

AlphaFold DB (A4K7Z0), UniProt , Accession A0A3Q0KMB0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 590 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55.2	Low	67.8	Low	192 Å²	192	114.3 Å²	114.3	95%	0.946	58%	0.579	S	S	*	*				0	-52.4	0	-153.5	-170.1	-45.1	0	0	111.2	S4 L5	M1-S4 PolarHBondContact O-N 3.3Å; M1-S4 PolarHBondContact O-OG 3.05Å; M1-L5 PolarHBondContact O-N 2.9Å; M1-L5 VanDerWaalsContact O-N 3.09Å
2	Q	47.3	Very low	68.4	Low	145 Å²	145	118.6 Å²	118.6	68%	0.678	58%	0.583	S	S	*	*	H	α-helix	trans	-64.9	-44.3	176.1	-160.9	172.6	-10.1	0	0	112.4	S4 L5 I6	Q2-S4 PolarHBondContact O-N 3.49Å; Q2-L5 PolarHBondContact O-N 3.15Å; Q2-I6 WeakPolarHBondContact O-CG1 3.37Å; Q2-I6 PolarHBondContact O-N 3.09Å; Q2-I6 VanDerWaalsContact O-N 3.14Å
3	E	57.7	Low	68.9	Low	165 Å²	165	119.8 Å²	119.8	77%	0.771	58%	0.577	S	S	*	*	H	α-helix	trans	-61.3	-40.4	173.3	-74.5	178.5	155.4	0	0	112.8	L5 I6 D7	E3-L5 PolarHBondContact O-N 3.19Å; E3-I6 PolarHBondContact O-N 3.33Å; E3-D7 PolarHBondContact O-N 3.28Å
4	S	64.1	Low	69.4	Low	71 Å²	71	122.6 Å²	122.6	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-68.2	-34.4	-180	72.7	0	0	0	0	112.7	M1 Q2 E8	M1-S4 PolarHBondContact O-N 3.3Å; M1-S4 PolarHBondContact O-OG 3.05Å; Q2-S4 PolarHBondContact O-N 3.49Å; S4-E8 WeakPolarHBondContact O-CB 3.43Å; S4-E8 PolarHBondContact O-N 3.18Å
5	L	68.2	Low	69.7	Low	96 Å²	96	122.2 Å²	122.2	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-67.5	-40.1	174.1	-84.8	164.5	0	0	0	111.8	M1 Q2 E3 D7 E8 M9	M1-L5 PolarHBondContact O-N 2.9Å; M1-L5 VanDerWaalsContact O-N 3.09Å; Q2-L5 PolarHBondContact O-N 3.15Å; E3-L5 PolarHBondContact O-N 3.19Å; L5-D7 VanDerWaalsContact C-N 3.35Å; L5-E8 PolarHBondContact O-N 3.04Å; L5-M9 WeakPolarHBondContact O-CB 3.48Å; L5-M9 VanDerWaalsContact O-CG 3.32Å; L5-M9 WeakPolarHBondContact O-CG 3.35Å; L5-M9 PolarHBondContact O-N 3.46Å
6	I	74.8	Confident	70.1	Confident	88 Å²	88	121 Å²	121	45%	0.451	58%	0.575	S	S	.	*	H	α-helix	trans	-64	-42.3	176.3	-67.6	168.5	0	0	0	110.5	Q2 E3 M9 N10	Q2-I6 WeakPolarHBondContact O-CG1 3.37Å; Q2-I6 PolarHBondContact O-N 3.09Å; Q2-I6 VanDerWaalsContact O-N 3.14Å; E3-I6 PolarHBondContact O-N 3.33Å; I6-M9 PolarHBondContact O-N 3.3Å; I6-N10 WeakPolarHBondContact O-CB 3.37Å; I6-N10 PolarHBondContact O-N 3.45Å; I6-N10 PolarHBondContact O-ND2 3.33Å
7	D	75.5	Confident	70.3	Confident	97 Å²	97	120.1 Å²	120.1	52%	0.519	57%	0.57	S	S	.	*	H	α-helix	trans	-64.9	-42.7	176.3	-93.5	-13.9	0	0	0	112.6	E3 L5 M9 N10 I11	E3-D7 PolarHBondContact O-N 3.28Å; L5-D7 VanDerWaalsContact C-N 3.35Å; D7-M9 VanDerWaalsContact C-N 3.33Å; D7-M9 PolarHBondContact O-N 3.25Å; D7-N10 PolarHBondContact O-N 3.4Å; D7-I11 VanDerWaalsContact O-CG1 3.3Å; D7-I11 WeakPolarHBondContact O-CG1 3.38Å; D7-I11 PolarHBondContact O-N 3.13Å
8	E	75.9	Confident	70.5	Confident	104 Å²	104	121.8 Å²	121.8	49%	0.486	58%	0.575	S	S	.	*	H	α-helix	trans	-63.1	-40.1	177.8	-140.4	-165.3	154.5	0	0	111.7	S4 L5 I11 R12	S4-E8 WeakPolarHBondContact O-CB 3.43Å; S4-E8 PolarHBondContact O-N 3.18Å; L5-E8 PolarHBondContact O-N 3.04Å; E8-I11 PolarHBondContact O-N 3.44Å; E8-R12 PolarHBondContact O-N 3.36Å; E8-R12 VanDerWaalsContact O-N 3.08Å; E8-R12 IonicContact OE1-NH2 3.9Å
9	M	72.3	Confident	70.6	Confident	133 Å²	133	119.8 Å²	119.8	66%	0.655	57%	0.568	S	S	*	*	H	α-helix	trans	-64.3	-42.3	174.3	-73.8	-179.3	64.6	0	0	112.1	L5 I6 D7 I11 R12 R13	L5-M9 WeakPolarHBondContact O-CB 3.48Å; L5-M9 VanDerWaalsContact O-CG 3.32Å; L5-M9 WeakPolarHBondContact O-CG 3.35Å; L5-M9 PolarHBondContact O-N 3.46Å; I6-M9 PolarHBondContact O-N 3.3Å; D7-M9 VanDerWaalsContact C-N 3.33Å; D7-M9 PolarHBondContact O-N 3.25Å; M9-I11 VanDerWaalsContact C-N 3.32Å; M9-I11 PolarHBondContact O-N 3.14Å; M9-R12 PolarHBondContact O-N 3.39Å; M9-R13 PolarHBondContact O-N 2.95Å
10	N	76.5	Confident	70.5	Confident	62 Å²	62	120 Å²	120	33%	0.332	57%	0.57	S	S	.	*	H	α-helix	trans	-66.6	-32.3	177.4	-77.8	-26.8	0	0	0	112.7	I6 D7 R14	I6-N10 WeakPolarHBondContact O-CB 3.37Å; I6-N10 PolarHBondContact O-N 3.45Å; I6-N10 PolarHBondContact O-ND2 3.33Å; D7-N10 PolarHBondContact O-N 3.4Å; N10-R14 WeakPolarHBondContact O-CG 3.46Å; N10-R14 PolarHBondContact O-N 3.48Å; N10-R14 PolarHBondContact O-NE 3.4Å
11	I	78.6	Confident	70.6	Confident	104 Å²	104	121 Å²	121	53%	0.533	57%	0.572	S	S	.	*	H	α-helix	trans	-68.3	-46.5	174.1	-69.4	165.8	0	0	0	110.5	D7 E8 M9 R14 H15	D7-I11 VanDerWaalsContact O-CG1 3.3Å; D7-I11 WeakPolarHBondContact O-CG1 3.38Å; D7-I11 PolarHBondContact O-N 3.13Å; E8-I11 PolarHBondContact O-N 3.44Å; M9-I11 VanDerWaalsContact C-N 3.32Å; M9-I11 PolarHBondContact O-N 3.14Å; I11-R14 PolarHBondContact O-N 3.14Å; I11-H15 PolarHBondContact O-N 2.94Å
12	R	75	Confident	71.4	Confident	166 Å²	166	115.6 Å²	115.6	63%	0.626	55%	0.55	S	S	*	.	H	α-helix	trans	-60.4	-46.6	176.9	-73	-174.6	-173.6	-141.3	3.7	112.1	E8 M9 R14 H15 D16	E8-R12 PolarHBondContact O-N 3.36Å; E8-R12 VanDerWaalsContact O-N 3.08Å; E8-R12 IonicContact OE1-NH2 3.9Å; M9-R12 PolarHBondContact O-N 3.39Å; R12-R14 VanDerWaalsContact C-N 3.32Å; R12-R14 PolarHBondContact O-N 3.04Å; R12-H15 WeakPolarHBondContact O-CB 3.45Å; R12-H15 PolarHBondContact O-N 2.97Å; R12-D16 PolarHBondContact O-N 3.26Å
13	R	74.9	Confident	72.4	Confident	134 Å²	134	111.3 Å²	111.3	51%	0.506	54%	0.539	S	S	.	.	H	α-helix	trans	-56.4	-44.8	176.7	-177.3	-176.8	-94.3	167.1	-9.6	112	M9 H15 D16 E17	M9-R13 PolarHBondContact O-N 2.95Å; R13-H15 VanDerWaalsContact C-N 3.31Å; R13-H15 PolarHBondContact O-N 3.41Å; R13-D16 PolarHBondContact O-N 3.48Å; R13-E17 PolarHBondContact O-N 2.97Å
14	R	75.4	Confident	72.8	Confident	160 Å²	160	106.4 Å²	106.4	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-64.9	-33.6	177.2	-80.5	-172.8	-79.8	-159	-2.6	112.9	N10 I11 R12 K18	N10-R14 WeakPolarHBondContact O-CG 3.46Å; N10-R14 PolarHBondContact O-N 3.48Å; N10-R14 PolarHBondContact O-NE 3.4Å; I11-R14 PolarHBondContact O-N 3.14Å; R12-R14 VanDerWaalsContact C-N 3.32Å; R12-R14 PolarHBondContact O-N 3.04Å; R14-K18 PolarHBondContact O-N 3.15Å
15	H	74.9	Confident	73.1	Confident	116 Å²	116	106.7 Å²	106.7	54%	0.537	52%	0.522	S	S	.	.	H	α-helix	trans	-69.2	-44.1	176.3	-162.4	69.5	0	0	0	111.4	I11 R12 R13 K18 N19	I11-H15 PolarHBondContact O-N 2.94Å; R12-H15 WeakPolarHBondContact O-CB 3.45Å; R12-H15 PolarHBondContact O-N 2.97Å; R13-H15 VanDerWaalsContact C-N 3.31Å; R13-H15 PolarHBondContact O-N 3.41Å; H15-K18 WeakPolarHBondContact O-CB 3.5Å; H15-K18 PolarHBondContact O-N 3.11Å; H15-N19 PolarHBondContact CD2-ND2 3.13Å; H15-N19 PolarHBondContact O-N 3.16Å; H15-N19 PolarHBondContact O-ND2 3.46Å
16	D	75.1	Confident	73.2	Confident	103 Å²	103	108.3 Å²	108.3	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-65.8	-41.4	178.3	-66.9	-24.1	0	0	0	112.2	R12 R13 K18 N19 M20	R12-D16 PolarHBondContact O-N 3.26Å; R13-D16 PolarHBondContact O-N 3.48Å; D16-K18 VanDerWaalsContact C-N 3.29Å; D16-K18 PolarHBondContact O-N 3.45Å; D16-N19 PolarHBondContact O-N 3.39Å; D16-M20 WeakPolarHBondContact O-CB 3.47Å; D16-M20 PolarHBondContact O-N 3.46Å
17	E	73.6	Confident	72.7	Confident	106 Å²	106	107.3 Å²	107.3	50%	0.495	53%	0.528	S	S	.	.	H	α-helix	trans	-60	-39	173.1	-80.4	-178.4	179.3	0	0	112.3	R13 K21	R13-E17 PolarHBondContact O-N 2.97Å; E17-K21 WeakPolarHBondContact O-CG 3.3Å; E17-K21 PolarHBondContact O-N 3.13Å
18	K	74.4	Confident	72.4	Confident	151 Å²	151	107.7 Å²	107.7	66%	0.657	53%	0.529	S	S	*	.	H	α-helix	trans	-65.3	-45.8	176.5	-123.5	-178.8	-179.9	-176.4	0	111	R14 H15 D16 M20 K21 T22	R14-K18 PolarHBondContact O-N 3.15Å; H15-K18 WeakPolarHBondContact O-CB 3.5Å; H15-K18 PolarHBondContact O-N 3.11Å; D16-K18 VanDerWaalsContact C-N 3.29Å; D16-K18 PolarHBondContact O-N 3.45Å; K18-M20 VanDerWaalsContact C-N 3.33Å; K18-M20 PolarHBondContact O-N 3.14Å; K18-K21 PolarHBondContact O-N 3.43Å; K18-T22 PolarHBondContact O-N 3.01Å; K18-T22 PolarHBondContact O-OG1 3Å
19	N	72.4	Confident	72.1	Confident	83 Å²	83	107 Å²	107	44%	0.444	53%	0.529	S	S	.	.	H	α-helix	trans	-63.1	-41.3	178.6	-70.1	-21.5	0	0	0	111.3	H15 D16 T22 A23	H15-N19 PolarHBondContact CD2-ND2 3.13Å; H15-N19 PolarHBondContact O-N 3.16Å; H15-N19 PolarHBondContact O-ND2 3.46Å; D16-N19 PolarHBondContact O-N 3.39Å; N19-T22 PolarHBondContact O-N 3.01Å; N19-A23 PolarHBondContact O-N 3.4Å
20	M	67.8	Low	72	Confident	124 Å²	124	105.8 Å²	105.8	61%	0.611	53%	0.525	S	S	*	.	H	α-helix	trans	-67.2	-41.6	179.5	-153.3	178.4	84.4	0	0	112.4	D16 K18 T22 A23 S24	D16-M20 WeakPolarHBondContact O-CB 3.47Å; D16-M20 PolarHBondContact O-N 3.46Å; K18-M20 VanDerWaalsContact C-N 3.33Å; K18-M20 PolarHBondContact O-N 3.14Å; M20-T22 VanDerWaalsContact C-N 3.31Å; M20-T22 PolarHBondContact O-N 3.21Å; M20-A23 PolarHBondContact O-N 3.33Å; M20-S24 PolarHBondContact O-N 3.5Å
21	K	74	Confident	71.5	Confident	142 Å²	142	107.7 Å²	107.7	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-63.2	-37.4	172.8	-75.1	179.8	-179.6	178.8	0	112.1	E17 K18 S24 T25	E17-K21 WeakPolarHBondContact O-CG 3.3Å; E17-K21 PolarHBondContact O-N 3.13Å; K18-K21 PolarHBondContact O-N 3.43Å; K21-S24 PolarHBondContact O-OG 2.97Å; K21-S24 VanDerWaalsContact O-OG 3.09Å; K21-T25 WeakPolarHBondContact O-CB 3.27Å; K21-T25 PolarHBondContact O-N 3.34Å; K21-T25 PolarHBondContact O-OG1 3.39Å
22	T	71.9	Confident	71	Confident	77 Å²	77	107.2 Å²	107.2	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-68	-42.8	179.2	-45.9	0	0	0	0	111	K18 N19 M20 T25 Q26	K18-T22 PolarHBondContact O-N 3.01Å; K18-T22 PolarHBondContact O-OG1 3Å; N19-T22 PolarHBondContact O-N 3.01Å; M20-T22 VanDerWaalsContact C-N 3.31Å; M20-T22 PolarHBondContact O-N 3.21Å; T22-T25 PolarHBondContact O-N 3Å; T22-Q26 PolarHBondContact O-N 3.4Å
23	A	67.6	Low	70.8	Confident	56 Å²	56	104 Å²	104	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-42	175.4	0	0	0	0	0	112.7	N19 M20 T25 Q26 S27	N19-A23 PolarHBondContact O-N 3.4Å; M20-A23 PolarHBondContact O-N 3.33Å; A23-T25 VanDerWaalsContact C-N 3.34Å; A23-T25 PolarHBondContact O-N 3.01Å; A23-Q26 PolarHBondContact O-N 3.02Å; A23-S27 WeakPolarHBondContact O-CB 3.47Å; A23-S27 PolarHBondContact O-N 3.49Å
24	S	65	Low	70.4	Confident	61 Å²	61	103.9 Å²	103.9	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-65.6	-38.7	176.7	77.2	0	0	0	0	111.9	M20 K21 S27 L28	M20-S24 PolarHBondContact O-N 3.5Å; K21-S24 PolarHBondContact O-OG 2.97Å; K21-S24 VanDerWaalsContact O-OG 3.09Å; S24-S27 WeakPolarHBondContact O-CB 3.46Å; S24-S27 PolarHBondContact O-N 3.03Å; S24-L28 PolarHBondContact O-N 3.38Å
25	T	71.4	Confident	69.8	Low	77 Å²	77	99 Å²	99	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-38.2	178.1	-45.7	0	0	0	0	111.6	K21 T22 A23 L28 N29	K21-T25 WeakPolarHBondContact O-CB 3.27Å; K21-T25 PolarHBondContact O-N 3.34Å; K21-T25 PolarHBondContact O-OG1 3.39Å; T22-T25 PolarHBondContact O-N 3Å; A23-T25 VanDerWaalsContact C-N 3.34Å; A23-T25 PolarHBondContact O-N 3.01Å; T25-L28 PolarHBondContact O-N 3.13Å; T25-N29 WeakPolarHBondContact O-CB 3.43Å; T25-N29 PolarHBondContact O-N 3.39Å
26	Q	70.1	Confident	69.6	Low	131 Å²	131	100.6 Å²	100.6	61%	0.612	53%	0.529	S	S	*	.	H	α-helix	trans	-65.1	-42.6	173.1	-88.3	-179.9	-23	0	0	112.5	T22 A23 N29 N30	T22-Q26 PolarHBondContact O-N 3.4Å; A23-Q26 PolarHBondContact O-N 3.02Å; Q26-N29 PolarHBondContact O-N 2.99Å; Q26-N30 PolarHBondContact O-N 2.98Å
27	S	64.3	Low	69.2	Low	67 Å²	67	101.9 Å²	101.9	47%	0.469	53%	0.532	S	S	.	.	H	α-helix	trans	-57.2	-49.5	173.8	164.4	0	0	0	0	111.7	A23 S24 N29 N30 L31	A23-S27 WeakPolarHBondContact O-CB 3.47Å; A23-S27 PolarHBondContact O-N 3.49Å; S24-S27 WeakPolarHBondContact O-CB 3.46Å; S24-S27 PolarHBondContact O-N 3.03Å; S27-N29 VanDerWaalsContact C-N 3.33Å; S27-N29 PolarHBondContact O-N 3.24Å; S27-N30 PolarHBondContact O-N 3.44Å; S27-L31 PolarHBondContact O-N 2.97Å
28	L	68.4	Low	68.6	Low	104 Å²	104	103.6 Å²	103.6	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-62.1	-38.2	178.3	-112.4	132.9	0	0	0	112.8	S24 T25 N32	S24-L28 PolarHBondContact O-N 3.38Å; T25-L28 PolarHBondContact O-N 3.13Å; L28-N32 WeakPolarHBondContact O-CB 3.48Å; L28-N32 PolarHBondContact O-N 3.47Å
29	N	70.6	Confident	68.2	Low	91 Å²	91	103 Å²	103	49%	0.487	54%	0.536	S	S	.	.	H	α-helix	trans	-67.5	-39.6	175.9	-80.8	-14.1	0	0	0	112.3	T25 Q26 S27 N32 L33	T25-N29 WeakPolarHBondContact O-CB 3.43Å; T25-N29 PolarHBondContact O-N 3.39Å; Q26-N29 PolarHBondContact O-N 2.99Å; S27-N29 VanDerWaalsContact C-N 3.33Å; S27-N29 PolarHBondContact O-N 3.24Å; N29-N32 PolarHBondContact O-N 3.38Å; N29-L33 PolarHBondContact O-N 3.04Å
30	N	69.1	Low	67.8	Low	106 Å²	106	104.7 Å²	104.7	57%	0.567	54%	0.543	S	S	*	.	H	α-helix	trans	-65.6	-41	176	-78.7	-9.8	0	0	0	112.1	Q26 S27 L33 Q34	Q26-N30 PolarHBondContact O-N 2.98Å; S27-N30 PolarHBondContact O-N 3.44Å; N30-L33 WeakPolarHBondContact O-CB 3.42Å; N30-L33 PolarHBondContact O-N 3.09Å; N30-Q34 PolarHBondContact O-N 3.43Å
31	L	66.1	Low	67.3	Low	103 Å²	103	101.3 Å²	101.3	54%	0.539	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-41.8	174.3	-86	155.8	0	0	0	112.2	S27 L33 Q34 S35	S27-L31 PolarHBondContact O-N 2.97Å; L31-L33 VanDerWaalsContact C-N 3.32Å; L31-L33 PolarHBondContact O-N 2.99Å; L31-Q34 PolarHBondContact O-N 2.95Å; L31-S35 WeakPolarHBondContact O-CB 3.39Å; L31-S35 PolarHBondContact O-N 3.47Å
32	N	69.2	Low	66.5	Low	93 Å²	93	99.8 Å²	99.8	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-66.5	-33.4	175.3	-86.9	-30.8	0	0	0	112.9	L28 N29 K36	L28-N32 WeakPolarHBondContact O-CB 3.48Å; L28-N32 PolarHBondContact O-N 3.47Å; N29-N32 PolarHBondContact O-N 3.38Å; N32-K36 PolarHBondContact O-N 2.99Å
33	L	70	Confident	65.9	Low	99 Å²	99	104.5 Å²	104.5	52%	0.518	55%	0.547	S	S	.	.	H	α-helix	trans	-66	-48	173.1	-100.4	148.8	0	0	0	111.4	N29 N30 L31 S35 K36 E37	N29-L33 PolarHBondContact O-N 3.04Å; N30-L33 WeakPolarHBondContact O-CB 3.42Å; N30-L33 PolarHBondContact O-N 3.09Å; L31-L33 VanDerWaalsContact C-N 3.32Å; L31-L33 PolarHBondContact O-N 2.99Å; L33-S35 VanDerWaalsContact C-N 3.32Å; L33-S35 PolarHBondContact O-N 3.25Å; L33-K36 PolarHBondContact O-N 2.66Å; L33-K36 VanDerWaalsContact O-N 3.14Å; L33-E37 PolarHBondContact O-N 3.27Å
34	Q	66.9	Low	65.4	Low	131 Å²	131	106.8 Å²	106.8	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-60.9	-39.7	175.2	-79.5	-175.3	-41.7	0	0	112.5	N30 L31 K36 E37 F38	N30-Q34 PolarHBondContact O-N 3.43Å; L31-Q34 PolarHBondContact O-N 2.95Å; Q34-K36 VanDerWaalsContact C-N 3.34Å; Q34-K36 PolarHBondContact O-N 2.91Å; Q34-E37 PolarHBondContact O-N 3Å; Q34-F38 PolarHBondContact O-N 2.66Å
35	S	63.8	Low	64.6	Low	59 Å²	59	110.8 Å²	110.8	41%	0.413	57%	0.572	S	S	.	*	H	α-helix	trans	-62	-40	174.5	176.4	0	0	0	0	112.4	L31 L33 K39	L31-S35 WeakPolarHBondContact O-CB 3.39Å; L31-S35 PolarHBondContact O-N 3.47Å; L33-S35 VanDerWaalsContact C-N 3.32Å; L33-S35 PolarHBondContact O-N 3.25Å; S35-K39 PolarHBondContact O-N 3.47Å; S35-K39 VanDerWaalsContact O-N 3.13Å
36	K	69.9	Low	63.2	Low	148 Å²	148	112.9 Å²	112.9	64%	0.643	59%	0.59	S	S	*	*	H	α-helix	trans	-68.4	-42.7	175.6	-86.4	-177	174	-179.5	0	112.6	N32 L33 Q34 F38 K39 I40	N32-K36 PolarHBondContact O-N 2.99Å; L33-K36 PolarHBondContact O-N 2.66Å; L33-K36 VanDerWaalsContact O-N 3.14Å; Q34-K36 VanDerWaalsContact C-N 3.34Å; Q34-K36 PolarHBondContact O-N 2.91Å; K36-F38 VanDerWaalsContact C-N 3.29Å; K36-F38 PolarHBondContact O-N 3.47Å; K36-K39 PolarHBondContact O-N 3.43Å; K36-I40 WeakPolarHBondContact O-CG1 3.47Å; K36-I40 PolarHBondContact O-N 2.95Å
37	E	67.7	Low	62.1	Low	130 Å²	130	112.1 Å²	112.1	61%	0.607	60%	0.598	S	S	*	*	H	α-helix	trans	-61.6	-39.3	176.9	-73.6	-175.7	160.6	0	0	111.6	L33 Q34 I40 A41	L33-E37 PolarHBondContact O-N 3.27Å; Q34-E37 PolarHBondContact O-N 3Å; E37-I40 PolarHBondContact O-N 2.98Å; E37-A41 PolarHBondContact O-N 3.33Å; E37-A41 VanDerWaalsContact O-N 3.09Å
38	F	60.2	Low	61	Low	143 Å²	143	114.5 Å²	114.5	63%	0.627	62%	0.615	S	S	*	*	H	α-helix	trans	-69.3	-38.2	177.9	-155.5	-93	0	0	0	112.8	Q34 K36 I40 A41 E42	Q34-F38 PolarHBondContact O-N 2.66Å; K36-F38 VanDerWaalsContact C-N 3.29Å; K36-F38 PolarHBondContact O-N 3.47Å; F38-I40 PolarHBondContact O-N 3.03Å; F38-A41 PolarHBondContact O-N 3.48Å; F38-A41 VanDerWaalsContact O-N 3.15Å; F38-E42 PolarHBondContact O-N 2.91Å
39	K	66	Low	60.2	Low	139 Å²	139	113.6 Å²	113.6	60%	0.604	62%	0.615	S	S	*	*	H	α-helix	trans	-62.3	-31.3	173.5	-80.4	-175.2	177.1	-177.7	0	113.1	S35 K36	S35-K39 PolarHBondContact O-N 3.47Å; S35-K39 VanDerWaalsContact O-N 3.13Å; K36-K39 PolarHBondContact O-N 3.43Å
40	I	63.5	Low	59.4	Low	118 Å²	118	116.4 Å²	116.4	61%	0.605	63%	0.63	S	S	*	*	H	α-helix	trans	-73.8	-37.1	175.3	-64.2	166.4	0	0	0	110.4	K36 E37 F38 Q43	K36-I40 WeakPolarHBondContact O-CG1 3.47Å; K36-I40 PolarHBondContact O-N 2.95Å; E37-I40 PolarHBondContact O-N 2.98Å; F38-I40 PolarHBondContact O-N 3.03Å; I40-Q43 PolarHBondContact O-N 2.94Å
41	A	58.1	Low	58.8	Low	53 Å²	53	118.4 Å²	118.4	44%	0.438	64%	0.641	S	S	.	*	H	α-helix	trans	-68.1	-35.7	174.4	0	0	0	0	0	112.9	E37 F38 Q43 T44	E37-A41 PolarHBondContact O-N 3.33Å; E37-A41 VanDerWaalsContact O-N 3.09Å; F38-A41 PolarHBondContact O-N 3.48Å; F38-A41 VanDerWaalsContact O-N 3.15Å; A41-Q43 PolarHBondContact O-N 3.31Å; A41-T44 PolarHBondContact O-N 3.44Å; A41-T44 PolarHBondContact O-OG1 3.07Å; A41-T44 VanDerWaalsContact O-OG1 3.05Å
42	E	56.3	Low	58.5	Low	109 Å²	109	119.1 Å²	119.1	51%	0.509	65%	0.646	S	S	.	*	H	α-helix	trans	-67.3	-23.9	179.5	-153.5	175.1	-168.3	0	0	112.5	F38 T44 K53	F38-E42 PolarHBondContact O-N 2.91Å; E42-T44 VanDerWaalsContact C-N 3.34Å; E42-K53 IonicContact OE1-NZ 3.86Å
43	Q	59.7	Low	58	Low	176 Å²	176	120.9 Å²	120.9	82%	0.822	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-12.8	175.5	-83.8	-177.4	-21.1	0	0	114.5	I40 A41	I40-Q43 PolarHBondContact O-N 2.94Å; A41-Q43 PolarHBondContact O-N 3.31Å
44	T	57.2	Low	57.5	Low	105 Å²	105	123.6 Å²	123.6	64%	0.644	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-9.6	-171.8	38	0	0	0	0	115.6	A41 E42	A41-T44 PolarHBondContact O-N 3.44Å; A41-T44 PolarHBondContact O-OG1 3.07Å; A41-T44 VanDerWaalsContact O-OG1 3.05Å; E42-T44 VanDerWaalsContact C-N 3.34Å
45	N	48.8	Very low	57.2	Low	145 Å²	145	126.1 Å²	126.1	78%	0.775	66%	0.663	S	S	*	*			trans	-137.6	110.1	178.7	-83.5	-34	0	0	0	112.4
46	S	42.3	Very low	57.4	Low	121 Å²	121	130.3 Å²	130.3	85%	0.846	67%	0.673	S	S	*	*			trans	-93.9	94.8	167.9	53.8	0	0	0	0	109.7
47	S	45.9	Very low	57.2	Low	114 Å²	114	127.6 Å²	127.6	80%	0.797	67%	0.669	S	S	*	*	S	Bend	trans	177.7	114.9	145.2	34.3	0	0	0	0	111.1
48	S	41.5	Very low	57.3	Low	118 Å²	118	126.5 Å²	126.5	83%	0.825	66%	0.664	S	S	*	*			trans	70.7	95.6	159.1	-171.2	0	0	0	0	119.4
49	P	52	Low	57.9	Low	84 Å²	84	124 Å²	124	55%	0.545	66%	0.657	S	S	.	*			trans	-148.6	100.4	147.2	35.3	-15	0	0	0	113.4
50	D	54.1	Low	58.3	Low	150 Å²	150	121.2 Å²	121.2	80%	0.802	65%	0.651	S	S	*	*	S	Bend	trans	-98.5	-23.7	170	-132.7	2.7	0	0	0	112.5
51	N	56.3	Low	58.9	Low	149 Å²	149	120 Å²	120	80%	0.797	65%	0.649	S	S	*	*	H	α-helix	trans	-80.2	-26.9	-177.7	-106.5	-10.9	0	0	0	114.6
52	D	58.5	Low	59.5	Low	117 Å²	117	124.6 Å²	124.6	63%	0.626	66%	0.655	S	S	*	*	H	α-helix	trans	-79.5	-27.1	-175.5	-76.5	-29.6	0	0	0	113.5	F56	D52-F56 PolarHBondContact O-N 2.97Å
53	K	59.2	Low	60.6	Low	131 Å²	131	123.7 Å²	123.7	57%	0.57	66%	0.66	S	S	*	*	H	α-helix	trans	-65.9	-40.4	177.8	-92	178.6	177.2	167	0	112.6	E42 R55 F56 V57	E42-K53 IonicContact OE1-NZ 3.86Å; K53-R55 VanDerWaalsContact C-N 3.34Å; K53-R55 PolarHBondContact O-N 3.39Å; K53-F56 PolarHBondContact O-N 3.43Å; K53-V57 WeakPolarHBondContact O-CG2 3.21Å; K53-V57 PolarHBondContact O-N 3.04Å
54	H	59.6	Low	61.5	Low	155 Å²	155	119.4 Å²	119.4	72%	0.718	64%	0.642	S	S	*	*	H	α-helix	trans	-68.6	-34.8	-175.5	-127.6	-69.2	0	0	0	112.6	H58	H54-H58 PolarHBondContact O-N 3.43Å
55	R	61.1	Low	62.3	Low	185 Å²	185	119.1 Å²	119.1	70%	0.698	64%	0.636	S	S	*	*	H	α-helix	trans	-70.2	-40.9	178.1	-166.3	174.2	179.2	-177.5	0	112	K53 H58 D59	K53-R55 VanDerWaalsContact C-N 3.34Å; K53-R55 PolarHBondContact O-N 3.39Å; R55-H58 PolarHBondContact O-N 3.22Å; R55-D59 PolarHBondContact O-N 3.22Å; R55-D59 VanDerWaalsContact O-N 3.14Å
56	F	67.1	Low	63.6	Low	146 Å²	146	115 Å²	115	64%	0.64	62%	0.623	S	S	*	*	H	α-helix	trans	-65.6	-41.9	179.1	-168.2	-95	0	0	0	112.6	D52 K53 H58 D59 V60	D52-F56 PolarHBondContact O-N 2.97Å; K53-F56 PolarHBondContact O-N 3.43Å; F56-H58 VanDerWaalsContact C-N 3.32Å; F56-H58 PolarHBondContact O-N 3.37Å; F56-D59 PolarHBondContact O-N 2.99Å; F56-V60 HydrophobicContact CD1-CG2 4.16Å; F56-V60 HydrophobicContact CE1-CG2 3.85Å; F56-V60 HydrophobicContact CZ-CG2 4.27Å; F56-V60 WeakPolarHBondContact O-CG2 3.45Å; F56-V60 PolarHBondContact O-N 3.48Å; F56-V60 VanDerWaalsContact O-N 3.16Å
57	V	67.3	Low	65.5	Low	91 Å²	91	114.6 Å²	114.6	55%	0.552	61%	0.608	S	S	*	*	H	α-helix	trans	-64.4	-39.4	177.6	176.3	0	0	0	0	111.2	K53 V60 V61	K53-V57 WeakPolarHBondContact O-CG2 3.21Å; K53-V57 PolarHBondContact O-N 3.04Å; V57-V60 PolarHBondContact O-N 3.12Å; V57-V61 HydrophobicContact CG1-CG2 4.49Å; V57-V61 WeakPolarHBondContact O-CG2 3.32Å; V57-V61 PolarHBondContact O-N 2.98Å; V57-V61 VanDerWaalsContact O-N 3.14Å
58	H	69.3	Low	67.1	Low	108 Å²	108	114.2 Å²	114.2	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-63.6	-42.9	177.8	-174.3	-91	0	0	0	112.3	H54 R55 F56 V61 W62	H54-H58 PolarHBondContact O-N 3.43Å; R55-H58 PolarHBondContact O-N 3.22Å; F56-H58 VanDerWaalsContact C-N 3.32Å; F56-H58 PolarHBondContact O-N 3.37Å; H58-V61 PolarHBondContact O-N 2.96Å; H58-W62 AromaticContact CE1-CD1 3.13Å; H58-W62 AromaticContact CE1-NE1 3.11Å; H58-W62 PolarHBondContact CE1-NE1 3.43Å; H58-W62 AromaticContact ND1-CD1 3.53Å; H58-W62 AromaticContact ND1-NE1 3.97Å; H58-W62 AromaticContact NE2-CD1 3.46Å; H58-W62 AromaticContact NE2-NE1 3.15Å; H58-W62 PolarHBondContact NE2-NE1 3.05Å; H58-W62 VanDerWaalsContact NE2-NE1 3.15Å; H58-W62 PolarHBondContact O-N 3.06Å; H58-W62 VanDerWaalsContact O-N 3.13Å
59	D	71.5	Confident	69	Low	90 Å²	90	115.5 Å²	115.5	48%	0.481	58%	0.584	S	S	.	*	H	α-helix	trans	-67.3	-36.2	179.4	-72	-15.4	0	0	0	112.3	R55 F56 C63	R55-D59 PolarHBondContact O-N 3.22Å; R55-D59 VanDerWaalsContact O-N 3.14Å; F56-D59 PolarHBondContact O-N 2.99Å; D59-C63 PolarHBondContact O-N 2.99Å; D59-C63 VanDerWaalsContact O-N 3.13Å; D59-C63 PolarHBondContact O-SG 3.2Å
60	V	75.5	Confident	70.3	Confident	80 Å²	80	117.9 Å²	117.9	49%	0.485	58%	0.582	S	S	.	*	H	α-helix	trans	-67.6	-42.8	176.7	173.8	0	0	0	0	111.8	F56 V57 C63 D64	F56-V60 HydrophobicContact CD1-CG2 4.16Å; F56-V60 HydrophobicContact CE1-CG2 3.85Å; F56-V60 HydrophobicContact CZ-CG2 4.27Å; F56-V60 WeakPolarHBondContact O-CG2 3.45Å; F56-V60 PolarHBondContact O-N 3.48Å; F56-V60 VanDerWaalsContact O-N 3.16Å; V57-V60 PolarHBondContact O-N 3.12Å; V60-C63 PolarHBondContact O-N 3.04Å; V60-D64 PolarHBondContact O-N 3.38Å; V60-D64 VanDerWaalsContact O-N 3.13Å
61	V	75.2	Confident	71.6	Confident	92 Å²	92	115.1 Å²	115.1	56%	0.558	57%	0.567	S	S	*	*	H	α-helix	trans	-66.6	-39.8	179.6	173.3	0	0	0	0	111.6	V57 H58 D64 L65	V57-V61 HydrophobicContact CG1-CG2 4.49Å; V57-V61 WeakPolarHBondContact O-CG2 3.32Å; V57-V61 PolarHBondContact O-N 2.98Å; V57-V61 VanDerWaalsContact O-N 3.14Å; H58-V61 PolarHBondContact O-N 2.96Å; V61-D64 PolarHBondContact O-N 3.48Å; V61-L65 PolarHBondContact O-N 3.09Å
62	W	72.3	Confident	72.8	Confident	151 Å²	151	113.1 Å²	113.1	57%	0.572	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-38.3	176.3	-93.4	100.4	0	0	0	113	H58 A66	H58-W62 AromaticContact CE1-CD1 3.13Å; H58-W62 AromaticContact CE1-NE1 3.11Å; H58-W62 PolarHBondContact CE1-NE1 3.43Å; H58-W62 AromaticContact ND1-CD1 3.53Å; H58-W62 AromaticContact ND1-NE1 3.97Å; H58-W62 AromaticContact NE2-CD1 3.46Å; H58-W62 AromaticContact NE2-NE1 3.15Å; H58-W62 PolarHBondContact NE2-NE1 3.05Å; H58-W62 VanDerWaalsContact NE2-NE1 3.15Å; H58-W62 PolarHBondContact O-N 3.06Å; H58-W62 VanDerWaalsContact O-N 3.13Å; W62-A66 VanDerWaalsContact O-CB 3.27Å; W62-A66 WeakPolarHBondContact O-CB 3.44Å; W62-A66 PolarHBondContact O-N 2.94Å
63	C	78	Confident	73.7	Confident	89 Å²	89	112 Å²	112	60%	0.601	55%	0.55	S	S	*	.	H	α-helix	trans	-62.1	-44.1	173.9	-79.8	0	0	0	0	112	D59 V60 A66 E67	D59-C63 PolarHBondContact O-N 2.99Å; D59-C63 VanDerWaalsContact O-N 3.13Å; D59-C63 PolarHBondContact O-SG 3.2Å; V60-C63 PolarHBondContact O-N 3.04Å; C63-A66 PolarHBondContact O-N 2.89Å; C63-E67 WeakPolarHBondContact O-CB 3.4Å; C63-E67 PolarHBondContact O-N 3.3Å
64	D	78	Confident	74.8	Confident	86 Å²	86	109.7 Å²	109.7	46%	0.46	54%	0.543	S	S	.	.	H	α-helix	trans	-65.5	-43.3	178.6	-168.4	63.4	0	0	0	112	V60 V61 A66 E67 Q68	V60-D64 PolarHBondContact O-N 3.38Å; V60-D64 VanDerWaalsContact O-N 3.13Å; V61-D64 PolarHBondContact O-N 3.48Å; D64-A66 PolarHBondContact O-N 3.2Å; D64-E67 PolarHBondContact O-N 3.46Å; D64-Q68 WeakPolarHBondContact O-CG 3.46Å; D64-Q68 PolarHBondContact O-N 3.08Å; D64-Q68 PolarHBondContact OD2-NE2 2.98Å
65	L	74.8	Confident	75.8	Confident	99 Å²	99	106 Å²	106	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-64.4	-41.1	177.5	-168.6	72.5	0	0	0	112	V61 E67 Q68 F69	V61-L65 PolarHBondContact O-N 3.09Å; L65-E67 VanDerWaalsContact C-N 3.32Å; L65-Q68 PolarHBondContact O-N 3.46Å; L65-F69 WeakPolarHBondContact O-CB 3.41Å; L65-F69 PolarHBondContact O-N 3.23Å
66	A	77.3	Confident	76.7	Confident	59 Å²	59	104.2 Å²	104.2	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.7	0	0	0	0	0	111.6	W62 C63 D64 R70	W62-A66 VanDerWaalsContact O-CB 3.27Å; W62-A66 WeakPolarHBondContact O-CB 3.44Å; W62-A66 PolarHBondContact O-N 2.94Å; C63-A66 PolarHBondContact O-N 2.89Å; D64-A66 PolarHBondContact O-N 3.2Å; A66-R70 VanDerWaalsContact O-CB 3.3Å; A66-R70 WeakPolarHBondContact O-CB 3.44Å; A66-R70 PolarHBondContact O-N 3.33Å
67	E	80.8	Confident	77.5	Confident	113 Å²	113	103 Å²	103	53%	0.528	53%	0.531	S	S	.	.	H	α-helix	trans	-69.6	-42.1	177.7	-161.1	174.5	-165.4	0	0	112	C63 D64 L65 R70 L71	C63-E67 WeakPolarHBondContact O-CB 3.4Å; C63-E67 PolarHBondContact O-N 3.3Å; D64-E67 PolarHBondContact O-N 3.46Å; L65-E67 VanDerWaalsContact C-N 3.32Å; E67-R70 WeakPolarHBondContact O-CB 3.43Å; E67-R70 PolarHBondContact O-N 2.99Å; E67-L71 WeakPolarHBondContact O-CG 3.41Å; E67-L71 PolarHBondContact O-N 3.37Å
68	Q	79.9	Confident	78.3	Confident	105 Å²	105	101.5 Å²	101.5	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-44.1	174.5	-72.4	-173.7	24.9	0	0	112.4	D64 L65 R70 L71 N72	D64-Q68 WeakPolarHBondContact O-CG 3.46Å; D64-Q68 PolarHBondContact O-N 3.08Å; D64-Q68 PolarHBondContact OD2-NE2 2.98Å; L65-Q68 PolarHBondContact O-N 3.46Å; Q68-R70 VanDerWaalsContact C-N 3.35Å; Q68-L71 PolarHBondContact O-N 3.38Å; Q68-N72 PolarHBondContact O-N 2.93Å
69	F	80.4	Confident	78.9	Confident	145 Å²	145	102.3 Å²	102.3	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-62.9	-42.7	175.8	-173.9	-98.2	0	0	0	111.3	L65 L71 N72 L73	L65-F69 WeakPolarHBondContact O-CB 3.41Å; L65-F69 PolarHBondContact O-N 3.23Å; F69-L71 VanDerWaalsContact C-N 3.35Å; F69-L71 PolarHBondContact O-N 3.41Å; F69-N72 PolarHBondContact O-N 3.44Å; F69-L73 HydrophobicContact CE1-CD1 3.76Å; F69-L73 HydrophobicContact CZ-CD1 3.8Å; F69-L73 WeakPolarHBondContact O-CB 3.32Å; F69-L73 PolarHBondContact O-N 3.02Å
70	R	80.8	Confident	79.5	Confident	135 Å²	135	104.5 Å²	104.5	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-58.8	-44.6	175.6	-166.1	-174.6	96	103.4	0.2	111.6	A66 E67 Q68 I74	A66-R70 VanDerWaalsContact O-CB 3.3Å; A66-R70 WeakPolarHBondContact O-CB 3.44Å; A66-R70 PolarHBondContact O-N 3.33Å; E67-R70 WeakPolarHBondContact O-CB 3.43Å; E67-R70 PolarHBondContact O-N 2.99Å; Q68-R70 VanDerWaalsContact C-N 3.35Å; R70-I74 HydrophobicContact CG-CD1 3.98Å; R70-I74 WeakPolarHBondContact O-CB 3.27Å; R70-I74 WeakPolarHBondContact O-CD1 3.5Å; R70-I74 WeakPolarHBondContact O-CG1 3.1Å; R70-I74 PolarHBondContact O-N 3.43Å
71	L	80.9	Confident	79.8	Confident	91 Å²	91	105.9 Å²	105.9	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-45.9	179.6	-74.2	168.8	0	0	0	112.3	E67 Q68 F69 L73 I74 T75	E67-L71 WeakPolarHBondContact O-CG 3.41Å; E67-L71 PolarHBondContact O-N 3.37Å; Q68-L71 PolarHBondContact O-N 3.38Å; F69-L71 VanDerWaalsContact C-N 3.35Å; F69-L71 PolarHBondContact O-N 3.41Å; L71-L73 PolarHBondContact O-N 2.8Å; L71-I74 PolarHBondContact O-N 3Å; L71-T75 WeakPolarHBondContact O-CG2 3.3Å; L71-T75 PolarHBondContact O-N 2.93Å; L71-T75 PolarHBondContact O-OG1 2.95Å
72	N	80.4	Confident	80.2	Confident	108 Å²	108	105.6 Å²	105.6	58%	0.578	53%	0.526	S	S	*	.	H	α-helix	trans	-64.8	-37.5	177.4	-88.2	-16.9	0	0	0	113	Q68 F69 T75 Q76	Q68-N72 PolarHBondContact O-N 2.93Å; F69-N72 PolarHBondContact O-N 3.44Å; N72-T75 WeakPolarHBondContact CA-OG1 3.49Å; N72-T75 PolarHBondContact O-OG1 2.98Å; N72-Q76 PolarHBondContact O-N 3.09Å; N72-Q76 VanDerWaalsContact O-N 3.12Å
73	L	79.1	Confident	80.9	Confident	93 Å²	93	102.9 Å²	102.9	49%	0.487	53%	0.526	S	S	.	.	H	α-helix	trans	-68.7	-39.4	178.1	-161.5	122.8	0	0	0	111.4	F69 L71 L77	F69-L73 HydrophobicContact CE1-CD1 3.76Å; F69-L73 HydrophobicContact CZ-CD1 3.8Å; F69-L73 WeakPolarHBondContact O-CB 3.32Å; F69-L73 PolarHBondContact O-N 3.02Å; L71-L73 PolarHBondContact O-N 2.8Å; L73-L77 VanDerWaalsContact O-CB 3.27Å; L73-L77 WeakPolarHBondContact O-CB 3.32Å; L73-L77 PolarHBondContact O-N 3.09Å; L73-L77 VanDerWaalsContact O-N 3.09Å
74	I	82.5	Confident	81	Confident	82 Å²	82	101.3 Å²	101.3	42%	0.421	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-43.4	175.6	-70.7	168.1	0	0	0	111.2	R70 L71 L77 D78	R70-I74 HydrophobicContact CG-CD1 3.98Å; R70-I74 WeakPolarHBondContact O-CB 3.27Å; R70-I74 WeakPolarHBondContact O-CD1 3.5Å; R70-I74 WeakPolarHBondContact O-CG1 3.1Å; R70-I74 PolarHBondContact O-N 3.43Å; L71-I74 PolarHBondContact O-N 3Å; I74-L77 PolarHBondContact O-N 3.44Å; I74-D78 VanDerWaalsContact O-CB 3.32Å; I74-D78 WeakPolarHBondContact O-CB 3.5Å; I74-D78 PolarHBondContact O-N 2.77Å
75	T	80.3	Confident	81.2	Confident	78 Å²	78	101.8 Å²	101.8	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-68.3	-41.9	-178.2	52.1	0	0	0	0	112.6	L71 N72 D78 E79	L71-T75 WeakPolarHBondContact O-CG2 3.3Å; L71-T75 PolarHBondContact O-N 2.93Å; L71-T75 PolarHBondContact O-OG1 2.95Å; N72-T75 WeakPolarHBondContact CA-OG1 3.49Å; N72-T75 PolarHBondContact O-OG1 2.98Å; T75-D78 PolarHBondContact O-N 3.39Å; T75-E79 PolarHBondContact O-N 3.12Å; T75-E79 VanDerWaalsContact O-N 3.09Å
76	Q	80.2	Confident	81.7	Confident	148 Å²	148	102.4 Å²	102.4	69%	0.692	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-40.6	175.6	-74.5	-171.2	-18.6	0	0	112.5	N72 H80	N72-Q76 PolarHBondContact O-N 3.09Å; N72-Q76 VanDerWaalsContact O-N 3.12Å; Q76-H80 WeakPolarHBondContact O-CB 3.28Å; Q76-H80 PolarHBondContact O-N 3.07Å
77	L	83.1	Confident	82	Confident	121 Å²	121	104.5 Å²	104.5	63%	0.634	53%	0.525	S	S	*	.	H	α-helix	trans	-66.7	-38.9	177.3	-162.8	76.1	0	0	0	111.4	L73 I74 L81	L73-L77 VanDerWaalsContact O-CB 3.27Å; L73-L77 WeakPolarHBondContact O-CB 3.32Å; L73-L77 PolarHBondContact O-N 3.09Å; L73-L77 VanDerWaalsContact O-N 3.09Å; I74-L77 PolarHBondContact O-N 3.44Å; L77-L81 WeakPolarHBondContact O-CB 3.46Å; L77-L81 PolarHBondContact O-N 3.38Å
78	D	83.9	Confident	82.2	Confident	59 Å²	59	104.5 Å²	104.5	32%	0.316	53%	0.528	S	S	.	.	H	α-helix	trans	-65.3	-44.2	177.3	-176.1	65.5	0	0	0	112.3	I74 T75 K82	I74-D78 VanDerWaalsContact O-CB 3.32Å; I74-D78 WeakPolarHBondContact O-CB 3.5Å; I74-D78 PolarHBondContact O-N 2.77Å; T75-D78 PolarHBondContact O-N 3.39Å; D78-K82 WeakPolarHBondContact O-CB 3.24Å; D78-K82 VanDerWaalsContact O-CG 3.24Å; D78-K82 WeakPolarHBondContact O-CG 3.38Å; D78-K82 PolarHBondContact O-N 3.43Å; D78-K82 WeakPolarHBondContact OD2-CE 3.38Å; D78-K82 IonicContact OD2-NZ 2.65Å; D78-K82 PolarHBondContact OD2-NZ 3.49Å
79	E	83.1	Confident	82.5	Confident	124 Å²	124	102.6 Å²	102.6	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-50.2	174.2	-86.4	-81	132.7	0	0	111.9	T75 L81 K82 V83	T75-E79 PolarHBondContact O-N 3.12Å; T75-E79 VanDerWaalsContact O-N 3.09Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 2.76Å; E79-K82 PolarHBondContact O-N 3.1Å; E79-V83 PolarHBondContact O-N 3.27Å; E79-V83 VanDerWaalsContact O-N 3.1Å
80	H	83.6	Confident	82.5	Confident	136 Å²	136	98.6 Å²	98.6	63%	0.63	51%	0.513	S	S	*	.	H	α-helix	trans	-66.4	-36.5	-179.1	-162.4	-70.1	0	0	0	112.1	Q76 S84	Q76-H80 WeakPolarHBondContact O-CB 3.28Å; Q76-H80 PolarHBondContact O-N 3.07Å; H80-S84 PolarHBondContact ND1-OG 2.65Å; H80-S84 WeakPolarHBondContact O-CB 3.15Å; H80-S84 PolarHBondContact O-N 2.92Å; H80-S84 PolarHBondContact O-OG 2.98Å
81	L	81.6	Confident	82.6	Confident	110 Å²	110	95.7 Å²	95.7	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-66.8	-41.5	175.1	-173.2	68.9	0	0	0	111.2	L77 E79 S84 L85	L77-L81 WeakPolarHBondContact O-CB 3.46Å; L77-L81 PolarHBondContact O-N 3.38Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 2.76Å; L81-S84 PolarHBondContact O-N 3.06Å; L81-L85 WeakPolarHBondContact O-CB 3.1Å; L81-L85 PolarHBondContact O-N 3.28Å
82	K	84	Confident	82.6	Confident	86 Å²	86	94 Å²	94	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-47.2	175.6	-80.9	167.2	175.3	163.5	0	112.2	D78 E79 L85 N86	D78-K82 WeakPolarHBondContact O-CB 3.24Å; D78-K82 VanDerWaalsContact O-CG 3.24Å; D78-K82 WeakPolarHBondContact O-CG 3.38Å; D78-K82 PolarHBondContact O-N 3.43Å; D78-K82 WeakPolarHBondContact OD2-CE 3.38Å; D78-K82 IonicContact OD2-NZ 2.65Å; D78-K82 PolarHBondContact OD2-NZ 3.49Å; E79-K82 PolarHBondContact O-N 3.1Å; K82-L85 PolarHBondContact O-N 3.14Å; K82-N86 WeakPolarHBondContact O-CB 3.38Å; K82-N86 VanDerWaalsContact O-CG 3.23Å; K82-N86 PolarHBondContact O-N 2.84Å; K82-N86 PolarHBondContact O-ND2 3.42Å
83	V	85.7	Confident	82.7	Confident	94 Å²	94	93.4 Å²	93.4	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-63.9	-47.5	178.5	175.3	0	0	0	0	110.9	E79 L85 N86 D87	E79-V83 PolarHBondContact O-N 3.27Å; E79-V83 VanDerWaalsContact O-N 3.1Å; V83-L85 VanDerWaalsContact C-N 3.33Å; V83-L85 PolarHBondContact O-N 3.44Å; V83-N86 PolarHBondContact O-N 3.43Å; V83-D87 PolarHBondContact O-N 3.35Å
84	S	80.7	Confident	82.6	Confident	56 Å²	56	92.1 Å²	92.1	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-63.7	-38.6	180	-53.8	0	0	0	0	112.2	H80 L81 L88	H80-S84 PolarHBondContact ND1-OG 2.65Å; H80-S84 WeakPolarHBondContact O-CB 3.15Å; H80-S84 PolarHBondContact O-N 2.92Å; H80-S84 PolarHBondContact O-OG 2.98Å; L81-S84 PolarHBondContact O-N 3.06Å; S84-L88 WeakPolarHBondContact O-CB 3.47Å; S84-L88 PolarHBondContact O-N 3.12Å
85	L	82.2	Confident	82.3	Confident	95 Å²	95	96.9 Å²	96.9	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-68.3	-42	176.8	-171.3	70.3	0	0	0	111.2	L81 K82 V83 D87 L88 V89	L81-L85 WeakPolarHBondContact O-CB 3.1Å; L81-L85 PolarHBondContact O-N 3.28Å; K82-L85 PolarHBondContact O-N 3.14Å; V83-L85 VanDerWaalsContact C-N 3.33Å; V83-L85 PolarHBondContact O-N 3.44Å; L85-D87 VanDerWaalsContact C-N 3.34Å; L85-D87 PolarHBondContact O-N 3.37Å; L85-L88 PolarHBondContact O-N 3.28Å; L85-V89 HydrophobicContact CG-CG2 4.39Å; L85-V89 VanDerWaalsContact O-CB 3.32Å; L85-V89 WeakPolarHBondContact O-CB 3.45Å; L85-V89 WeakPolarHBondContact O-CG2 3.38Å; L85-V89 PolarHBondContact O-N 3.37Å
86	N	85.9	Confident	82.2	Confident	112 Å²	112	97.1 Å²	97.1	60%	0.599	52%	0.515	S	S	*	.	H	α-helix	trans	-62.3	-40.9	176.2	-76.2	-19.9	0	0	0	112	K82 V83 V89 S90	K82-N86 WeakPolarHBondContact O-CB 3.38Å; K82-N86 VanDerWaalsContact O-CG 3.23Å; K82-N86 PolarHBondContact O-N 2.84Å; K82-N86 PolarHBondContact O-ND2 3.42Å; V83-N86 PolarHBondContact O-N 3.43Å; N86-V89 PolarHBondContact O-N 3.09Å; N86-S90 WeakPolarHBondContact O-CB 3.42Å; N86-S90 PolarHBondContact O-N 3.45Å
87	D	83.8	Confident	81.9	Confident	104 Å²	104	92.4 Å²	92.4	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-67.8	-42.8	177.5	-165.8	45.9	0	0	0	112	V83 L85 V89 S90 T91	V83-D87 PolarHBondContact O-N 3.35Å; L85-D87 VanDerWaalsContact C-N 3.34Å; L85-D87 PolarHBondContact O-N 3.37Å; D87-V89 PolarHBondContact O-N 3Å; D87-S90 PolarHBondContact O-N 3.44Å; D87-S90 PolarHBondContact O-OG 3.13Å; D87-T91 WeakPolarHBondContact O-CB 3.5Å; D87-T91 PolarHBondContact O-N 3.2Å; D87-T91 PolarHBondContact O-OG1 2.95Å
88	L	84.3	Confident	81.2	Confident	113 Å²	113	94.3 Å²	94.3	59%	0.592	50%	0.498	S	S	*	.	H	α-helix	trans	-61.2	-44.6	173.5	-179.5	63.8	0	0	0	111.9	S84 L85 T91 A92	S84-L88 WeakPolarHBondContact O-CB 3.47Å; S84-L88 PolarHBondContact O-N 3.12Å; L85-L88 PolarHBondContact O-N 3.28Å; L88-T91 PolarHBondContact O-N 2.94Å; L88-A92 VanDerWaalsContact O-CB 3.28Å; L88-A92 WeakPolarHBondContact O-CB 3.39Å; L88-A92 PolarHBondContact O-N 3.3Å
89	V	85.6	Confident	80.4	Confident	65 Å²	65	95.9 Å²	95.9	39%	0.394	51%	0.506	S	S	.	.	H	α-helix	trans	-64.6	-43.4	178.3	168.5	0	0	0	0	110.6	L85 N86 D87 T91 A92 I93	L85-V89 HydrophobicContact CG-CG2 4.39Å; L85-V89 VanDerWaalsContact O-CB 3.32Å; L85-V89 WeakPolarHBondContact O-CB 3.45Å; L85-V89 WeakPolarHBondContact O-CG2 3.38Å; L85-V89 PolarHBondContact O-N 3.37Å; N86-V89 PolarHBondContact O-N 3.09Å; D87-V89 PolarHBondContact O-N 3Å; V89-T91 PolarHBondContact O-N 3.24Å; V89-A92 PolarHBondContact O-N 3.38Å; V89-I93 HydrophobicContact CG1-CD1 3.67Å; V89-I93 HydrophobicContact CG1-CG1 4.37Å; V89-I93 WeakPolarHBondContact O-CB 3.26Å; V89-I93 VanDerWaalsContact O-CG1 3.25Å; V89-I93 WeakPolarHBondContact O-CG1 3.49Å; V89-I93 PolarHBondContact O-N 3.33Å
90	S	81.2	Confident	80	Confident	61 Å²	61	95 Å²	95	43%	0.427	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-40.6	177.9	80.9	0	0	0	0	112.1	N86 D87 I93 S94	N86-S90 WeakPolarHBondContact O-CB 3.42Å; N86-S90 PolarHBondContact O-N 3.45Å; D87-S90 PolarHBondContact O-N 3.44Å; D87-S90 PolarHBondContact O-OG 3.13Å; S90-I93 PolarHBondContact O-N 2.98Å; S90-S94 WeakPolarHBondContact O-CB 3.48Å; S90-S94 PolarHBondContact O-N 3.16Å; S90-S94 PolarHBondContact O-OG 2.91Å
91	T	83.2	Confident	79.4	Confident	74 Å²	74	94 Å²	94	45%	0.454	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-40.8	174.8	-58.8	0	0	0	0	111.6	D87 L88 V89 S94 R95	D87-T91 WeakPolarHBondContact O-CB 3.5Å; D87-T91 PolarHBondContact O-N 3.2Å; D87-T91 PolarHBondContact O-OG1 2.95Å; L88-T91 PolarHBondContact O-N 2.94Å; V89-T91 PolarHBondContact O-N 3.24Å; T91-S94 WeakPolarHBondContact CA-OG 3.24Å; T91-S94 PolarHBondContact O-OG 3.19Å; T91-R95 WeakPolarHBondContact O-CB 3.17Å; T91-R95 PolarHBondContact O-N 3.38Å
92	A	79.9	Confident	79	Confident	54 Å²	54	91.1 Å²	91.1	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-44.8	176.1	0	0	0	0	0	111.9	L88 V89 R95 D96	L88-A92 VanDerWaalsContact O-CB 3.28Å; L88-A92 WeakPolarHBondContact O-CB 3.39Å; L88-A92 PolarHBondContact O-N 3.3Å; V89-A92 PolarHBondContact O-N 3.38Å; A92-R95 PolarHBondContact O-N 3.12Å; A92-D96 VanDerWaalsContact O-CB 3.32Å; A92-D96 WeakPolarHBondContact O-CB 3.41Å; A92-D96 PolarHBondContact O-N 3.39Å
93	I	82.2	Confident	78.5	Confident	96 Å²	96	92.7 Å²	92.7	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-63.7	-44.1	177.6	-68.5	166.2	0	0	0	111.1	V89 S90 R95 D96 S97	V89-I93 HydrophobicContact CG1-CD1 3.67Å; V89-I93 HydrophobicContact CG1-CG1 4.37Å; V89-I93 WeakPolarHBondContact O-CB 3.26Å; V89-I93 VanDerWaalsContact O-CG1 3.25Å; V89-I93 WeakPolarHBondContact O-CG1 3.49Å; V89-I93 PolarHBondContact O-N 3.33Å; S90-I93 PolarHBondContact O-N 2.98Å; I93-R95 PolarHBondContact O-N 3.48Å; I93-D96 PolarHBondContact O-N 3.23Å; I93-S97 WeakPolarHBondContact O-CB 3.39Å; I93-S97 PolarHBondContact O-N 2.83Å; I93-S97 PolarHBondContact O-OG 3.36Å
94	S	78	Confident	78	Confident	66 Å²	66	90.9 Å²	90.9	46%	0.462	49%	0.492	S	S	.	.	H	α-helix	trans	-64.8	-39.2	177.8	62.8	0	0	0	0	112.2	S90 T91 S97 Y98	S90-S94 WeakPolarHBondContact O-CB 3.48Å; S90-S94 PolarHBondContact O-N 3.16Å; S90-S94 PolarHBondContact O-OG 2.91Å; T91-S94 WeakPolarHBondContact CA-OG 3.24Å; T91-S94 PolarHBondContact O-OG 3.19Å; S94-S97 WeakPolarHBondContact CA-OG 3.25Å; S94-S97 PolarHBondContact O-OG 3.4Å; S94-Y98 WeakPolarHBondContact O-CB 3.32Å; S94-Y98 PolarHBondContact O-N 3.34Å
95	R	76.1	Confident	77.5	Confident	182 Å²	182	92.2 Å²	92.2	69%	0.687	49%	0.494	S	S	*	.	H	α-helix	trans	-68.8	-41.5	175.3	-170.9	172.4	178.8	129.6	-2.5	112.4	T91 A92 I93 Y98 L99	T91-R95 WeakPolarHBondContact O-CB 3.17Å; T91-R95 PolarHBondContact O-N 3.38Å; A92-R95 PolarHBondContact O-N 3.12Å; I93-R95 PolarHBondContact O-N 3.48Å; R95-Y98 PolarHBondContact O-N 3.01Å; R95-L99 HydrophobicContact CG-CD1 4.24Å; R95-L99 WeakPolarHBondContact O-CB 3.34Å; R95-L99 VanDerWaalsContact O-CG 3.31Å; R95-L99 WeakPolarHBondContact O-CG 3.31Å; R95-L99 PolarHBondContact O-N 2.96Å
96	D	77.4	Confident	77.1	Confident	84 Å²	84	91.8 Å²	91.8	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-64.3	-46.1	176.7	-171.3	45.9	0	0	0	111.1	A92 I93 Y98 L99 Q100	A92-D96 VanDerWaalsContact O-CB 3.32Å; A92-D96 WeakPolarHBondContact O-CB 3.41Å; A92-D96 PolarHBondContact O-N 3.39Å; I93-D96 PolarHBondContact O-N 3.23Å; D96-Y98 VanDerWaalsContact C-N 3.33Å; D96-Y98 PolarHBondContact O-N 2.96Å; D96-L99 PolarHBondContact O-N 3.37Å; D96-L99 VanDerWaalsContact O-N 3.15Å; D96-Q100 WeakPolarHBondContact O-CB 3.47Å; D96-Q100 VanDerWaalsContact O-CG 3.27Å; D96-Q100 WeakPolarHBondContact O-CG 3.28Å; D96-Q100 PolarHBondContact O-N 3.02Å; D96-Q100 PolarHBondContact OD2-NE2 2.94Å
97	S	73.8	Confident	76.5	Confident	49 Å²	49	90.4 Å²	90.4	34%	0.343	49%	0.485	S	S	.	.	H	α-helix	trans	-61.2	-38.2	175.3	62	0	0	0	0	112.9	I93 S94 N101	I93-S97 WeakPolarHBondContact O-CB 3.39Å; I93-S97 PolarHBondContact O-N 2.83Å; I93-S97 PolarHBondContact O-OG 3.36Å; S94-S97 WeakPolarHBondContact CA-OG 3.25Å; S94-S97 PolarHBondContact O-OG 3.4Å; S97-N101 WeakPolarHBondContact O-CB 3.5Å; S97-N101 PolarHBondContact O-N 3.28Å; S97-N101 PolarHBondContact O-ND2 2.95Å; S97-N101 VanDerWaalsContact O-ND2 3.11Å
98	Y	68.4	Low	76	Confident	161 Å²	161	88.7 Å²	88.7	63%	0.631	47%	0.471	S	S	*	.	H	α-helix	trans	-64.5	-44.3	172.7	178.4	-94	0	0	0	112.5	S94 R95 D96 N101 T102	S94-Y98 WeakPolarHBondContact O-CB 3.32Å; S94-Y98 PolarHBondContact O-N 3.34Å; R95-Y98 PolarHBondContact O-N 3.01Å; D96-Y98 VanDerWaalsContact C-N 3.33Å; D96-Y98 PolarHBondContact O-N 2.96Å; Y98-N101 PolarHBondContact O-N 3.48Å; Y98-T102 WeakPolarHBondContact O-CB 3.22Å; Y98-T102 PolarHBondContact O-N 3.47Å; Y98-T102 PolarHBondContact O-OG1 3.48Å
99	L	68.9	Low	75.7	Confident	91 Å²	91	84 Å²	84	48%	0.476	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-44.2	177.2	-74.4	168.6	0	0	0	111.3	R95 D96 T102 Q103	R95-L99 HydrophobicContact CG-CD1 4.24Å; R95-L99 WeakPolarHBondContact O-CB 3.34Å; R95-L99 VanDerWaalsContact O-CG 3.31Å; R95-L99 WeakPolarHBondContact O-CG 3.31Å; R95-L99 PolarHBondContact O-N 2.96Å; D96-L99 PolarHBondContact O-N 3.37Å; D96-L99 VanDerWaalsContact O-N 3.15Å; L99-T102 PolarHBondContact O-N 2.85Å; L99-Q103 VanDerWaalsContact O-CB 3.3Å; L99-Q103 WeakPolarHBondContact O-CB 3.32Å; L99-Q103 PolarHBondContact O-N 3.44Å
100	Q	73.5	Confident	75.2	Confident	107 Å²	107	83.6 Å²	83.6	50%	0.5	44%	0.444	S	S	.	.	H	α-helix	trans	-60.4	-44.5	174.7	-72.5	178	8.4	0	0	111.5	D96 T102 Q103 A104	D96-Q100 WeakPolarHBondContact O-CB 3.47Å; D96-Q100 VanDerWaalsContact O-CG 3.27Å; D96-Q100 WeakPolarHBondContact O-CG 3.28Å; D96-Q100 PolarHBondContact O-N 3.02Å; D96-Q100 PolarHBondContact OD2-NE2 2.94Å; Q100-T102 PolarHBondContact O-N 3.29Å; Q100-Q103 PolarHBondContact O-N 2.91Å; Q100-A104 WeakPolarHBondContact O-CB 3.49Å; Q100-A104 PolarHBondContact O-N 3.49Å
101	N	71.1	Confident	74.9	Confident	115 Å²	115	81.2 Å²	81.2	62%	0.615	43%	0.426	S	S	*	.	H	α-helix	trans	-63.5	-40.7	175.6	-75.9	-30.3	0	0	0	112.1	S97 Y98 L105	S97-N101 WeakPolarHBondContact O-CB 3.5Å; S97-N101 PolarHBondContact O-N 3.28Å; S97-N101 PolarHBondContact O-ND2 2.95Å; S97-N101 VanDerWaalsContact O-ND2 3.11Å; Y98-N101 PolarHBondContact O-N 3.48Å; N101-L105 VanDerWaalsContact O-CB 3.32Å; N101-L105 WeakPolarHBondContact O-CB 3.4Å; N101-L105 PolarHBondContact O-N 2.9Å
102	T	72.4	Confident	74.5	Confident	48 Å²	48	79.2 Å²	79.2	29%	0.294	41%	0.411	S	S	.	.	H	α-helix	trans	-67.1	-41.7	177.5	-55.9	0	0	0	0	111.2	Y98 L99 Q100 L105 N106	Y98-T102 WeakPolarHBondContact O-CB 3.22Å; Y98-T102 PolarHBondContact O-N 3.47Å; Y98-T102 PolarHBondContact O-OG1 3.48Å; L99-T102 PolarHBondContact O-N 2.85Å; Q100-T102 PolarHBondContact O-N 3.29Å; T102-L105 PolarHBondContact O-N 2.84Å; T102-N106 WeakPolarHBondContact O-CB 3.25Å; T102-N106 VanDerWaalsContact O-CG 3.28Å; T102-N106 PolarHBondContact O-N 3.28Å; T102-N106 PolarHBondContact O-ND2 3.21Å
103	Q	74.6	Confident	73.5	Confident	120 Å²	120	80.8 Å²	80.8	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-67.5	-44.9	176.1	-174.6	170.9	-11.1	0	0	111.1	L99 Q100 L105 N106 D107	L99-Q103 VanDerWaalsContact O-CB 3.3Å; L99-Q103 WeakPolarHBondContact O-CB 3.32Å; L99-Q103 PolarHBondContact O-N 3.44Å; Q100-Q103 PolarHBondContact O-N 2.91Å; Q103-L105 VanDerWaalsContact C-N 3.29Å; Q103-L105 PolarHBondContact O-N 2.85Å; Q103-N106 PolarHBondContact O-N 3.27Å; Q103-N106 VanDerWaalsContact O-N 3.15Å; Q103-D107 WeakPolarHBondContact O-CB 3.33Å; Q103-D107 VanDerWaalsContact O-CG 3.26Å; Q103-D107 PolarHBondContact O-N 3.41Å
104	A	74	Confident	72	Confident	56 Å²	56	84.4 Å²	84.4	46%	0.463	42%	0.422	S	S	.	.	H	α-helix	trans	-59.1	-40.3	174.7	0	0	0	0	0	111.6	Q100 D107 W108	Q100-A104 WeakPolarHBondContact O-CB 3.49Å; Q100-A104 PolarHBondContact O-N 3.49Å; A104-D107 PolarHBondContact O-N 3.37Å; A104-W108 WeakPolarHBondContact O-CB 3.48Å; A104-W108 PolarHBondContact O-N 2.99Å
105	L	70.8	Confident	70.6	Confident	84 Å²	84	85.7 Å²	85.7	44%	0.44	43%	0.427	S	S	.	.	H	α-helix	trans	-66.5	-43.8	174.5	-175	68.2	0	0	0	111.8	N101 T102 Q103 D107 W108 M109	N101-L105 VanDerWaalsContact O-CB 3.32Å; N101-L105 WeakPolarHBondContact O-CB 3.4Å; N101-L105 PolarHBondContact O-N 2.9Å; T102-L105 PolarHBondContact O-N 2.84Å; Q103-L105 VanDerWaalsContact C-N 3.29Å; Q103-L105 PolarHBondContact O-N 2.85Å; L105-D107 VanDerWaalsContact C-N 3.34Å; L105-D107 PolarHBondContact O-N 2.9Å; L105-W108 HydrophobicContact CD1-CE3 4.2Å; L105-W108 WeakPolarHBondContact O-CB 3.44Å; L105-W108 PolarHBondContact O-N 2.82Å; L105-M109 HydrophobicContact CD1-CE 4.4Å; L105-M109 HydrophobicContact CD2-CE 3.99Å; L105-M109 HydrophobicContact CG-CE 3.7Å; L105-M109 WeakPolarHBondContact O-CB 3.47Å; L105-M109 WeakPolarHBondContact O-CG 3.33Å; L105-M109 PolarHBondContact O-N 3.45Å
106	N	74	Confident	68.9	Low	85 Å²	85	84.5 Å²	84.5	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-61.9	-42.2	175.3	-76.6	-26.9	0	0	0	111.8	T102 Q103 W108 M109 T110	T102-N106 WeakPolarHBondContact O-CB 3.25Å; T102-N106 VanDerWaalsContact O-CG 3.28Å; T102-N106 PolarHBondContact O-N 3.28Å; T102-N106 PolarHBondContact O-ND2 3.21Å; Q103-N106 PolarHBondContact O-N 3.27Å; Q103-N106 VanDerWaalsContact O-N 3.15Å; N106-W108 VanDerWaalsContact C-N 3.35Å; N106-M109 CarbonylContact O-C 3.57Å; N106-M109 PolarHBondContact O-N 3.38Å; N106-T110 WeakPolarHBondContact O-CB 3.41Å; N106-T110 PolarHBondContact O-N 2.88Å; N106-T110 PolarHBondContact O-OG1 2.79Å
107	D	74.4	Confident	66.8	Low	84 Å²	84	85.5 Å²	85.5	45%	0.449	45%	0.446	S	S	.	.	H	α-helix	trans	-67.2	-38	176.3	-72.2	-17.4	0	0	0	111.2	Q103 A104 L105 T110	Q103-D107 WeakPolarHBondContact O-CB 3.33Å; Q103-D107 VanDerWaalsContact O-CG 3.26Å; Q103-D107 PolarHBondContact O-N 3.41Å; A104-D107 PolarHBondContact O-N 3.37Å; L105-D107 VanDerWaalsContact C-N 3.34Å; L105-D107 PolarHBondContact O-N 2.9Å; D107-T110 PolarHBondContact O-N 3.39Å
108	W	72	Confident	65.1	Low	68 Å²	68	93.1 Å²	93.1	26%	0.258	47%	0.473	S	S	.	.	H	α-helix	trans	-66.2	-38	175	-178.1	89.5	0	0	0	112.4	A104 L105 N106 T110 R133 D134 V136 L440	A104-W108 WeakPolarHBondContact O-CB 3.48Å; A104-W108 PolarHBondContact O-N 2.99Å; L105-W108 HydrophobicContact CD1-CE3 4.2Å; L105-W108 WeakPolarHBondContact O-CB 3.44Å; L105-W108 PolarHBondContact O-N 2.82Å; N106-W108 VanDerWaalsContact C-N 3.35Å; W108-T110 VanDerWaalsContact C-N 3.32Å; W108-R133 HydrophobicContact CZ2-CB 3.92Å; W108-R133 HydrophobicContact CZ2-CG 4.47Å; W108-R133 PolarHBondContact O-NH1 2.93Å; W108-D134 VanDerWaalsContact CH2-O 3.29Å; W108-D134 WeakPolarHBondContact CH2-O 3.43Å; W108-D134 WeakPolarHBondContact CZ2-O 3.44Å; W108-V136 HydrophobicContact CH2-CB 4.28Å; W108-V136 HydrophobicContact CH2-CG2 3.82Å; W108-V136 HydrophobicContact CZ3-CB 4.18Å; W108-V136 HydrophobicContact CZ3-CG2 3.5Å; W108-L440 HydrophobicContact CH2-CD1 4.45Å; W108-L440 HydrophobicContact CZ3-CD1 4.24Å
109	M	78.5	Confident	63.4	Low	14 Å²	14	88.2 Å²	88.2	7%	0.069	46%	0.463	C	S	.	.	H	α-helix	trans	-79.1	-12.7	173.9	-69.8	-163.1	-80.9	0	0	113.1	L105 N106 D111 K443 D444	L105-M109 HydrophobicContact CD1-CE 4.4Å; L105-M109 HydrophobicContact CD2-CE 3.99Å; L105-M109 HydrophobicContact CG-CE 3.7Å; L105-M109 WeakPolarHBondContact O-CB 3.47Å; L105-M109 WeakPolarHBondContact O-CG 3.33Å; L105-M109 PolarHBondContact O-N 3.45Å; N106-M109 CarbonylContact O-C 3.57Å; N106-M109 PolarHBondContact O-N 3.38Å; M109-D111 PolarHBondContact O-N 3.06Å; M109-K443 HydrophobicContact CB-CD 4.46Å; M109-K443 WeakPolarHBondContact O-CE 3.35Å; M109-K443 PolarHBondContact O-NZ 2.98Å; M109-K443 HydrophobicContact SD-CB 4.42Å; M109-D444 HydrophobicContact SD-CB 4.32Å
110	T	75.6	Confident	61.7	Low	57 Å²	57	91.3 Å²	91.3	35%	0.35	48%	0.479	S	S	.	.			trans	-79.6	119.7	177.7	-62.9	0	0	0	0	109.9	N106 D107 W108 K112 R133	N106-T110 WeakPolarHBondContact O-CB 3.41Å; N106-T110 PolarHBondContact O-N 2.88Å; N106-T110 PolarHBondContact O-OG1 2.79Å; D107-T110 PolarHBondContact O-N 3.39Å; W108-T110 VanDerWaalsContact C-N 3.32Å; T110-K112 WeakPolarHBondContact CG2-O 3.19Å; T110-R133 PolarHBondContact O-NH1 2.92Å
111	D	73.6	Confident	59.8	Low	10 Å²	10	92.7 Å²	92.7	5%	0.053	50%	0.495	C	S	.	.			trans	-111.9	-12.3	-177.8	65.3	-49.5	0	0	0	112.5	M109 K128 H129 L440 K443	M109-D111 PolarHBondContact O-N 3.06Å; D111-K128 CarbonylContact O-C 3.59Å; D111-K128 WeakPolarHBondContact O-CA 3.5Å; D111-H129 PolarHBondContact O-N 2.7Å; D111-L440 HydrophobicContact CB-CD2 4.03Å; D111-K443 IonicContact OD1-NZ 2.77Å; D111-K443 PolarHBondContact OD1-NZ 2.6Å
112	K	75.5	Confident	58.1	Low	32 Å²	32	90.3 Å²	90.3	14%	0.139	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.3	-178	-64.6	177.3	-171	179.5	0	109.7	T110 P126 T127 H463 D464 Y467	T110-K112 WeakPolarHBondContact CG2-O 3.19Å; K112-P126 HydrophobicContact CB-CB 3.8Å; K112-T127 WeakPolarHBondContact CA-O 3.25Å; K112-H463 PolarHBondContact NZ-CE1 3.37Å; K112-D464 WeakPolarHBondContact CE-OD1 3.37Å; K112-D464 IonicContact NZ-OD1 3.45Å; K112-D464 PolarHBondContact NZ-OD1 3.03Å; K112-Y467 HydrophobicContact CD-CD1 4.21Å; K112-Y467 HydrophobicContact CD-CE1 3.9Å; K112-Y467 VanDerWaalsContact NZ-CD1 3.28Å
113	Q	58.6	Low	57	Low	88 Å²	88	95.5 Å²	95.5	41%	0.411	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	149	174.9	-71.7	-174.3	-50.8	0	0	110.3	P126 T127	Q113-P126 WeakPolarHBondContact O-CA 3.23Å; Q113-T127 PolarHBondContact N-O 2.96Å; Q113-T127 PolarHBondContact O-N 2.93Å
114	K	51.9	Low	56.2	Low	172 Å²	172	92 Å²	92	75%	0.748	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-72.7	134	162.9	-69.8	-179.2	-178.6	175.2	0	106.9	P126	K114-P126 HydrophobicContact CG-CG 4.18Å
115	T	48	Very low	55.8	Low	93 Å²	93	92 Å²	92	57%	0.571	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-57.2	138.5	170.9	21.9	0	0	0	0	109.8	S124	T115-S124 PolarHBondContact OG1-OG 3.46Å; T115-S124 VanDerWaalsContact OG1-OG 3.13Å
116	D	40.5	Very low	56	Low	156 Å²	156	89.6 Å²	89.6	83%	0.834	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-53.5	148.6	-171.1	-91	-38.6	0	0	0	114.4	K118	D116-K118 PolarHBondContact O-N 3.03Å
117	C	33.3	Very low	56.2	Low	106 Å²	106	87.9 Å²	87.9	72%	0.716	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	46.5	-167.2	-150.9	0	0	0	0	115.4
118	K	37.6	Very low	56.7	Low	208 Å²	208	84.5 Å²	84.5	90%	0.904	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-3.5	171.4	-72.8	-169.8	178.7	-178.5	0	114.7	D116	D116-K118 PolarHBondContact O-N 3.03Å
119	S	31.9	Very low	57.4	Low	59 Å²	59	85.8 Å²	85.8	41%	0.413	46%	0.46	S	S	.	.			trans	-128.5	86.2	167.6	59.9	0	0	0	0	110.5	T121 S122	S119-T121 PolarHBondContact O-N 3.44Å; S119-S122 PolarHBondContact O-N 3.36Å; S119-S122 VanDerWaalsContact O-N 3.09Å; S119-S122 VanDerWaalsContact OG-CB 3.28Å; S119-S122 WeakPolarHBondContact OG-CB 3.31Å
120	L	33.5	Very low	57.9	Low	156 Å²	156	86.1 Å²	86.1	82%	0.817	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-3.8	171.9	-98.5	97.3	0	0	0	113.5
121	T	34.3	Very low	58.5	Low	135 Å²	135	87.4 Å²	87.4	83%	0.828	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-7.6	177.6	50.1	0	0	0	0	114.2	S119	S119-T121 PolarHBondContact O-N 3.44Å
122	S	34.6	Very low	59.3	Low	65 Å²	65	91.5 Å²	91.5	46%	0.455	49%	0.485	S	S	.	.			trans	-105.5	88.1	-179.7	-177	0	0	0	0	111.7	S119 S124	S119-S122 PolarHBondContact O-N 3.36Å; S119-S122 VanDerWaalsContact O-N 3.09Å; S119-S122 VanDerWaalsContact OG-CB 3.28Å; S119-S122 WeakPolarHBondContact OG-CB 3.31Å; S122-S124 PolarHBondContact O-N 3.45Å
123	H	49.2	Very low	60	Low	158 Å²	158	90.6 Å²	90.6	73%	0.731	48%	0.481	S	S	*	.			trans	-67.8	58.7	169.3	-81.6	-73.8	0	0	0	112.6
124	S	58.5	Low	61.6	Low	47 Å²	47	89 Å²	89	33%	0.329	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-78.1	135.6	179.9	58.6	0	0	0	0	111.3	T115 S122	T115-S124 PolarHBondContact OG1-OG 3.46Å; T115-S124 VanDerWaalsContact OG1-OG 3.13Å; S122-S124 PolarHBondContact O-N 3.45Å
125	L	66.3	Low	63.6	Low	55 Å²	55	80.8 Å²	80.8	29%	0.288	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-67.4	139.5	175.9	-75.3	158.4	0	0	0	110	R472 Q475	L125-R472 HydrophobicContact CB-CG 4.02Å; L125-R472 HydrophobicContact CD1-CB 4.22Å; L125-R472 HydrophobicContact CD1-CG 3.76Å; L125-R472 HydrophobicContact CG-CG 4.49Å; L125-R472 PolarHBondContact O-NH2 2.95Å; L125-Q475 HydrophobicContact CD1-CB 4.18Å
126	P	74.6	Confident	65.6	Low	33 Å²	33	76.9 Å²	76.9	21%	0.214	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-52.6	138.8	-178.5	-28.9	35.1	0	0	0	113	K112 Q113 K114 Y467	K112-P126 HydrophobicContact CB-CB 3.8Å; Q113-P126 WeakPolarHBondContact O-CA 3.23Å; K114-P126 HydrophobicContact CG-CG 4.18Å; P126-Y467 WeakPolarHBondContact O-CE1 3.34Å; P126-Y467 PolarHBondContact O-OH 3.25Å
127	T	77.5	Confident	68.1	Low	49 Å²	49	70.4 Å²	70.4	30%	0.301	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	152	179.4	55.1	0	0	0	0	110.8	K112 Q113 H129	K112-T127 WeakPolarHBondContact CA-O 3.25Å; Q113-T127 PolarHBondContact N-O 2.96Å; Q113-T127 PolarHBondContact O-N 2.93Å; T127-H129 PolarHBondContact O-N 3.35Å
128	K	85.5	Confident	70.9	Confident	14 Å²	14	66.5 Å²	66.5	6%	0.061	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	123.8	176.2	-175.2	176.3	-169.8	155.1	0	110.6	D111 Y130 D464	D111-K128 CarbonylContact O-C 3.59Å; D111-K128 WeakPolarHBondContact O-CA 3.5Å; K128-Y130 HydrophobicContact CD-CE1 4.03Å; K128-Y130 HydrophobicContact CD-CE2 4.16Å; K128-Y130 HydrophobicContact CG-CE2 4.4Å; K128-D464 HydrophobicContact CD-CB 4.35Å; K128-D464 VanDerWaalsContact CD-OD2 3.26Å; K128-D464 WeakPolarHBondContact CD-OD2 3.31Å; K128-D464 VanDerWaalsContact CE-OD2 3.26Å; K128-D464 WeakPolarHBondContact CE-OD2 3.44Å; K128-D464 IonicContact NZ-OD2 3.56Å; K128-D464 PolarHBondContact NZ-OD2 3.5Å
129	H	86.4	Confident	73.3	Confident	94 Å²	94	59.4 Å²	59.4	44%	0.435	33%	0.328	S	S	.	.			trans	-107.5	115.5	171.7	-173.8	-69.6	0	0	0	109.7	D111 T127 R131	D111-H129 PolarHBondContact O-N 2.7Å; T127-H129 PolarHBondContact O-N 3.35Å; H129-R131 WeakPolarHBondContact ND1-CG 3.5Å
130	Y	88.9	Confident	76.1	Confident	22 Å²	22	58.9 Å²	58.9	9%	0.086	32%	0.32	C	S	.	.			trans	-76.5	134.7	178.3	-69	-86.2	0	0	0	110.8	K128 T342 V344 R346 Y349 P350 F436 D438	K128-Y130 HydrophobicContact CD-CE1 4.03Å; K128-Y130 HydrophobicContact CD-CE2 4.16Å; K128-Y130 HydrophobicContact CG-CE2 4.4Å; Y130-T342 PolarHBondContact OH-OG1 3.33Å; Y130-V344 WeakPolarHBondContact OH-CB 3.36Å; Y130-V344 PolarHBondContact OH-O 2.94Å; Y130-R346 HydrophobicContact CD2-CG 3.84Å; Y130-R346 HydrophobicContact CE2-CB 4.47Å; Y130-R346 HydrophobicContact CE2-CG 3.45Å; Y130-R346 VanDerWaalsContact CE2-CG 3.45Å; Y130-Y349 HydrophobicContact CD1-CD1 4.26Å; Y130-Y349 HydrophobicContact CD2-CD1 4.21Å; Y130-Y349 HydrophobicContact CD2-CE1 4.34Å; Y130-Y349 HydrophobicContact CE1-CD1 4.22Å; Y130-Y349 HydrophobicContact CE1-CE1 4.19Å; Y130-Y349 HydrophobicContact CE2-CD1 4.16Å; Y130-Y349 AromaticContact CE2-CE1 3.85Å; Y130-Y349 HydrophobicContact CE2-CE1 3.85Å; Y130-Y349 HydrophobicContact CG-CD1 4.24Å; Y130-Y349 AromaticContact CZ-CE1 3.73Å; Y130-P350 VanDerWaalsContact CB-CD 3.48Å; Y130-F436 HydrophobicContact CD1-CZ 4.14Å; Y130-F436 AromaticContact CE1-CZ 3.96Å; Y130-F436 HydrophobicContact CE1-CZ 3.96Å; Y130-D438 WeakPolarHBondContact CA-OD2 3.45Å; Y130-D438 HydrophobicContact CD1-CB 3.82Å; Y130-D438 WeakPolarHBondContact CD1-OD2 3.2Å
131	R	88	Confident	78.7	Confident	84 Å²	84	53.3 Å²	53.3	32%	0.317	29%	0.289	S	S	.	.			trans	-135	149.6	177.4	-63.9	-176.6	179.4	173.6	-1.8	109.6	H129 R133 D438	H129-R131 WeakPolarHBondContact ND1-CG 3.5Å; R131-R133 PolarHBondContact O-N 2.92Å; R131-D438 WeakPolarHBondContact O-CA 3.23Å; R131-D438 WeakPolarHBondContact O-CB 3.36Å
132	T	90.5	Very high	81.3	Confident	96 Å²	96	53.1 Å²	53.1	59%	0.589	28%	0.279	S	S	*	.			trans	-70.2	115.1	172.6	-53.4	0	0	0	0	109.2	P350 G437	T132-P350 WeakPolarHBondContact OG1-CB 3.4Å; T132-G437 CarbonylContact C-O 3.57Å; T132-G437 VanDerWaalsContact CA-O 3.3Å; T132-G437 WeakPolarHBondContact CA-O 3.46Å
133	R	91.4	Very high	83.9	Confident	13 Å²	13	54 Å²	54	5%	0.049	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-157.1	149	178.4	56.8	-171.8	153.5	-159.6	-10.2	111	W108 T110 R131 G437 D438 R439 L440	W108-R133 HydrophobicContact CZ2-CB 3.92Å; W108-R133 HydrophobicContact CZ2-CG 4.47Å; W108-R133 PolarHBondContact O-NH1 2.93Å; T110-R133 PolarHBondContact O-NH1 2.92Å; R131-R133 PolarHBondContact O-N 2.92Å; R133-G437 PolarHBondContact N-O 2.93Å; R133-G437 VanDerWaalsContact O-O 3.06Å; R133-D438 WeakPolarHBondContact CG-OD1 3.44Å; R133-D438 IonicContact CZ-OD1 3.8Å; R133-D438 IonicContact NE-OD1 2.58Å; R133-D438 PolarHBondContact NE-OD1 3.19Å; R133-D438 IonicContact NE-OD2 3.56Å; R133-D438 IonicContact NH2-OD1 3.28Å; R133-D438 PolarHBondContact NH2-OD1 3.45Å; R133-D438 IonicContact NH2-OD2 3.4Å; R133-D438 PolarHBondContact NH2-OD2 2.77Å; R133-D438 VanDerWaalsContact NH2-OD2 3.13Å; R133-R439 VanDerWaalsContact O-CB 3.28Å; R133-R439 WeakPolarHBondContact O-CB 3.46Å; R133-R439 WeakPolarHBondContact O-CG 3.43Å; R133-R439 PolarHBondContact O-N 3.45Å; R133-L440 HydrophobicContact CG-CB 4.46Å
134	D	91.4	Very high	85.7	Confident	53 Å²	53	50 Å²	50	28%	0.283	27%	0.268	S	S	.	.			trans	-75.7	168.5	172.4	-75.5	-41	0	0	0	111.7	W108 R356	W108-D134 VanDerWaalsContact CH2-O 3.29Å; W108-D134 WeakPolarHBondContact CH2-O 3.43Å; W108-D134 WeakPolarHBondContact CZ2-O 3.44Å; D134-R356 IonicContact OD1-NH2 3.16Å
135	S	93.2	Very high	87.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.			trans	-71	145.2	174.5	-68.9	0	0	0	0	110.6	L137 T138 T139 N428 R439	S135-L137 PolarHBondContact O-N 3.1Å; S135-L137 VanDerWaalsContact O-N 3.15Å; S135-T138 WeakPolarHBondContact O-CA 3.33Å; S135-T138 WeakPolarHBondContact O-CB 3.27Å; S135-T138 PolarHBondContact O-N 3.26Å; S135-T139 PolarHBondContact O-N 2.9Å; S135-T139 VanDerWaalsContact O-N 3.15Å; S135-N428 PolarHBondContact OG-ND2 2.95Å; S135-N428 PolarHBondContact OG-OD1 3.15Å; S135-R439 WeakPolarHBondContact CA-O 3.39Å; S135-R439 PolarHBondContact OG-O 3.5Å
136	V	91.6	Very high	88.2	Confident	12 Å²	12	54.4 Å²	54.4	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-50.9	-46.1	-177.7	-179.4	0	0	0	0	111.5	W108 T138 T139 L140 L440 Y442 W446	W108-V136 HydrophobicContact CH2-CB 4.28Å; W108-V136 HydrophobicContact CH2-CG2 3.82Å; W108-V136 HydrophobicContact CZ3-CB 4.18Å; W108-V136 HydrophobicContact CZ3-CG2 3.5Å; V136-T138 PolarHBondContact O-N 3.04Å; V136-T139 PolarHBondContact O-N 3.28Å; V136-L140 VanDerWaalsContact O-CB 3.3Å; V136-L140 WeakPolarHBondContact O-CB 3.43Å; V136-L140 PolarHBondContact O-N 3.4Å; V136-L440 HydrophobicContact CG2-CD1 3.73Å; V136-Y442 HydrophobicContact CB-CE2 4.14Å; V136-Y442 WeakPolarHBondContact CG2-O 3.4Å; V136-W446 HydrophobicContact CB-CH2 4.48Å; V136-W446 HydrophobicContact CG1-CH2 3.91Å; V136-W446 HydrophobicContact CG1-CZ2 3.97Å
137	L	91.7	Very high	89	Confident	20 Å²	20	58.8 Å²	58.8	11%	0.105	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-30.8	-178	-165.6	64.6	0	0	0	112.6	S135 T139 L140 F141 Y420 Y442	S135-L137 PolarHBondContact O-N 3.1Å; S135-L137 VanDerWaalsContact O-N 3.15Å; L137-T139 VanDerWaalsContact C-N 3.35Å; L137-L140 HydrophobicContact CD1-CD2 4.3Å; L137-L140 PolarHBondContact O-N 3.29Å; L137-F141 HydrophobicContact CD1-CD1 4.33Å; L137-F141 HydrophobicContact CD1-CE1 3.77Å; L137-F141 HydrophobicContact CD1-CE2 4.35Å; L137-F141 HydrophobicContact CD1-CZ 3.81Å; L137-F141 HydrophobicContact CD2-CE1 4.35Å; L137-F141 HydrophobicContact CD2-CE2 3.76Å; L137-F141 HydrophobicContact CD2-CZ 3.54Å; L137-F141 HydrophobicContact CG-CD1 4.41Å; L137-F141 HydrophobicContact CG-CD2 4.05Å; L137-F141 HydrophobicContact CG-CE1 3.88Å; L137-F141 HydrophobicContact CG-CE2 3.53Å; L137-F141 HydrophobicContact CG-CG 4.48Å; L137-F141 HydrophobicContact CG-CZ 3.43Å; L137-F141 VanDerWaalsContact CG-CZ 3.43Å; L137-F141 WeakPolarHBondContact O-CB 3.41Å; L137-F141 VanDerWaalsContact O-CD2 3.28Å; L137-F141 WeakPolarHBondContact O-CD2 3.17Å; L137-F141 VanDerWaalsContact O-CG 3.24Å; L137-F141 WeakPolarHBondContact O-CG 3.3Å; L137-F141 PolarHBondContact O-N 3.34Å; L137-Y420 HydrophobicContact CD2-CD2 3.56Å; L137-Y420 HydrophobicContact CD2-CE2 3.53Å; L137-Y442 HydrophobicContact CB-CE2 4.13Å; L137-Y442 WeakPolarHBondContact CB-OH 3.41Å
138	T	91.5	Very high	89.7	Confident	24 Å²	24	60.1 Å²	60.1	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-44.1	174.8	-56.7	0	0	0	0	110.3	S135 V136 F359 H424	S135-T138 WeakPolarHBondContact O-CA 3.33Å; S135-T138 WeakPolarHBondContact O-CB 3.27Å; S135-T138 PolarHBondContact O-N 3.26Å; V136-T138 PolarHBondContact O-N 3.04Å; T138-F359 HydrophobicContact CG2-CE2 4.36Å; T138-H424 PolarHBondContact OG1-CE1 3Å
139	T	89.7	Confident	89.8	Confident	59 Å²	59	62.8 Å²	62.8	36%	0.362	32%	0.32	S	S	.	.	H	α-helix	trans	-65.9	-41.9	173.6	-54.6	0	0	0	0	110.7	S135 V136 L137 F141 Q142	S135-T139 PolarHBondContact O-N 2.9Å; S135-T139 VanDerWaalsContact O-N 3.15Å; V136-T139 PolarHBondContact O-N 3.28Å; L137-T139 VanDerWaalsContact C-N 3.35Å; T139-F141 PolarHBondContact O-N 3.43Å; T139-Q142 VanDerWaalsContact O-CB 3.28Å; T139-Q142 WeakPolarHBondContact O-CB 3.35Å; T139-Q142 PolarHBondContact O-N 2.96Å; T139-Q142 VanDerWaalsContact O-N 3.16Å
140	L	89.3	Confident	89.9	Confident	47 Å²	47	61.5 Å²	61.5	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-67.4	-33.6	-177.4	-161.5	71.7	0	0	0	113.3	V136 L137 Q142 I143 I146 W446	V136-L140 VanDerWaalsContact O-CB 3.3Å; V136-L140 WeakPolarHBondContact O-CB 3.43Å; V136-L140 PolarHBondContact O-N 3.4Å; L137-L140 HydrophobicContact CD1-CD2 4.3Å; L137-L140 PolarHBondContact O-N 3.29Å; L140-Q142 PolarHBondContact O-N 3.46Å; L140-I143 HydrophobicContact CD1-CD1 3.83Å; L140-I143 WeakPolarHBondContact O-CB 3.42Å; L140-I143 PolarHBondContact O-N 3.29Å; L140-I146 HydrophobicContact CD1-CG1 4.39Å; L140-I146 HydrophobicContact CD2-CG1 4.04Å; L140-I146 HydrophobicContact CD2-CG2 3.94Å; L140-I146 HydrophobicContact CG-CB 4.21Å; L140-I146 HydrophobicContact CG-CG1 3.84Å; L140-I146 HydrophobicContact CG-CG2 4Å; L140-W446 HydrophobicContact CD2-CZ2 4.02Å
141	F	89.8	Confident	90.1	Very high	40 Å²	40	64.6 Å²	64.6	18%	0.175	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-12.4	174.6	-71.5	-33.8	0	0	0	114.4	L137 T139 I143 I146 R147 Y150 Y420	L137-F141 HydrophobicContact CD1-CD1 4.33Å; L137-F141 HydrophobicContact CD1-CE1 3.77Å; L137-F141 HydrophobicContact CD1-CE2 4.35Å; L137-F141 HydrophobicContact CD1-CZ 3.81Å; L137-F141 HydrophobicContact CD2-CE1 4.35Å; L137-F141 HydrophobicContact CD2-CE2 3.76Å; L137-F141 HydrophobicContact CD2-CZ 3.54Å; L137-F141 HydrophobicContact CG-CD1 4.41Å; L137-F141 HydrophobicContact CG-CD2 4.05Å; L137-F141 HydrophobicContact CG-CE1 3.88Å; L137-F141 HydrophobicContact CG-CE2 3.53Å; L137-F141 HydrophobicContact CG-CG 4.48Å; L137-F141 HydrophobicContact CG-CZ 3.43Å; L137-F141 VanDerWaalsContact CG-CZ 3.43Å; L137-F141 WeakPolarHBondContact O-CB 3.41Å; L137-F141 VanDerWaalsContact O-CD2 3.28Å; L137-F141 WeakPolarHBondContact O-CD2 3.17Å; L137-F141 VanDerWaalsContact O-CG 3.24Å; L137-F141 WeakPolarHBondContact O-CG 3.3Å; L137-F141 PolarHBondContact O-N 3.34Å; T139-F141 PolarHBondContact O-N 3.43Å; F141-I143 PolarHBondContact O-N 2.78Å; F141-I146 HydrophobicContact CD1-CG2 3.74Å; F141-I146 HydrophobicContact CE1-CG2 3.96Å; F141-R147 PolarHBondContact O-NE 2.88Å; F141-R147 VanDerWaalsContact O-NE 3.13Å; F141-Y150 HydrophobicContact CE1-CD2 4.15Å; F141-Y150 HydrophobicContact CE1-CG 4.23Å; F141-Y150 HydrophobicContact CE2-CD2 4.19Å; F141-Y150 AromaticContact CZ-CD2 3.72Å; F141-Y150 HydrophobicContact CZ-CD2 3.72Å; F141-Y150 HydrophobicContact CZ-CG 4.24Å; F141-Y420 AromaticContact CE2-CE2 3.72Å; F141-Y420 HydrophobicContact CE2-CE2 3.72Å; F141-Y420 AromaticContact CZ-CE2 3.7Å; F141-Y420 HydrophobicContact CZ-CE2 3.7Å
142	Q	87.3	Confident	90.2	Very high	130 Å²	130	65.1 Å²	65.1	61%	0.607	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-28.6	170.3	-61.2	-178.9	-10.9	0	0	111.1	T139 L140 R147	T139-Q142 VanDerWaalsContact O-CB 3.28Å; T139-Q142 WeakPolarHBondContact O-CB 3.35Å; T139-Q142 PolarHBondContact O-N 2.96Å; T139-Q142 VanDerWaalsContact O-N 3.16Å; L140-Q142 PolarHBondContact O-N 3.46Å; Q142-R147 PolarHBondContact O-NH2 3.15Å
143	I	88.9	Confident	90	Very high	83 Å²	83	64.8 Å²	64.8	43%	0.426	33%	0.329	S	S	.	.	S	Bend	trans	-72.2	129.6	175.3	-52.8	179.7	0	0	0	109.8	L140 F141 H145 I146 R147	L140-I143 HydrophobicContact CD1-CD1 3.83Å; L140-I143 WeakPolarHBondContact O-CB 3.42Å; L140-I143 PolarHBondContact O-N 3.29Å; F141-I143 PolarHBondContact O-N 2.78Å; I143-H145 VanDerWaalsContact C-N 3.32Å; I143-H145 HydrophobicContact CG2-CB 4.44Å; I143-H145 PolarHBondContact O-N 3.03Å; I143-I146 PolarHBondContact O-N 3.2Å; I143-R147 PolarHBondContact O-N 2.87Å
144	S	88.2	Confident	89.8	Confident	75 Å²	75	66.8 Å²	66.8	52%	0.524	34%	0.342	S	S	.	.	H	α-helix	trans	-54.4	-44.1	-177.1	53.6	0	0	0	0	112.9	I146 R147 T148	S144-I146 PolarHBondContact O-N 2.98Å; S144-R147 WeakPolarHBondContact O-CB 3.41Å; S144-R147 PolarHBondContact O-N 3.03Å; S144-T148 PolarHBondContact O-N 2.94Å; S144-T148 PolarHBondContact O-OG1 2.92Å; S144-T148 VanDerWaalsContact O-OG1 3.13Å
145	H	89	Confident	89.7	Confident	141 Å²	141	66.3 Å²	66.3	65%	0.653	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-44.3	-178.1	-57.9	-64.3	0	0	0	113.4	I143 T148 V149	I143-H145 VanDerWaalsContact C-N 3.32Å; I143-H145 HydrophobicContact CG2-CB 4.44Å; I143-H145 PolarHBondContact O-N 3.03Å; H145-T148 WeakPolarHBondContact O-CB 3.48Å; H145-T148 PolarHBondContact O-N 3.28Å; H145-V149 PolarHBondContact O-N 2.79Å
146	I	88.8	Confident	89.5	Confident	53 Å²	53	69.6 Å²	69.6	27%	0.272	37%	0.365	S	S	.	.	H	α-helix	trans	-77.3	-32.3	-178.8	-56.5	-58.2	0	0	0	110.7	L140 F141 I143 S144 T148 V149 Y150	L140-I146 HydrophobicContact CD1-CG1 4.39Å; L140-I146 HydrophobicContact CD2-CG1 4.04Å; L140-I146 HydrophobicContact CD2-CG2 3.94Å; L140-I146 HydrophobicContact CG-CB 4.21Å; L140-I146 HydrophobicContact CG-CG1 3.84Å; L140-I146 HydrophobicContact CG-CG2 4Å; F141-I146 HydrophobicContact CD1-CG2 3.74Å; F141-I146 HydrophobicContact CE1-CG2 3.96Å; I143-I146 PolarHBondContact O-N 3.2Å; S144-I146 PolarHBondContact O-N 2.98Å; I146-T148 PolarHBondContact O-N 3.36Å; I146-V149 WeakPolarHBondContact O-CB 3.25Å; I146-V149 PolarHBondContact O-N 2.79Å; I146-V149 VanDerWaalsContact O-N 3.11Å; I146-Y150 PolarHBondContact O-N 3.47Å
147	R	89.7	Confident	89	Confident	125 Å²	125	69.9 Å²	69.9	47%	0.472	37%	0.367	S	S	.	.	H	α-helix	trans	-58.5	-38.6	169.7	-165.3	-177.6	-56.1	174.3	7	111.9	F141 Q142 I143 S144 Y150 N151	F141-R147 PolarHBondContact O-NE 2.88Å; F141-R147 VanDerWaalsContact O-NE 3.13Å; Q142-R147 PolarHBondContact O-NH2 3.15Å; I143-R147 PolarHBondContact O-N 2.87Å; S144-R147 WeakPolarHBondContact O-CB 3.41Å; S144-R147 PolarHBondContact O-N 3.03Å; R147-Y150 WeakPolarHBondContact O-CB 3.35Å; R147-Y150 PolarHBondContact O-N 3.49Å; R147-N151 VanDerWaalsContact O-CG 3.27Å; R147-N151 PolarHBondContact O-N 3.06Å; R147-N151 PolarHBondContact O-ND2 3.25Å
148	T	92.1	Very high	88.7	Confident	78 Å²	78	74 Å²	74	48%	0.479	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-43.5	173.2	-58	0	0	0	0	111.7	S144 H145 I146 Y150 N151 I152	S144-T148 PolarHBondContact O-N 2.94Å; S144-T148 PolarHBondContact O-OG1 2.92Å; S144-T148 VanDerWaalsContact O-OG1 3.13Å; H145-T148 WeakPolarHBondContact O-CB 3.48Å; H145-T148 PolarHBondContact O-N 3.28Å; I146-T148 PolarHBondContact O-N 3.36Å; T148-Y150 VanDerWaalsContact C-N 3.34Å; T148-Y150 PolarHBondContact O-N 3.39Å; T148-N151 PolarHBondContact O-N 3.11Å; T148-I152 HydrophobicContact CG2-CD1 4.16Å; T148-I152 WeakPolarHBondContact O-CG1 3.28Å; T148-I152 PolarHBondContact O-N 2.9Å
149	V	89.5	Confident	88.6	Confident	69 Å²	69	78.3 Å²	78.3	42%	0.418	41%	0.409	S	S	.	.	H	α-helix	trans	-59.6	-45.5	175.7	177.8	0	0	0	0	110.9	H145 I146 N151 I152 F153	H145-V149 PolarHBondContact O-N 2.79Å; I146-V149 WeakPolarHBondContact O-CB 3.25Å; I146-V149 PolarHBondContact O-N 2.79Å; I146-V149 VanDerWaalsContact O-N 3.11Å; V149-N151 VanDerWaalsContact C-N 3.35Å; V149-N151 PolarHBondContact O-N 3.39Å; V149-I152 WeakPolarHBondContact O-CB 3.18Å; V149-I152 PolarHBondContact O-N 3.49Å; V149-F153 HydrophobicContact CG1-CD2 3.96Å; V149-F153 HydrophobicContact CG1-CE2 3.95Å; V149-F153 WeakPolarHBondContact O-CD2 3.17Å; V149-F153 PolarHBondContact O-N 3.42Å
150	Y	88.6	Confident	88.2	Confident	67 Å²	67	77.3 Å²	77.3	26%	0.263	40%	0.4	S	S	.	.	H	α-helix	trans	-56.1	-48	173.9	172.7	-96.6	0	0	0	112	F141 I146 R147 T148 I152 F153 V154 Y420	F141-Y150 HydrophobicContact CE1-CD2 4.15Å; F141-Y150 HydrophobicContact CE1-CG 4.23Å; F141-Y150 HydrophobicContact CE2-CD2 4.19Å; F141-Y150 AromaticContact CZ-CD2 3.72Å; F141-Y150 HydrophobicContact CZ-CD2 3.72Å; F141-Y150 HydrophobicContact CZ-CG 4.24Å; I146-Y150 PolarHBondContact O-N 3.47Å; R147-Y150 WeakPolarHBondContact O-CB 3.35Å; R147-Y150 PolarHBondContact O-N 3.49Å; T148-Y150 VanDerWaalsContact C-N 3.34Å; T148-Y150 PolarHBondContact O-N 3.39Å; Y150-I152 VanDerWaalsContact C-N 3.29Å; Y150-I152 PolarHBondContact O-N 3.39Å; Y150-F153 PolarHBondContact O-N 3.31Å; Y150-F153 VanDerWaalsContact O-N 3.14Å; Y150-V154 HydrophobicContact CD1-CG2 4.24Å; Y150-V154 HydrophobicContact CE1-CG2 3.78Å; Y150-V154 HydrophobicContact CE2-CG2 4.18Å; Y150-V154 WeakPolarHBondContact O-CG2 3.41Å; Y150-V154 PolarHBondContact O-N 2.79Å; Y150-Y420 AromaticContact CE2-CZ 3.96Å; Y150-Y420 WeakPolarHBondContact CE2-OH 3.43Å
151	N	91.3	Very high	87.5	Confident	87 Å²	87	76.3 Å²	76.3	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-61.6	-36.2	178.3	-68.1	-16.5	0	0	0	112.5	R147 T148 V149 V154 A155	R147-N151 VanDerWaalsContact O-CG 3.27Å; R147-N151 PolarHBondContact O-N 3.06Å; R147-N151 PolarHBondContact O-ND2 3.25Å; T148-N151 PolarHBondContact O-N 3.11Å; V149-N151 VanDerWaalsContact C-N 3.35Å; V149-N151 PolarHBondContact O-N 3.39Å; N151-V154 PolarHBondContact O-N 3.15Å; N151-A155 WeakPolarHBondContact O-CB 2.99Å; N151-A155 PolarHBondContact O-N 2.78Å
152	I	90.4	Very high	87.1	Confident	96 Å²	96	76.5 Å²	76.5	49%	0.492	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-46.3	173.8	-69	165.4	0	0	0	110.4	T148 V149 Y150 V154 A155 V156	T148-I152 HydrophobicContact CG2-CD1 4.16Å; T148-I152 WeakPolarHBondContact O-CG1 3.28Å; T148-I152 PolarHBondContact O-N 2.9Å; V149-I152 WeakPolarHBondContact O-CB 3.18Å; V149-I152 PolarHBondContact O-N 3.49Å; Y150-I152 VanDerWaalsContact C-N 3.29Å; Y150-I152 PolarHBondContact O-N 3.39Å; I152-V154 VanDerWaalsContact C-N 3.31Å; I152-V154 PolarHBondContact O-N 2.77Å; I152-A155 PolarHBondContact O-N 3.46Å; I152-V156 HydrophobicContact CG2-CG2 4.33Å; I152-V156 WeakPolarHBondContact O-CG2 3.41Å; I152-V156 PolarHBondContact O-N 2.91Å
153	F	86.1	Confident	87	Confident	89 Å²	89	73.9 Å²	73.9	39%	0.39	40%	0.396	S	S	.	.	H	α-helix	trans	-60.7	-41.6	176.9	-91	-86	0	0	0	112	V149 Y150 V156 T157 L413 L416	V149-F153 HydrophobicContact CG1-CD2 3.96Å; V149-F153 HydrophobicContact CG1-CE2 3.95Å; V149-F153 WeakPolarHBondContact O-CD2 3.17Å; V149-F153 PolarHBondContact O-N 3.42Å; Y150-F153 PolarHBondContact O-N 3.31Å; Y150-F153 VanDerWaalsContact O-N 3.14Å; F153-V156 PolarHBondContact O-N 3.37Å; F153-T157 WeakPolarHBondContact O-CB 3.35Å; F153-T157 PolarHBondContact O-N 3.28Å; F153-T157 PolarHBondContact O-OG1 3.21Å; F153-L413 HydrophobicContact CE1-CD1 3.9Å; F153-L416 HydrophobicContact CZ-CD1 4.38Å
154	V	86.9	Confident	86.2	Confident	55 Å²	55	70.8 Å²	70.8	33%	0.333	38%	0.381	S	S	.	.	H	α-helix	trans	-61.4	-46.9	174.2	174.1	0	0	0	0	110.9	Y150 N151 I152 V156 T157 I158	Y150-V154 HydrophobicContact CD1-CG2 4.24Å; Y150-V154 HydrophobicContact CE1-CG2 3.78Å; Y150-V154 HydrophobicContact CE2-CG2 4.18Å; Y150-V154 WeakPolarHBondContact O-CG2 3.41Å; Y150-V154 PolarHBondContact O-N 2.79Å; N151-V154 PolarHBondContact O-N 3.15Å; I152-V154 VanDerWaalsContact C-N 3.31Å; I152-V154 PolarHBondContact O-N 2.77Å; V154-V156 PolarHBondContact O-N 3.22Å; V154-T157 WeakPolarHBondContact O-CB 3.43Å; V154-T157 PolarHBondContact O-N 2.91Å; V154-I158 HydrophobicContact CG1-CD1 3.91Å; V154-I158 WeakPolarHBondContact O-CG1 3.5Å; V154-I158 PolarHBondContact O-N 3.36Å
155	A	91.2	Very high	85.4	Confident	43 Å²	43	69.9 Å²	69.9	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-61	-44.7	177.2	0	0	0	0	0	112.2	N151 I152 T157 I158 I159	N151-A155 WeakPolarHBondContact O-CB 2.99Å; N151-A155 PolarHBondContact O-N 2.78Å; I152-A155 PolarHBondContact O-N 3.46Å; A155-T157 VanDerWaalsContact C-N 3.29Å; A155-T157 PolarHBondContact O-N 3.44Å; A155-I158 PolarHBondContact O-N 3.47Å; A155-I159 WeakPolarHBondContact O-CB 3.35Å; A155-I159 VanDerWaalsContact O-CG1 3.26Å; A155-I159 WeakPolarHBondContact O-CG1 3.36Å; A155-I159 PolarHBondContact O-N 2.69Å
156	V	87	Confident	85.1	Confident	68 Å²	68	67.4 Å²	67.4	41%	0.412	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-40.7	175.1	170	0	0	0	0	110.9	I152 F153 V154 I159 F160	I152-V156 HydrophobicContact CG2-CG2 4.33Å; I152-V156 WeakPolarHBondContact O-CG2 3.41Å; I152-V156 PolarHBondContact O-N 2.91Å; F153-V156 PolarHBondContact O-N 3.37Å; V154-V156 PolarHBondContact O-N 3.22Å; V156-I159 PolarHBondContact O-N 3.43Å; V156-F160 WeakPolarHBondContact O-CB 3.24Å; V156-F160 PolarHBondContact O-N 3.23Å
157	T	82.8	Confident	84.3	Confident	18 Å²	18	67.3 Å²	67.3	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-63.3	-45.2	177.8	-59	0	0	0	0	111.1	F153 V154 A155 F160 S161 V369 F373	F153-T157 WeakPolarHBondContact O-CB 3.35Å; F153-T157 PolarHBondContact O-N 3.28Å; F153-T157 PolarHBondContact O-OG1 3.21Å; V154-T157 WeakPolarHBondContact O-CB 3.43Å; V154-T157 PolarHBondContact O-N 2.91Å; A155-T157 VanDerWaalsContact C-N 3.29Å; A155-T157 PolarHBondContact O-N 3.44Å; T157-F160 PolarHBondContact O-N 3.25Å; T157-S161 VanDerWaalsContact O-CB 3.29Å; T157-S161 WeakPolarHBondContact O-CB 3.35Å; T157-S161 PolarHBondContact O-N 2.83Å; T157-S161 PolarHBondContact O-OG 2.83Å; T157-V369 HydrophobicContact CG2-CG1 4.01Å; T157-F373 HydrophobicContact CG2-CB 3.78Å; T157-F373 HydrophobicContact CG2-CD1 4.06Å; T157-F373 HydrophobicContact CG2-CD2 3.89Å; T157-F373 HydrophobicContact CG2-CE2 4.5Å; T157-F373 HydrophobicContact CG2-CG 3.66Å
158	I	85.6	Confident	83.3	Confident	107 Å²	107	63.2 Å²	63.2	55%	0.549	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-49	177.1	-67	166.9	0	0	0	110.4	V154 A155 F160 S161 A162	V154-I158 HydrophobicContact CG1-CD1 3.91Å; V154-I158 WeakPolarHBondContact O-CG1 3.5Å; V154-I158 PolarHBondContact O-N 3.36Å; A155-I158 PolarHBondContact O-N 3.47Å; I158-F160 PolarHBondContact O-N 3.26Å; I158-S161 PolarHBondContact O-N 3.23Å; I158-A162 VanDerWaalsContact O-CB 3.29Å; I158-A162 WeakPolarHBondContact O-CB 3.05Å; I158-A162 PolarHBondContact O-N 3.45Å
159	I	88	Confident	82.4	Confident	115 Å²	115	67.3 Å²	67.3	59%	0.59	36%	0.36	S	S	*	.	H	α-helix	trans	-62.1	-43.7	179.9	-68.5	166.2	0	0	0	110.9	A155 V156 A162 N163	A155-I159 WeakPolarHBondContact O-CB 3.35Å; A155-I159 VanDerWaalsContact O-CG1 3.26Å; A155-I159 WeakPolarHBondContact O-CG1 3.36Å; A155-I159 PolarHBondContact O-N 2.69Å; V156-I159 PolarHBondContact O-N 3.43Å; I159-A162 PolarHBondContact O-N 3.25Å; I159-N163 VanDerWaalsContact O-CB 3.26Å; I159-N163 WeakPolarHBondContact O-CB 3.22Å; I159-N163 PolarHBondContact O-N 3.44Å
160	F	81.3	Confident	81.9	Confident	37 Å²	37	69.7 Å²	69.7	16%	0.162	37%	0.369	C	S	.	.	H	α-helix	trans	-67	-40.7	-180	-170	-95.2	0	0	0	111.9	V156 T157 I158 N163 T164 F373 I377 R380 F381	V156-F160 WeakPolarHBondContact O-CB 3.24Å; V156-F160 PolarHBondContact O-N 3.23Å; T157-F160 PolarHBondContact O-N 3.25Å; I158-F160 PolarHBondContact O-N 3.26Å; F160-N163 PolarHBondContact O-N 2.89Å; F160-T164 PolarHBondContact O-N 3.29Å; F160-T164 PolarHBondContact O-OG1 3.02Å; F160-F373 HydrophobicContact CB-CE2 3.84Å; F160-F373 AromaticContact CD1-CD2 3.99Å; F160-F373 HydrophobicContact CD1-CD2 3.99Å; F160-F373 AromaticContact CD1-CE2 3.57Å; F160-F373 HydrophobicContact CD1-CE2 3.57Å; F160-F373 HydrophobicContact CE1-CE2 4.34Å; F160-F373 AromaticContact CG-CE2 3.83Å; F160-F373 HydrophobicContact CG-CE2 3.83Å; F160-I377 HydrophobicContact CE1-CG1 4.18Å; F160-R380 HydrophobicContact CZ-CB 4.16Å; F160-R380 HydrophobicContact CZ-CG 4.34Å; F160-F381 AromaticContact CE2-CE2 3.85Å; F160-F381 HydrophobicContact CE2-CE2 3.85Å; F160-F381 HydrophobicContact CE2-CZ 4.28Å; F160-F381 HydrophobicContact CZ-CD2 4.41Å; F160-F381 AromaticContact CZ-CE2 3.67Å; F160-F381 HydrophobicContact CZ-CE2 3.67Å; F160-F381 HydrophobicContact CZ-CZ 4.48Å
161	S	74.9	Confident	80.9	Confident	27 Å²	27	70.1 Å²	70.1	19%	0.189	38%	0.376	C	S	.	.	H	α-helix	trans	-64.1	-46.5	175	-54.4	0	0	0	0	110.5	T157 I158 N163 T164 V165	T157-S161 VanDerWaalsContact O-CB 3.29Å; T157-S161 WeakPolarHBondContact O-CB 3.35Å; T157-S161 PolarHBondContact O-N 2.83Å; T157-S161 PolarHBondContact O-OG 2.83Å; I158-S161 PolarHBondContact O-N 3.23Å; S161-N163 PolarHBondContact O-N 2.99Å; S161-T164 PolarHBondContact O-N 3.26Å; S161-V165 VanDerWaalsContact O-CG2 3.3Å; S161-V165 WeakPolarHBondContact O-CG2 3.33Å; S161-V165 PolarHBondContact O-N 3.37Å
162	A	82.5	Confident	79.4	Confident	44 Å²	44	69.5 Å²	69.5	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-61.1	-44.3	176.3	0	0	0	0	0	111.9	I158 I159 T164 V165 I166	I158-A162 VanDerWaalsContact O-CB 3.29Å; I158-A162 WeakPolarHBondContact O-CB 3.05Å; I158-A162 PolarHBondContact O-N 3.45Å; I159-A162 PolarHBondContact O-N 3.25Å; A162-T164 VanDerWaalsContact C-N 3.29Å; A162-T164 PolarHBondContact O-N 3.42Å; A162-V165 PolarHBondContact O-N 3.4Å; A162-I166 WeakPolarHBondContact O-CB 3.18Å; A162-I166 WeakPolarHBondContact O-CD1 3.43Å; A162-I166 WeakPolarHBondContact O-CG1 3.43Å; A162-I166 PolarHBondContact O-N 3.41Å
163	N	84	Confident	77.7	Confident	74 Å²	74	74.9 Å²	74.9	40%	0.396	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-40.7	176.7	-174.4	22.9	0	0	0	111.7	I159 F160 S161 I166 Q167	I159-N163 VanDerWaalsContact O-CB 3.26Å; I159-N163 WeakPolarHBondContact O-CB 3.22Å; I159-N163 PolarHBondContact O-N 3.44Å; F160-N163 PolarHBondContact O-N 2.89Å; S161-N163 PolarHBondContact O-N 2.99Å; N163-I166 PolarHBondContact O-N 2.66Å; N163-Q167 PolarHBondContact ND2-NE2 2.89Å; N163-Q167 WeakPolarHBondContact O-CB 3.27Å; N163-Q167 VanDerWaalsContact O-CG 3.28Å; N163-Q167 WeakPolarHBondContact O-CG 3.19Å; N163-Q167 PolarHBondContact O-N 3.38Å; N163-Q167 PolarHBondContact OD1-NE2 2.92Å
164	T	71.5	Confident	76.2	Confident	18 Å²	18	74.3 Å²	74.3	11%	0.11	40%	0.397	C	S	.	.	H	α-helix	trans	-65.8	-48.6	177.6	-52.1	0	0	0	0	110.8	F160 S161 A162 I166 Q167 D168 Y376	F160-T164 PolarHBondContact O-N 3.29Å; F160-T164 PolarHBondContact O-OG1 3.02Å; S161-T164 PolarHBondContact O-N 3.26Å; A162-T164 VanDerWaalsContact C-N 3.29Å; A162-T164 PolarHBondContact O-N 3.42Å; T164-I166 VanDerWaalsContact C-N 3.32Å; T164-I166 PolarHBondContact O-N 2.92Å; T164-Q167 PolarHBondContact O-N 2.93Å; T164-D168 VanDerWaalsContact O-CG 3.27Å; T164-D168 PolarHBondContact O-N 3.33Å; T164-Y376 HydrophobicContact CG2-CD1 3.56Å; T164-Y376 HydrophobicContact CG2-CE1 3.79Å; T164-Y376 HydrophobicContact CG2-CG 4.42Å
165	V	72.8	Confident	74.2	Confident	56 Å²	56	77 Å²	77	34%	0.339	41%	0.409	S	S	.	.	H	α-helix	trans	-57.9	-44.3	176.3	171.1	0	0	0	0	111.4	S161 A162 D168 F169	S161-V165 VanDerWaalsContact O-CG2 3.3Å; S161-V165 WeakPolarHBondContact O-CG2 3.33Å; S161-V165 PolarHBondContact O-N 3.37Å; A162-V165 PolarHBondContact O-N 3.4Å; V165-D168 PolarHBondContact O-N 3.25Å; V165-F169 HydrophobicContact CG1-CD2 3.61Å; V165-F169 HydrophobicContact CG1-CE2 3.44Å; V165-F169 VanDerWaalsContact CG1-CE2 3.44Å; V165-F169 WeakPolarHBondContact O-CD2 3.42Å; V165-F169 PolarHBondContact O-N 3.23Å
166	I	81.3	Confident	72.1	Confident	89 Å²	89	80.2 Å²	80.2	46%	0.456	42%	0.42	S	S	.	.	H	α-helix	trans	-63.3	-43.6	178.2	-70.9	164.3	0	0	0	111.3	A162 N163 T164 D168 F169 I170	A162-I166 WeakPolarHBondContact O-CB 3.18Å; A162-I166 WeakPolarHBondContact O-CD1 3.43Å; A162-I166 WeakPolarHBondContact O-CG1 3.43Å; A162-I166 PolarHBondContact O-N 3.41Å; N163-I166 PolarHBondContact O-N 2.66Å; T164-I166 VanDerWaalsContact C-N 3.32Å; T164-I166 PolarHBondContact O-N 2.92Å; I166-D168 VanDerWaalsContact C-N 3.33Å; I166-F169 PolarHBondContact O-N 3.15Å; I166-I170 HydrophobicContact CG2-CD1 3.53Å; I166-I170 HydrophobicContact CG2-CG1 4.24Å; I166-I170 WeakPolarHBondContact O-CG1 3.44Å; I166-I170 PolarHBondContact O-N 3.18Å
167	Q	73.3	Confident	70.4	Confident	51 Å²	51	79.2 Å²	79.2	24%	0.238	41%	0.409	C	S	.	.	H	α-helix	trans	-64.2	-40.6	177.4	-73.8	175.9	26.8	0	0	111.7	N163 T164 F169 I170 D171	N163-Q167 PolarHBondContact ND2-NE2 2.89Å; N163-Q167 WeakPolarHBondContact O-CB 3.27Å; N163-Q167 VanDerWaalsContact O-CG 3.28Å; N163-Q167 WeakPolarHBondContact O-CG 3.19Å; N163-Q167 PolarHBondContact O-N 3.38Å; N163-Q167 PolarHBondContact OD1-NE2 2.92Å; T164-Q167 PolarHBondContact O-N 2.93Å; Q167-F169 VanDerWaalsContact C-N 3.26Å; Q167-F169 PolarHBondContact O-N 3.05Å; Q167-I170 PolarHBondContact O-N 2.94Å; Q167-D171 PolarHBondContact O-N 2.8Å; Q167-D171 VanDerWaalsContact O-N 3.07Å
168	D	67.4	Low	68.8	Low	39 Å²	39	81.7 Å²	81.7	21%	0.209	43%	0.431	C	S	.	.	H	α-helix	trans	-63.9	-32.4	175.1	-66.5	-18.2	0	0	0	111.7	T164 V165 I166	T164-D168 VanDerWaalsContact O-CG 3.27Å; T164-D168 PolarHBondContact O-N 3.33Å; V165-D168 PolarHBondContact O-N 3.25Å; I166-D168 VanDerWaalsContact C-N 3.33Å
169	F	73.8	Confident	67	Low	165 Å²	165	87.1 Å²	87.1	72%	0.724	45%	0.447	S	S	*	.	H	α-helix	trans	-75.1	-38.4	174.2	-86.1	-66.4	0	0	0	113.8	V165 I166 Q167	V165-F169 HydrophobicContact CG1-CD2 3.61Å; V165-F169 HydrophobicContact CG1-CE2 3.44Å; V165-F169 VanDerWaalsContact CG1-CE2 3.44Å; V165-F169 WeakPolarHBondContact O-CD2 3.42Å; V165-F169 PolarHBondContact O-N 3.23Å; I166-F169 PolarHBondContact O-N 3.15Å; Q167-F169 VanDerWaalsContact C-N 3.26Å; Q167-F169 PolarHBondContact O-N 3.05Å
170	I	79.7	Confident	65.4	Low	119 Å²	119	82.8 Å²	82.8	61%	0.61	43%	0.425	S	S	*	.	H	α-helix	trans	-81	-35.6	-172.6	-70.4	174.1	0	0	0	112.5	I166 Q167 P172	I166-I170 HydrophobicContact CG2-CD1 3.53Å; I166-I170 HydrophobicContact CG2-CG1 4.24Å; I166-I170 WeakPolarHBondContact O-CG1 3.44Å; I166-I170 PolarHBondContact O-N 3.18Å; Q167-I170 PolarHBondContact O-N 2.94Å; I170-P172 WeakPolarHBondContact O-CD 3.34Å
171	D	68	Low	64.6	Low	75 Å²	75	87.5 Å²	87.5	40%	0.401	45%	0.449	S	S	.	.			trans	-103.2	78.2	-178.5	-79.1	-40.3	0	0	0	111.1	Q167 K173 I174	Q167-D171 PolarHBondContact O-N 2.8Å; Q167-D171 VanDerWaalsContact O-N 3.07Å; D171-K173 PolarHBondContact O-N 3.12Å; D171-K173 VanDerWaalsContact O-N 3.08Å; D171-I174 HydrophobicContact CB-CB 4.05Å; D171-I174 HydrophobicContact CB-CD1 3.74Å; D171-I174 HydrophobicContact CB-CG1 3.93Å; D171-I174 CarbonylContact O-C 3.18Å; D171-I174 VanDerWaalsContact O-CA 3.27Å; D171-I174 WeakPolarHBondContact O-CA 3.3Å; D171-I174 WeakPolarHBondContact O-CB 3.26Å; D171-I174 PolarHBondContact O-N 3.23Å
172	P	59.2	Low	64.4	Low	74 Å²	74	90.6 Å²	90.6	48%	0.481	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-67.2	-10.1	173.7	28.1	-34	0	0	0	112.1	I170 I174 N175	I170-P172 WeakPolarHBondContact O-CD 3.34Å; P172-I174 VanDerWaalsContact C-N 3.27Å; P172-N175 WeakPolarHBondContact CA-OD1 3.39Å; P172-N175 WeakPolarHBondContact O-CB 3.36Å; P172-N175 PolarHBondContact O-N 3.41Å; P172-N175 VanDerWaalsContact O-N 3.07Å; P172-N175 PolarHBondContact O-ND2 3.1Å; P172-N175 PolarHBondContact O-OD1 3.08Å
173	K	54.7	Low	64.1	Low	209 Å²	209	89.8 Å²	89.8	91%	0.909	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-77.5	-18.3	168.5	-69.3	-176.2	-179.8	177.8	0	112.4	D171 N175	D171-K173 PolarHBondContact O-N 3.12Å; D171-K173 VanDerWaalsContact O-N 3.08Å; K173-N175 VanDerWaalsContact C-N 3.26Å
174	I	54.3	Low	63.9	Low	78 Å²	78	87.9 Å²	87.9	40%	0.4	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-97.6	41.1	160	-47.8	166.9	0	0	0	107.7	D171 P172 L176 Y177	D171-I174 HydrophobicContact CB-CB 4.05Å; D171-I174 HydrophobicContact CB-CD1 3.74Å; D171-I174 HydrophobicContact CB-CG1 3.93Å; D171-I174 CarbonylContact O-C 3.18Å; D171-I174 VanDerWaalsContact O-CA 3.27Å; D171-I174 WeakPolarHBondContact O-CA 3.3Å; D171-I174 WeakPolarHBondContact O-CB 3.26Å; D171-I174 PolarHBondContact O-N 3.23Å; P172-I174 VanDerWaalsContact C-N 3.27Å; I174-L176 PolarHBondContact O-N 3.43Å; I174-Y177 HydrophobicContact CG2-CD2 4.23Å; I174-Y177 HydrophobicContact CG2-CE2 4.2Å
175	N	44.3	Very low	64.5	Low	111 Å²	111	96.1 Å²	96.1	59%	0.594	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	33.8	166.2	-91.5	-19.2	0	0	0	112.3	P172 K173 Y177	P172-N175 WeakPolarHBondContact CA-OD1 3.39Å; P172-N175 WeakPolarHBondContact O-CB 3.36Å; P172-N175 PolarHBondContact O-N 3.41Å; P172-N175 VanDerWaalsContact O-N 3.07Å; P172-N175 PolarHBondContact O-ND2 3.1Å; P172-N175 PolarHBondContact O-OD1 3.08Å; K173-N175 VanDerWaalsContact C-N 3.26Å; N175-Y177 VanDerWaalsContact C-N 3.33Å
176	L	48.8	Very low	65	Low	111 Å²	111	98.8 Å²	98.8	58%	0.581	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-16.2	169.9	-142.9	80.9	0	0	0	111.4	I174 D180	I174-L176 PolarHBondContact O-N 3.43Å; L176-D180 WeakPolarHBondContact O-CB 3.15Å
177	Y	51.2	Low	65.2	Low	46 Å²	46	96.1 Å²	96.1	18%	0.18	47%	0.467	C	S	.	.	S	Bend	trans	-123.8	-18.2	-166.3	-59	-53.7	0	0	0	118	I174 N175 Y179 D180 I183 M379	I174-Y177 HydrophobicContact CG2-CD2 4.23Å; I174-Y177 HydrophobicContact CG2-CE2 4.2Å; N175-Y177 VanDerWaalsContact C-N 3.33Å; Y177-Y179 PolarHBondContact O-N 3.43Å; Y177-D180 HydrophobicContact CD1-CB 4.05Å; Y177-D180 PolarHBondContact O-N 3.27Å; Y177-D180 VanDerWaalsContact O-N 3.14Å; Y177-I183 HydrophobicContact CE1-CD1 4.04Å; Y177-M379 HydrophobicContact CD1-CE 3.59Å; Y177-M379 HydrophobicContact CE1-CE 2.94Å; Y177-M379 HydrophobicContact CE2-CE 4.31Å; Y177-M379 WeakPolarHBondContact OH-CE 3.4Å
178	A	47.6	Very low	65.9	Low	70 Å²	70	96.4 Å²	96.4	58%	0.579	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-5.1	-179.8	0	0	0	0	0	114.8
179	Y	48.7	Very low	66.8	Low	221 Å²	221	95.1 Å²	95.1	87%	0.867	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	3.1	170.1	-99.9	-92.5	0	0	0	113.7	Y177 M181	Y177-Y179 PolarHBondContact O-N 3.43Å; Y179-M181 PolarHBondContact O-N 2.97Å; Y179-M181 VanDerWaalsContact O-N 3.12Å
180	D	53.9	Low	67.6	Low	24 Å²	24	90.8 Å²	90.8	13%	0.128	45%	0.447	C	S	.	.			trans	-97.8	53.5	-160	-158.2	0.4	0	0	0	113.3	L176 Y177 D182 I183 Y375	L176-D180 WeakPolarHBondContact O-CB 3.15Å; Y177-D180 HydrophobicContact CD1-CB 4.05Å; Y177-D180 PolarHBondContact O-N 3.27Å; Y177-D180 VanDerWaalsContact O-N 3.14Å; D180-D182 PolarHBondContact O-N 3.29Å; D180-D182 WeakPolarHBondContact OD1-CA 3.26Å; D180-D182 WeakPolarHBondContact OD1-CB 3.43Å; D180-D182 PolarHBondContact OD1-N 3.36Å; D180-I183 PolarHBondContact OD1-N 2.92Å; D180-I183 WeakPolarHBondContact OD2-CD1 3.4Å; D180-Y375 PolarHBondContact O-OH 3.37Å
181	M	64.3	Low	68.1	Low	137 Å²	137	89.7 Å²	89.7	68%	0.675	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	1.8	148.8	-69.6	-71.2	172.9	0	0	110.4	Y179 L184 R185	Y179-M181 PolarHBondContact O-N 2.97Å; Y179-M181 VanDerWaalsContact O-N 3.12Å; M181-L184 PolarHBondContact O-N 3.19Å; M181-L184 HydrophobicContact SD-CD1 3.62Å; M181-R185 WeakPolarHBondContact O-CB 3.28Å; M181-R185 PolarHBondContact O-N 2.78Å
182	D	71.9	Confident	69.3	Low	92 Å²	92	90.2 Å²	90.2	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-70.7	-34.3	178.9	-57.8	-38.8	0	0	0	112	D180 R185 F186	D180-D182 PolarHBondContact O-N 3.29Å; D180-D182 WeakPolarHBondContact OD1-CA 3.26Å; D180-D182 WeakPolarHBondContact OD1-CB 3.43Å; D180-D182 PolarHBondContact OD1-N 3.36Å; D182-R185 CarbonylContact O-C 3.5Å; D182-R185 PolarHBondContact O-N 2.88Å; D182-F186 WeakPolarHBondContact O-CA 3.4Å; D182-F186 WeakPolarHBondContact O-CB 3.32Å; D182-F186 PolarHBondContact O-N 3.13Å
183	I	76.2	Confident	70.9	Confident	27 Å²	27	88.2 Å²	88.2	14%	0.138	43%	0.43	C	S	.	.	H	α-helix	trans	-64.5	-43.4	170.9	-66.9	170.6	0	0	0	110.9	Y177 D180 F186 T187 Y375 M379 F383	Y177-I183 HydrophobicContact CE1-CD1 4.04Å; D180-I183 PolarHBondContact OD1-N 2.92Å; D180-I183 WeakPolarHBondContact OD2-CD1 3.4Å; I183-F186 PolarHBondContact O-N 3.41Å; I183-T187 WeakPolarHBondContact O-CB 3.35Å; I183-T187 PolarHBondContact O-N 3.06Å; I183-T187 PolarHBondContact O-OG1 3.15Å; I183-Y375 HydrophobicContact CB-CE2 4.44Å; I183-Y375 HydrophobicContact CG2-CE2 4.17Å; I183-M379 HydrophobicContact CD1-CE 3.35Å; I183-M379 HydrophobicContact CD1-SD 3.56Å; I183-M379 VanDerWaalsContact CD1-SD 3.56Å; I183-M379 HydrophobicContact CG2-SD 4.19Å; I183-F383 HydrophobicContact CD1-CD1 4.33Å; I183-F383 HydrophobicContact CD1-CE1 4.43Å; I183-F383 HydrophobicContact CG2-CE1 3.93Å; I183-F383 HydrophobicContact CG2-CE2 4.44Å; I183-F383 HydrophobicContact CG2-CZ 3.75Å
184	L	79.4	Confident	72.7	Confident	33 Å²	33	78.7 Å²	78.7	17%	0.173	39%	0.39	C	S	.	.	H	α-helix	trans	-64.7	-43.4	175.3	-79.9	170.4	0	0	0	110.9	M181 F186 T187 F188 F371 Y375	M181-L184 PolarHBondContact O-N 3.19Å; M181-L184 HydrophobicContact SD-CD1 3.62Å; L184-F186 VanDerWaalsContact C-N 3.33Å; L184-F186 PolarHBondContact O-N 3.18Å; L184-T187 PolarHBondContact O-N 2.91Å; L184-F188 HydrophobicContact CD2-CD2 4.29Å; L184-F188 HydrophobicContact CD2-CE2 4.2Å; L184-F188 WeakPolarHBondContact O-CB 3.5Å; L184-F188 WeakPolarHBondContact O-CD2 3.42Å; L184-F188 PolarHBondContact O-N 3.33Å; L184-F371 HydrophobicContact CD2-CE1 4.05Å; L184-F371 HydrophobicContact CD2-CZ 3.79Å; L184-Y375 HydrophobicContact CD1-CD1 4.37Å; L184-Y375 HydrophobicContact CD1-CD2 4.23Å; L184-Y375 HydrophobicContact CD1-CE1 4.31Å; L184-Y375 HydrophobicContact CD1-CE2 4.19Å; L184-Y375 HydrophobicContact CD1-CG 4.32Å; L184-Y375 HydrophobicContact CD2-CD2 3.7Å; L184-Y375 HydrophobicContact CD2-CE2 4.1Å; L184-Y375 HydrophobicContact CD2-CG 4.21Å; L184-Y375 HydrophobicContact CG-CD2 3.8Å; L184-Y375 HydrophobicContact CG-CE2 3.68Å; L184-Y375 HydrophobicContact CG-CG 4.35Å
185	R	83.1	Confident	74.6	Confident	191 Å²	191	80.7 Å²	80.7	72%	0.721	40%	0.396	S	S	*	.	H	α-helix	trans	-66.1	-34.4	177.4	-171.5	-180	-175.9	175.5	1.9	112.5	M181 D182 F188 G189	M181-R185 WeakPolarHBondContact O-CB 3.28Å; M181-R185 PolarHBondContact O-N 2.78Å; D182-R185 CarbonylContact O-C 3.5Å; D182-R185 PolarHBondContact O-N 2.88Å; R185-F188 CarbonylContact O-C 3.59Å; R185-G189 WeakPolarHBondContact O-CA 3.42Å; R185-G189 PolarHBondContact O-N 2.86Å
186	F	85.2	Confident	77	Confident	113 Å²	113	81 Å²	81	50%	0.496	39%	0.389	S	S	.	.	H	α-helix	trans	-67.5	-51.6	172.2	168.8	-99.1	0	0	0	109.4	D182 I183 L184 F188 G189 P259 W557	D182-F186 WeakPolarHBondContact O-CA 3.4Å; D182-F186 WeakPolarHBondContact O-CB 3.32Å; D182-F186 PolarHBondContact O-N 3.13Å; I183-F186 PolarHBondContact O-N 3.41Å; L184-F186 VanDerWaalsContact C-N 3.33Å; L184-F186 PolarHBondContact O-N 3.18Å; F186-F188 VanDerWaalsContact C-N 3.32Å; F186-F188 PolarHBondContact O-N 2.99Å; F186-G189 PolarHBondContact O-N 3.32Å; F186-P259 WeakPolarHBondContact O-CB 3.3Å; F186-P259 WeakPolarHBondContact O-CG 3.43Å; F186-W557 HydrophobicContact CZ-CZ2 4.5Å
187	T	85.3	Confident	79.1	Confident	33 Å²	33	76.2 Å²	76.2	20%	0.202	36%	0.364	C	S	.	.	H	α-helix	trans	-65	-36.8	-175.1	-59	0	0	0	0	112.1	I183 L184 A261 S262	I183-T187 WeakPolarHBondContact O-CB 3.35Å; I183-T187 PolarHBondContact O-N 3.06Å; I183-T187 PolarHBondContact O-OG1 3.15Å; L184-T187 PolarHBondContact O-N 2.91Å; T187-A261 HydrophobicContact CG2-CB 3.32Å; T187-A261 WeakPolarHBondContact O-CB 3.39Å; T187-A261 PolarHBondContact O-N 3.4Å; T187-S262 PolarHBondContact O-N 3.08Å
188	F	86.8	Confident	81.2	Confident	56 Å²	56	77.6 Å²	77.6	25%	0.246	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	28.9	175.6	-68	-85.1	0	0	0	112.2	L184 R185 F186 L191 A261 S262 I265 F371	L184-F188 HydrophobicContact CD2-CD2 4.29Å; L184-F188 HydrophobicContact CD2-CE2 4.2Å; L184-F188 WeakPolarHBondContact O-CB 3.5Å; L184-F188 WeakPolarHBondContact O-CD2 3.42Å; L184-F188 PolarHBondContact O-N 3.33Å; R185-F188 CarbonylContact O-C 3.59Å; F186-F188 VanDerWaalsContact C-N 3.32Å; F186-F188 PolarHBondContact O-N 2.99Å; F188-L191 HydrophobicContact CB-CD2 4.18Å; F188-L191 VanDerWaalsContact O-CD2 3.28Å; F188-L191 WeakPolarHBondContact O-CD2 3.44Å; F188-L191 WeakPolarHBondContact O-CG 3.12Å; F188-A261 HydrophobicContact CD1-CB 4.18Å; F188-A261 HydrophobicContact CD2-CB 4.47Å; F188-A261 HydrophobicContact CE1-CB 3.78Å; F188-A261 HydrophobicContact CE2-CB 4.06Å; F188-A261 HydrophobicContact CZ-CB 3.7Å; F188-S262 WeakPolarHBondContact CA-OG 3.43Å; F188-I265 HydrophobicContact CD1-CD1 4.06Å; F188-I265 HydrophobicContact CE1-CD1 3.86Å; F188-F371 HydrophobicContact CD2-CZ 4.29Å; F188-F371 AromaticContact CE2-CE2 3.7Å; F188-F371 HydrophobicContact CE2-CE2 3.7Å; F188-F371 AromaticContact CE2-CZ 3.41Å; F188-F371 HydrophobicContact CE2-CZ 3.41Å; F188-F371 VanDerWaalsContact CE2-CZ 3.41Å; F188-F371 AromaticContact CZ-CE2 3.53Å; F188-F371 HydrophobicContact CZ-CE2 3.53Å; F188-F371 AromaticContact CZ-CZ 3.68Å; F188-F371 HydrophobicContact CZ-CZ 3.68Å
189	G	87.2	Confident	83.5	Confident	13 Å²	13	77.3 Å²	77.3	13%	0.134	36%	0.357	C	S	.	.			trans	-64.9	160.7	177.7	0	0	0	0	0	112.5	R185 F186 L191 S262	R185-G189 WeakPolarHBondContact O-CA 3.42Å; R185-G189 PolarHBondContact O-N 2.86Å; F186-G189 PolarHBondContact O-N 3.32Å; G189-L191 PolarHBondContact O-N 3.5Å; G189-S262 PolarHBondContact O-OG 2.87Å
190	N	89.2	Confident	85.7	Confident	73 Å²	73	70.4 Å²	70.4	39%	0.39	34%	0.341	S	S	.	.			trans	55.3	42.9	176.6	-55.1	-8.7	0	0	0	113.6	D192 D193 V194 C256 L258	N190-D192 PolarHBondContact O-N 3.34Å; N190-D193 HydrophobicContact CB-CB 4.24Å; N190-D193 WeakPolarHBondContact O-CB 3.47Å; N190-D193 PolarHBondContact O-N 3.28Å; N190-D193 VanDerWaalsContact O-N 3.13Å; N190-V194 WeakPolarHBondContact O-CG2 3.19Å; N190-V194 PolarHBondContact O-N 2.82Å; N190-C256 PolarHBondContact ND2-O 2.81Å; N190-L258 HydrophobicContact CB-CD2 3.84Å
191	L	90.5	Very high	87.7	Confident	97 Å²	97	69.7 Å²	69.7	51%	0.508	34%	0.337	S	S	.	.	H	α-helix	trans	-61.1	-27.4	178.9	-67.5	-178.2	0	0	0	113.3	F188 G189 V194 F195	F188-L191 HydrophobicContact CB-CD2 4.18Å; F188-L191 VanDerWaalsContact O-CD2 3.28Å; F188-L191 WeakPolarHBondContact O-CD2 3.44Å; F188-L191 WeakPolarHBondContact O-CG 3.12Å; G189-L191 PolarHBondContact O-N 3.5Å; L191-V194 PolarHBondContact O-N 3.5Å; L191-F195 WeakPolarHBondContact O-CB 3.32Å; L191-F195 PolarHBondContact O-N 3.4Å
192	D	93.1	Very high	89.1	Confident	86 Å²	86	63.8 Å²	63.8	46%	0.46	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-41.8	175.4	64.7	-56.2	0	0	0	111.2	N190 F195 R196	N190-D192 PolarHBondContact O-N 3.34Å; D192-F195 PolarHBondContact O-N 3.15Å; D192-R196 WeakPolarHBondContact O-CG 3.09Å; D192-R196 PolarHBondContact O-N 3.34Å; D192-R196 IonicContact OD2-CZ 2.8Å; D192-R196 VanDerWaalsContact OD2-CZ 3.25Å; D192-R196 IonicContact OD2-NH1 2.62Å; D192-R196 PolarHBondContact OD2-NH1 2.94Å; D192-R196 IonicContact OD2-NH2 3.34Å; D192-R196 PolarHBondContact OD2-NH2 3.44Å
193	D	92.6	Very high	90.3	Very high	31 Å²	31	63.6 Å²	63.6	17%	0.166	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-45	169.9	-80.8	-52.8	0	0	0	111.8	N190 F195 R196 I197 C256 L258	N190-D193 HydrophobicContact CB-CB 4.24Å; N190-D193 WeakPolarHBondContact O-CB 3.47Å; N190-D193 PolarHBondContact O-N 3.28Å; N190-D193 VanDerWaalsContact O-N 3.13Å; D193-F195 VanDerWaalsContact C-N 3.28Å; D193-F195 PolarHBondContact O-N 2.81Å; D193-R196 PolarHBondContact O-N 3.05Å; D193-R196 IonicContact OD1-CZ 3.42Å; D193-R196 IonicContact OD1-NE 3.37Å; D193-R196 PolarHBondContact OD1-NE 3.37Å; D193-R196 IonicContact OD1-NH2 2.79Å; D193-R196 PolarHBondContact OD1-NH2 3.09Å; D193-R196 IonicContact OD2-NH2 2.78Å; D193-R196 PolarHBondContact OD2-NH2 2.97Å; D193-I197 VanDerWaalsContact O-CG1 3.27Å; D193-I197 WeakPolarHBondContact O-CG1 3.45Å; D193-I197 PolarHBondContact O-N 3.24Å; D193-C256 HydrophobicContact CB-CB 4.18Å; D193-L258 HydrophobicContact CB-CD2 3.88Å
194	V	93.9	Very high	91.2	Very high	10 Å²	10	63.7 Å²	63.7	6%	0.061	31%	0.308	C	S	.	.	H	α-helix	trans	-55.7	-46.3	176.6	173	0	0	0	0	110.5	N190 L191 I197 W198 L258 I265 V266	N190-V194 WeakPolarHBondContact O-CG2 3.19Å; N190-V194 PolarHBondContact O-N 2.82Å; L191-V194 PolarHBondContact O-N 3.5Å; V194-I197 PolarHBondContact O-N 2.89Å; V194-W198 WeakPolarHBondContact O-CB 3.2Å; V194-W198 PolarHBondContact O-N 2.86Å; V194-L258 HydrophobicContact CG2-CD1 4.14Å; V194-L258 HydrophobicContact CG2-CD2 4.04Å; V194-I265 HydrophobicContact CG1-CG2 4.1Å; V194-V266 HydrophobicContact CB-CG2 4.36Å; V194-V266 HydrophobicContact CG1-CG2 3.89Å; V194-V266 HydrophobicContact CG2-CG2 4.27Å
195	F	94.3	Very high	91.9	Very high	119 Å²	119	62.1 Å²	62.1	52%	0.522	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-44.1	178.3	-176.5	-100.8	0	0	0	111.9	L191 D192 D193 W198 L199	L191-F195 WeakPolarHBondContact O-CB 3.32Å; L191-F195 PolarHBondContact O-N 3.4Å; D192-F195 PolarHBondContact O-N 3.15Å; D193-F195 VanDerWaalsContact C-N 3.28Å; D193-F195 PolarHBondContact O-N 2.81Å; F195-W198 HydrophobicContact CD2-CE3 4.36Å; F195-W198 HydrophobicContact CE2-CE3 4.3Å; F195-W198 HydrophobicContact CE2-CZ3 4.24Å; F195-W198 PolarHBondContact O-N 2.72Å; F195-L199 HydrophobicContact CE1-CD2 4.17Å; F195-L199 VanDerWaalsContact O-CB 3.23Å; F195-L199 WeakPolarHBondContact O-CB 3.46Å; F195-L199 PolarHBondContact O-N 2.73Å
196	R	93.7	Very high	92.5	Very high	119 Å²	119	53.9 Å²	53.9	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-59	-47.4	175.9	-74.9	-173.5	-69	-92.9	12.4	112.2	D192 D193 S200	D192-R196 WeakPolarHBondContact O-CG 3.09Å; D192-R196 PolarHBondContact O-N 3.34Å; D192-R196 IonicContact OD2-CZ 2.8Å; D192-R196 VanDerWaalsContact OD2-CZ 3.25Å; D192-R196 IonicContact OD2-NH1 2.62Å; D192-R196 PolarHBondContact OD2-NH1 2.94Å; D192-R196 IonicContact OD2-NH2 3.34Å; D192-R196 PolarHBondContact OD2-NH2 3.44Å; D193-R196 PolarHBondContact O-N 3.05Å; D193-R196 IonicContact OD1-CZ 3.42Å; D193-R196 IonicContact OD1-NE 3.37Å; D193-R196 PolarHBondContact OD1-NE 3.37Å; D193-R196 IonicContact OD1-NH2 2.79Å; D193-R196 PolarHBondContact OD1-NH2 3.09Å; D193-R196 IonicContact OD2-NH2 2.78Å; D193-R196 PolarHBondContact OD2-NH2 2.97Å; R196-S200 WeakPolarHBondContact O-CB 3.37Å; R196-S200 PolarHBondContact O-N 3.29Å; R196-S200 PolarHBondContact O-OG 2.93Å
197	I	94.1	Very high	93	Very high	10 Å²	10	53.1 Å²	53.1	5%	0.051	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-47.2	179	-63.7	163.4	0	0	0	110	D193 V194 L199 S200 M201 F252 C256 L258 V266	D193-I197 VanDerWaalsContact O-CG1 3.27Å; D193-I197 WeakPolarHBondContact O-CG1 3.45Å; D193-I197 PolarHBondContact O-N 3.24Å; V194-I197 PolarHBondContact O-N 2.89Å; I197-L199 PolarHBondContact O-N 3Å; I197-S200 PolarHBondContact O-N 3.33Å; I197-M201 HydrophobicContact CG2-CE 4.1Å; I197-M201 HydrophobicContact CG2-CG 4.4Å; I197-M201 HydrophobicContact CG2-SD 4.31Å; I197-M201 WeakPolarHBondContact O-CG 3.22Å; I197-M201 PolarHBondContact O-N 3.09Å; I197-F252 HydrophobicContact CD1-CB 3.99Å; I197-F252 HydrophobicContact CG1-CB 4.07Å; I197-C256 HydrophobicContact CD1-CB 4.49Å; I197-L258 HydrophobicContact CD1-CD1 3.9Å; I197-V266 HydrophobicContact CG2-CG1 3.68Å
198	W	94.7	Very high	93.5	Very high	74 Å²	74	55.5 Å²	55.5	28%	0.28	28%	0.277	S	S	.	.	H	α-helix	trans	-60	-46.8	178.8	178.2	81.5	0	0	0	112.4	V194 F195 S200 M201 K202 E269	V194-W198 WeakPolarHBondContact O-CB 3.2Å; V194-W198 PolarHBondContact O-N 2.86Å; F195-W198 HydrophobicContact CD2-CE3 4.36Å; F195-W198 HydrophobicContact CE2-CE3 4.3Å; F195-W198 HydrophobicContact CE2-CZ3 4.24Å; F195-W198 PolarHBondContact O-N 2.72Å; W198-S200 VanDerWaalsContact C-N 3.32Å; W198-S200 PolarHBondContact O-N 3.13Å; W198-M201 PolarHBondContact O-N 2.92Å; W198-K202 VanDerWaalsContact O-CB 3.25Å; W198-K202 WeakPolarHBondContact O-CB 3.26Å; W198-K202 PolarHBondContact O-N 3.23Å; W198-E269 PolarHBondContact NE1-OE2 2.97Å
199	L	95.3	Very high	93.8	Very high	65 Å²	65	53.1 Å²	53.1	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-60.5	-43.4	177.4	-177.1	61.4	0	0	0	110.9	F195 I197 K202 M203	F195-L199 HydrophobicContact CE1-CD2 4.17Å; F195-L199 VanDerWaalsContact O-CB 3.23Å; F195-L199 WeakPolarHBondContact O-CB 3.46Å; F195-L199 PolarHBondContact O-N 2.73Å; I197-L199 PolarHBondContact O-N 3Å; L199-K202 PolarHBondContact O-N 2.92Å; L199-M203 HydrophobicContact CD1-CE 4Å; L199-M203 HydrophobicContact CD1-CG 4.3Å; L199-M203 WeakPolarHBondContact O-CB 3.35Å; L199-M203 WeakPolarHBondContact O-CG 3.17Å; L199-M203 PolarHBondContact O-N 3.33Å
200	S	94.6	Very high	94.1	Very high	75 Å²	75	53 Å²	53	52%	0.524	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-47.1	178.1	-58	0	0	0	0	112	R196 I197 W198 K202 M203 S204	R196-S200 WeakPolarHBondContact O-CB 3.37Å; R196-S200 PolarHBondContact O-N 3.29Å; R196-S200 PolarHBondContact O-OG 2.93Å; I197-S200 PolarHBondContact O-N 3.33Å; W198-S200 VanDerWaalsContact C-N 3.32Å; W198-S200 PolarHBondContact O-N 3.13Å; S200-K202 VanDerWaalsContact C-N 3.33Å; S200-K202 PolarHBondContact O-N 3.11Å; S200-M203 PolarHBondContact O-N 3.31Å; S200-S204 WeakPolarHBondContact O-CB 3.4Å; S200-S204 PolarHBondContact O-N 3.42Å
201	M	95.6	Very high	94.3	Very high	9 Å²	9	56.5 Å²	56.5	4%	0.044	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-42.5	174.5	-71.9	-170.7	-57.3	0	0	111.8	I197 W198 T205 F245 S249 V266 E269 Q270 L273	I197-M201 HydrophobicContact CG2-CE 4.1Å; I197-M201 HydrophobicContact CG2-CG 4.4Å; I197-M201 HydrophobicContact CG2-SD 4.31Å; I197-M201 WeakPolarHBondContact O-CG 3.22Å; I197-M201 PolarHBondContact O-N 3.09Å; W198-M201 PolarHBondContact O-N 2.92Å; M201-T205 WeakPolarHBondContact O-CB 3.39Å; M201-T205 PolarHBondContact O-N 3.46Å; M201-T205 PolarHBondContact O-OG1 3.43Å; M201-F245 HydrophobicContact CB-CE2 3.95Å; M201-F245 HydrophobicContact CB-CZ 3.83Å; M201-F245 HydrophobicContact CG-CE2 4.17Å; M201-F245 HydrophobicContact CG-CZ 3.99Å; M201-F245 HydrophobicContact SD-CZ 4.25Å; M201-S249 PolarHBondContact SD-OG 3.12Å; M201-V266 HydrophobicContact CE-CG1 3.84Å; M201-V266 HydrophobicContact SD-CG1 4.37Å; M201-E269 HydrophobicContact CE-CB 4.45Å; M201-Q270 HydrophobicContact SD-CB 3.91Å; M201-Q270 HydrophobicContact SD-CG 4.22Å; M201-L273 HydrophobicContact CB-CD1 3.89Å
202	K	94.8	Very high	94.4	Very high	13 Å²	13	53.1 Å²	53.1	6%	0.057	26%	0.259	C	S	.	.	H	α-helix	trans	-64.7	-48	-179.6	-173.5	66	174.6	-168.2	0	111.4	W198 L199 S200 T205 I206 L273 L338	W198-K202 VanDerWaalsContact O-CB 3.25Å; W198-K202 WeakPolarHBondContact O-CB 3.26Å; W198-K202 PolarHBondContact O-N 3.23Å; L199-K202 PolarHBondContact O-N 2.92Å; S200-K202 VanDerWaalsContact C-N 3.33Å; S200-K202 PolarHBondContact O-N 3.11Å; K202-T205 PolarHBondContact O-N 2.76Å; K202-I206 HydrophobicContact CD-CD1 4.45Å; K202-I206 HydrophobicContact CG-CD1 3.98Å; K202-I206 VanDerWaalsContact O-CG1 3.3Å; K202-I206 WeakPolarHBondContact O-CG1 3.48Å; K202-I206 PolarHBondContact O-N 2.7Å; K202-L273 HydrophobicContact CD-CD2 4.07Å; K202-L338 PolarHBondContact NZ-O 3.43Å
203	M	95.9	Very high	94.4	Very high	88 Å²	88	49.2 Å²	49.2	43%	0.433	24%	0.239	S	C	.	.	H	α-helix	trans	-62.2	-45.3	177.7	-71	-58	-170.2	0	0	111.6	L199 S200 T205 I206 F207	L199-M203 HydrophobicContact CD1-CE 4Å; L199-M203 HydrophobicContact CD1-CG 4.3Å; L199-M203 WeakPolarHBondContact O-CB 3.35Å; L199-M203 WeakPolarHBondContact O-CG 3.17Å; L199-M203 PolarHBondContact O-N 3.33Å; S200-M203 PolarHBondContact O-N 3.31Å; M203-T205 VanDerWaalsContact C-N 3.29Å; M203-T205 PolarHBondContact O-N 2.82Å; M203-I206 PolarHBondContact O-N 3.42Å; M203-I206 VanDerWaalsContact O-N 3.13Å; M203-I206 HydrophobicContact SD-CD1 4.41Å; M203-F207 VanDerWaalsContact O-CD2 3.23Å; M203-F207 WeakPolarHBondContact O-CD2 3.11Å; M203-F207 PolarHBondContact O-N 2.98Å; M203-F207 HydrophobicContact SD-CE2 3.85Å
204	S	95.7	Very high	94.3	Very high	30 Å²	30	50.2 Å²	50.2	21%	0.21	24%	0.244	C	C	.	.	H	α-helix	trans	-53.9	-46.1	173.7	171.8	0	0	0	0	111.9	S200 I208 P209 Y241	S200-S204 WeakPolarHBondContact O-CB 3.4Å; S200-S204 PolarHBondContact O-N 3.42Å; S204-I208 WeakPolarHBondContact O-CB 3.26Å; S204-I208 PolarHBondContact O-N 3.05Å; S204-P209 WeakPolarHBondContact O-CD 3.46Å; S204-Y241 PolarHBondContact O-OH 3.04Å; S204-Y241 WeakPolarHBondContact OG-CE2 3.43Å; S204-Y241 PolarHBondContact OG-OH 2.81Å
205	T	95.3	Very high	94.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71	-29.8	179.4	-50.4	0	0	0	0	113	M201 K202 M203 P209 L273 Y334 L338	M201-T205 WeakPolarHBondContact O-CB 3.39Å; M201-T205 PolarHBondContact O-N 3.46Å; M201-T205 PolarHBondContact O-OG1 3.43Å; K202-T205 PolarHBondContact O-N 2.76Å; M203-T205 VanDerWaalsContact C-N 3.29Å; M203-T205 PolarHBondContact O-N 2.82Å; T205-P209 VanDerWaalsContact O-CD 3.26Å; T205-P209 WeakPolarHBondContact O-CD 3.31Å; T205-L273 HydrophobicContact CG2-CB 4.22Å; T205-L273 HydrophobicContact CG2-CD2 4.02Å; T205-Y334 PolarHBondContact O-OH 3.46Å; T205-L338 HydrophobicContact CG2-CD2 4.04Å
206	I	95.5	Very high	94	Very high	17 Å²	17	48.3 Å²	48.3	9%	0.087	24%	0.237	C	C	.	.	H	α-helix	trans	-69.8	-46.6	176.4	-72.7	165.3	0	0	0	110.6	K202 M203 F210 F331 Y334 L335 L338	K202-I206 HydrophobicContact CD-CD1 4.45Å; K202-I206 HydrophobicContact CG-CD1 3.98Å; K202-I206 VanDerWaalsContact O-CG1 3.3Å; K202-I206 WeakPolarHBondContact O-CG1 3.48Å; K202-I206 PolarHBondContact O-N 2.7Å; M203-I206 PolarHBondContact O-N 3.42Å; M203-I206 VanDerWaalsContact O-N 3.13Å; M203-I206 HydrophobicContact SD-CD1 4.41Å; I206-F210 WeakPolarHBondContact O-CB 3.35Å; I206-F331 HydrophobicContact CG2-CE2 3.83Å; I206-F331 HydrophobicContact CG2-CZ 3.76Å; I206-Y334 WeakPolarHBondContact O-CE1 3.03Å; I206-L335 HydrophobicContact CD1-CD1 4.16Å; I206-L335 HydrophobicContact CG1-CD1 4.35Å; I206-L338 HydrophobicContact CB-CD1 4.34Å; I206-L338 HydrophobicContact CG1-CD1 3.52Å
207	F	94.8	Very high	93.7	Very high	97 Å²	97	45.1 Å²	45.1	43%	0.425	23%	0.228	S	C	.	.	H	α-helix	trans	-90	-49.9	-171	-65.4	-68.1	0	0	0	112.8	M203 F210 W211	M203-F207 VanDerWaalsContact O-CD2 3.23Å; M203-F207 WeakPolarHBondContact O-CD2 3.11Å; M203-F207 PolarHBondContact O-N 2.98Å; M203-F207 HydrophobicContact SD-CE2 3.85Å; F207-F210 PolarHBondContact O-N 3.36Å; F207-W211 AromaticContact CD1-NE1 3.95Å; F207-W211 WeakPolarHBondContact O-CB 3.46Å; F207-W211 VanDerWaalsContact O-CD1 3.23Å; F207-W211 PolarHBondContact O-N 2.99Å
208	I	95.1	Very high	93.3	Very high	83 Å²	83	48.4 Å²	48.4	43%	0.426	26%	0.257	S	S	.	.	H	α-helix	trans	-67.2	-51.7	-165.6	-60.1	175.6	0	0	0	112.8	S204 F210 G212 Y241	S204-I208 WeakPolarHBondContact O-CB 3.26Å; S204-I208 PolarHBondContact O-N 3.05Å; I208-F210 VanDerWaalsContact C-N 3.33Å; I208-F210 PolarHBondContact O-N 3.28Å; I208-G212 WeakPolarHBondContact O-CA 3.25Å; I208-G212 PolarHBondContact O-N 2.62Å; I208-Y241 HydrophobicContact CB-CD2 4.19Å; I208-Y241 HydrophobicContact CB-CE2 3.79Å; I208-Y241 HydrophobicContact CD1-CD2 4.1Å; I208-Y241 HydrophobicContact CD1-CE2 3.7Å; I208-Y241 HydrophobicContact CG1-CE2 4.31Å; I208-Y241 HydrophobicContact CG2-CD2 3.55Å; I208-Y241 HydrophobicContact CG2-CE2 3.69Å; I208-Y241 HydrophobicContact CG2-CG 4.02Å
209	P	94.1	Very high	92.9	Very high	6 Å²	6	52.7 Å²	52.7	4%	0.039	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-37.8	177.2	-22.3	33.5	0	0	0	113.4	S204 T205 V213 Y241 F280 V281	S204-P209 WeakPolarHBondContact O-CD 3.46Å; T205-P209 VanDerWaalsContact O-CD 3.26Å; T205-P209 WeakPolarHBondContact O-CD 3.31Å; P209-V213 WeakPolarHBondContact O-CG2 3.35Å; P209-V213 PolarHBondContact O-N 3.21Å; P209-V213 VanDerWaalsContact O-N 3.08Å; P209-Y241 HydrophobicContact CG-CE1 3.86Å; P209-F280 HydrophobicContact CB-CD1 4.48Å; P209-V281 HydrophobicContact CB-CG2 4.42Å
210	F	93.9	Very high	92.4	Very high	12 Å²	12	51.3 Å²	51.3	5%	0.053	26%	0.264	C	S	.	.	H	α-helix	trans	-68.5	-52.3	-178.5	-177	-100.1	0	0	0	111.5	I206 F207 I208 G212 V213 L214 F280 P329 F331 Y334	I206-F210 WeakPolarHBondContact O-CB 3.35Å; F207-F210 PolarHBondContact O-N 3.36Å; I208-F210 VanDerWaalsContact C-N 3.33Å; I208-F210 PolarHBondContact O-N 3.28Å; F210-G212 VanDerWaalsContact C-N 3.32Å; F210-G212 PolarHBondContact O-N 2.88Å; F210-V213 PolarHBondContact O-N 2.83Å; F210-L214 HydrophobicContact CD1-CD1 3.75Å; F210-L214 HydrophobicContact CD1-CG 4.43Å; F210-L214 HydrophobicContact CE1-CD1 3.29Å; F210-L214 HydrophobicContact CE1-CG 4.1Å; F210-L214 HydrophobicContact CZ-CD1 3.89Å; F210-L214 HydrophobicContact CZ-CG 4.32Å; F210-L214 WeakPolarHBondContact O-CG 3.41Å; F210-L214 PolarHBondContact O-N 2.67Å; F210-F280 HydrophobicContact CD2-CE1 4.43Å; F210-F280 AromaticContact CD2-CZ 3.91Å; F210-F280 HydrophobicContact CD2-CZ 3.91Å; F210-P329 HydrophobicContact CE2-CB 4Å; F210-P329 HydrophobicContact CE2-CG 3.93Å; F210-P329 HydrophobicContact CZ-CG 4.23Å; F210-F331 AromaticContact CD1-CD2 3.67Å; F210-F331 HydrophobicContact CD1-CD2 3.67Å; F210-F331 HydrophobicContact CD1-CE2 4.29Å; F210-F331 HydrophobicContact CD2-CD2 4.25Å; F210-F331 HydrophobicContact CE1-CB 3.93Å; F210-F331 AromaticContact CE1-CD2 3.59Å; F210-F331 HydrophobicContact CE1-CD2 3.59Å; F210-F331 HydrophobicContact CE1-CG 4.18Å; F210-F331 HydrophobicContact CE2-CB 4.13Å; F210-F331 HydrophobicContact CE2-CD2 4.2Å; F210-F331 HydrophobicContact CG-CD2 4.01Å; F210-F331 HydrophobicContact CZ-CB 3.57Å; F210-F331 AromaticContact CZ-CD2 3.9Å; F210-F331 HydrophobicContact CZ-CD2 3.9Å; F210-F331 HydrophobicContact CZ-CG 4.23Å; F210-Y334 HydrophobicContact CB-CD1 3.9Å; F210-Y334 HydrophobicContact CB-CE1 3.81Å; F210-Y334 AromaticContact CD2-CD1 3.78Å; F210-Y334 HydrophobicContact CD2-CD1 3.78Å; F210-Y334 HydrophobicContact CD2-CE1 4.5Å; F210-Y334 AromaticContact CD2-CG 3.96Å; F210-Y334 HydrophobicContact CD2-CG 3.96Å; F210-Y334 HydrophobicContact CG-CD1 4.09Å; F210-Y334 HydrophobicContact CG-CE1 4.5Å
211	W	93.2	Very high	91.6	Very high	145 Å²	145	50.2 Å²	50.2	55%	0.549	26%	0.255	S	S	.	.	H	α-helix	trans	-64.8	-36	176	-79.4	95.9	0	0	0	112	F207 V213 L214 L215	F207-W211 AromaticContact CD1-NE1 3.95Å; F207-W211 WeakPolarHBondContact O-CB 3.46Å; F207-W211 VanDerWaalsContact O-CD1 3.23Å; F207-W211 PolarHBondContact O-N 2.99Å; W211-V213 PolarHBondContact O-N 2.83Å; W211-L214 HydrophobicContact CD2-CD1 4.49Å; W211-L214 HydrophobicContact CE3-CD1 4.38Å; W211-L214 PolarHBondContact O-N 3.41Å; W211-L215 WeakPolarHBondContact O-CB 3.18Å; W211-L215 VanDerWaalsContact O-CG 3.24Å; W211-L215 WeakPolarHBondContact O-CG 3.27Å; W211-L215 PolarHBondContact O-N 2.84Å
212	G	93.2	Very high	90.6	Very high	26 Å²	26	59 Å²	59	27%	0.268	29%	0.293	S	S	.	.	H	α-helix	trans	-59.4	-43.8	174.6	0	0	0	0	0	112.7	I208 F210 W216	I208-G212 WeakPolarHBondContact O-CA 3.25Å; I208-G212 PolarHBondContact O-N 2.62Å; F210-G212 VanDerWaalsContact C-N 3.32Å; F210-G212 PolarHBondContact O-N 2.88Å; G212-W216 WeakPolarHBondContact O-CB 3.28Å; G212-W216 PolarHBondContact O-N 3.5Å
213	V	92	Very high	89.2	Confident	5 Å²	5	63 Å²	63	3%	0.03	31%	0.314	C	S	.	.	H	α-helix	trans	-67.8	-42.4	175	169.2	0	0	0	0	111.5	P209 F210 W211 W216 M217 F280 V281 A284 F328	P209-V213 WeakPolarHBondContact O-CG2 3.35Å; P209-V213 PolarHBondContact O-N 3.21Å; P209-V213 VanDerWaalsContact O-N 3.08Å; F210-V213 PolarHBondContact O-N 2.83Å; W211-V213 PolarHBondContact O-N 2.83Å; V213-W216 WeakPolarHBondContact O-CB 3.45Å; V213-W216 PolarHBondContact O-N 3.34Å; V213-M217 HydrophobicContact CG1-CE 3.73Å; V213-M217 HydrophobicContact CG1-SD 4.35Å; V213-M217 WeakPolarHBondContact O-CE 3.41Å; V213-M217 PolarHBondContact O-N 3.42Å; V213-F280 HydrophobicContact CB-CE1 4.03Å; V213-F280 HydrophobicContact CG1-CE1 4.44Å; V213-F280 HydrophobicContact CG2-CD1 4.3Å; V213-F280 HydrophobicContact CG2-CE1 3.75Å; V213-V281 HydrophobicContact CG2-CG2 4.14Å; V213-A284 HydrophobicContact CG1-CB 3.65Å; V213-A284 HydrophobicContact CG2-CB 3.99Å; V213-F328 HydrophobicContact CG1-CE1 4.13Å; V213-F328 HydrophobicContact CG1-CZ 4.42Å
214	L	91.4	Very high	87.9	Confident	51 Å²	51	60.5 Å²	60.5	27%	0.267	31%	0.31	S	S	.	.	H	α-helix	trans	-57.9	-49.4	175.7	-77.6	176.1	0	0	0	112.3	F210 W211 W216 M217 A218 P329	F210-L214 HydrophobicContact CD1-CD1 3.75Å; F210-L214 HydrophobicContact CD1-CG 4.43Å; F210-L214 HydrophobicContact CE1-CD1 3.29Å; F210-L214 HydrophobicContact CE1-CG 4.1Å; F210-L214 HydrophobicContact CZ-CD1 3.89Å; F210-L214 HydrophobicContact CZ-CG 4.32Å; F210-L214 WeakPolarHBondContact O-CG 3.41Å; F210-L214 PolarHBondContact O-N 2.67Å; W211-L214 HydrophobicContact CD2-CD1 4.49Å; W211-L214 HydrophobicContact CE3-CD1 4.38Å; W211-L214 PolarHBondContact O-N 3.41Å; L214-W216 VanDerWaalsContact C-N 3.3Å; L214-W216 PolarHBondContact O-N 3.46Å; L214-M217 HydrophobicContact CD2-CE 4.25Å; L214-M217 PolarHBondContact O-N 3.22Å; L214-A218 WeakPolarHBondContact O-CB 3.38Å; L214-A218 PolarHBondContact O-N 3.39Å; L214-P329 HydrophobicContact CD2-CG 3.39Å; L214-P329 HydrophobicContact CG-CG 3.95Å
215	L	91.3	Very high	86.5	Confident	74 Å²	74	64.3 Å²	64.3	39%	0.387	32%	0.323	S	S	.	.	H	α-helix	trans	-62.3	-40.6	177	-68.8	169.1	0	0	0	110.8	W211 M217 A218 Y219 F234	W211-L215 WeakPolarHBondContact O-CB 3.18Å; W211-L215 VanDerWaalsContact O-CG 3.24Å; W211-L215 WeakPolarHBondContact O-CG 3.27Å; W211-L215 PolarHBondContact O-N 2.84Å; L215-M217 PolarHBondContact O-N 3.32Å; L215-A218 PolarHBondContact O-N 3.4Å; L215-Y219 HydrophobicContact CB-CD2 4.37Å; L215-Y219 HydrophobicContact CD2-CD2 4.47Å; L215-Y219 HydrophobicContact CD2-CE2 3.86Å; L215-Y219 WeakPolarHBondContact O-CD2 3.49Å; L215-Y219 PolarHBondContact O-N 2.93Å; L215-F234 HydrophobicContact CB-CE1 3.79Å; L215-F234 HydrophobicContact CB-CZ 3.95Å
216	W	90.2	Very high	85.6	Confident	16 Å²	16	71.9 Å²	71.9	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-58	-48.9	176.3	-179.3	28.6	0	0	0	111.6	G212 V213 L214 A218 Y219 R220 D231 F234 I285 I288 F289	G212-W216 WeakPolarHBondContact O-CB 3.28Å; G212-W216 PolarHBondContact O-N 3.5Å; V213-W216 WeakPolarHBondContact O-CB 3.45Å; V213-W216 PolarHBondContact O-N 3.34Å; L214-W216 VanDerWaalsContact C-N 3.3Å; L214-W216 PolarHBondContact O-N 3.46Å; W216-A218 PolarHBondContact O-N 2.62Å; W216-Y219 PolarHBondContact O-N 2.88Å; W216-R220 WeakPolarHBondContact O-CB 3.16Å; W216-R220 PolarHBondContact O-N 2.88Å; W216-D231 HydrophobicContact CZ2-CB 4.4Å; W216-D231 PolarHBondContact NE1-OD1 3.32Å; W216-F234 HydrophobicContact CB-CB 4.18Å; W216-F234 HydrophobicContact CB-CD1 3.73Å; W216-F234 HydrophobicContact CB-CD2 3.76Å; W216-F234 HydrophobicContact CB-CE1 4Å; W216-F234 HydrophobicContact CB-CE2 4.05Å; W216-F234 HydrophobicContact CB-CG 3.61Å; W216-F234 HydrophobicContact CB-CZ 4.16Å; W216-F234 AromaticContact CD1-CD2 3.34Å; W216-F234 AromaticContact CD1-CE2 3.99Å; W216-F234 AromaticContact CD1-CG 3.8Å; W216-F234 HydrophobicContact CD2-CB 4.48Å; W216-F234 HydrophobicContact CG-CB 3.96Å; W216-F234 HydrophobicContact CG-CD1 4.39Å; W216-F234 AromaticContact CG-CD2 3.75Å; W216-F234 HydrophobicContact CG-CD2 3.75Å; W216-F234 HydrophobicContact CG-CE2 4.38Å; W216-F234 AromaticContact CG-CG 3.77Å; W216-F234 HydrophobicContact CG-CG 3.77Å; W216-I285 HydrophobicContact CH2-CB 4.16Å; W216-I285 HydrophobicContact CH2-CG1 3.58Å; W216-I285 HydrophobicContact CZ3-CB 4.34Å; W216-I285 HydrophobicContact CZ3-CG1 3.56Å; W216-I288 HydrophobicContact CD2-CD1 4.05Å; W216-I288 HydrophobicContact CE3-CD1 3.53Å; W216-I288 HydrophobicContact CH2-CB 4.5Å; W216-I288 HydrophobicContact CH2-CD1 3.63Å; W216-I288 HydrophobicContact CZ2-CD1 4.14Å; W216-I288 HydrophobicContact CZ2-CG2 4.44Å; W216-I288 HydrophobicContact CZ3-CD1 3.31Å; W216-F289 HydrophobicContact CH2-CE2 4.26Å; W216-F289 HydrophobicContact CZ2-CE2 4.26Å
217	M	86.2	Confident	85	Confident	52 Å²	52	76.3 Å²	76.3	26%	0.256	38%	0.379	S	S	.	.	H	α-helix	trans	-66.5	-36	178.4	-68.3	-180	-60.8	0	0	113.2	V213 L214 L215 I288 F328 P329	V213-M217 HydrophobicContact CG1-CE 3.73Å; V213-M217 HydrophobicContact CG1-SD 4.35Å; V213-M217 WeakPolarHBondContact O-CE 3.41Å; V213-M217 PolarHBondContact O-N 3.42Å; L214-M217 HydrophobicContact CD2-CE 4.25Å; L214-M217 PolarHBondContact O-N 3.22Å; L215-M217 PolarHBondContact O-N 3.32Å; M217-I288 HydrophobicContact CG-CD1 3.59Å; M217-I288 HydrophobicContact CG-CG1 4.06Å; M217-I288 HydrophobicContact SD-CD1 4.11Å; M217-I288 HydrophobicContact SD-CG1 4.26Å; M217-F328 HydrophobicContact CE-CD1 3.93Å; M217-F328 HydrophobicContact CE-CE1 3.95Å; M217-F328 HydrophobicContact SD-CD1 3.33Å; M217-F328 WeakPolarHBondContact SD-CD1 3.28Å; M217-F328 HydrophobicContact SD-CE1 3.47Å; M217-F328 WeakPolarHBondContact SD-CE1 3.48Å; M217-P329 HydrophobicContact CE-CG 3.63Å
218	A	86.6	Confident	84.5	Confident	79 Å²	79	72.3 Å²	72.3	65%	0.653	36%	0.363	S	S	*	.	H	α-helix	trans	-67.7	-38	179	0	0	0	0	0	112.9	L214 L215 W216	L214-A218 WeakPolarHBondContact O-CB 3.38Å; L214-A218 PolarHBondContact O-N 3.39Å; L215-A218 PolarHBondContact O-N 3.4Å; W216-A218 PolarHBondContact O-N 2.62Å
219	Y	86.7	Confident	84.1	Confident	164 Å²	164	73 Å²	73	64%	0.643	38%	0.375	S	S	*	.	H	α-helix	trans	-96.6	-8.5	-177.5	-70	-68.5	0	0	0	114.2	L215 W216 P221 F234	L215-Y219 HydrophobicContact CB-CD2 4.37Å; L215-Y219 HydrophobicContact CD2-CD2 4.47Å; L215-Y219 HydrophobicContact CD2-CE2 3.86Å; L215-Y219 WeakPolarHBondContact O-CD2 3.49Å; L215-Y219 PolarHBondContact O-N 2.93Å; W216-Y219 PolarHBondContact O-N 2.88Å; Y219-P221 WeakPolarHBondContact O-CD 3.39Å; Y219-F234 HydrophobicContact CD2-CZ 4.45Å
220	R	84.2	Confident	83.8	Confident	36 Å²	36	74.6 Å²	74.6	14%	0.136	39%	0.385	C	S	.	.			trans	-69.9	121.4	-179.7	-175.3	174.3	-166.8	-88.1	-8.3	110	W216 G224 K226 D231	W216-R220 WeakPolarHBondContact O-CB 3.16Å; W216-R220 PolarHBondContact O-N 2.88Å; R220-G224 PolarHBondContact NH1-O 3.36Å; R220-G224 PolarHBondContact NH2-O 3.05Å; R220-K226 PolarHBondContact NH2-O 3.18Å; R220-D231 WeakPolarHBondContact CD-OD1 3.37Å; R220-D231 IonicContact CZ-OD2 3.11Å; R220-D231 IonicContact NE-OD1 3.35Å; R220-D231 PolarHBondContact NE-OD1 2.96Å; R220-D231 IonicContact NE-OD2 3.97Å; R220-D231 PolarHBondContact NE-OD2 3.47Å; R220-D231 IonicContact NH2-OD2 2.64Å; R220-D231 PolarHBondContact NH2-OD2 2.93Å
221	P	78.8	Confident	83.6	Confident	52 Å²	52	74.6 Å²	74.6	34%	0.338	39%	0.385	S	S	.	.			trans	-68.7	143.6	175.7	30.3	-34.4	0	0	0	110.1	Y219 I223 C228 T230	Y219-P221 WeakPolarHBondContact O-CD 3.39Å; P221-I223 HydrophobicContact CB-CD1 3.76Å; P221-I223 HydrophobicContact CB-CG1 3.91Å; P221-I223 HydrophobicContact CG-CD1 3.66Å; P221-I223 HydrophobicContact CG-CG1 4.14Å; P221-I223 PolarHBondContact O-N 3.18Å; P221-C228 HydrophobicContact CG-CB 4.17Å; P221-T230 WeakPolarHBondContact CD-OG1 3.33Å
222	K	73.2	Confident	83.5	Confident	193 Å²	193	74.7 Å²	74.7	84%	0.839	39%	0.386	S	S	*	.			trans	-72	52.4	-177.7	-62.8	-170.5	177.1	-167.9	0	113.5	G224	K222-G224 PolarHBondContact O-N 3.2Å
223	I	65.6	Low	83.5	Confident	98 Å²	98	77.7 Å²	77.7	50%	0.503	40%	0.398	S	S	.	.			trans	-91.1	29.5	-173.4	-55.6	174	0	0	0	111.2	P221 K226	P221-I223 HydrophobicContact CB-CD1 3.76Å; P221-I223 HydrophobicContact CB-CG1 3.91Å; P221-I223 HydrophobicContact CG-CD1 3.66Å; P221-I223 HydrophobicContact CG-CG1 4.14Å; P221-I223 PolarHBondContact O-N 3.18Å; I223-K226 HydrophobicContact CG2-CB 4.43Å
224	G	68.2	Low	83.5	Confident	34 Å²	34	79.7 Å²	79.7	35%	0.351	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-138.9	-176.5	0	0	0	0	0	112.9	R220 K222 K226	R220-G224 PolarHBondContact NH1-O 3.36Å; R220-G224 PolarHBondContact NH2-O 3.05Å; K222-G224 PolarHBondContact O-N 3.2Å; G224-K226 VanDerWaalsContact C-N 3.32Å; G224-K226 PolarHBondContact O-N 3.48Å
225	K	66.8	Low	83.6	Confident	111 Å²	111	82 Å²	82	48%	0.483	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-11.9	-174.4	-65.8	177.7	-176.2	173.1	0	115.4	I227	K225-I227 PolarHBondContact O-N 3.47Å
226	K	76.5	Confident	83.7	Confident	158 Å²	158	82.8 Å²	82.8	69%	0.687	42%	0.418	S	S	*	.	S	Bend	trans	-71.5	135.5	-175.4	-72	-173.7	179	179.6	0	109.8	R220 I223 G224 C228	R220-K226 PolarHBondContact NH2-O 3.18Å; I223-K226 HydrophobicContact CG2-CB 4.43Å; G224-K226 VanDerWaalsContact C-N 3.32Å; G224-K226 PolarHBondContact O-N 3.48Å; K226-C228 PolarHBondContact O-N 2.99Å; K226-C228 PolarHBondContact O-SG 3.22Å
227	I	82.7	Confident	84	Confident	111 Å²	111	84.4 Å²	84.4	57%	0.569	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-64.8	122.4	173.6	-59.2	172.1	0	0	0	107.5	K225 D231 F289	K225-I227 PolarHBondContact O-N 3.47Å; I227-D231 HydrophobicContact CG2-CB 4.04Å; I227-F289 HydrophobicContact CG1-CE1 4.24Å; I227-F289 HydrophobicContact CG1-CZ 4.3Å
228	C	84.1	Confident	84.4	Confident	13 Å²	13	83.3 Å²	83.3	9%	0.088	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-95.1	161.6	179.2	-65.7	0	0	0	0	110.8	P221 K226 T230 D231	P221-C228 HydrophobicContact CG-CB 4.17Å; K226-C228 PolarHBondContact O-N 2.99Å; K226-C228 PolarHBondContact O-SG 3.22Å; C228-T230 WeakPolarHBondContact CB-OG1 3.46Å; C228-T230 PolarHBondContact O-N 3.49Å; C228-D231 PolarHBondContact N-OD2 3.47Å; C228-D231 WeakPolarHBondContact O-CB 3.41Å; C228-D231 PolarHBondContact O-N 3.37Å
229	S	87.1	Confident	84.8	Confident	97 Å²	97	83.2 Å²	83.2	68%	0.678	42%	0.416	S	S	*	.	H	α-helix	trans	-57.2	-36.8	174	-175.9	0	0	0	0	111.9	D231 W232 V233	S229-D231 VanDerWaalsContact C-N 3.28Å; S229-D231 PolarHBondContact O-N 3.46Å; S229-W232 PolarHBondContact O-N 3.24Å; S229-V233 PolarHBondContact O-N 2.99Å; S229-V233 VanDerWaalsContact O-N 3.13Å
230	T	87.3	Confident	85.3	Confident	39 Å²	39	80.1 Å²	80.1	24%	0.239	41%	0.41	C	S	.	.	H	α-helix	trans	-57.6	-38.6	174.1	51.3	0	0	0	0	112.6	P221 C228 W232 V233 F234	P221-T230 WeakPolarHBondContact CD-OG1 3.33Å; C228-T230 WeakPolarHBondContact CB-OG1 3.46Å; C228-T230 PolarHBondContact O-N 3.49Å; T230-W232 VanDerWaalsContact C-N 3.31Å; T230-W232 PolarHBondContact O-N 2.96Å; T230-V233 PolarHBondContact O-N 3.29Å; T230-F234 VanDerWaalsContact O-CD2 3.28Å; T230-F234 WeakPolarHBondContact O-CD2 3.47Å; T230-F234 PolarHBondContact O-N 2.94Å
231	D	90.2	Very high	85.9	Confident	12 Å²	12	79.6 Å²	79.6	6%	0.064	41%	0.408	C	S	.	.	H	α-helix	trans	-62.9	-39.8	179.8	-58.5	-24	0	0	0	110.7	W216 R220 I227 C228 S229 F235	W216-D231 HydrophobicContact CZ2-CB 4.4Å; W216-D231 PolarHBondContact NE1-OD1 3.32Å; R220-D231 WeakPolarHBondContact CD-OD1 3.37Å; R220-D231 IonicContact CZ-OD2 3.11Å; R220-D231 IonicContact NE-OD1 3.35Å; R220-D231 PolarHBondContact NE-OD1 2.96Å; R220-D231 IonicContact NE-OD2 3.97Å; R220-D231 PolarHBondContact NE-OD2 3.47Å; R220-D231 IonicContact NH2-OD2 2.64Å; R220-D231 PolarHBondContact NH2-OD2 2.93Å; I227-D231 HydrophobicContact CG2-CB 4.04Å; C228-D231 PolarHBondContact N-OD2 3.47Å; C228-D231 WeakPolarHBondContact O-CB 3.41Å; C228-D231 PolarHBondContact O-N 3.37Å; S229-D231 VanDerWaalsContact C-N 3.28Å; S229-D231 PolarHBondContact O-N 3.46Å; D231-F235 VanDerWaalsContact O-CB 3.26Å; D231-F235 WeakPolarHBondContact O-CB 3.48Å; D231-F235 PolarHBondContact O-N 2.99Å
232	W	90.9	Very high	86.7	Confident	148 Å²	148	78.3 Å²	78.3	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-66.7	-39.4	174.4	-77.4	107.2	0	0	0	112.9	S229 T230 F235 I236	S229-W232 PolarHBondContact O-N 3.24Å; T230-W232 VanDerWaalsContact C-N 3.31Å; T230-W232 PolarHBondContact O-N 2.96Å; W232-F235 HydrophobicContact CE3-CD1 4.04Å; W232-F235 HydrophobicContact CZ3-CD1 4.03Å; W232-F235 HydrophobicContact CZ3-CE1 4.25Å; W232-F235 PolarHBondContact O-N 2.91Å; W232-I236 WeakPolarHBondContact O-CB 3.49Å; W232-I236 VanDerWaalsContact O-CG1 3.26Å; W232-I236 WeakPolarHBondContact O-CG1 3.47Å; W232-I236 PolarHBondContact O-N 3.46Å
233	V	93	Very high	87.7	Confident	88 Å²	88	72.9 Å²	72.9	53%	0.533	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-49.8	177.2	174	0	0	0	0	110.8	S229 T230 F235 I236 A237	S229-V233 PolarHBondContact O-N 2.99Å; S229-V233 VanDerWaalsContact O-N 3.13Å; T230-V233 PolarHBondContact O-N 3.29Å; V233-F235 VanDerWaalsContact C-N 3.35Å; V233-F235 PolarHBondContact O-N 2.91Å; V233-I236 PolarHBondContact O-N 2.98Å; V233-A237 VanDerWaalsContact O-CB 3.31Å; V233-A237 WeakPolarHBondContact O-CB 3.42Å; V233-A237 PolarHBondContact O-N 3.37Å
234	F	92.5	Very high	89.1	Confident	48 Å²	48	71.9 Å²	71.9	21%	0.211	38%	0.379	C	S	.	.	H	α-helix	trans	-67.6	-35	178.5	-78.5	-77.8	0	0	0	112.6	L215 W216 Y219 T230 Y238	L215-F234 HydrophobicContact CB-CE1 3.79Å; L215-F234 HydrophobicContact CB-CZ 3.95Å; W216-F234 HydrophobicContact CB-CB 4.18Å; W216-F234 HydrophobicContact CB-CD1 3.73Å; W216-F234 HydrophobicContact CB-CD2 3.76Å; W216-F234 HydrophobicContact CB-CE1 4Å; W216-F234 HydrophobicContact CB-CE2 4.05Å; W216-F234 HydrophobicContact CB-CG 3.61Å; W216-F234 HydrophobicContact CB-CZ 4.16Å; W216-F234 AromaticContact CD1-CD2 3.34Å; W216-F234 AromaticContact CD1-CE2 3.99Å; W216-F234 AromaticContact CD1-CG 3.8Å; W216-F234 HydrophobicContact CD2-CB 4.48Å; W216-F234 HydrophobicContact CG-CB 3.96Å; W216-F234 HydrophobicContact CG-CD1 4.39Å; W216-F234 AromaticContact CG-CD2 3.75Å; W216-F234 HydrophobicContact CG-CD2 3.75Å; W216-F234 HydrophobicContact CG-CE2 4.38Å; W216-F234 AromaticContact CG-CG 3.77Å; W216-F234 HydrophobicContact CG-CG 3.77Å; Y219-F234 HydrophobicContact CD2-CZ 4.45Å; T230-F234 VanDerWaalsContact O-CD2 3.28Å; T230-F234 WeakPolarHBondContact O-CD2 3.47Å; T230-F234 PolarHBondContact O-N 2.94Å; F234-Y238 WeakPolarHBondContact O-CB 3.37Å; F234-Y238 PolarHBondContact O-N 2.97Å
235	F	92.6	Very high	90.4	Very high	98 Å²	98	70.8 Å²	70.8	43%	0.43	37%	0.365	S	S	.	.	H	α-helix	trans	-62.8	-49.9	173.8	179.5	-109.3	0	0	0	111.9	D231 W232 V233 A237 Y238 I239	D231-F235 VanDerWaalsContact O-CB 3.26Å; D231-F235 WeakPolarHBondContact O-CB 3.48Å; D231-F235 PolarHBondContact O-N 2.99Å; W232-F235 HydrophobicContact CE3-CD1 4.04Å; W232-F235 HydrophobicContact CZ3-CD1 4.03Å; W232-F235 HydrophobicContact CZ3-CE1 4.25Å; W232-F235 PolarHBondContact O-N 2.91Å; V233-F235 VanDerWaalsContact C-N 3.35Å; V233-F235 PolarHBondContact O-N 2.91Å; F235-A237 PolarHBondContact O-N 3.43Å; F235-Y238 WeakPolarHBondContact O-CB 3.21Å; F235-Y238 PolarHBondContact O-N 3.46Å; F235-I239 HydrophobicContact CE1-CG1 4.23Å; F235-I239 HydrophobicContact CE2-CD1 4.27Å; F235-I239 HydrophobicContact CE2-CG1 4.33Å; F235-I239 HydrophobicContact CZ-CD1 4.18Å; F235-I239 HydrophobicContact CZ-CG1 4.09Å; F235-I239 WeakPolarHBondContact O-CG1 3.42Å; F235-I239 PolarHBondContact O-N 3.06Å
236	I	95	Very high	91.6	Very high	91 Å²	91	68.3 Å²	68.3	47%	0.467	35%	0.354	S	S	.	.	H	α-helix	trans	-62.3	-43.6	177.7	-68.3	166.3	0	0	0	110.5	W232 V233 Y238 I239 I240	W232-I236 WeakPolarHBondContact O-CB 3.49Å; W232-I236 VanDerWaalsContact O-CG1 3.26Å; W232-I236 WeakPolarHBondContact O-CG1 3.47Å; W232-I236 PolarHBondContact O-N 3.46Å; V233-I236 PolarHBondContact O-N 2.98Å; I236-Y238 VanDerWaalsContact C-N 3.29Å; I236-Y238 PolarHBondContact O-N 3.21Å; I236-I239 PolarHBondContact O-N 3.42Å; I236-I240 HydrophobicContact CG2-CD1 3.82Å; I236-I240 HydrophobicContact CG2-CG1 4.38Å; I236-I240 WeakPolarHBondContact O-CG1 3.34Å; I236-I240 PolarHBondContact O-N 3.44Å
237	A	95	Very high	92.4	Very high	51 Å²	51	65.2 Å²	65.2	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-59	-40.7	176.2	0	0	0	0	0	112.1	V233 F235 I240 Y241	V233-A237 VanDerWaalsContact O-CB 3.31Å; V233-A237 WeakPolarHBondContact O-CB 3.42Å; V233-A237 PolarHBondContact O-N 3.37Å; F235-A237 PolarHBondContact O-N 3.43Å; A237-I240 PolarHBondContact O-N 3.22Å; A237-Y241 WeakPolarHBondContact O-CB 3.39Å; A237-Y241 PolarHBondContact O-N 3.3Å
238	Y	95.6	Very high	92.8	Very high	29 Å²	29	62.7 Å²	62.7	11%	0.114	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-41.1	175.2	171.1	-103.2	0	0	0	112.8	F234 F235 I236 Y241 Q242 H278 V281	F234-Y238 WeakPolarHBondContact O-CB 3.37Å; F234-Y238 PolarHBondContact O-N 2.97Å; F235-Y238 WeakPolarHBondContact O-CB 3.21Å; F235-Y238 PolarHBondContact O-N 3.46Å; I236-Y238 VanDerWaalsContact C-N 3.29Å; I236-Y238 PolarHBondContact O-N 3.21Å; Y238-Y241 HydrophobicContact CD2-CD1 4.41Å; Y238-Y241 WeakPolarHBondContact O-CB 3.2Å; Y238-Y241 PolarHBondContact O-N 3.35Å; Y238-Q242 HydrophobicContact CD2-CG 4.49Å; Y238-Q242 HydrophobicContact CE1-CG 4.09Å; Y238-Q242 HydrophobicContact CE2-CG 3.96Å; Y238-Q242 VanDerWaalsContact CZ-NE2 3.29Å; Y238-Q242 WeakPolarHBondContact O-CG 3.29Å; Y238-Q242 PolarHBondContact O-N 2.89Å; Y238-Q242 PolarHBondContact OH-NE2 2.94Å; Y238-H278 WeakPolarHBondContact OH-CA 3.36Å; Y238-H278 WeakPolarHBondContact OH-CB 3.28Å; Y238-H278 PolarHBondContact OH-N 3.01Å; Y238-H278 PolarHBondContact OH-ND1 3.05Å; Y238-V281 HydrophobicContact CD1-CG1 4.45Å; Y238-V281 HydrophobicContact CD2-CG1 4.34Å; Y238-V281 HydrophobicContact CD2-CG2 3.91Å; Y238-V281 HydrophobicContact CE1-CG1 4.47Å; Y238-V281 HydrophobicContact CE2-CB 4.13Å; Y238-V281 HydrophobicContact CE2-CG1 4.36Å; Y238-V281 HydrophobicContact CE2-CG2 3.65Å; Y238-V281 HydrophobicContact CG-CG1 4.37Å
239	I	95.6	Very high	93	Very high	76 Å²	76	62.2 Å²	62.2	39%	0.39	33%	0.33	S	S	.	.	H	α-helix	trans	-62.9	-45.3	174.9	-64.8	-57.9	0	0	0	110.8	F235 I236 Y241 Q242 V243	F235-I239 HydrophobicContact CE1-CG1 4.23Å; F235-I239 HydrophobicContact CE2-CD1 4.27Å; F235-I239 HydrophobicContact CE2-CG1 4.33Å; F235-I239 HydrophobicContact CZ-CD1 4.18Å; F235-I239 HydrophobicContact CZ-CG1 4.09Å; F235-I239 WeakPolarHBondContact O-CG1 3.42Å; F235-I239 PolarHBondContact O-N 3.06Å; I236-I239 PolarHBondContact O-N 3.42Å; I239-Y241 VanDerWaalsContact C-N 3.31Å; I239-Y241 PolarHBondContact O-N 2.93Å; I239-Q242 PolarHBondContact O-N 3.23Å; I239-V243 HydrophobicContact CG2-CG2 4.5Å; I239-V243 WeakPolarHBondContact O-CG2 3.29Å; I239-V243 PolarHBondContact O-N 3.35Å
240	I	96.3	Very high	93.1	Very high	99 Å²	99	60.8 Å²	60.8	51%	0.508	31%	0.311	S	S	.	.	H	α-helix	trans	-58.4	-45.8	175.3	-67.7	167.7	0	0	0	110.1	I236 A237 Q242 V243 V244	I236-I240 HydrophobicContact CG2-CD1 3.82Å; I236-I240 HydrophobicContact CG2-CG1 4.38Å; I236-I240 WeakPolarHBondContact O-CG1 3.34Å; I236-I240 PolarHBondContact O-N 3.44Å; A237-I240 PolarHBondContact O-N 3.22Å; I240-Q242 PolarHBondContact O-N 3.25Å; I240-V243 PolarHBondContact O-N 3.46Å; I240-V244 HydrophobicContact CG2-CG2 4.16Å; I240-V244 WeakPolarHBondContact O-CB 3.33Å; I240-V244 VanDerWaalsContact O-CG2 3.28Å; I240-V244 WeakPolarHBondContact O-CG2 3.31Å; I240-V244 PolarHBondContact O-N 3.39Å
241	Y	96.2	Very high	93.3	Very high	25 Å²	25	67.5 Å²	67.5	10%	0.098	33%	0.332	C	S	.	.	H	α-helix	trans	-55.9	-47.3	175.6	166.3	-104.6	0	0	0	112.2	S204 I208 P209 A237 Y238 I239 V243 V244 F245	S204-Y241 PolarHBondContact O-OH 3.04Å; S204-Y241 WeakPolarHBondContact OG-CE2 3.43Å; S204-Y241 PolarHBondContact OG-OH 2.81Å; I208-Y241 HydrophobicContact CB-CD2 4.19Å; I208-Y241 HydrophobicContact CB-CE2 3.79Å; I208-Y241 HydrophobicContact CD1-CD2 4.1Å; I208-Y241 HydrophobicContact CD1-CE2 3.7Å; I208-Y241 HydrophobicContact CG1-CE2 4.31Å; I208-Y241 HydrophobicContact CG2-CD2 3.55Å; I208-Y241 HydrophobicContact CG2-CE2 3.69Å; I208-Y241 HydrophobicContact CG2-CG 4.02Å; P209-Y241 HydrophobicContact CG-CE1 3.86Å; A237-Y241 WeakPolarHBondContact O-CB 3.39Å; A237-Y241 PolarHBondContact O-N 3.3Å; Y238-Y241 HydrophobicContact CD2-CD1 4.41Å; Y238-Y241 WeakPolarHBondContact O-CB 3.2Å; Y238-Y241 PolarHBondContact O-N 3.35Å; I239-Y241 VanDerWaalsContact C-N 3.31Å; I239-Y241 PolarHBondContact O-N 2.93Å; Y241-V243 PolarHBondContact O-N 2.86Å; Y241-V244 PolarHBondContact O-N 2.84Å; Y241-F245 HydrophobicContact CE2-CD2 4.42Å; Y241-F245 VanDerWaalsContact O-CB 3.23Å; Y241-F245 WeakPolarHBondContact O-CB 3.28Å; Y241-F245 PolarHBondContact O-N 2.75Å
242	Q	95.4	Very high	93.4	Very high	25 Å²	25	71.4 Å²	71.4	12%	0.117	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-42	179.2	-71.3	-67.4	7.3	0	0	112.5	Y238 I239 I240 F245 F246 S277	Y238-Q242 HydrophobicContact CD2-CG 4.49Å; Y238-Q242 HydrophobicContact CE1-CG 4.09Å; Y238-Q242 HydrophobicContact CE2-CG 3.96Å; Y238-Q242 VanDerWaalsContact CZ-NE2 3.29Å; Y238-Q242 WeakPolarHBondContact O-CG 3.29Å; Y238-Q242 PolarHBondContact O-N 2.89Å; Y238-Q242 PolarHBondContact OH-NE2 2.94Å; I239-Q242 PolarHBondContact O-N 3.23Å; I240-Q242 PolarHBondContact O-N 3.25Å; Q242-F245 PolarHBondContact O-N 2.85Å; Q242-F246 WeakPolarHBondContact O-CB 3.46Å; Q242-F246 PolarHBondContact O-N 2.84Å; Q242-S277 PolarHBondContact NE2-OG 2.93Å
243	V	95.2	Very high	93.2	Very high	80 Å²	80	64.4 Å²	64.4	49%	0.485	32%	0.323	S	S	.	.	H	α-helix	trans	-64.6	-46.3	177.2	173.6	0	0	0	0	110.6	I239 I240 Y241 F246 M247	I239-V243 HydrophobicContact CG2-CG2 4.5Å; I239-V243 WeakPolarHBondContact O-CG2 3.29Å; I239-V243 PolarHBondContact O-N 3.35Å; I240-V243 PolarHBondContact O-N 3.46Å; Y241-V243 PolarHBondContact O-N 2.86Å; V243-F246 PolarHBondContact O-N 3.02Å; V243-M247 HydrophobicContact CG1-CG 4.41Å; V243-M247 WeakPolarHBondContact O-CB 3.06Å; V243-M247 VanDerWaalsContact O-CG 3.28Å; V243-M247 WeakPolarHBondContact O-CG 3.27Å; V243-M247 PolarHBondContact O-N 3.33Å
244	V	94.8	Very high	93	Very high	77 Å²	77	64.1 Å²	64.1	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-47.6	177.2	171.8	0	0	0	0	110.5	I240 Y241 F246 M247 T248	I240-V244 HydrophobicContact CG2-CG2 4.16Å; I240-V244 WeakPolarHBondContact O-CB 3.33Å; I240-V244 VanDerWaalsContact O-CG2 3.28Å; I240-V244 WeakPolarHBondContact O-CG2 3.31Å; I240-V244 PolarHBondContact O-N 3.39Å; Y241-V244 PolarHBondContact O-N 2.84Å; V244-F246 VanDerWaalsContact C-N 3.29Å; V244-F246 PolarHBondContact O-N 3.45Å; V244-M247 PolarHBondContact O-N 3.29Å; V244-T248 VanDerWaalsContact O-CB 3.25Å; V244-T248 WeakPolarHBondContact O-CB 3.44Å; V244-T248 PolarHBondContact O-N 2.95Å; V244-T248 PolarHBondContact O-OG1 3.36Å
245	F	95.4	Very high	93	Very high	11 Å²	11	68 Å²	68	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-56.3	-44.4	177	-175.7	-88.7	0	0	0	111.6	M201 Y241 Q242 S249 Q270 L273 I274	M201-F245 HydrophobicContact CB-CE2 3.95Å; M201-F245 HydrophobicContact CB-CZ 3.83Å; M201-F245 HydrophobicContact CG-CE2 4.17Å; M201-F245 HydrophobicContact CG-CZ 3.99Å; M201-F245 HydrophobicContact SD-CZ 4.25Å; Y241-F245 HydrophobicContact CE2-CD2 4.42Å; Y241-F245 VanDerWaalsContact O-CB 3.23Å; Y241-F245 WeakPolarHBondContact O-CB 3.28Å; Y241-F245 PolarHBondContact O-N 2.75Å; Q242-F245 PolarHBondContact O-N 2.85Å; F245-S249 PolarHBondContact O-N 2.76Å; F245-S249 PolarHBondContact O-OG 3.42Å; F245-S249 VanDerWaalsContact O-OG 3.08Å; F245-Q270 HydrophobicContact CD1-CG 4.23Å; F245-Q270 HydrophobicContact CE1-CG 3.69Å; F245-L273 HydrophobicContact CE1-CB 4.42Å; F245-L273 HydrophobicContact CZ-CB 4.03Å; F245-L273 HydrophobicContact CZ-CD1 4.13Å; F245-I274 HydrophobicContact CD1-CD1 4.03Å; F245-I274 HydrophobicContact CD1-CG1 3.69Å; F245-I274 HydrophobicContact CE1-CD1 4.26Å; F245-I274 HydrophobicContact CE1-CG1 3.78Å
246	F	93.2	Very high	92.9	Very high	59 Å²	59	64.6 Å²	64.6	26%	0.259	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-50.4	177	-175.2	-85	0	0	0	112.1	Q242 V243 V244 T248 F250 Q270 I274 Y500	Q242-F246 WeakPolarHBondContact O-CB 3.46Å; Q242-F246 PolarHBondContact O-N 2.84Å; V243-F246 PolarHBondContact O-N 3.02Å; V244-F246 VanDerWaalsContact C-N 3.29Å; V244-F246 PolarHBondContact O-N 3.45Å; F246-T248 PolarHBondContact O-N 2.8Å; F246-F250 WeakPolarHBondContact O-CB 3.41Å; F246-F250 PolarHBondContact O-N 2.71Å; F246-F250 VanDerWaalsContact O-N 3.16Å; F246-Q270 VanDerWaalsContact CA-NE2 3.34Å; F246-Q270 PolarHBondContact O-NE2 3.37Å; F246-I274 HydrophobicContact CD2-CD1 4.11Å; F246-Y500 HydrophobicContact CE1-CE2 4.09Å; F246-Y500 HydrophobicContact CE2-CD1 4.26Å; F246-Y500 HydrophobicContact CE2-CD2 4.34Å; F246-Y500 AromaticContact CE2-CE1 3.73Å; F246-Y500 HydrophobicContact CE2-CE1 3.73Å; F246-Y500 AromaticContact CE2-CE2 3.83Å; F246-Y500 HydrophobicContact CE2-CE2 3.83Å; F246-Y500 AromaticContact CE2-CZ 3.5Å; F246-Y500 VanDerWaalsContact CE2-CZ 3.5Å; F246-Y500 HydrophobicContact CZ-CD1 4.49Å; F246-Y500 AromaticContact CZ-CD2 3.78Å; F246-Y500 HydrophobicContact CZ-CD2 3.78Å; F246-Y500 HydrophobicContact CZ-CE1 4.08Å; F246-Y500 AromaticContact CZ-CE2 3.29Å; F246-Y500 HydrophobicContact CZ-CE2 3.29Å; F246-Y500 HydrophobicContact CZ-CG 4.35Å; F246-Y500 AromaticContact CZ-CZ 3.46Å; F246-Y500 VanDerWaalsContact CZ-CZ 3.46Å
247	M	92.4	Very high	92.6	Very high	92 Å²	92	66.1 Å²	66.1	45%	0.453	34%	0.336	S	S	.	.	H	α-helix	trans	-67.9	-35.3	-177.2	-68.6	-58.8	147.3	0	0	113	V243 V244 F250 R251	V243-M247 HydrophobicContact CG1-CG 4.41Å; V243-M247 WeakPolarHBondContact O-CB 3.06Å; V243-M247 VanDerWaalsContact O-CG 3.28Å; V243-M247 WeakPolarHBondContact O-CG 3.27Å; V243-M247 PolarHBondContact O-N 3.33Å; V244-M247 PolarHBondContact O-N 3.29Å; M247-F250 PolarHBondContact O-N 2.94Å; M247-R251 WeakPolarHBondContact O-CB 3.43Å; M247-R251 WeakPolarHBondContact O-CG 3.4Å; M247-R251 PolarHBondContact O-N 2.98Å
248	T	91	Very high	92.4	Very high	59 Å²	59	63.9 Å²	63.9	36%	0.362	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-49	179.3	-67.6	0	0	0	0	111.2	V244 F246 F250 R251 F252	V244-T248 VanDerWaalsContact O-CB 3.25Å; V244-T248 WeakPolarHBondContact O-CB 3.44Å; V244-T248 PolarHBondContact O-N 2.95Å; V244-T248 PolarHBondContact O-OG1 3.36Å; F246-T248 PolarHBondContact O-N 2.8Å; T248-F250 VanDerWaalsContact C-N 3.31Å; T248-F250 PolarHBondContact O-N 3.42Å; T248-R251 PolarHBondContact O-N 3.31Å; T248-F252 HydrophobicContact CG2-CD2 3.51Å; T248-F252 HydrophobicContact CG2-CE2 3.29Å; T248-F252 HydrophobicContact CG2-CZ 4.49Å; T248-F252 WeakPolarHBondContact O-CD2 3.18Å; T248-F252 PolarHBondContact O-N 3.2Å
249	S	89.1	Confident	92.2	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-67.6	-34.4	178	-29.6	0	0	0	0	112.1	M201 F245 F252 T253 Q270	M201-S249 PolarHBondContact SD-OG 3.12Å; F245-S249 PolarHBondContact O-N 2.76Å; F245-S249 PolarHBondContact O-OG 3.42Å; F245-S249 VanDerWaalsContact O-OG 3.08Å; S249-F252 PolarHBondContact O-N 3.42Å; S249-T253 WeakPolarHBondContact O-CB 3.17Å; S249-T253 PolarHBondContact O-N 3.32Å; S249-T253 PolarHBondContact O-OG1 3.42Å; S249-Q270 PolarHBondContact OG-NE2 2.86Å
250	F	88.9	Confident	92	Very high	66 Å²	66	61 Å²	61	29%	0.289	31%	0.307	S	S	.	.	H	α-helix	trans	-56.9	-51.2	171.8	175.9	-89.3	0	0	0	111.2	F246 M247 T248 T253 I254 Y500 M504	F246-F250 WeakPolarHBondContact O-CB 3.41Å; F246-F250 PolarHBondContact O-N 2.71Å; F246-F250 VanDerWaalsContact O-N 3.16Å; M247-F250 PolarHBondContact O-N 2.94Å; T248-F250 VanDerWaalsContact C-N 3.31Å; T248-F250 PolarHBondContact O-N 3.42Å; F250-T253 PolarHBondContact O-N 3Å; F250-I254 HydrophobicContact CD1-CD1 3.79Å; F250-I254 HydrophobicContact CE1-CD1 3.22Å; F250-I254 HydrophobicContact CE2-CD1 4.19Å; F250-I254 HydrophobicContact CG-CD1 4.47Å; F250-I254 HydrophobicContact CZ-CD1 3.46Å; F250-I254 VanDerWaalsContact CZ-CD1 3.46Å; F250-I254 PolarHBondContact O-N 3.39Å; F250-Y500 HydrophobicContact CD2-CE2 4.41Å; F250-M504 HydrophobicContact CD2-CE 3.43Å; F250-M504 VanDerWaalsContact CD2-CE 3.43Å; F250-M504 HydrophobicContact CD2-SD 3.28Å; F250-M504 WeakPolarHBondContact CD2-SD 3.25Å; F250-M504 HydrophobicContact CE2-CE 3.75Å; F250-M504 HydrophobicContact CE2-SD 3.23Å; F250-M504 WeakPolarHBondContact CE2-SD 3.25Å; F250-M504 HydrophobicContact CG-CE 4.17Å; F250-M504 HydrophobicContact CG-SD 4.49Å; F250-M504 HydrophobicContact CZ-SD 4.42Å
251	R	91.7	Very high	91.8	Very high	180 Å²	180	57.3 Å²	57.3	68%	0.679	29%	0.291	S	S	*	.	H	α-helix	trans	-62.6	-46.4	179.1	-79.1	-172	172.6	-176.6	-1.2	112.6	M247 T248 T253 I254 I255	M247-R251 WeakPolarHBondContact O-CB 3.43Å; M247-R251 WeakPolarHBondContact O-CG 3.4Å; M247-R251 PolarHBondContact O-N 2.98Å; T248-R251 PolarHBondContact O-N 3.31Å; R251-T253 VanDerWaalsContact C-N 3.3Å; R251-T253 PolarHBondContact O-N 3.06Å; R251-I254 PolarHBondContact O-N 2.75Å; R251-I254 VanDerWaalsContact O-N 3.16Å; R251-I255 HydrophobicContact CB-CD1 4.39Å; R251-I255 VanDerWaalsContact O-CG1 3.27Å; R251-I255 WeakPolarHBondContact O-CG1 3.48Å; R251-I255 PolarHBondContact O-N 2.92Å
252	F	90.8	Very high	91.6	Very high	95 Å²	95	56.1 Å²	56.1	42%	0.417	29%	0.286	S	S	.	.	H	α-helix	trans	-61.7	-39.2	179.1	-81.3	-59.9	0	0	0	112.6	I197 T248 S249 I254 I255 C256	I197-F252 HydrophobicContact CD1-CB 3.99Å; I197-F252 HydrophobicContact CG1-CB 4.07Å; T248-F252 HydrophobicContact CG2-CD2 3.51Å; T248-F252 HydrophobicContact CG2-CE2 3.29Å; T248-F252 HydrophobicContact CG2-CZ 4.49Å; T248-F252 WeakPolarHBondContact O-CD2 3.18Å; T248-F252 PolarHBondContact O-N 3.2Å; S249-F252 PolarHBondContact O-N 3.42Å; F252-I254 VanDerWaalsContact C-N 3.28Å; F252-I254 PolarHBondContact O-N 3.06Å; F252-I255 PolarHBondContact O-N 3.31Å; F252-C256 WeakPolarHBondContact O-CB 3.2Å; F252-C256 PolarHBondContact O-N 3.45Å; F252-C256 PolarHBondContact O-SG 2.88Å
253	T	88.7	Confident	91.6	Very high	1 Å²	1	55 Å²	55	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-40.6	176.8	-53	0	0	0	0	110.8	S249 F250 R251 L258 T263 M504 R507	S249-T253 WeakPolarHBondContact O-CB 3.17Å; S249-T253 PolarHBondContact O-N 3.32Å; S249-T253 PolarHBondContact O-OG1 3.42Å; F250-T253 PolarHBondContact O-N 3Å; R251-T253 VanDerWaalsContact C-N 3.3Å; R251-T253 PolarHBondContact O-N 3.06Å; T253-L258 HydrophobicContact CG2-CB 4.35Å; T253-L258 HydrophobicContact CG2-CD1 4.21Å; T253-L258 PolarHBondContact O-N 3.49Å; T253-T263 HydrophobicContact CG2-CG2 3.31Å; T253-M504 HydrophobicContact CG2-CE 4.21Å; T253-R507 PolarHBondContact O-NH2 2.97Å
254	I	88.8	Confident	91.5	Very high	81 Å²	81	53 Å²	53	42%	0.415	27%	0.273	S	S	.	.	H	α-helix	trans	-70.1	-45.8	176.2	-65.4	168.6	0	0	0	111.9	F250 R251 F252 D257	F250-I254 HydrophobicContact CD1-CD1 3.79Å; F250-I254 HydrophobicContact CE1-CD1 3.22Å; F250-I254 HydrophobicContact CE2-CD1 4.19Å; F250-I254 HydrophobicContact CG-CD1 4.47Å; F250-I254 HydrophobicContact CZ-CD1 3.46Å; F250-I254 VanDerWaalsContact CZ-CD1 3.46Å; F250-I254 PolarHBondContact O-N 3.39Å; R251-I254 PolarHBondContact O-N 2.75Å; R251-I254 VanDerWaalsContact O-N 3.16Å; F252-I254 VanDerWaalsContact C-N 3.28Å; F252-I254 PolarHBondContact O-N 3.06Å; I254-D257 PolarHBondContact O-N 3.42Å
255	I	91.4	Very high	91.5	Very high	130 Å²	130	52.5 Å²	52.5	67%	0.667	27%	0.267	S	S	*	.	H	α-helix	trans	-65.5	-41.5	-175.9	-68.8	165.2	0	0	0	111.7	R251 F252 D257	R251-I255 HydrophobicContact CB-CD1 4.39Å; R251-I255 VanDerWaalsContact O-CG1 3.27Å; R251-I255 WeakPolarHBondContact O-CG1 3.48Å; R251-I255 PolarHBondContact O-N 2.92Å; F252-I255 PolarHBondContact O-N 3.31Å; I255-D257 PolarHBondContact O-N 2.99Å
256	C	90.1	Very high	91.5	Very high	26 Å²	26	52 Å²	52	18%	0.176	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	2.2	178.8	-64.8	0	0	0	0	113.6	N190 D193 I197 F252 L258	N190-C256 PolarHBondContact ND2-O 2.81Å; D193-C256 HydrophobicContact CB-CB 4.18Å; I197-C256 HydrophobicContact CD1-CB 4.49Å; F252-C256 WeakPolarHBondContact O-CB 3.2Å; F252-C256 PolarHBondContact O-N 3.45Å; F252-C256 PolarHBondContact O-SG 2.88Å; C256-L258 HydrophobicContact CB-CD2 4.02Å; C256-L258 HydrophobicContact CB-CG 4.01Å; C256-L258 PolarHBondContact O-N 3.03Å; C256-L258 VanDerWaalsContact O-N 3.14Å
257	D	90.2	Very high	91.6	Very high	124 Å²	124	49.2 Å²	49.2	66%	0.663	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.2	49.3	-176.8	-162.9	26.6	0	0	0	113.3	I254 I255	I254-D257 PolarHBondContact O-N 3.42Å; I255-D257 PolarHBondContact O-N 2.99Å
258	L	90.6	Very high	91.7	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	25%	0.246	C	C	.	.			trans	-65.3	136.5	-174.2	-68.1	-177.2	0	0	0	111.2	N190 D193 V194 I197 T253 C256 T263 V266 R507	N190-L258 HydrophobicContact CB-CD2 3.84Å; D193-L258 HydrophobicContact CB-CD2 3.88Å; V194-L258 HydrophobicContact CG2-CD1 4.14Å; V194-L258 HydrophobicContact CG2-CD2 4.04Å; I197-L258 HydrophobicContact CD1-CD1 3.9Å; T253-L258 HydrophobicContact CG2-CB 4.35Å; T253-L258 HydrophobicContact CG2-CD1 4.21Å; T253-L258 PolarHBondContact O-N 3.49Å; C256-L258 HydrophobicContact CB-CD2 4.02Å; C256-L258 HydrophobicContact CB-CG 4.01Å; C256-L258 PolarHBondContact O-N 3.03Å; C256-L258 VanDerWaalsContact O-N 3.14Å; L258-T263 VanDerWaalsContact CB-OG1 3.28Å; L258-T263 WeakPolarHBondContact CB-OG1 3.41Å; L258-T263 PolarHBondContact O-OG1 3.03Å; L258-V266 HydrophobicContact CD1-CG2 3.95Å; L258-R507 PolarHBondContact O-NH2 3.43Å; L258-R507 VanDerWaalsContact O-NH2 3.15Å
259	P	91.5	Very high	91.9	Very high	20 Å²	20	45.1 Å²	45.1	13%	0.13	24%	0.237	C	C	.	.			trans	-63.5	171.5	172.4	-24.3	35	0	0	0	113.6	F186 A261 S262 T263	F186-P259 WeakPolarHBondContact O-CB 3.3Å; F186-P259 WeakPolarHBondContact O-CG 3.43Å; P259-A261 PolarHBondContact O-N 3.01Å; P259-S262 PolarHBondContact O-N 2.98Å; P259-T263 WeakPolarHBondContact O-CB 3.48Å; P259-T263 PolarHBondContact O-N 3.01Å; P259-T263 PolarHBondContact O-OG1 3.22Å
260	P	90.8	Very high	92.3	Very high	25 Å²	25	45 Å²	45	16%	0.162	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-48.4	-169.5	-27.8	36.5	0	0	0	115.8	T263 A264 S505 W557	P260-T263 PolarHBondContact O-N 3.43Å; P260-A264 WeakPolarHBondContact O-CB 3.22Å; P260-A264 PolarHBondContact O-N 3.44Å; P260-S505 WeakPolarHBondContact CA-O 3.37Å; P260-S505 WeakPolarHBondContact CB-O 3.37Å; P260-W557 HydrophobicContact CG-CH2 3.39Å; P260-W557 HydrophobicContact CG-CZ2 4.06Å; P260-W557 HydrophobicContact CG-CZ3 3.85Å
261	A	91.5	Very high	92.6	Very high	21 Å²	21	43 Å²	43	17%	0.174	23%	0.229	C	C	.	.	H	α-helix	trans	-75.1	-36.8	-178.8	0	0	0	0	0	112.1	T187 F188 P259 T263 A264 I265	T187-A261 HydrophobicContact CG2-CB 3.32Å; T187-A261 WeakPolarHBondContact O-CB 3.39Å; T187-A261 PolarHBondContact O-N 3.4Å; F188-A261 HydrophobicContact CD1-CB 4.18Å; F188-A261 HydrophobicContact CD2-CB 4.47Å; F188-A261 HydrophobicContact CE1-CB 3.78Å; F188-A261 HydrophobicContact CE2-CB 4.06Å; F188-A261 HydrophobicContact CZ-CB 3.7Å; P259-A261 PolarHBondContact O-N 3.01Å; A261-T263 VanDerWaalsContact C-N 3.28Å; A261-T263 PolarHBondContact O-N 3.38Å; A261-A264 WeakPolarHBondContact O-CB 2.96Å; A261-A264 PolarHBondContact O-N 2.96Å; A261-I265 WeakPolarHBondContact O-CG1 3.27Å; A261-I265 PolarHBondContact O-N 3.43Å
262	S	93.4	Very high	92.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-44.3	170.2	-69.5	0	0	0	0	111.6	T187 F188 G189 P259 I265 V266	T187-S262 PolarHBondContact O-N 3.08Å; F188-S262 WeakPolarHBondContact CA-OG 3.43Å; G189-S262 PolarHBondContact O-OG 2.87Å; P259-S262 PolarHBondContact O-N 2.98Å; S262-I265 PolarHBondContact O-N 2.87Å; S262-V266 WeakPolarHBondContact O-CG2 3.49Å; S262-V266 PolarHBondContact O-N 3.08Å
263	T	94.4	Very high	93.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-41.4	174.8	-61.8	0	0	0	0	112.3	T253 L258 P259 P260 A261 I265 V266 T267 M504	T253-T263 HydrophobicContact CG2-CG2 3.31Å; L258-T263 VanDerWaalsContact CB-OG1 3.28Å; L258-T263 WeakPolarHBondContact CB-OG1 3.41Å; L258-T263 PolarHBondContact O-OG1 3.03Å; P259-T263 WeakPolarHBondContact O-CB 3.48Å; P259-T263 PolarHBondContact O-N 3.01Å; P259-T263 PolarHBondContact O-OG1 3.22Å; P260-T263 PolarHBondContact O-N 3.43Å; A261-T263 VanDerWaalsContact C-N 3.28Å; A261-T263 PolarHBondContact O-N 3.38Å; T263-I265 VanDerWaalsContact C-N 3.3Å; T263-I265 PolarHBondContact O-N 2.82Å; T263-V266 PolarHBondContact O-N 3.42Å; T263-T267 HydrophobicContact CG2-CG2 3.96Å; T263-T267 WeakPolarHBondContact O-CB 3.39Å; T263-T267 WeakPolarHBondContact O-CG2 3.5Å; T263-T267 PolarHBondContact O-N 3.01Å; T263-T267 PolarHBondContact O-OG1 3.46Å; T263-M504 VanDerWaalsContact CG2-C 3.47Å; T263-M504 HydrophobicContact CG2-CB 4.02Å; T263-M504 VanDerWaalsContact CG2-O 3.26Å; T263-M504 WeakPolarHBondContact CG2-O 3.21Å
264	A	93.6	Very high	93.5	Very high	38 Å²	38	35.2 Å²	35.2	31%	0.314	20%	0.199	S	C	.	.	H	α-helix	trans	-60.9	-38.3	176.9	0	0	0	0	0	112.1	P260 A261 T267 G268 S505	P260-A264 WeakPolarHBondContact O-CB 3.22Å; P260-A264 PolarHBondContact O-N 3.44Å; A261-A264 WeakPolarHBondContact O-CB 2.96Å; A261-A264 PolarHBondContact O-N 2.96Å; A264-T267 WeakPolarHBondContact CA-OG1 3.39Å; A264-T267 PolarHBondContact O-OG1 3.32Å; A264-G268 PolarHBondContact O-N 2.88Å; A264-S505 WeakPolarHBondContact CA-OG 3.37Å; A264-S505 WeakPolarHBondContact CB-OG 3.39Å; A264-S505 PolarHBondContact N-OG 2.9Å
265	I	94.3	Very high	93.9	Very high	68 Å²	68	32.3 Å²	32.3	35%	0.349	18%	0.184	S	C	.	.	H	α-helix	trans	-61.6	-52.8	174.3	-68.4	164.1	0	0	0	110.3	F188 V194 A261 S262 T263 T267 E269	F188-I265 HydrophobicContact CD1-CD1 4.06Å; F188-I265 HydrophobicContact CE1-CD1 3.86Å; V194-I265 HydrophobicContact CG1-CG2 4.1Å; A261-I265 WeakPolarHBondContact O-CG1 3.27Å; A261-I265 PolarHBondContact O-N 3.43Å; S262-I265 PolarHBondContact O-N 2.87Å; T263-I265 VanDerWaalsContact C-N 3.3Å; T263-I265 PolarHBondContact O-N 2.82Å; I265-T267 PolarHBondContact O-N 3.31Å; I265-E269 VanDerWaalsContact O-CB 3.29Å; I265-E269 WeakPolarHBondContact O-CB 3.29Å; I265-E269 VanDerWaalsContact O-CG 3.3Å; I265-E269 WeakPolarHBondContact O-CG 3.17Å; I265-E269 PolarHBondContact O-N 3.28Å
266	V	95.3	Very high	94.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-47	-177.5	173.1	0	0	0	0	111.2	V194 I197 M201 L258 S262 T263 E269 Q270	V194-V266 HydrophobicContact CB-CG2 4.36Å; V194-V266 HydrophobicContact CG1-CG2 3.89Å; V194-V266 HydrophobicContact CG2-CG2 4.27Å; I197-V266 HydrophobicContact CG2-CG1 3.68Å; M201-V266 HydrophobicContact CE-CG1 3.84Å; M201-V266 HydrophobicContact SD-CG1 4.37Å; L258-V266 HydrophobicContact CD1-CG2 3.95Å; S262-V266 WeakPolarHBondContact O-CG2 3.49Å; S262-V266 PolarHBondContact O-N 3.08Å; T263-V266 PolarHBondContact O-N 3.42Å; V266-E269 PolarHBondContact O-N 3.19Å; V266-Q270 VanDerWaalsContact O-CB 3.28Å; V266-Q270 WeakPolarHBondContact O-CB 3.22Å; V266-Q270 PolarHBondContact O-N 2.9Å
267	T	95.1	Very high	94.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.2	-39.1	-178.1	53.9	0	0	0	0	112.4	T263 A264 I265 Q270 V271 M504	T263-T267 HydrophobicContact CG2-CG2 3.96Å; T263-T267 WeakPolarHBondContact O-CB 3.39Å; T263-T267 WeakPolarHBondContact O-CG2 3.5Å; T263-T267 PolarHBondContact O-N 3.01Å; T263-T267 PolarHBondContact O-OG1 3.46Å; A264-T267 WeakPolarHBondContact CA-OG1 3.39Å; A264-T267 PolarHBondContact O-OG1 3.32Å; I265-T267 PolarHBondContact O-N 3.31Å; T267-Q270 WeakPolarHBondContact O-CB 3.5Å; T267-Q270 PolarHBondContact O-N 3.31Å; T267-V271 WeakPolarHBondContact O-CG2 3.5Å; T267-V271 PolarHBondContact O-N 3.28Å; T267-M504 HydrophobicContact CG2-CB 3.6Å; T267-M504 HydrophobicContact CG2-CG 4.04Å
268	G	95.1	Very high	94.8	Very high	31 Å²	31	21.6 Å²	21.6	32%	0.32	12%	0.124	S	C	.	.	H	α-helix	trans	-62.9	-43.4	173.1	0	0	0	0	0	112.4	A264 V271 R272	A264-G268 PolarHBondContact O-N 2.88Å; G268-V271 PolarHBondContact O-N 2.99Å; G268-R272 WeakPolarHBondContact O-CB 3.04Å; G268-R272 PolarHBondContact O-N 3.48Å
269	E	95.5	Very high	95	Very high	34 Å²	34	21.4 Å²	21.4	16%	0.159	12%	0.123	C	C	.	.	H	α-helix	trans	-65.6	-40.2	174.7	-77.6	-69.7	133	0	0	112.5	W198 M201 I265 V266 R272 L273	W198-E269 PolarHBondContact NE1-OE2 2.97Å; M201-E269 HydrophobicContact CE-CB 4.45Å; I265-E269 VanDerWaalsContact O-CB 3.29Å; I265-E269 WeakPolarHBondContact O-CB 3.29Å; I265-E269 VanDerWaalsContact O-CG 3.3Å; I265-E269 WeakPolarHBondContact O-CG 3.17Å; I265-E269 PolarHBondContact O-N 3.28Å; V266-E269 PolarHBondContact O-N 3.19Å; E269-R272 VanDerWaalsContact CD-NH2 3.27Å; E269-R272 WeakPolarHBondContact O-CB 3.41Å; E269-R272 PolarHBondContact O-N 3.46Å; E269-R272 IonicContact OE1-CZ 2.67Å; E269-R272 IonicContact OE1-NE 3.89Å; E269-R272 IonicContact OE1-NH1 2.75Å; E269-R272 PolarHBondContact OE1-NH1 3.44Å; E269-R272 IonicContact OE1-NH2 2.79Å; E269-R272 PolarHBondContact OE1-NH2 3.41Å; E269-R272 VanDerWaalsContact OE1-NH2 3.16Å; E269-R272 IonicContact OE2-CZ 2.83Å; E269-R272 IonicContact OE2-NE 3.96Å; E269-R272 IonicContact OE2-NH1 3.7Å; E269-R272 IonicContact OE2-NH2 3.1Å; E269-R272 PolarHBondContact OE2-NH2 3.42Å; E269-L273 VanDerWaalsContact O-CG 3.27Å; E269-L273 WeakPolarHBondContact O-CG 3.38Å; E269-L273 PolarHBondContact O-N 3.21Å
270	Q	96	Very high	95.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-56.7	-52.8	174.1	-176.4	-165	32.6	0	0	111	M201 F245 F246 S249 V266 T267 R272 L273 I274 Y500	M201-Q270 HydrophobicContact SD-CB 3.91Å; M201-Q270 HydrophobicContact SD-CG 4.22Å; F245-Q270 HydrophobicContact CD1-CG 4.23Å; F245-Q270 HydrophobicContact CE1-CG 3.69Å; F246-Q270 VanDerWaalsContact CA-NE2 3.34Å; F246-Q270 PolarHBondContact O-NE2 3.37Å; S249-Q270 PolarHBondContact OG-NE2 2.86Å; V266-Q270 VanDerWaalsContact O-CB 3.28Å; V266-Q270 WeakPolarHBondContact O-CB 3.22Å; V266-Q270 PolarHBondContact O-N 2.9Å; T267-Q270 WeakPolarHBondContact O-CB 3.5Å; T267-Q270 PolarHBondContact O-N 3.31Å; Q270-R272 VanDerWaalsContact C-N 3.31Å; Q270-R272 PolarHBondContact O-N 2.84Å; Q270-L273 PolarHBondContact O-N 3.04Å; Q270-I274 HydrophobicContact CG-CD1 4.07Å; Q270-I274 WeakPolarHBondContact O-CG1 3.25Å; Q270-I274 PolarHBondContact O-N 2.86Å; Q270-Y500 PolarHBondContact OE1-OH 3.29Å
271	V	96.4	Very high	95.4	Very high	24 Å²	24	19.9 Å²	19.9	15%	0.145	11%	0.113	C	C	.	.	H	α-helix	trans	-59.7	-42.9	178.5	171.8	0	0	0	0	110.8	T267 G268 L273 I274 M275 V497 Y500 I501	T267-V271 WeakPolarHBondContact O-CG2 3.5Å; T267-V271 PolarHBondContact O-N 3.28Å; G268-V271 PolarHBondContact O-N 2.99Å; V271-L273 VanDerWaalsContact C-N 3.35Å; V271-L273 PolarHBondContact O-N 3.48Å; V271-I274 PolarHBondContact O-N 3.24Å; V271-M275 HydrophobicContact CG1-CG 4.44Å; V271-M275 HydrophobicContact CG1-SD 3.94Å; V271-M275 VanDerWaalsContact O-CG 3.28Å; V271-M275 WeakPolarHBondContact O-CG 3.48Å; V271-M275 PolarHBondContact O-N 3.49Å; V271-V497 HydrophobicContact CG1-CG1 3.82Å; V271-V497 HydrophobicContact CG2-CG1 4.01Å; V271-Y500 HydrophobicContact CG2-CD1 4.45Å; V271-Y500 HydrophobicContact CG2-CE1 4.33Å; V271-I501 HydrophobicContact CG2-CD1 4.2Å; V271-I501 HydrophobicContact CG2-CG1 4.24Å
272	R	97.1	Very high	95.5	Very high	73 Å²	73	22.5 Å²	22.5	28%	0.275	12%	0.119	S	C	.	.	H	α-helix	trans	-58.4	-45.1	176.3	-170.5	-175.9	78.6	-174.6	2.7	112.1	G268 E269 Q270 M275 K276 L343	G268-R272 WeakPolarHBondContact O-CB 3.04Å; G268-R272 PolarHBondContact O-N 3.48Å; E269-R272 VanDerWaalsContact CD-NH2 3.27Å; E269-R272 WeakPolarHBondContact O-CB 3.41Å; E269-R272 PolarHBondContact O-N 3.46Å; E269-R272 IonicContact OE1-CZ 2.67Å; E269-R272 IonicContact OE1-NE 3.89Å; E269-R272 IonicContact OE1-NH1 2.75Å; E269-R272 PolarHBondContact OE1-NH1 3.44Å; E269-R272 IonicContact OE1-NH2 2.79Å; E269-R272 PolarHBondContact OE1-NH2 3.41Å; E269-R272 VanDerWaalsContact OE1-NH2 3.16Å; E269-R272 IonicContact OE2-CZ 2.83Å; E269-R272 IonicContact OE2-NE 3.96Å; E269-R272 IonicContact OE2-NH1 3.7Å; E269-R272 IonicContact OE2-NH2 3.1Å; E269-R272 PolarHBondContact OE2-NH2 3.42Å; Q270-R272 VanDerWaalsContact C-N 3.31Å; Q270-R272 PolarHBondContact O-N 2.84Å; R272-M275 PolarHBondContact O-N 2.67Å; R272-K276 WeakPolarHBondContact O-CG 3.34Å; R272-K276 PolarHBondContact O-N 3.15Å; R272-L343 HydrophobicContact CG-CD2 4.14Å
273	L	96.7	Very high	95.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.4	-37.1	-179.2	-68.8	172.4	0	0	0	112.3	M201 K202 T205 F245 E269 Q270 V271 K276 S277	M201-L273 HydrophobicContact CB-CD1 3.89Å; K202-L273 HydrophobicContact CD-CD2 4.07Å; T205-L273 HydrophobicContact CG2-CB 4.22Å; T205-L273 HydrophobicContact CG2-CD2 4.02Å; F245-L273 HydrophobicContact CE1-CB 4.42Å; F245-L273 HydrophobicContact CZ-CB 4.03Å; F245-L273 HydrophobicContact CZ-CD1 4.13Å; E269-L273 VanDerWaalsContact O-CG 3.27Å; E269-L273 WeakPolarHBondContact O-CG 3.38Å; E269-L273 PolarHBondContact O-N 3.21Å; Q270-L273 PolarHBondContact O-N 3.04Å; V271-L273 VanDerWaalsContact C-N 3.35Å; V271-L273 PolarHBondContact O-N 3.48Å; L273-K276 PolarHBondContact O-N 3.04Å; L273-S277 WeakPolarHBondContact O-CB 3.49Å; L273-S277 PolarHBondContact O-N 2.83Å; L273-S277 PolarHBondContact O-OG 3.43Å
274	I	96.4	Very high	95.2	Very high	39 Å²	39	24.6 Å²	24.6	20%	0.2	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-47.8	172.1	-68.3	169.3	0	0	0	110.4	F245 F246 Q270 V271 K276 S277 H278	F245-I274 HydrophobicContact CD1-CD1 4.03Å; F245-I274 HydrophobicContact CD1-CG1 3.69Å; F245-I274 HydrophobicContact CE1-CD1 4.26Å; F245-I274 HydrophobicContact CE1-CG1 3.78Å; F246-I274 HydrophobicContact CD2-CD1 4.11Å; Q270-I274 HydrophobicContact CG-CD1 4.07Å; Q270-I274 WeakPolarHBondContact O-CG1 3.25Å; Q270-I274 PolarHBondContact O-N 2.86Å; V271-I274 PolarHBondContact O-N 3.24Å; I274-K276 VanDerWaalsContact C-N 3.34Å; I274-K276 PolarHBondContact O-N 3.3Å; I274-S277 WeakPolarHBondContact CA-OG 3.29Å; I274-S277 PolarHBondContact O-N 2.89Å; I274-S277 PolarHBondContact O-OG 3.38Å; I274-H278 WeakPolarHBondContact O-CB 3.04Å; I274-H278 PolarHBondContact O-N 3.15Å
275	M	97	Very high	95	Very high	20 Å²	20	25 Å²	25	10%	0.099	12%	0.124	C	C	.	.	H	α-helix	trans	-61.1	-42.5	178.2	-69	173.4	86.3	0	0	111.7	V271 R272 A279 L343 V462 W465	V271-M275 HydrophobicContact CG1-CG 4.44Å; V271-M275 HydrophobicContact CG1-SD 3.94Å; V271-M275 VanDerWaalsContact O-CG 3.28Å; V271-M275 WeakPolarHBondContact O-CG 3.48Å; V271-M275 PolarHBondContact O-N 3.49Å; R272-M275 PolarHBondContact O-N 2.67Å; M275-A279 WeakPolarHBondContact O-CB 3.39Å; M275-A279 PolarHBondContact O-N 2.93Å; M275-L343 HydrophobicContact CB-CD1 4.44Å; M275-L343 HydrophobicContact CB-CD2 4.21Å; M275-L343 HydrophobicContact CE-CD1 3.47Å; M275-L343 VanDerWaalsContact CE-CD1 3.47Å; M275-L343 HydrophobicContact SD-CD1 3.87Å; M275-V462 HydrophobicContact CE-CG1 4.21Å; M275-W465 HydrophobicContact CB-CD2 4.24Å; M275-W465 HydrophobicContact CB-CG 4.41Å; M275-W465 HydrophobicContact CB-CZ2 4.13Å; M275-W465 HydrophobicContact CE-CB 3.77Å; M275-W465 HydrophobicContact CE-CD2 3.4Å; M275-W465 VanDerWaalsContact CE-CD2 3.4Å; M275-W465 HydrophobicContact CE-CE3 3.48Å; M275-W465 VanDerWaalsContact CE-CE3 3.48Å; M275-W465 HydrophobicContact CE-CG 3.52Å; M275-W465 HydrophobicContact CE-CZ3 4.26Å; M275-W465 HydrophobicContact CG-CD2 4.11Å; M275-W465 HydrophobicContact CG-CE3 4.44Å; M275-W465 HydrophobicContact CG-CH2 4.35Å; M275-W465 HydrophobicContact CG-CZ2 3.98Å; M275-W465 PolarHBondContact O-NE1 3.04Å
276	K	97.2	Very high	94.6	Very high	5 Å²	5	22.7 Å²	22.7	2%	0.022	12%	0.116	C	C	.	.	H	α-helix	trans	-68.6	-44	178.6	-73.6	-162.4	177.5	-160.5	0	113.3	R272 L273 I274 H278 A279 F280 F337 L338 A340 T342 L343	R272-K276 WeakPolarHBondContact O-CG 3.34Å; R272-K276 PolarHBondContact O-N 3.15Å; L273-K276 PolarHBondContact O-N 3.04Å; I274-K276 VanDerWaalsContact C-N 3.34Å; I274-K276 PolarHBondContact O-N 3.3Å; K276-H278 VanDerWaalsContact C-N 3.3Å; K276-H278 PolarHBondContact O-N 2.81Å; K276-A279 WeakPolarHBondContact O-CB 3.46Å; K276-A279 PolarHBondContact O-N 3.42Å; K276-F280 PolarHBondContact O-N 3.44Å; K276-F337 HydrophobicContact CB-CE1 3.71Å; K276-F337 HydrophobicContact CB-CZ 3.96Å; K276-F337 HydrophobicContact CD-CE1 4.18Å; K276-F337 HydrophobicContact CD-CZ 4.21Å; K276-F337 HydrophobicContact CG-CE1 3.98Å; K276-F337 HydrophobicContact CG-CZ 3.82Å; K276-F337 PolarHBondContact NZ-O 2.97Å; K276-F337 WeakPolarHBondContact O-CE1 3.33Å; K276-L338 HydrophobicContact CB-CD2 4.14Å; K276-L338 HydrophobicContact CD-CD2 4.25Å; K276-L338 PolarHBondContact NZ-O 2.79Å; K276-A340 PolarHBondContact NZ-O 2.94Å; K276-T342 VanDerWaalsContact CE-O 3.24Å; K276-T342 WeakPolarHBondContact CE-O 3.47Å; K276-L343 HydrophobicContact CD-CD2 4.39Å; K276-L343 HydrophobicContact CG-CD2 3.62Å
277	S	96.4	Very high	94	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-61.2	-41.2	176.5	53.8	0	0	0	0	111.2	Q242 L273 I274 F280 V281	Q242-S277 PolarHBondContact NE2-OG 2.93Å; L273-S277 WeakPolarHBondContact O-CB 3.49Å; L273-S277 PolarHBondContact O-N 2.83Å; L273-S277 PolarHBondContact O-OG 3.43Å; I274-S277 WeakPolarHBondContact CA-OG 3.29Å; I274-S277 PolarHBondContact O-N 2.89Å; I274-S277 PolarHBondContact O-OG 3.38Å; S277-F280 PolarHBondContact O-N 3.49Å; S277-V281 WeakPolarHBondContact O-CG2 3.42Å; S277-V281 PolarHBondContact O-N 3.37Å
278	H	96.2	Very high	93.4	Very high	49 Å²	49	27 Å²	27	23%	0.227	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-46.1	172	-173.9	73.7	0	0	0	113.4	Y238 I274 K276 F280 V281 R282 W465 Y469	Y238-H278 WeakPolarHBondContact OH-CA 3.36Å; Y238-H278 WeakPolarHBondContact OH-CB 3.28Å; Y238-H278 PolarHBondContact OH-N 3.01Å; Y238-H278 PolarHBondContact OH-ND1 3.05Å; I274-H278 WeakPolarHBondContact O-CB 3.04Å; I274-H278 PolarHBondContact O-N 3.15Å; K276-H278 VanDerWaalsContact C-N 3.3Å; K276-H278 PolarHBondContact O-N 2.81Å; H278-F280 VanDerWaalsContact C-N 3.28Å; H278-F280 PolarHBondContact O-N 2.88Å; H278-V281 PolarHBondContact O-N 2.85Å; H278-R282 WeakPolarHBondContact O-CB 3.39Å; H278-R282 PolarHBondContact O-N 2.82Å; H278-W465 HydrophobicContact CB-CZ2 4.06Å; H278-W465 AromaticContact CD2-CZ2 3.6Å; H278-Y469 AromaticContact CD2-CG 4Å
279	A	95.9	Very high	92.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.8	-39.4	178.6	0	0	0	0	0	113	M275 K276 Y283 F337 L343 Y469	M275-A279 WeakPolarHBondContact O-CB 3.39Å; M275-A279 PolarHBondContact O-N 2.93Å; K276-A279 WeakPolarHBondContact O-CB 3.46Å; K276-A279 PolarHBondContact O-N 3.42Å; A279-Y283 WeakPolarHBondContact O-CB 3.49Å; A279-Y283 PolarHBondContact O-N 2.73Å; A279-F337 HydrophobicContact CB-CE1 4.46Å; A279-F337 HydrophobicContact CB-CZ 3.88Å; A279-L343 WeakPolarHBondContact CB-O 3.28Å; A279-Y469 WeakPolarHBondContact CA-OH 3.27Å; A279-Y469 HydrophobicContact CB-CE2 3.57Å; A279-Y469 VanDerWaalsContact CB-OH 3.28Å; A279-Y469 WeakPolarHBondContact CB-OH 3.47Å; A279-Y469 PolarHBondContact O-OH 2.95Å
280	F	95.4	Very high	91.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.6	-51.8	177.2	175.8	-106.2	0	0	0	112.3	P209 F210 V213 K276 S277 H278 R282 Y283 A284 P329 Y334 Y345	P209-F280 HydrophobicContact CB-CD1 4.48Å; F210-F280 HydrophobicContact CD2-CE1 4.43Å; F210-F280 AromaticContact CD2-CZ 3.91Å; F210-F280 HydrophobicContact CD2-CZ 3.91Å; V213-F280 HydrophobicContact CB-CE1 4.03Å; V213-F280 HydrophobicContact CG1-CE1 4.44Å; V213-F280 HydrophobicContact CG2-CD1 4.3Å; V213-F280 HydrophobicContact CG2-CE1 3.75Å; K276-F280 PolarHBondContact O-N 3.44Å; S277-F280 PolarHBondContact O-N 3.49Å; H278-F280 VanDerWaalsContact C-N 3.28Å; H278-F280 PolarHBondContact O-N 2.88Å; F280-R282 VanDerWaalsContact C-N 3.34Å; F280-R282 PolarHBondContact O-N 3.28Å; F280-Y283 WeakPolarHBondContact O-CB 3.43Å; F280-Y283 PolarHBondContact O-N 2.77Å; F280-A284 PolarHBondContact O-N 3.01Å; F280-P329 HydrophobicContact CZ-CB 4.31Å; F280-Y334 HydrophobicContact CB-CD2 4.24Å; F280-Y334 HydrophobicContact CB-CE2 3.77Å; F280-Y334 HydrophobicContact CD1-CD2 4.09Å; F280-Y334 AromaticContact CD1-CE2 3.72Å; F280-Y334 HydrophobicContact CD1-CE2 3.72Å; F280-Y334 AromaticContact CD2-CD2 3.38Å; F280-Y334 HydrophobicContact CD2-CD2 3.38Å; F280-Y334 AromaticContact CD2-CE2 3.75Å; F280-Y334 HydrophobicContact CD2-CE2 3.75Å; F280-Y334 HydrophobicContact CD2-CG 4.36Å; F280-Y334 HydrophobicContact CE1-CD2 4.3Å; F280-Y334 HydrophobicContact CE1-CE2 4.24Å; F280-Y334 AromaticContact CE2-CD2 3.62Å; F280-Y334 HydrophobicContact CE2-CD2 3.62Å; F280-Y334 HydrophobicContact CE2-CE2 4.26Å; F280-Y334 HydrophobicContact CE2-CG 4.19Å; F280-Y334 AromaticContact CG-CD2 3.63Å; F280-Y334 HydrophobicContact CG-CD2 3.63Å; F280-Y334 AromaticContact CG-CE2 3.44Å; F280-Y334 HydrophobicContact CG-CE2 3.44Å; F280-Y334 VanDerWaalsContact CG-CE2 3.44Å; F280-Y334 HydrophobicContact CZ-CD2 4.09Å; F280-Y334 HydrophobicContact CZ-CE2 4.48Å; F280-Y334 HydrophobicContact CZ-CG 4.44Å; F280-Y345 HydrophobicContact CD2-CD1 4.19Å; F280-Y345 HydrophobicContact CD2-CD2 4.18Å; F280-Y345 AromaticContact CD2-CE1 3.97Å; F280-Y345 HydrophobicContact CD2-CE1 3.97Å; F280-Y345 AromaticContact CD2-CE2 3.97Å; F280-Y345 HydrophobicContact CD2-CE2 3.97Å; F280-Y345 HydrophobicContact CD2-CG 4.29Å; F280-Y345 AromaticContact CD2-CZ 3.84Å; F280-Y345 HydrophobicContact CE2-CE1 4.26Å; F280-Y345 HydrophobicContact CE2-CE2 4.46Å
281	V	94.1	Very high	89.8	Confident	14 Å²	14	35.1 Å²	35.1	9%	0.085	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-42.6	-179.6	173.2	0	0	0	0	111	P209 V213 Y238 S277 H278 Y283 A284 I285	P209-V281 HydrophobicContact CB-CG2 4.42Å; V213-V281 HydrophobicContact CG2-CG2 4.14Å; Y238-V281 HydrophobicContact CD1-CG1 4.45Å; Y238-V281 HydrophobicContact CD2-CG1 4.34Å; Y238-V281 HydrophobicContact CD2-CG2 3.91Å; Y238-V281 HydrophobicContact CE1-CG1 4.47Å; Y238-V281 HydrophobicContact CE2-CB 4.13Å; Y238-V281 HydrophobicContact CE2-CG1 4.36Å; Y238-V281 HydrophobicContact CE2-CG2 3.65Å; Y238-V281 HydrophobicContact CG-CG1 4.37Å; S277-V281 WeakPolarHBondContact O-CG2 3.42Å; S277-V281 PolarHBondContact O-N 3.37Å; H278-V281 PolarHBondContact O-N 2.85Å; V281-Y283 VanDerWaalsContact C-N 3.29Å; V281-Y283 PolarHBondContact O-N 3.26Å; V281-A284 WeakPolarHBondContact O-CB 3.45Å; V281-A284 PolarHBondContact O-N 2.82Å; V281-I285 HydrophobicContact CG1-CD1 4.03Å; V281-I285 HydrophobicContact CG1-CG1 4.47Å; V281-I285 VanDerWaalsContact O-CG1 3.3Å; V281-I285 WeakPolarHBondContact O-CG1 3.4Å; V281-I285 PolarHBondContact O-N 2.71Å
282	R	93.2	Very high	87.7	Confident	75 Å²	75	34.7 Å²	34.7	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-64.5	-32.9	178.1	-176.7	58.9	-178.5	93.8	-0.7	113.2	H278 F280 G286 Y469 D473	H278-R282 WeakPolarHBondContact O-CB 3.39Å; H278-R282 PolarHBondContact O-N 2.82Å; F280-R282 VanDerWaalsContact C-N 3.34Å; F280-R282 PolarHBondContact O-N 3.28Å; R282-G286 PolarHBondContact O-N 2.86Å; R282-Y469 HydrophobicContact CB-CD1 4.14Å; R282-Y469 HydrophobicContact CB-CE1 4.08Å; R282-Y469 HydrophobicContact CG-CD1 3.66Å; R282-Y469 HydrophobicContact CG-CE1 3.87Å; R282-D473 IonicContact CZ-OD1 3.64Å; R282-D473 IonicContact CZ-OD2 3.05Å; R282-D473 IonicContact NE-OD1 2.67Å; R282-D473 IonicContact NE-OD2 2.89Å; R282-D473 PolarHBondContact NE-OD2 3.34Å; R282-D473 IonicContact NH2-OD1 3.43Å; R282-D473 PolarHBondContact NH2-OD1 2.9Å; R282-D473 IonicContact NH2-OD2 2.7Å; R282-D473 PolarHBondContact NH2-OD2 2.99Å
283	Y	91.8	Very high	85.4	Confident	45 Å²	45	36.1 Å²	36.1	18%	0.176	17%	0.172	C	C	.	.	H	α-helix	trans	-68.8	-45.3	171.7	-178.5	-89	0	0	0	111.7	A279 F280 V281 I285 G286 R287 F328 Y345 E347	A279-Y283 WeakPolarHBondContact O-CB 3.49Å; A279-Y283 PolarHBondContact O-N 2.73Å; F280-Y283 WeakPolarHBondContact O-CB 3.43Å; F280-Y283 PolarHBondContact O-N 2.77Å; V281-Y283 VanDerWaalsContact C-N 3.29Å; V281-Y283 PolarHBondContact O-N 3.26Å; Y283-I285 VanDerWaalsContact C-N 3.31Å; Y283-I285 PolarHBondContact O-N 2.85Å; Y283-G286 PolarHBondContact O-N 3.23Å; Y283-G286 VanDerWaalsContact O-N 3.12Å; Y283-R287 HydrophobicContact CD1-CG 4.11Å; Y283-R287 HydrophobicContact CE1-CG 3.66Å; Y283-R287 PolarHBondContact O-N 2.86Å; Y283-R287 VanDerWaalsContact O-N 3.1Å; Y283-F328 HydrophobicContact CD1-CE2 4.03Å; Y283-F328 HydrophobicContact CD1-CZ 4.47Å; Y283-F328 AromaticContact CE1-CE2 3.95Å; Y283-F328 HydrophobicContact CE1-CE2 3.95Å; Y283-Y345 AromaticContact CD1-CD1 3.48Å; Y283-Y345 HydrophobicContact CD1-CD1 3.48Å; Y283-Y345 VanDerWaalsContact CD1-CD1 3.48Å; Y283-Y345 AromaticContact CD1-CE1 3.56Å; Y283-Y345 HydrophobicContact CD1-CE1 3.56Å; Y283-Y345 HydrophobicContact CD2-CD1 4.03Å; Y283-Y345 HydrophobicContact CE1-CD1 4.03Å; Y283-Y345 AromaticContact CE1-CE1 3.81Å; Y283-Y345 HydrophobicContact CE1-CE1 3.81Å; Y283-Y345 AromaticContact CG-CD1 3.49Å; Y283-Y345 HydrophobicContact CG-CD1 3.49Å; Y283-Y345 VanDerWaalsContact CG-CD1 3.49Å; Y283-Y345 HydrophobicContact CG-CE1 4.08Å; Y283-E347 HydrophobicContact CE1-CG 4.01Å; Y283-E347 WeakPolarHBondContact CE1-OE1 3.41Å; Y283-E347 VanDerWaalsContact OH-CD 3.22Å; Y283-E347 WeakPolarHBondContact OH-CG 3.27Å; Y283-E347 PolarHBondContact OH-OE1 2.81Å
284	A	90.5	Very high	83.2	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-45.1	176	0	0	0	0	0	111.8	V213 F280 V281 G286 R287 I288 F328	V213-A284 HydrophobicContact CG1-CB 3.65Å; V213-A284 HydrophobicContact CG2-CB 3.99Å; F280-A284 PolarHBondContact O-N 3.01Å; V281-A284 WeakPolarHBondContact O-CB 3.45Å; V281-A284 PolarHBondContact O-N 2.82Å; A284-G286 VanDerWaalsContact C-N 3.35Å; A284-G286 PolarHBondContact O-N 3.18Å; A284-R287 PolarHBondContact O-N 3.39Å; A284-I288 WeakPolarHBondContact O-CD1 3.24Å; A284-I288 WeakPolarHBondContact O-CG1 3.49Å; A284-I288 PolarHBondContact O-N 2.98Å; A284-I288 VanDerWaalsContact O-N 3.08Å; A284-F328 HydrophobicContact CB-CE1 3.91Å; A284-F328 HydrophobicContact CB-CZ 3.6Å
285	I	88.5	Confident	80.9	Confident	47 Å²	47	48 Å²	48	24%	0.241	23%	0.231	C	C	.	.	H	α-helix	trans	-55.3	-50.1	174.1	-67.1	166	0	0	0	110.5	W216 V281 Y283 R287 I288 F289	W216-I285 HydrophobicContact CH2-CB 4.16Å; W216-I285 HydrophobicContact CH2-CG1 3.58Å; W216-I285 HydrophobicContact CZ3-CB 4.34Å; W216-I285 HydrophobicContact CZ3-CG1 3.56Å; V281-I285 HydrophobicContact CG1-CD1 4.03Å; V281-I285 HydrophobicContact CG1-CG1 4.47Å; V281-I285 VanDerWaalsContact O-CG1 3.3Å; V281-I285 WeakPolarHBondContact O-CG1 3.4Å; V281-I285 PolarHBondContact O-N 2.71Å; Y283-I285 VanDerWaalsContact C-N 3.31Å; Y283-I285 PolarHBondContact O-N 2.85Å; I285-R287 VanDerWaalsContact C-N 3.33Å; I285-R287 PolarHBondContact O-N 2.75Å; I285-I288 PolarHBondContact O-N 3.37Å; I285-F289 HydrophobicContact CG2-CD2 3.86Å; I285-F289 HydrophobicContact CG2-CE2 4.01Å; I285-F289 VanDerWaalsContact O-CD2 3.25Å; I285-F289 WeakPolarHBondContact O-CD2 3.28Å; I285-F289 PolarHBondContact O-N 3.48Å
286	G	85.8	Confident	78.3	Confident	19 Å²	19	51.1 Å²	51.1	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-56.3	-45.3	-180	0	0	0	0	0	113.1	R282 Y283 A284 E290	R282-G286 PolarHBondContact O-N 2.86Å; Y283-G286 PolarHBondContact O-N 3.23Å; Y283-G286 VanDerWaalsContact O-N 3.12Å; A284-G286 VanDerWaalsContact C-N 3.35Å; A284-G286 PolarHBondContact O-N 3.18Å; G286-E290 WeakPolarHBondContact O-CB 3.43Å; G286-E290 VanDerWaalsContact O-CG 3.23Å; G286-E290 WeakPolarHBondContact O-CG 3.33Å; G286-E290 PolarHBondContact O-N 3.14Å
287	R	83.3	Confident	75.2	Confident	77 Å²	77	55.3 Å²	55.3	29%	0.291	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-48	-179.8	-71.1	-84.8	74.7	-169.3	-4.5	113	Y283 A284 I285 F289 E290 E291	Y283-R287 HydrophobicContact CD1-CG 4.11Å; Y283-R287 HydrophobicContact CE1-CG 3.66Å; Y283-R287 PolarHBondContact O-N 2.86Å; Y283-R287 VanDerWaalsContact O-N 3.1Å; A284-R287 PolarHBondContact O-N 3.39Å; I285-R287 VanDerWaalsContact C-N 3.33Å; I285-R287 PolarHBondContact O-N 2.75Å; R287-F289 VanDerWaalsContact C-N 3.27Å; R287-F289 PolarHBondContact O-N 3.25Å; R287-E290 IonicContact CZ-OE2 3.3Å; R287-E290 IonicContact NE-OE2 2.75Å; R287-E290 PolarHBondContact NE-OE2 3.37Å; R287-E290 IonicContact NH2-OE2 3.19Å; R287-E290 PolarHBondContact NH2-OE2 2.88Å; R287-E290 PolarHBondContact O-N 3.47Å; R287-E290 VanDerWaalsContact O-N 3.1Å; R287-E291 PolarHBondContact O-N 2.71Å
288	I	81.9	Confident	72.3	Confident	15 Å²	15	60.2 Å²	60.2	8%	0.077	31%	0.312	C	S	.	.	H	α-helix	trans	-60.3	-36.7	-178.4	-68.4	161.8	0	0	0	111.9	W216 M217 A284 I285	W216-I288 HydrophobicContact CD2-CD1 4.05Å; W216-I288 HydrophobicContact CE3-CD1 3.53Å; W216-I288 HydrophobicContact CH2-CB 4.5Å; W216-I288 HydrophobicContact CH2-CD1 3.63Å; W216-I288 HydrophobicContact CZ2-CD1 4.14Å; W216-I288 HydrophobicContact CZ2-CG2 4.44Å; W216-I288 HydrophobicContact CZ3-CD1 3.31Å; M217-I288 HydrophobicContact CG-CD1 3.59Å; M217-I288 HydrophobicContact CG-CG1 4.06Å; M217-I288 HydrophobicContact SD-CD1 4.11Å; M217-I288 HydrophobicContact SD-CG1 4.26Å; A284-I288 WeakPolarHBondContact O-CD1 3.24Å; A284-I288 WeakPolarHBondContact O-CG1 3.49Å; A284-I288 PolarHBondContact O-N 2.98Å; A284-I288 VanDerWaalsContact O-N 3.08Å; I285-I288 PolarHBondContact O-N 3.37Å
289	F	80.7	Confident	69.4	Low	57 Å²	57	63.8 Å²	63.8	25%	0.25	34%	0.34	C	S	.	.	H	α-helix	trans	-85.1	-20.1	178.2	-73.7	-76	0	0	0	113.7	W216 I227 I285 R287	W216-F289 HydrophobicContact CH2-CE2 4.26Å; W216-F289 HydrophobicContact CZ2-CE2 4.26Å; I227-F289 HydrophobicContact CG1-CE1 4.24Å; I227-F289 HydrophobicContact CG1-CZ 4.3Å; I285-F289 HydrophobicContact CG2-CD2 3.86Å; I285-F289 HydrophobicContact CG2-CE2 4.01Å; I285-F289 VanDerWaalsContact O-CD2 3.25Å; I285-F289 WeakPolarHBondContact O-CD2 3.28Å; I285-F289 PolarHBondContact O-N 3.48Å; R287-F289 VanDerWaalsContact C-N 3.27Å; R287-F289 PolarHBondContact O-N 3.25Å
290	E	73.7	Confident	66.3	Low	94 Å²	94	68.5 Å²	68.5	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-79.1	-40.9	173.3	-79.7	171.8	-176.6	0	0	112.3	G286 R287 G292 Q293	G286-E290 WeakPolarHBondContact O-CB 3.43Å; G286-E290 VanDerWaalsContact O-CG 3.23Å; G286-E290 WeakPolarHBondContact O-CG 3.33Å; G286-E290 PolarHBondContact O-N 3.14Å; R287-E290 IonicContact CZ-OE2 3.3Å; R287-E290 IonicContact NE-OE2 2.75Å; R287-E290 PolarHBondContact NE-OE2 3.37Å; R287-E290 IonicContact NH2-OE2 3.19Å; R287-E290 PolarHBondContact NH2-OE2 2.88Å; R287-E290 PolarHBondContact O-N 3.47Å; R287-E290 VanDerWaalsContact O-N 3.1Å; E290-G292 PolarHBondContact O-N 3.31Å; E290-G292 VanDerWaalsContact O-N 3.15Å; E290-Q293 VanDerWaalsContact O-CB 3.24Å; E290-Q293 WeakPolarHBondContact O-CB 3.28Å; E290-Q293 PolarHBondContact O-N 3.01Å
291	E	58.5	Low	63.3	Low	83 Å²	83	74.1 Å²	74.1	39%	0.388	41%	0.409	S	S	.	.	H	α-helix	trans	-58.1	-29.3	177.2	-78.5	170.6	-172.4	0	0	112.6	R287 Q293 D294	R287-E291 PolarHBondContact O-N 2.71Å; E291-Q293 PolarHBondContact O-N 3.25Å; E291-Q293 VanDerWaalsContact O-N 3.12Å; E291-D294 PolarHBondContact O-N 3.16Å
292	G	51.9	Low	60.4	Low	15 Å²	15	79 Å²	79	16%	0.155	44%	0.44	C	S	.	.	H	α-helix	trans	-67.8	-2.8	171.5	0	0	0	0	0	115.3	E290	E290-G292 PolarHBondContact O-N 3.31Å; E290-G292 VanDerWaalsContact O-N 3.15Å
293	Q	47.8	Very low	57.6	Low	103 Å²	103	82.1 Å²	82.1	48%	0.481	47%	0.467	S	S	.	.	H	α-helix	trans	-83.6	-43.8	170.6	-70.8	-171.2	8.9	0	0	111.9	E290 E291 S296	E290-Q293 VanDerWaalsContact O-CB 3.24Å; E290-Q293 WeakPolarHBondContact O-CB 3.28Å; E290-Q293 PolarHBondContact O-N 3.01Å; E291-Q293 PolarHBondContact O-N 3.25Å; E291-Q293 VanDerWaalsContact O-N 3.12Å; Q293-S296 PolarHBondContact O-N 3.16Å; Q293-S296 PolarHBondContact O-OG 3.04Å
294	D	50	Low	54.6	Low	123 Å²	123	86.3 Å²	86.3	66%	0.658	50%	0.498	S	S	*	.	H	α-helix	trans	-76.8	-29.3	-168.1	-66	-23.2	0	0	0	112.4	E291 S296	E291-D294 PolarHBondContact O-N 3.16Å; D294-S296 VanDerWaalsContact C-N 3.28Å; D294-S296 PolarHBondContact O-N 3.48Å
295	E	49.2	Very low	51.9	Low	166 Å²	166	92.5 Å²	92.5	78%	0.776	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.1	175.8	-86	-173.2	151.5	0	0	114.4
296	S	42.8	Very low	49.4	Very low	85 Å²	85	97.3 Å²	97.3	59%	0.594	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	1.3	-173.6	61.7	0	0	0	0	115.1	Q293 D294	Q293-S296 PolarHBondContact O-N 3.16Å; Q293-S296 PolarHBondContact O-OG 3.04Å; D294-S296 VanDerWaalsContact C-N 3.28Å; D294-S296 PolarHBondContact O-N 3.48Å
297	T	32.3	Very low	47	Very low	94 Å²	94	101.5 Å²	101.5	58%	0.577	60%	0.6	S	S	*	*	S	Bend	trans	-119.8	113.7	-179.6	-35.6	0	0	0	0	109.6
298	P	34.4	Very low	44.6	Very low	103 Å²	103	102.5 Å²	102.5	67%	0.669	62%	0.624	S	S	*	*			trans	-62.9	140.2	171.7	17.5	-16.5	0	0	0	109	S300	P298-S300 PolarHBondContact O-N 3.4Å
299	P	36.4	Very low	42.6	Very low	125 Å²	125	108.8 Å²	108.8	81%	0.812	66%	0.657	S	S	*	*			trans	-60.9	112.7	178.8	25.1	-30.9	0	0	0	108	P301	P299-P301 WeakPolarHBondContact O-CD 3.3Å
300	S	29.4	Very low	40.8	Very low	98 Å²	98	112.9 Å²	112.9	69%	0.685	68%	0.681	S	S	*	*			trans	-68.9	121.3	177.7	-50.4	0	0	0	0	108.3	P298 T302	P298-S300 PolarHBondContact O-N 3.4Å; S300-T302 VanDerWaalsContact C-N 3.29Å; S300-T302 PolarHBondContact O-N 3.48Å
301	P	33.8	Very low	39.2	Very low	118 Å²	118	115.8 Å²	115.8	77%	0.766	70%	0.7	S	S	*	*			trans	-82.7	77.1	179.1	33.4	-30.7	0	0	0	108.2	P299	P299-P301 WeakPolarHBondContact O-CD 3.3Å
302	T	32	Very low	38.1	Very low	117 Å²	117	120.3 Å²	120.3	72%	0.718	72%	0.721	S	S	*	*			trans	-154.9	61.2	177.3	-23.1	0	0	0	0	113.4	S300	S300-T302 VanDerWaalsContact C-N 3.29Å; S300-T302 PolarHBondContact O-N 3.48Å
303	T	34	Very low	37.6	Very low	141 Å²	141	128.8 Å²	128.8	87%	0.865	76%	0.756	S	S	*	*			trans	-153.9	58.9	148.2	-33.4	0	0	0	0	110.7
304	T	30.2	Very low	36.9	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	77%	0.772	S	S	*	*			trans	-122.7	45	174.2	-1.6	0	0	0	0	110.8
305	V	33.5	Very low	36.4	Very low	129 Å²	129	133 Å²	133	78%	0.782	78%	0.78	S	S	*	*	S	Bend	trans	-151	87.8	171	-172.1	0	0	0	0	109.1
306	T	36.2	Very low	35.5	Very low	148 Å²	148	132.2 Å²	132.2	91%	0.908	78%	0.781	S	S	*	*	S	Bend	trans	174.6	18.6	148.7	34.1	0	0	0	0	115.6
307	A	35.4	Very low	35	Very low	107 Å²	107	136.8 Å²	136.8	88%	0.884	79%	0.793	S	S	*	*			trans	-130.6	27.7	178.6	0	0	0	0	0	114.8
308	A	32.7	Very low	34.9	Very low	98 Å²	98	136.8 Å²	136.8	81%	0.81	80%	0.797	S	S	*	*			trans	-111.5	51.4	179.2	0	0	0	0	0	112.1
309	I	40.7	Very low	34.6	Very low	148 Å²	148	138.9 Å²	138.9	76%	0.759	80%	0.803	S	S	*	*	S	Bend	trans	-145.6	115.7	164.2	-58.2	-177.4	0	0	0	108.1
310	N	41.4	Very low	34.3	Very low	142 Å²	142	138.1 Å²	138.1	76%	0.759	80%	0.8	S	S	*	*	S	Bend	trans	96.6	114.3	165.2	-58.1	-18.9	0	0	0	119.6
311	N	41.2	Very low	34.2	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	81%	0.808	S	S	*	*			trans	105	94.9	148.2	-62.3	-11.8	0	0	0	118.2	H313	N311-H313 PolarHBondContact O-N 2.94Å
312	H	35.3	Very low	33.9	Very low	179 Å²	179	139.1 Å²	139.1	83%	0.829	80%	0.803	S	S	*	*			trans	-35.6	122.9	146	-85.7	-68.6	0	0	0	112.5
313	H	40.9	Very low	34	Very low	193 Å²	193	138 Å²	138	89%	0.894	80%	0.796	S	S	*	*			trans	-163.4	125.2	131.2	-103.5	-70.9	0	0	0	110	N311 V315	N311-H313 PolarHBondContact O-N 2.94Å; H313-V315 PolarHBondContact O-N 3.44Å
314	H	33.1	Very low	34	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.815	79%	0.792	S	S	*	*			trans	-52.9	122.1	171.3	-90.1	-103.1	0	0	0	112.5
315	V	39.1	Very low	34.5	Very low	137 Å²	137	139.2 Å²	139.2	83%	0.83	79%	0.787	S	S	*	*			trans	-148.9	128.7	143.2	-178.6	0	0	0	0	108.9	H313 Q317	H313-V315 PolarHBondContact O-N 3.44Å; V315-Q317 PolarHBondContact O-N 2.9Å
316	N	31.2	Very low	35.3	Very low	151 Å²	151	141 Å²	141	81%	0.807	79%	0.787	S	S	*	*			trans	-46.1	115.4	175.9	-69.3	-29.3	0	0	0	112.9
317	Q	32.8	Very low	36.5	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	78%	0.775	S	S	*	*			trans	-105.6	79.1	168.5	-156.3	170.6	42.3	0	0	108.6	V315	V315-Q317 PolarHBondContact O-N 2.9Å
318	S	28.7	Very low	38.1	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	74%	0.742	S	S	*	*			trans	-83.2	122.3	162.9	44.2	0	0	0	0	109.4
319	N	29.4	Very low	40.1	Very low	147 Å²	147	133.9 Å²	133.9	79%	0.786	71%	0.709	S	S	*	*	S	Bend	trans	62.6	63.9	147.6	-60.4	-8.7	0	0	0	120.2
320	S	29.2	Very low	42.3	Very low	108 Å²	108	129.3 Å²	129.3	76%	0.755	69%	0.686	S	S	*	*	S	Bend	trans	-125.4	15.7	166.9	71.4	0	0	0	0	116.1
321	C	26.7	Very low	44.7	Very low	126 Å²	126	126.5 Å²	126.5	85%	0.851	67%	0.667	S	S	*	*			trans	-139.5	53.6	176.6	-164.7	0	0	0	0	111.7
322	V	29.4	Very low	47.2	Very low	111 Å²	111	123.1 Å²	123.1	67%	0.673	66%	0.656	S	S	*	*	S	Bend	trans	-114.3	102.2	170.5	-178	0	0	0	0	107.2
323	T	32.4	Very low	49.9	Very low	93 Å²	93	118.3 Å²	118.3	57%	0.571	63%	0.63	S	S	*	*			trans	55	64.2	141.9	-27.7	0	0	0	0	117.8	L325	T323-L325 PolarHBondContact O-N 3.27Å
324	E	34.9	Very low	52.5	Low	167 Å²	167	109.1 Å²	109.1	78%	0.78	59%	0.588	S	S	*	*	S	Bend	trans	-77.1	15.3	163.4	-84.8	-155.3	153.2	0	0	113.2	K348	E324-K348 IonicContact OE1-NZ 2.83Å; E324-K348 PolarHBondContact OE1-NZ 2.97Å; E324-K348 IonicContact OE2-NZ 2.96Å; E324-K348 PolarHBondContact OE2-NZ 2.82Å
325	L	40.6	Very low	55.4	Low	133 Å²	133	103.8 Å²	103.8	70%	0.696	57%	0.565	S	S	*	*			trans	-99.7	10.6	-168.9	-96.8	140.9	0	0	0	115.8	T323	T323-L325 PolarHBondContact O-N 3.27Å
326	E	50.3	Low	58.1	Low	167 Å²	167	99.1 Å²	99.1	78%	0.78	53%	0.533	S	S	*	.	S	Bend	trans	-117.6	1.6	-168.6	-94.7	-172.3	165.9	0	0	119.2
327	E	62	Low	61.2	Low	144 Å²	144	92 Å²	92	67%	0.673	49%	0.494	S	S	*	.			trans	-132.2	66.2	-177.3	-78.4	-169	161.9	0	0	114.9
328	F	69.4	Low	64.2	Low	42 Å²	42	83.3 Å²	83.3	18%	0.184	45%	0.454	C	S	.	.			trans	-101.7	127.2	160.3	-175.7	-101	0	0	0	110	V213 M217 Y283 A284	V213-F328 HydrophobicContact CG1-CE1 4.13Å; V213-F328 HydrophobicContact CG1-CZ 4.42Å; M217-F328 HydrophobicContact CE-CD1 3.93Å; M217-F328 HydrophobicContact CE-CE1 3.95Å; M217-F328 HydrophobicContact SD-CD1 3.33Å; M217-F328 WeakPolarHBondContact SD-CD1 3.28Å; M217-F328 HydrophobicContact SD-CE1 3.47Å; M217-F328 WeakPolarHBondContact SD-CE1 3.48Å; Y283-F328 HydrophobicContact CD1-CE2 4.03Å; Y283-F328 HydrophobicContact CD1-CZ 4.47Å; Y283-F328 AromaticContact CE1-CE2 3.95Å; Y283-F328 HydrophobicContact CE1-CE2 3.95Å; A284-F328 HydrophobicContact CB-CE1 3.91Å; A284-F328 HydrophobicContact CB-CZ 3.6Å
329	P	74.5	Confident	67.4	Low	17 Å²	17	82.6 Å²	82.6	11%	0.11	44%	0.442	C	S	.	.			cis	-110.6	132.2	1.4	38.2	-22.4	0	0	0	113.1	F210 L214 M217 F280	F210-P329 HydrophobicContact CE2-CB 4Å; F210-P329 HydrophobicContact CE2-CG 3.93Å; F210-P329 HydrophobicContact CZ-CG 4.23Å; L214-P329 HydrophobicContact CD2-CG 3.39Å; L214-P329 HydrophobicContact CG-CG 3.95Å; M217-P329 HydrophobicContact CE-CG 3.63Å; F280-P329 HydrophobicContact CZ-CB 4.31Å
330	N	87	Confident	70.5	Confident	53 Å²	53	75.6 Å²	75.6	28%	0.283	41%	0.405	S	S	.	.			trans	-82.3	121.3	175.9	-171.1	-51.6	0	0	0	112.3	S332 R333 Y334	N330-S332 VanDerWaalsContact C-N 3.31Å; N330-S332 PolarHBondContact O-N 3.19Å; N330-S332 VanDerWaalsContact OD1-CB 3.3Å; N330-S332 WeakPolarHBondContact OD1-CB 3.24Å; N330-S332 PolarHBondContact OD1-N 3.45Å; N330-R333 HydrophobicContact CB-CB 4.39Å; N330-R333 HydrophobicContact CB-CG 4.01Å; N330-R333 PolarHBondContact O-N 3.2Å; N330-Y334 PolarHBondContact O-N 3.39Å
331	F	91.6	Very high	73.7	Confident	82 Å²	82	71 Å²	71	36%	0.36	37%	0.373	S	S	.	.	H	α-helix	trans	-58	-38.4	-178.9	-176.7	-111.5	0	0	0	113.5	I206 F210 R333 Y334 L335	I206-F331 HydrophobicContact CG2-CE2 3.83Å; I206-F331 HydrophobicContact CG2-CZ 3.76Å; F210-F331 AromaticContact CD1-CD2 3.67Å; F210-F331 HydrophobicContact CD1-CD2 3.67Å; F210-F331 HydrophobicContact CD1-CE2 4.29Å; F210-F331 HydrophobicContact CD2-CD2 4.25Å; F210-F331 HydrophobicContact CE1-CB 3.93Å; F210-F331 AromaticContact CE1-CD2 3.59Å; F210-F331 HydrophobicContact CE1-CD2 3.59Å; F210-F331 HydrophobicContact CE1-CG 4.18Å; F210-F331 HydrophobicContact CE2-CB 4.13Å; F210-F331 HydrophobicContact CE2-CD2 4.2Å; F210-F331 HydrophobicContact CG-CD2 4.01Å; F210-F331 HydrophobicContact CZ-CB 3.57Å; F210-F331 AromaticContact CZ-CD2 3.9Å; F210-F331 HydrophobicContact CZ-CD2 3.9Å; F210-F331 HydrophobicContact CZ-CG 4.23Å; F331-R333 VanDerWaalsContact C-N 3.35Å; F331-R333 PolarHBondContact O-N 2.95Å; F331-Y334 PolarHBondContact O-N 2.78Å; F331-L335 WeakPolarHBondContact O-CB 3.35Å; F331-L335 PolarHBondContact O-N 3.06Å
332	S	92.6	Very high	77	Confident	84 Å²	84	65.2 Å²	65.2	59%	0.587	33%	0.333	S	S	*	.	H	α-helix	trans	-64.2	-39.9	180	-177.8	0	0	0	0	111.8	N330 L335 Y336	N330-S332 VanDerWaalsContact C-N 3.31Å; N330-S332 PolarHBondContact O-N 3.19Å; N330-S332 VanDerWaalsContact OD1-CB 3.3Å; N330-S332 WeakPolarHBondContact OD1-CB 3.24Å; N330-S332 PolarHBondContact OD1-N 3.45Å; S332-L335 PolarHBondContact O-N 3.01Å; S332-Y336 WeakPolarHBondContact O-CB 3.5Å; S332-Y336 PolarHBondContact O-N 3.34Å
333	R	93.1	Very high	80.2	Confident	79 Å²	79	60.4 Å²	60.4	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-67	-39.6	176.6	-61.3	-179.1	-172.7	170.4	4.5	111.4	N330 F331 Y336 F337 E347	N330-R333 HydrophobicContact CB-CB 4.39Å; N330-R333 HydrophobicContact CB-CG 4.01Å; N330-R333 PolarHBondContact O-N 3.2Å; F331-R333 VanDerWaalsContact C-N 3.35Å; F331-R333 PolarHBondContact O-N 2.95Å; R333-Y336 PolarHBondContact O-N 2.98Å; R333-F337 PolarHBondContact O-N 3.39Å; R333-E347 WeakPolarHBondContact CD-O 3.11Å; R333-E347 IonicContact NH1-OE2 3.56Å
334	Y	94.1	Very high	83.1	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-47.9	174.5	178.7	-117.2	0	0	0	112.1	T205 I206 F210 F280 N330 F331 Y336 F337 L338	T205-Y334 PolarHBondContact O-OH 3.46Å; I206-Y334 WeakPolarHBondContact O-CE1 3.03Å; F210-Y334 HydrophobicContact CB-CD1 3.9Å; F210-Y334 HydrophobicContact CB-CE1 3.81Å; F210-Y334 AromaticContact CD2-CD1 3.78Å; F210-Y334 HydrophobicContact CD2-CD1 3.78Å; F210-Y334 HydrophobicContact CD2-CE1 4.5Å; F210-Y334 AromaticContact CD2-CG 3.96Å; F210-Y334 HydrophobicContact CD2-CG 3.96Å; F210-Y334 HydrophobicContact CG-CD1 4.09Å; F210-Y334 HydrophobicContact CG-CE1 4.5Å; F280-Y334 HydrophobicContact CB-CD2 4.24Å; F280-Y334 HydrophobicContact CB-CE2 3.77Å; F280-Y334 HydrophobicContact CD1-CD2 4.09Å; F280-Y334 AromaticContact CD1-CE2 3.72Å; F280-Y334 HydrophobicContact CD1-CE2 3.72Å; F280-Y334 AromaticContact CD2-CD2 3.38Å; F280-Y334 HydrophobicContact CD2-CD2 3.38Å; F280-Y334 AromaticContact CD2-CE2 3.75Å; F280-Y334 HydrophobicContact CD2-CE2 3.75Å; F280-Y334 HydrophobicContact CD2-CG 4.36Å; F280-Y334 HydrophobicContact CE1-CD2 4.3Å; F280-Y334 HydrophobicContact CE1-CE2 4.24Å; F280-Y334 AromaticContact CE2-CD2 3.62Å; F280-Y334 HydrophobicContact CE2-CD2 3.62Å; F280-Y334 HydrophobicContact CE2-CE2 4.26Å; F280-Y334 HydrophobicContact CE2-CG 4.19Å; F280-Y334 AromaticContact CG-CD2 3.63Å; F280-Y334 HydrophobicContact CG-CD2 3.63Å; F280-Y334 AromaticContact CG-CE2 3.44Å; F280-Y334 HydrophobicContact CG-CE2 3.44Å; F280-Y334 VanDerWaalsContact CG-CE2 3.44Å; F280-Y334 HydrophobicContact CZ-CD2 4.09Å; F280-Y334 HydrophobicContact CZ-CE2 4.48Å; F280-Y334 HydrophobicContact CZ-CG 4.44Å; N330-Y334 PolarHBondContact O-N 3.39Å; F331-Y334 PolarHBondContact O-N 2.78Å; Y334-Y336 VanDerWaalsContact C-N 3.32Å; Y334-Y336 PolarHBondContact O-N 3.3Å; Y334-F337 WeakPolarHBondContact O-CB 3.42Å; Y334-F337 PolarHBondContact O-N 3.3Å; Y334-F337 VanDerWaalsContact O-N 3.16Å; Y334-L338 HydrophobicContact CD1-CD1 4.18Å; Y334-L338 HydrophobicContact CE1-CD1 3.61Å; Y334-L338 HydrophobicContact CE1-CG 4.2Å; Y334-L338 HydrophobicContact CE2-CD1 4.43Å; Y334-L338 HydrophobicContact CE2-CD2 4.15Å; Y334-L338 HydrophobicContact CE2-CG 4.16Å; Y334-L338 PolarHBondContact O-N 3.31Å
335	L	95.1	Very high	86	Confident	64 Å²	64	48.2 Å²	48.2	34%	0.335	24%	0.24	S	C	.	.	H	α-helix	trans	-60.8	-41.7	177.5	-175.5	63.1	0	0	0	111.8	I206 F331 S332 F337 L338 L339	I206-L335 HydrophobicContact CD1-CD1 4.16Å; I206-L335 HydrophobicContact CG1-CD1 4.35Å; F331-L335 WeakPolarHBondContact O-CB 3.35Å; F331-L335 PolarHBondContact O-N 3.06Å; S332-L335 PolarHBondContact O-N 3.01Å; L335-F337 PolarHBondContact O-N 2.93Å; L335-L338 PolarHBondContact O-N 3.24Å; L335-L339 PolarHBondContact O-N 3.41Å
336	Y	95.8	Very high	88.3	Confident	39 Å²	39	44.5 Å²	44.5	15%	0.153	22%	0.217	C	C	.	.	H	α-helix	trans	-57.3	-48.2	173.7	-178	-96.8	0	0	0	111.6	S332 R333 Y334 L338 L339 A340 Y349 L434 F436	S332-Y336 WeakPolarHBondContact O-CB 3.5Å; S332-Y336 PolarHBondContact O-N 3.34Å; R333-Y336 PolarHBondContact O-N 2.98Å; Y334-Y336 VanDerWaalsContact C-N 3.32Å; Y334-Y336 PolarHBondContact O-N 3.3Å; Y336-L338 VanDerWaalsContact C-N 3.32Å; Y336-L338 PolarHBondContact O-N 3.41Å; Y336-L339 PolarHBondContact O-N 3.19Å; Y336-A340 HydrophobicContact CD1-CB 4.42Å; Y336-A340 HydrophobicContact CE1-CB 4.18Å; Y336-A340 WeakPolarHBondContact O-CB 3.43Å; Y336-A340 PolarHBondContact O-N 3.39Å; Y336-Y349 AromaticContact CD1-CD2 3.98Å; Y336-Y349 HydrophobicContact CD1-CD2 3.98Å; Y336-Y349 HydrophobicContact CD1-CE2 4.35Å; Y336-Y349 AromaticContact CE1-CD2 3.81Å; Y336-Y349 HydrophobicContact CE1-CD2 3.81Å; Y336-Y349 HydrophobicContact CE1-CG 4.48Å; Y336-L434 HydrophobicContact CE2-CB 4.13Å; Y336-L434 WeakPolarHBondContact CE2-O 3.36Å; Y336-L434 PolarHBondContact OH-O 2.94Å; Y336-F436 HydrophobicContact CE1-CD2 4.36Å
337	F	96.1	Very high	90	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-40.5	177.3	164.9	-112.5	0	0	0	112.6	K276 A279 R333 Y334 L335 L339 A340 T342 Y345 Y349	K276-F337 HydrophobicContact CB-CE1 3.71Å; K276-F337 HydrophobicContact CB-CZ 3.96Å; K276-F337 HydrophobicContact CD-CE1 4.18Å; K276-F337 HydrophobicContact CD-CZ 4.21Å; K276-F337 HydrophobicContact CG-CE1 3.98Å; K276-F337 HydrophobicContact CG-CZ 3.82Å; K276-F337 PolarHBondContact NZ-O 2.97Å; K276-F337 WeakPolarHBondContact O-CE1 3.33Å; A279-F337 HydrophobicContact CB-CE1 4.46Å; A279-F337 HydrophobicContact CB-CZ 3.88Å; R333-F337 PolarHBondContact O-N 3.39Å; Y334-F337 WeakPolarHBondContact O-CB 3.42Å; Y334-F337 PolarHBondContact O-N 3.3Å; Y334-F337 VanDerWaalsContact O-N 3.16Å; L335-F337 PolarHBondContact O-N 2.93Å; F337-L339 PolarHBondContact O-N 2.63Å; F337-L339 VanDerWaalsContact O-N 3.16Å; F337-A340 PolarHBondContact O-N 2.91Å; F337-T342 HydrophobicContact CD2-CG2 4.24Å; F337-T342 HydrophobicContact CE2-CG2 4.3Å; F337-Y345 HydrophobicContact CB-CD2 3.65Å; F337-Y345 HydrophobicContact CB-CE2 3.79Å; F337-Y345 AromaticContact CD1-CD2 3.52Å; F337-Y345 HydrophobicContact CD1-CD2 3.52Å; F337-Y345 HydrophobicContact CD1-CE2 4.22Å; F337-Y345 HydrophobicContact CD1-CG 4.45Å; F337-Y345 AromaticContact CD2-CD2 3.92Å; F337-Y345 HydrophobicContact CD2-CD2 3.92Å; F337-Y345 HydrophobicContact CE1-CD2 4.04Å; F337-Y345 HydrophobicContact CE2-CD2 4.41Å; F337-Y345 AromaticContact CG-CD2 3.42Å; F337-Y345 HydrophobicContact CG-CD2 3.42Å; F337-Y345 VanDerWaalsContact CG-CD2 3.42Å; F337-Y345 HydrophobicContact CG-CE2 4.07Å; F337-Y345 HydrophobicContact CG-CG 4.47Å; F337-Y345 HydrophobicContact CZ-CD2 4.46Å; F337-Y349 HydrophobicContact CB-CE2 4.48Å; F337-Y349 WeakPolarHBondContact CD2-OH 3.24Å
338	L	95.4	Very high	91.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-27.9	179.5	-73	-179.7	0	0	0	112.9	K202 T205 I206 K276 Y334 L335 Y336	K202-L338 PolarHBondContact NZ-O 3.43Å; T205-L338 HydrophobicContact CG2-CD2 4.04Å; I206-L338 HydrophobicContact CB-CD1 4.34Å; I206-L338 HydrophobicContact CG1-CD1 3.52Å; K276-L338 HydrophobicContact CB-CD2 4.14Å; K276-L338 HydrophobicContact CD-CD2 4.25Å; K276-L338 PolarHBondContact NZ-O 2.79Å; Y334-L338 HydrophobicContact CD1-CD1 4.18Å; Y334-L338 HydrophobicContact CE1-CD1 3.61Å; Y334-L338 HydrophobicContact CE1-CG 4.2Å; Y334-L338 HydrophobicContact CE2-CD1 4.43Å; Y334-L338 HydrophobicContact CE2-CD2 4.15Å; Y334-L338 HydrophobicContact CE2-CG 4.16Å; Y334-L338 PolarHBondContact O-N 3.31Å; L335-L338 PolarHBondContact O-N 3.24Å; Y336-L338 VanDerWaalsContact C-N 3.32Å; Y336-L338 PolarHBondContact O-N 3.41Å
339	L	95.3	Very high	92.5	Very high	78 Å²	78	37 Å²	37	41%	0.408	18%	0.18	S	C	.	.	H	α-helix	trans	-96.4	-28.1	176.6	-62	174.5	0	0	0	113.3	L335 Y336 F337 L434	L335-L339 PolarHBondContact O-N 3.41Å; Y336-L339 PolarHBondContact O-N 3.19Å; F337-L339 PolarHBondContact O-N 2.63Å; F337-L339 VanDerWaalsContact O-N 3.16Å; L339-L434 HydrophobicContact CB-CD1 3.77Å; L339-L434 HydrophobicContact CB-CD2 4.1Å; L339-L434 HydrophobicContact CD1-CD2 4.46Å; L339-L434 WeakPolarHBondContact O-CD1 3.48Å
340	A	95.6	Very high	93.4	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.008	18%	0.184	C	C	.	.	S	Bend	trans	-58.6	143.7	-178	0	0	0	0	0	112.4	K276 Y336 F337 T342 F436	K276-A340 PolarHBondContact NZ-O 2.94Å; Y336-A340 HydrophobicContact CD1-CB 4.42Å; Y336-A340 HydrophobicContact CE1-CB 4.18Å; Y336-A340 WeakPolarHBondContact O-CB 3.43Å; Y336-A340 PolarHBondContact O-N 3.39Å; F337-A340 PolarHBondContact O-N 2.91Å; A340-T342 HydrophobicContact CB-CG2 4.26Å; A340-T342 PolarHBondContact O-N 3.23Å; A340-F436 HydrophobicContact CB-CD2 4.33Å
341	P	96.1	Very high	93.7	Very high	12 Å²	12	41.6 Å²	41.6	8%	0.078	20%	0.195	C	C	.	.	S	Bend	trans	-78.4	52.6	179.2	31.8	-33	0	0	0	111.9	L427 A431 F436 F441 I461	P341-L427 HydrophobicContact CB-CB 4.4Å; P341-L427 HydrophobicContact CB-CD2 3.83Å; P341-A431 HydrophobicContact CG-CB 3.81Å; P341-F436 HydrophobicContact CG-CD1 3.83Å; P341-F436 HydrophobicContact CG-CE1 4.32Å; P341-F436 HydrophobicContact CG-CG 4.35Å; P341-F441 HydrophobicContact CB-CE1 4.03Å; P341-F441 HydrophobicContact CB-CZ 4.17Å; P341-F441 HydrophobicContact CG-CE1 3.92Å; P341-F441 HydrophobicContact CG-CZ 3.84Å; P341-I461 WeakPolarHBondContact O-CD1 3.4Å
342	T	96	Very high	93.8	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	19%	0.185	C	C	.	.			trans	-143.6	154.6	172.2	-172.8	0	0	0	0	110.3	Y130 K276 F337 A340 V344 Y349 F436	Y130-T342 PolarHBondContact OH-OG1 3.33Å; K276-T342 VanDerWaalsContact CE-O 3.24Å; K276-T342 WeakPolarHBondContact CE-O 3.47Å; F337-T342 HydrophobicContact CD2-CG2 4.24Å; F337-T342 HydrophobicContact CE2-CG2 4.3Å; A340-T342 HydrophobicContact CB-CG2 4.26Å; A340-T342 PolarHBondContact O-N 3.23Å; T342-V344 PolarHBondContact OG1-N 3.33Å; T342-Y349 HydrophobicContact CG2-CE1 3.85Å; T342-F436 HydrophobicContact CG2-CE2 4.18Å; T342-F436 HydrophobicContact CG2-CZ 3.96Å
343	L	96.7	Very high	93.8	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.058	20%	0.199	C	C	.	.	S	Bend	trans	-110.2	-4.9	178.1	-65.4	177	0	0	0	112.9	R272 M275 K276 A279 I461 V462 W465	R272-L343 HydrophobicContact CG-CD2 4.14Å; M275-L343 HydrophobicContact CB-CD1 4.44Å; M275-L343 HydrophobicContact CB-CD2 4.21Å; M275-L343 HydrophobicContact CE-CD1 3.47Å; M275-L343 VanDerWaalsContact CE-CD1 3.47Å; M275-L343 HydrophobicContact SD-CD1 3.87Å; K276-L343 HydrophobicContact CD-CD2 4.39Å; K276-L343 HydrophobicContact CG-CD2 3.62Å; A279-L343 WeakPolarHBondContact CB-O 3.28Å; L343-I461 HydrophobicContact CB-CG2 3.98Å; L343-I461 HydrophobicContact CD1-CG2 3.7Å; L343-I461 HydrophobicContact CG-CG2 3.49Å; L343-I461 VanDerWaalsContact CG-CG2 3.49Å; L343-V462 HydrophobicContact CD1-CG2 4.1Å; L343-W465 HydrophobicContact CB-CB 3.96Å; L343-W465 HydrophobicContact CB-CG 4.16Å; L343-W465 HydrophobicContact CD1-CB 4.35Å
344	V	94	Very high	93.9	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	21%	0.211	C	C	.	.	S	Bend	trans	-104.1	113.4	178.4	175.6	0	0	0	0	109.7	Y130 T342 Y349 D464 Y469	Y130-V344 WeakPolarHBondContact OH-CB 3.36Å; Y130-V344 PolarHBondContact OH-O 2.94Å; T342-V344 PolarHBondContact OG1-N 3.33Å; V344-Y349 PolarHBondContact O-OH 3.49Å; V344-Y349 VanDerWaalsContact O-OH 3.12Å; V344-D464 HydrophobicContact CG2-CB 4.15Å; V344-Y469 HydrophobicContact CG2-CE2 4.12Å
345	Y	94.1	Very high	93.9	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.008	23%	0.225	C	C	.	.			trans	-69.5	136.5	-177.7	-174.1	-101.2	0	0	0	112.5	F280 Y283 F337 Y349 Y469	F280-Y345 HydrophobicContact CD2-CD1 4.19Å; F280-Y345 HydrophobicContact CD2-CD2 4.18Å; F280-Y345 AromaticContact CD2-CE1 3.97Å; F280-Y345 HydrophobicContact CD2-CE1 3.97Å; F280-Y345 AromaticContact CD2-CE2 3.97Å; F280-Y345 HydrophobicContact CD2-CE2 3.97Å; F280-Y345 HydrophobicContact CD2-CG 4.29Å; F280-Y345 AromaticContact CD2-CZ 3.84Å; F280-Y345 HydrophobicContact CE2-CE1 4.26Å; F280-Y345 HydrophobicContact CE2-CE2 4.46Å; Y283-Y345 AromaticContact CD1-CD1 3.48Å; Y283-Y345 HydrophobicContact CD1-CD1 3.48Å; Y283-Y345 VanDerWaalsContact CD1-CD1 3.48Å; Y283-Y345 AromaticContact CD1-CE1 3.56Å; Y283-Y345 HydrophobicContact CD1-CE1 3.56Å; Y283-Y345 HydrophobicContact CD2-CD1 4.03Å; Y283-Y345 HydrophobicContact CE1-CD1 4.03Å; Y283-Y345 AromaticContact CE1-CE1 3.81Å; Y283-Y345 HydrophobicContact CE1-CE1 3.81Å; Y283-Y345 AromaticContact CG-CD1 3.49Å; Y283-Y345 HydrophobicContact CG-CD1 3.49Å; Y283-Y345 VanDerWaalsContact CG-CD1 3.49Å; Y283-Y345 HydrophobicContact CG-CE1 4.08Å; F337-Y345 HydrophobicContact CB-CD2 3.65Å; F337-Y345 HydrophobicContact CB-CE2 3.79Å; F337-Y345 AromaticContact CD1-CD2 3.52Å; F337-Y345 HydrophobicContact CD1-CD2 3.52Å; F337-Y345 HydrophobicContact CD1-CE2 4.22Å; F337-Y345 HydrophobicContact CD1-CG 4.45Å; F337-Y345 AromaticContact CD2-CD2 3.92Å; F337-Y345 HydrophobicContact CD2-CD2 3.92Å; F337-Y345 HydrophobicContact CE1-CD2 4.04Å; F337-Y345 HydrophobicContact CE2-CD2 4.41Å; F337-Y345 AromaticContact CG-CD2 3.42Å; F337-Y345 HydrophobicContact CG-CD2 3.42Å; F337-Y345 VanDerWaalsContact CG-CD2 3.42Å; F337-Y345 HydrophobicContact CG-CE2 4.07Å; F337-Y345 HydrophobicContact CG-CG 4.47Å; F337-Y345 HydrophobicContact CZ-CD2 4.46Å; Y345-Y349 VanDerWaalsContact CA-OH 3.29Å; Y345-Y349 WeakPolarHBondContact CA-OH 3.41Å; Y345-Y469 PolarHBondContact N-OH 3.41Å
346	R	90.8	Very high	94	Very high	56 Å²	56	51 Å²	51	21%	0.211	23%	0.229	C	C	.	.			trans	-144	152.5	169.3	-62	-65.5	-178.9	-110.4	5.9	108.5	Y130 Y349	Y130-R346 HydrophobicContact CD2-CG 3.84Å; Y130-R346 HydrophobicContact CE2-CB 4.47Å; Y130-R346 HydrophobicContact CE2-CG 3.45Å; Y130-R346 VanDerWaalsContact CE2-CG 3.45Å; R346-Y349 HydrophobicContact CB-CD1 4.29Å; R346-Y349 HydrophobicContact CB-CE1 3.79Å; R346-Y349 HydrophobicContact CG-CE1 4.14Å; R346-Y349 PolarHBondContact N-OH 3.39Å; R346-Y349 VanDerWaalsContact O-CE2 3.22Å; R346-Y349 WeakPolarHBondContact O-CE2 3.34Å
347	E	85.8	Confident	94	Very high	53 Å²	53	55.6 Å²	55.6	25%	0.248	25%	0.246	C	C	.	.	S	Bend	trans	-70.9	-38.9	177.3	-75.3	169.4	-142.1	0	0	113.3	Y283 R333	Y283-E347 HydrophobicContact CE1-CG 4.01Å; Y283-E347 WeakPolarHBondContact CE1-OE1 3.41Å; Y283-E347 VanDerWaalsContact OH-CD 3.22Å; Y283-E347 WeakPolarHBondContact OH-CG 3.27Å; Y283-E347 PolarHBondContact OH-OE1 2.81Å; R333-E347 WeakPolarHBondContact CD-O 3.11Å; R333-E347 IonicContact NH1-OE2 3.56Å
348	K	89.8	Confident	94	Very high	120 Å²	120	64.9 Å²	64.9	52%	0.522	28%	0.283	S	S	.	.			trans	-122.4	126.4	179.9	-64.4	178.6	-179.3	173.3	0	109.1	E324	E324-K348 IonicContact OE1-NZ 2.83Å; E324-K348 PolarHBondContact OE1-NZ 2.97Å; E324-K348 IonicContact OE2-NZ 2.96Å; E324-K348 PolarHBondContact OE2-NZ 2.82Å
349	Y	93	Very high	94	Very high	23 Å²	23	66.7 Å²	66.7	9%	0.09	29%	0.29	C	S	.	.			trans	-110.1	148.9	171.2	-62.9	-76.9	0	0	0	109.8	Y130 Y336 F337 T342 V344 Y345 R346 R351 F436	Y130-Y349 HydrophobicContact CD1-CD1 4.26Å; Y130-Y349 HydrophobicContact CD2-CD1 4.21Å; Y130-Y349 HydrophobicContact CD2-CE1 4.34Å; Y130-Y349 HydrophobicContact CE1-CD1 4.22Å; Y130-Y349 HydrophobicContact CE1-CE1 4.19Å; Y130-Y349 HydrophobicContact CE2-CD1 4.16Å; Y130-Y349 AromaticContact CE2-CE1 3.85Å; Y130-Y349 HydrophobicContact CE2-CE1 3.85Å; Y130-Y349 HydrophobicContact CG-CD1 4.24Å; Y130-Y349 AromaticContact CZ-CE1 3.73Å; Y336-Y349 AromaticContact CD1-CD2 3.98Å; Y336-Y349 HydrophobicContact CD1-CD2 3.98Å; Y336-Y349 HydrophobicContact CD1-CE2 4.35Å; Y336-Y349 AromaticContact CE1-CD2 3.81Å; Y336-Y349 HydrophobicContact CE1-CD2 3.81Å; Y336-Y349 HydrophobicContact CE1-CG 4.48Å; F337-Y349 HydrophobicContact CB-CE2 4.48Å; F337-Y349 WeakPolarHBondContact CD2-OH 3.24Å; T342-Y349 HydrophobicContact CG2-CE1 3.85Å; V344-Y349 PolarHBondContact O-OH 3.49Å; V344-Y349 VanDerWaalsContact O-OH 3.12Å; Y345-Y349 VanDerWaalsContact CA-OH 3.29Å; Y345-Y349 WeakPolarHBondContact CA-OH 3.41Å; R346-Y349 HydrophobicContact CB-CD1 4.29Å; R346-Y349 HydrophobicContact CB-CE1 3.79Å; R346-Y349 HydrophobicContact CG-CE1 4.14Å; R346-Y349 PolarHBondContact N-OH 3.39Å; R346-Y349 VanDerWaalsContact O-CE2 3.22Å; R346-Y349 WeakPolarHBondContact O-CE2 3.34Å; Y349-R351 WeakPolarHBondContact O-CG 3.34Å; Y349-R351 PolarHBondContact O-N 2.86Å; Y349-F436 AromaticContact CD1-CE2 3.61Å; Y349-F436 HydrophobicContact CD1-CE2 3.61Å; Y349-F436 HydrophobicContact CD1-CZ 4.27Å; Y349-F436 HydrophobicContact CD2-CE2 4.49Å; Y349-F436 HydrophobicContact CE1-CE2 4.27Å; Y349-F436 HydrophobicContact CG-CD2 4.37Å; Y349-F436 AromaticContact CG-CE2 3.73Å; Y349-F436 HydrophobicContact CG-CE2 3.73Å
350	P	93.6	Very high	94.1	Very high	28 Å²	28	63 Å²	63	18%	0.182	27%	0.271	C	S	.	.			trans	-59.6	134.8	169.2	25.6	-33.1	0	0	0	109.6	Y130 T132 G437 D438	Y130-P350 VanDerWaalsContact CB-CD 3.48Å; T132-P350 WeakPolarHBondContact OG1-CB 3.4Å; P350-G437 WeakPolarHBondContact O-CA 3.5Å; P350-G437 PolarHBondContact O-N 3.19Å; P350-D438 HydrophobicContact CG-CB 4.08Å
351	R	93.4	Very high	94.1	Very high	138 Å²	138	69.4 Å²	69.4	52%	0.521	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-120.1	146	-178.8	-59.5	-172.2	75.3	164.8	3.7	112.2	Y349 R435	Y349-R351 WeakPolarHBondContact O-CG 3.34Å; Y349-R351 PolarHBondContact O-N 2.86Å; R351-R435 CarbonylContact C-O 3.59Å; R351-R435 WeakPolarHBondContact CA-O 3.42Å; R351-R435 WeakPolarHBondContact CB-O 3.36Å
352	T	93.2	Very high	94.1	Very high	24 Å²	24	70.6 Å²	70.6	15%	0.147	31%	0.307	C	S	.	.			trans	-76.7	154.5	171.3	61.7	0	0	0	0	111.1	S354 R435	T352-S354 PolarHBondContact OG1-O 3.11Å; T352-R435 PolarHBondContact N-O 3.13Å; T352-R435 VanDerWaalsContact O-CZ 3.3Å; T352-R435 PolarHBondContact O-NE 3.29Å; T352-R435 PolarHBondContact O-NH2 3.32Å; T352-R435 VanDerWaalsContact OG1-CA 3.28Å; T352-R435 WeakPolarHBondContact OG1-CA 3.48Å; T352-R435 WeakPolarHBondContact OG1-CB 3.46Å
353	R	93.7	Very high	94.1	Very high	237 Å²	237	70.6 Å²	70.6	89%	0.894	31%	0.307	S	S	*	.	S	Bend	trans	-70.7	-43	-178.5	-69.1	-175.6	178.9	177.3	-0.3	112.8	R435	R353-R435 PolarHBondContact O-NH2 3.18Å
354	S	93.6	Very high	94.1	Very high	79 Å²	79	72.8 Å²	72.8	55%	0.552	32%	0.317	S	S	*	.	S	Bend	trans	-136	167.7	-178.6	55.9	0	0	0	0	111.1	T352	T352-S354 PolarHBondContact OG1-O 3.11Å
355	I	96.1	Very high	94.2	Very high	55 Å²	55	78 Å²	78	28%	0.282	34%	0.344	S	S	.	.			trans	-100.7	121.8	173.8	-58	173.5	0	0	0	107.9	W357 V360 E432 M433 R435	I355-W357 HydrophobicContact CG2-CD2 4.06Å; I355-W357 HydrophobicContact CG2-CG 4.37Å; I355-W357 HydrophobicContact CG2-CZ2 4.3Å; I355-W357 PolarHBondContact O-N 2.98Å; I355-V360 HydrophobicContact CG2-CG2 4.27Å; I355-E432 HydrophobicContact CG2-CG 4.32Å; I355-M433 WeakPolarHBondContact CD1-O 3.23Å; I355-R435 HydrophobicContact CD1-CG 4.09Å; I355-R435 HydrophobicContact CG1-CG 3.52Å
356	R	95.6	Very high	94.2	Very high	110 Å²	110	79.3 Å²	79.3	42%	0.415	35%	0.35	S	S	.	.			trans	-88.4	87.2	173.6	-62.2	173.3	-66.8	-179.5	-1.5	109.6	D134 Y358 F359 V360 E432	D134-R356 IonicContact OD1-NH2 3.16Å; R356-Y358 VanDerWaalsContact C-N 3.29Å; R356-Y358 PolarHBondContact O-N 3.36Å; R356-F359 HydrophobicContact CB-CB 3.96Å; R356-F359 WeakPolarHBondContact O-CB 3.49Å; R356-F359 PolarHBondContact O-N 3.3Å; R356-V360 PolarHBondContact O-N 3.38Å; R356-E432 HydrophobicContact CB-CG 4.45Å; R356-E432 WeakPolarHBondContact CB-OE1 3.48Å; R356-E432 IonicContact CZ-OE2 2.8Å; R356-E432 PolarHBondContact N-OE1 3.3Å; R356-E432 IonicContact NE-OE1 2.72Å; R356-E432 PolarHBondContact NE-OE1 3.02Å; R356-E432 IonicContact NE-OE2 3.63Å; R356-E432 PolarHBondContact NE-OE2 3.34Å; R356-E432 IonicContact NH2-OE2 3.62Å; R356-E432 PolarHBondContact NH2-OE2 3.07Å
357	W	96.4	Very high	94.4	Very high	137 Å²	137	77.7 Å²	77.7	52%	0.519	35%	0.346	S	S	.	.	H	α-helix	trans	-56.7	-37.9	-176.6	-75.6	111.1	0	0	0	114.1	I355 F359 V360 F361 M433	I355-W357 HydrophobicContact CG2-CD2 4.06Å; I355-W357 HydrophobicContact CG2-CG 4.37Å; I355-W357 HydrophobicContact CG2-CZ2 4.3Å; I355-W357 PolarHBondContact O-N 2.98Å; W357-F359 VanDerWaalsContact C-N 3.27Å; W357-F359 PolarHBondContact O-N 2.92Å; W357-V360 HydrophobicContact CE3-CB 4.29Å; W357-V360 HydrophobicContact CE3-CG1 4.37Å; W357-V360 HydrophobicContact CE3-CG2 4.41Å; W357-V360 HydrophobicContact CZ3-CG1 4.42Å; W357-V360 WeakPolarHBondContact O-CB 3.49Å; W357-V360 PolarHBondContact O-N 3.13Å; W357-V360 VanDerWaalsContact O-N 3.08Å; W357-F361 HydrophobicContact CB-CD2 4.22Å; W357-F361 HydrophobicContact CB-CE2 3.98Å; W357-F361 HydrophobicContact CE3-CE2 4.21Å; W357-F361 HydrophobicContact CE3-CZ 4.38Å; W357-F361 WeakPolarHBondContact O-CD2 3.36Å; W357-F361 PolarHBondContact O-N 3.16Å; W357-M433 HydrophobicContact CZ3-CG 4.43Å
358	Y	96.4	Very high	94.8	Very high	195 Å²	195	79.7 Å²	79.7	77%	0.765	36%	0.358	S	S	*	.	H	α-helix	trans	-56.6	-41.8	173.9	177	-98.5	0	0	0	112.5	R356 F361 S362	R356-Y358 VanDerWaalsContact C-N 3.29Å; R356-Y358 PolarHBondContact O-N 3.36Å; Y358-F361 PolarHBondContact O-N 3.44Å; Y358-S362 VanDerWaalsContact O-CB 3.25Å; Y358-S362 WeakPolarHBondContact O-CB 3.45Å; Y358-S362 PolarHBondContact O-N 3.14Å
359	F	94.5	Very high	94.8	Very high	37 Å²	37	77.3 Å²	77.3	16%	0.162	35%	0.353	C	S	.	.	H	α-helix	trans	-65.4	-40	176.2	-178.2	-98.6	0	0	0	111.3	T138 R356 W357 N363 N428 E432	T138-F359 HydrophobicContact CG2-CE2 4.36Å; R356-F359 HydrophobicContact CB-CB 3.96Å; R356-F359 WeakPolarHBondContact O-CB 3.49Å; R356-F359 PolarHBondContact O-N 3.3Å; W357-F359 VanDerWaalsContact C-N 3.27Å; W357-F359 PolarHBondContact O-N 2.92Å; F359-N363 VanDerWaalsContact CD1-ND2 3.35Å; F359-N363 WeakPolarHBondContact CD1-ND2 3.39Å; F359-N363 WeakPolarHBondContact CE1-ND2 3.45Å; F359-N363 WeakPolarHBondContact CE2-ND2 3.3Å; F359-N363 WeakPolarHBondContact CZ-ND2 3.47Å; F359-N363 WeakPolarHBondContact O-CB 3.4Å; F359-N363 PolarHBondContact O-N 3.3Å; F359-N363 PolarHBondContact O-ND2 3.18Å; F359-N428 HydrophobicContact CE1-CB 3.93Å; F359-N428 HydrophobicContact CZ-CB 4.05Å; F359-E432 HydrophobicContact CD1-CB 4Å; F359-E432 HydrophobicContact CD1-CG 3.93Å; F359-E432 HydrophobicContact CE1-CB 4.34Å
360	V	97	Very high	94.8	Very high	2 Å²	2	77 Å²	77	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-53.6	175	178.8	0	0	0	0	110.9	I355 R356 W357 S362 N363 F364 E432 M433	I355-V360 HydrophobicContact CG2-CG2 4.27Å; R356-V360 PolarHBondContact O-N 3.38Å; W357-V360 HydrophobicContact CE3-CB 4.29Å; W357-V360 HydrophobicContact CE3-CG1 4.37Å; W357-V360 HydrophobicContact CE3-CG2 4.41Å; W357-V360 HydrophobicContact CZ3-CG1 4.42Å; W357-V360 WeakPolarHBondContact O-CB 3.49Å; W357-V360 PolarHBondContact O-N 3.13Å; W357-V360 VanDerWaalsContact O-N 3.08Å; V360-S362 PolarHBondContact O-N 3.39Å; V360-N363 PolarHBondContact O-N 3.15Å; V360-F364 HydrophobicContact CG1-CD2 3.66Å; V360-F364 HydrophobicContact CG1-CE2 3.5Å; V360-F364 WeakPolarHBondContact O-CD2 3.14Å; V360-F364 PolarHBondContact O-N 3.05Å; V360-E432 HydrophobicContact CG2-CB 3.81Å; V360-E432 HydrophobicContact CG2-CG 3.55Å; V360-M433 HydrophobicContact CB-CG 4.43Å; V360-M433 HydrophobicContact CG1-CG 3.58Å; V360-M433 HydrophobicContact CG1-SD 3.9Å; V360-M433 HydrophobicContact CG2-CG 3.9Å
361	F	96.8	Very high	94.6	Very high	135 Å²	135	80 Å²	80	59%	0.592	36%	0.364	S	S	*	.	H	α-helix	trans	-61.5	-42.6	-179.7	-70.9	-61.8	0	0	0	112.1	W357 Y358 N363 F364 L365	W357-F361 HydrophobicContact CB-CD2 4.22Å; W357-F361 HydrophobicContact CB-CE2 3.98Å; W357-F361 HydrophobicContact CE3-CE2 4.21Å; W357-F361 HydrophobicContact CE3-CZ 4.38Å; W357-F361 WeakPolarHBondContact O-CD2 3.36Å; W357-F361 PolarHBondContact O-N 3.16Å; Y358-F361 PolarHBondContact O-N 3.44Å; F361-N363 PolarHBondContact O-N 3.07Å; F361-F364 PolarHBondContact O-N 3Å; F361-L365 WeakPolarHBondContact O-CB 3.36Å; F361-L365 PolarHBondContact O-N 2.97Å
362	S	95.7	Very high	94.2	Very high	36 Å²	36	76.8 Å²	76.8	25%	0.252	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-44.7	176.5	-176.8	0	0	0	0	111.9	Y358 V360 L365 Q366	Y358-S362 VanDerWaalsContact O-CB 3.25Å; Y358-S362 WeakPolarHBondContact O-CB 3.45Å; Y358-S362 PolarHBondContact O-N 3.14Å; V360-S362 PolarHBondContact O-N 3.39Å; S362-L365 PolarHBondContact O-N 2.79Å; S362-Q366 VanDerWaalsContact O-CG 3.25Å; S362-Q366 WeakPolarHBondContact O-CG 3.38Å; S362-Q366 PolarHBondContact O-N 3.19Å; S362-Q366 PolarHBondContact O-NE2 3.34Å; S362-Q366 PolarHBondContact OG-NE2 3.32Å
363	N	96.3	Very high	93.9	Very high	3 Å²	3	75.9 Å²	75.9	2%	0.016	35%	0.351	C	S	.	.	H	α-helix	trans	-66.1	-42.1	178	-80.8	-69.1	0	0	0	112.3	F359 V360 F361 L365 Q366 V367 S425 A429	F359-N363 VanDerWaalsContact CD1-ND2 3.35Å; F359-N363 WeakPolarHBondContact CD1-ND2 3.39Å; F359-N363 WeakPolarHBondContact CE1-ND2 3.45Å; F359-N363 WeakPolarHBondContact CE2-ND2 3.3Å; F359-N363 WeakPolarHBondContact CZ-ND2 3.47Å; F359-N363 WeakPolarHBondContact O-CB 3.4Å; F359-N363 PolarHBondContact O-N 3.3Å; F359-N363 PolarHBondContact O-ND2 3.18Å; V360-N363 PolarHBondContact O-N 3.15Å; F361-N363 PolarHBondContact O-N 3.07Å; N363-L365 VanDerWaalsContact C-N 3.35Å; N363-L365 PolarHBondContact O-N 2.77Å; N363-Q366 WeakPolarHBondContact O-CB 3.44Å; N363-Q366 PolarHBondContact O-N 3.35Å; N363-V367 WeakPolarHBondContact O-CG2 3.44Å; N363-V367 PolarHBondContact O-N 3.45Å; N363-S425 WeakPolarHBondContact CB-O 3.43Å; N363-S425 WeakPolarHBondContact OD1-CA 3.41Å; N363-A429 HydrophobicContact CB-CB 3.97Å
364	F	97.1	Very high	93.6	Very high	57 Å²	57	65.8 Å²	65.8	25%	0.25	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-39.4	175.4	-79.8	-55.4	0	0	0	112.6	V360 F361 Q366 V367 I368 W426 A429 F430 M433	V360-F364 HydrophobicContact CG1-CD2 3.66Å; V360-F364 HydrophobicContact CG1-CE2 3.5Å; V360-F364 WeakPolarHBondContact O-CD2 3.14Å; V360-F364 PolarHBondContact O-N 3.05Å; F361-F364 PolarHBondContact O-N 3Å; F364-Q366 VanDerWaalsContact C-N 3.31Å; F364-Q366 PolarHBondContact O-N 3.43Å; F364-V367 WeakPolarHBondContact O-CB 3.35Å; F364-V367 PolarHBondContact O-N 3.17Å; F364-I368 WeakPolarHBondContact O-CG1 3.42Å; F364-I368 PolarHBondContact O-N 3.29Å; F364-I368 VanDerWaalsContact O-N 3.08Å; F364-W426 HydrophobicContact CD1-CE3 4.34Å; F364-W426 HydrophobicContact CD1-CZ3 4.36Å; F364-W426 AromaticContact CE1-CE3 3.95Å; F364-W426 HydrophobicContact CE1-CE3 3.95Å; F364-W426 AromaticContact CE1-CZ3 3.88Å; F364-W426 HydrophobicContact CE1-CZ3 3.88Å; F364-A429 HydrophobicContact CD1-CB 4.25Å; F364-A429 HydrophobicContact CD2-CB 4.09Å; F364-A429 HydrophobicContact CE1-CB 3.96Å; F364-A429 HydrophobicContact CE2-CB 3.82Å; F364-A429 HydrophobicContact CG-CB 4.3Å; F364-A429 HydrophobicContact CZ-CB 3.74Å; F364-F430 HydrophobicContact CE1-CE2 4.09Å; F364-F430 HydrophobicContact CZ-CD2 4.36Å; F364-F430 HydrophobicContact CZ-CE2 4.06Å; F364-M433 HydrophobicContact CE2-CE 3.88Å; F364-M433 HydrophobicContact CE2-SD 3.78Å; F364-M433 HydrophobicContact CZ-CE 3.59Å; F364-M433 HydrophobicContact CZ-SD 4.12Å
365	L	95.3	Very high	93.2	Very high	110 Å²	110	63.8 Å²	63.8	58%	0.576	30%	0.297	S	S	*	.	H	α-helix	trans	-60.5	-42.9	174	-177.5	63.5	0	0	0	111.3	F361 S362 N363 V367 I368 V369	F361-L365 WeakPolarHBondContact O-CB 3.36Å; F361-L365 PolarHBondContact O-N 2.97Å; S362-L365 PolarHBondContact O-N 2.79Å; N363-L365 VanDerWaalsContact C-N 3.35Å; N363-L365 PolarHBondContact O-N 2.77Å; L365-V367 VanDerWaalsContact C-N 3.33Å; L365-V367 PolarHBondContact O-N 3.48Å; L365-I368 PolarHBondContact O-N 3.36Å; L365-V369 WeakPolarHBondContact O-CG2 3.26Å; L365-V369 PolarHBondContact O-N 3.43Å
366	Q	94	Very high	92.5	Very high	31 Å²	31	63.5 Å²	63.5	15%	0.145	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-38.9	175.7	-70.3	169	39.3	0	0	112.5	S362 N363 F364 V369 C370 Y420 S425	S362-Q366 VanDerWaalsContact O-CG 3.25Å; S362-Q366 WeakPolarHBondContact O-CG 3.38Å; S362-Q366 PolarHBondContact O-N 3.19Å; S362-Q366 PolarHBondContact O-NE2 3.34Å; S362-Q366 PolarHBondContact OG-NE2 3.32Å; N363-Q366 WeakPolarHBondContact O-CB 3.44Å; N363-Q366 PolarHBondContact O-N 3.35Å; F364-Q366 VanDerWaalsContact C-N 3.31Å; F364-Q366 PolarHBondContact O-N 3.43Å; Q366-V369 PolarHBondContact O-N 2.95Å; Q366-C370 WeakPolarHBondContact O-CB 3.28Å; Q366-C370 PolarHBondContact O-N 3.42Å; Q366-C370 PolarHBondContact O-SG 3.41Å; Q366-Y420 HydrophobicContact CB-CE1 4.41Å; Q366-Y420 PolarHBondContact OE1-OH 3.08Å; Q366-S425 PolarHBondContact OE1-OG 3.17Å
367	V	95.7	Very high	92	Very high	21 Å²	21	58.2 Å²	58.2	13%	0.127	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-45.6	174.3	172.3	0	0	0	0	110.9	N363 F364 L365 C370 F371 S421 W426	N363-V367 WeakPolarHBondContact O-CG2 3.44Å; N363-V367 PolarHBondContact O-N 3.45Å; F364-V367 WeakPolarHBondContact O-CB 3.35Å; F364-V367 PolarHBondContact O-N 3.17Å; L365-V367 VanDerWaalsContact C-N 3.33Å; L365-V367 PolarHBondContact O-N 3.48Å; V367-C370 PolarHBondContact O-N 3.49Å; V367-F371 WeakPolarHBondContact O-CB 3.23Å; V367-F371 PolarHBondContact O-N 3.47Å; V367-S421 WeakPolarHBondContact CG2-O 3.35Å; V367-W426 HydrophobicContact CG1-CE3 4.23Å; V367-W426 HydrophobicContact CG2-CB 4.1Å
368	I	92.7	Very high	91.4	Very high	96 Å²	96	55.4 Å²	55.4	49%	0.492	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-46.7	178.2	-65.6	166.7	0	0	0	110.6	F364 L365 C370 F371 I372	F364-I368 WeakPolarHBondContact O-CG1 3.42Å; F364-I368 PolarHBondContact O-N 3.29Å; F364-I368 VanDerWaalsContact O-N 3.08Å; L365-I368 PolarHBondContact O-N 3.36Å; I368-C370 PolarHBondContact O-N 2.93Å; I368-F371 WeakPolarHBondContact O-CB 3.25Å; I368-F371 PolarHBondContact O-N 2.9Å; I368-I372 HydrophobicContact CG2-CD1 3.91Å; I368-I372 WeakPolarHBondContact O-CG1 3.36Å; I368-I372 PolarHBondContact O-N 2.88Å
369	V	90.6	Very high	90.5	Very high	69 Å²	69	46.7 Å²	46.7	42%	0.418	23%	0.231	S	C	.	.	H	α-helix	trans	-60.9	-45	177.2	172.8	0	0	0	0	111.2	T157 L365 Q366 F371 I372 F373	T157-V369 HydrophobicContact CG2-CG1 4.01Å; L365-V369 WeakPolarHBondContact O-CG2 3.26Å; L365-V369 PolarHBondContact O-N 3.43Å; Q366-V369 PolarHBondContact O-N 2.95Å; V369-F371 VanDerWaalsContact C-N 3.31Å; V369-F371 PolarHBondContact O-N 3.29Å; V369-I372 PolarHBondContact O-N 2.97Å; V369-F373 WeakPolarHBondContact O-CB 3.42Å; V369-F373 PolarHBondContact O-N 2.74Å
370	C	92.4	Very high	89.7	Confident	17 Å²	17	50 Å²	50	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-37.1	177.1	-71.7	0	0	0	0	112.7	Q366 V367 I368 F373 S374 I417	Q366-C370 WeakPolarHBondContact O-CB 3.28Å; Q366-C370 PolarHBondContact O-N 3.42Å; Q366-C370 PolarHBondContact O-SG 3.41Å; V367-C370 PolarHBondContact O-N 3.49Å; I368-C370 PolarHBondContact O-N 2.93Å; C370-F373 PolarHBondContact O-N 2.97Å; C370-S374 WeakPolarHBondContact O-CB 3.47Å; C370-S374 PolarHBondContact O-N 3.47Å; C370-S374 PolarHBondContact O-OG 3.24Å; C370-I417 HydrophobicContact CB-CG2 3.63Å
371	F	90.3	Very high	88.8	Confident	91 Å²	91	53.7 Å²	53.7	40%	0.399	26%	0.258	S	S	.	.	H	α-helix	trans	-65.2	-49	176.9	174.4	-100.5	0	0	0	111.5	L184 F188 V367 I368 V369 F373 S374 Y375	L184-F371 HydrophobicContact CD2-CE1 4.05Å; L184-F371 HydrophobicContact CD2-CZ 3.79Å; F188-F371 HydrophobicContact CD2-CZ 4.29Å; F188-F371 AromaticContact CE2-CE2 3.7Å; F188-F371 HydrophobicContact CE2-CE2 3.7Å; F188-F371 AromaticContact CE2-CZ 3.41Å; F188-F371 HydrophobicContact CE2-CZ 3.41Å; F188-F371 VanDerWaalsContact CE2-CZ 3.41Å; F188-F371 AromaticContact CZ-CE2 3.53Å; F188-F371 HydrophobicContact CZ-CE2 3.53Å; F188-F371 AromaticContact CZ-CZ 3.68Å; F188-F371 HydrophobicContact CZ-CZ 3.68Å; V367-F371 WeakPolarHBondContact O-CB 3.23Å; V367-F371 PolarHBondContact O-N 3.47Å; I368-F371 WeakPolarHBondContact O-CB 3.25Å; I368-F371 PolarHBondContact O-N 2.9Å; V369-F371 VanDerWaalsContact C-N 3.31Å; V369-F371 PolarHBondContact O-N 3.29Å; F371-F373 VanDerWaalsContact C-N 3.31Å; F371-F373 PolarHBondContact O-N 3.46Å; F371-S374 PolarHBondContact O-N 3.27Å; F371-Y375 PolarHBondContact O-N 2.64Å
372	I	85.2	Confident	87.8	Confident	71 Å²	71	47.4 Å²	47.4	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-44.4	175.3	-67.6	168.2	0	0	0	110.5	I368 V369 S374 Y375 Y376	I368-I372 HydrophobicContact CG2-CD1 3.91Å; I368-I372 WeakPolarHBondContact O-CG1 3.36Å; I368-I372 PolarHBondContact O-N 2.88Å; V369-I372 PolarHBondContact O-N 2.97Å; I372-S374 PolarHBondContact O-N 3.41Å; I372-Y375 WeakPolarHBondContact O-CB 3.41Å; I372-Y375 PolarHBondContact O-N 2.79Å; I372-Y376 HydrophobicContact CG2-CD2 3.77Å; I372-Y376 HydrophobicContact CG2-CE2 3.33Å; I372-Y376 WeakPolarHBondContact O-CD2 3.46Å; I372-Y376 PolarHBondContact O-N 3.08Å; I372-Y376 VanDerWaalsContact O-N 3.07Å
373	F	86.2	Confident	86.8	Confident	5 Å²	5	48.2 Å²	48.2	2%	0.022	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-42.2	178.6	-174.3	-141.5	0	0	0	112.5	T157 F160 V369 C370 F371 Y375 Y376 I377 L413 I417	T157-F373 HydrophobicContact CG2-CB 3.78Å; T157-F373 HydrophobicContact CG2-CD1 4.06Å; T157-F373 HydrophobicContact CG2-CD2 3.89Å; T157-F373 HydrophobicContact CG2-CE2 4.5Å; T157-F373 HydrophobicContact CG2-CG 3.66Å; F160-F373 HydrophobicContact CB-CE2 3.84Å; F160-F373 AromaticContact CD1-CD2 3.99Å; F160-F373 HydrophobicContact CD1-CD2 3.99Å; F160-F373 AromaticContact CD1-CE2 3.57Å; F160-F373 HydrophobicContact CD1-CE2 3.57Å; F160-F373 HydrophobicContact CE1-CE2 4.34Å; F160-F373 AromaticContact CG-CE2 3.83Å; F160-F373 HydrophobicContact CG-CE2 3.83Å; V369-F373 WeakPolarHBondContact O-CB 3.42Å; V369-F373 PolarHBondContact O-N 2.74Å; C370-F373 PolarHBondContact O-N 2.97Å; F371-F373 VanDerWaalsContact C-N 3.31Å; F371-F373 PolarHBondContact O-N 3.46Å; F373-Y375 VanDerWaalsContact C-N 3.33Å; F373-Y375 PolarHBondContact O-N 3.44Å; F373-Y376 PolarHBondContact O-N 2.75Å; F373-I377 HydrophobicContact CD1-CD1 4.13Å; F373-I377 HydrophobicContact CD2-CD1 4.24Å; F373-I377 HydrophobicContact CD2-CG1 4.35Å; F373-I377 HydrophobicContact CE1-CD1 3.92Å; F373-I377 HydrophobicContact CE2-CD1 4.01Å; F373-I377 HydrophobicContact CE2-CG1 4.12Å; F373-I377 HydrophobicContact CG-CD1 4.29Å; F373-I377 HydrophobicContact CZ-CD1 3.85Å; F373-I377 HydrophobicContact CZ-CG1 4.39Å; F373-I377 WeakPolarHBondContact O-CG1 3.45Å; F373-I377 PolarHBondContact O-N 2.96Å; F373-L413 HydrophobicContact CE1-CD1 4.43Å; F373-L413 HydrophobicContact CE1-CD2 4.27Å; F373-L413 HydrophobicContact CE1-CG 4.49Å; F373-L413 HydrophobicContact CZ-CD2 3.97Å; F373-I417 HydrophobicContact CD1-CD1 3.27Å; F373-I417 HydrophobicContact CD1-CG1 3.95Å; F373-I417 HydrophobicContact CE1-CD1 3.38Å; F373-I417 HydrophobicContact CE1-CG1 4.11Å; F373-I417 HydrophobicContact CG-CD1 4.25Å; F373-I417 HydrophobicContact CZ-CD1 4.41Å
374	S	88.8	Confident	85.5	Confident	24 Å²	24	52.2 Å²	52.2	17%	0.168	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-42.8	175.2	-58.5	0	0	0	0	111.4	C370 F371 I372 Y376 I377 F378 I417	C370-S374 WeakPolarHBondContact O-CB 3.47Å; C370-S374 PolarHBondContact O-N 3.47Å; C370-S374 PolarHBondContact O-OG 3.24Å; F371-S374 PolarHBondContact O-N 3.27Å; I372-S374 PolarHBondContact O-N 3.41Å; S374-Y376 PolarHBondContact O-N 2.91Å; S374-I377 PolarHBondContact O-N 3.38Å; S374-F378 VanDerWaalsContact O-CD2 3.31Å; S374-F378 WeakPolarHBondContact O-CD2 3.33Å; S374-F378 PolarHBondContact O-N 3.13Å; S374-I417 VanDerWaalsContact OG-CG2 3.3Å; S374-I417 WeakPolarHBondContact OG-CG2 3.33Å
375	Y	85.1	Confident	84.3	Confident	38 Å²	38	52.8 Å²	52.8	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-55.2	-51.2	174.3	168.3	-105.2	0	0	0	111.3	D180 I183 L184 F371 I372 F373 I377 F378 M379	D180-Y375 PolarHBondContact O-OH 3.37Å; I183-Y375 HydrophobicContact CB-CE2 4.44Å; I183-Y375 HydrophobicContact CG2-CE2 4.17Å; L184-Y375 HydrophobicContact CD1-CD1 4.37Å; L184-Y375 HydrophobicContact CD1-CD2 4.23Å; L184-Y375 HydrophobicContact CD1-CE1 4.31Å; L184-Y375 HydrophobicContact CD1-CE2 4.19Å; L184-Y375 HydrophobicContact CD1-CG 4.32Å; L184-Y375 HydrophobicContact CD2-CD2 3.7Å; L184-Y375 HydrophobicContact CD2-CE2 4.1Å; L184-Y375 HydrophobicContact CD2-CG 4.21Å; L184-Y375 HydrophobicContact CG-CD2 3.8Å; L184-Y375 HydrophobicContact CG-CE2 3.68Å; L184-Y375 HydrophobicContact CG-CG 4.35Å; F371-Y375 PolarHBondContact O-N 2.64Å; I372-Y375 WeakPolarHBondContact O-CB 3.41Å; I372-Y375 PolarHBondContact O-N 2.79Å; F373-Y375 VanDerWaalsContact C-N 3.33Å; F373-Y375 PolarHBondContact O-N 3.44Å; Y375-I377 VanDerWaalsContact C-N 3.34Å; Y375-I377 PolarHBondContact O-N 3.27Å; Y375-F378 PolarHBondContact O-N 3.47Å; Y375-M379 HydrophobicContact CD1-CG 4.28Å; Y375-M379 HydrophobicContact CD2-CG 3.96Å; Y375-M379 HydrophobicContact CD2-SD 4.49Å; Y375-M379 HydrophobicContact CE1-CG 3.89Å; Y375-M379 HydrophobicContact CE2-CG 3.52Å; Y375-M379 HydrophobicContact CE2-SD 3.72Å; Y375-M379 HydrophobicContact CG-CG 4.32Å; Y375-M379 VanDerWaalsContact CZ-CG 3.49Å; Y375-M379 WeakPolarHBondContact O-CB 3.17Å; Y375-M379 VanDerWaalsContact O-CG 3.3Å; Y375-M379 WeakPolarHBondContact O-CG 3.34Å; Y375-M379 PolarHBondContact O-N 2.94Å
376	Y	81.4	Confident	83.4	Confident	48 Å²	48	47.6 Å²	47.6	19%	0.188	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-38.1	179	-70.3	-56.6	0	0	0	113.4	T164 I372 F373 S374 M379 R380	T164-Y376 HydrophobicContact CG2-CD1 3.56Å; T164-Y376 HydrophobicContact CG2-CE1 3.79Å; T164-Y376 HydrophobicContact CG2-CG 4.42Å; I372-Y376 HydrophobicContact CG2-CD2 3.77Å; I372-Y376 HydrophobicContact CG2-CE2 3.33Å; I372-Y376 WeakPolarHBondContact O-CD2 3.46Å; I372-Y376 PolarHBondContact O-N 3.08Å; I372-Y376 VanDerWaalsContact O-N 3.07Å; F373-Y376 PolarHBondContact O-N 2.75Å; S374-Y376 PolarHBondContact O-N 2.91Å; Y376-M379 PolarHBondContact O-N 2.99Å; Y376-R380 WeakPolarHBondContact O-CB 3.45Å; Y376-R380 PolarHBondContact O-N 3.29Å
377	I	84.5	Confident	82.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-47.8	174.6	-67.3	165.2	0	0	0	110.1	F160 F373 S374 Y375 M379 R380 F381 P410 L413 L414 I417	F160-I377 HydrophobicContact CE1-CG1 4.18Å; F373-I377 HydrophobicContact CD1-CD1 4.13Å; F373-I377 HydrophobicContact CD2-CD1 4.24Å; F373-I377 HydrophobicContact CD2-CG1 4.35Å; F373-I377 HydrophobicContact CE1-CD1 3.92Å; F373-I377 HydrophobicContact CE2-CD1 4.01Å; F373-I377 HydrophobicContact CE2-CG1 4.12Å; F373-I377 HydrophobicContact CG-CD1 4.29Å; F373-I377 HydrophobicContact CZ-CD1 3.85Å; F373-I377 HydrophobicContact CZ-CG1 4.39Å; F373-I377 WeakPolarHBondContact O-CG1 3.45Å; F373-I377 PolarHBondContact O-N 2.96Å; S374-I377 PolarHBondContact O-N 3.38Å; Y375-I377 VanDerWaalsContact C-N 3.34Å; Y375-I377 PolarHBondContact O-N 3.27Å; I377-M379 PolarHBondContact O-N 3.43Å; I377-R380 PolarHBondContact O-N 3.02Å; I377-F381 HydrophobicContact CG2-CD2 3.9Å; I377-F381 WeakPolarHBondContact O-CB 3.43Å; I377-F381 WeakPolarHBondContact O-CD2 3.41Å; I377-F381 PolarHBondContact O-N 2.78Å; I377-P410 HydrophobicContact CG2-CB 4Å; I377-L413 HydrophobicContact CD1-CD2 3.58Å; I377-L413 HydrophobicContact CD1-CG 3.84Å; I377-L413 HydrophobicContact CG1-CD2 4.35Å; I377-L414 HydrophobicContact CB-CD2 4.16Å; I377-L414 HydrophobicContact CB-CG 4.43Å; I377-L414 HydrophobicContact CD1-CD2 4.28Å; I377-L414 HydrophobicContact CG2-CD1 3.91Å; I377-L414 HydrophobicContact CG2-CD2 4.08Å; I377-L414 HydrophobicContact CG2-CG 3.79Å; I377-I417 HydrophobicContact CD1-CD1 3.38Å
378	F	82.9	Confident	80.9	Confident	77 Å²	77	53.3 Å²	53.3	34%	0.338	26%	0.264	S	S	.	.	H	α-helix	trans	-58.9	-48.6	176.2	-90.5	-75.3	0	0	0	111.2	S374 Y375 R380 C382 F383 L414	S374-F378 VanDerWaalsContact O-CD2 3.31Å; S374-F378 WeakPolarHBondContact O-CD2 3.33Å; S374-F378 PolarHBondContact O-N 3.13Å; Y375-F378 PolarHBondContact O-N 3.47Å; F378-R380 VanDerWaalsContact C-N 3.35Å; F378-R380 PolarHBondContact O-N 3.35Å; F378-C382 HydrophobicContact CD1-CB 4Å; F378-C382 VanDerWaalsContact CD1-SG 3.6Å; F378-C382 CarbonylContact O-C 3.57Å; F378-C382 VanDerWaalsContact O-CA 3.28Å; F378-C382 WeakPolarHBondContact O-CA 3.49Å; F378-C382 WeakPolarHBondContact O-CB 3.22Å; F378-C382 PolarHBondContact O-N 3.35Å; F378-F383 HydrophobicContact CB-CD2 4.27Å; F378-F383 HydrophobicContact CB-CE2 4.04Å; F378-F383 WeakPolarHBondContact O-CD2 3.45Å; F378-F383 PolarHBondContact O-N 3.33Å; F378-L414 HydrophobicContact CD2-CD1 4Å; F378-L414 HydrophobicContact CD2-CD2 3.96Å; F378-L414 HydrophobicContact CE1-CD1 4.24Å; F378-L414 HydrophobicContact CE2-CD1 3.61Å; F378-L414 HydrophobicContact CE2-CD2 3.76Å; F378-L414 HydrophobicContact CE2-CG 4.32Å; F378-L414 HydrophobicContact CG-CD1 4.46Å; F378-L414 HydrophobicContact CZ-CD1 3.74Å
379	M	77.9	Confident	79.5	Confident	12 Å²	12	49.8 Å²	49.8	6%	0.059	25%	0.246	C	C	.	.	I	π-helix	trans	-55	-49.4	179.4	-73.8	-52.4	-62.8	0	0	112.2	Y177 I183 Y375 Y376 I377 F383 L384	Y177-M379 HydrophobicContact CD1-CE 3.59Å; Y177-M379 HydrophobicContact CE1-CE 2.94Å; Y177-M379 HydrophobicContact CE2-CE 4.31Å; Y177-M379 WeakPolarHBondContact OH-CE 3.4Å; I183-M379 HydrophobicContact CD1-CE 3.35Å; I183-M379 HydrophobicContact CD1-SD 3.56Å; I183-M379 VanDerWaalsContact CD1-SD 3.56Å; I183-M379 HydrophobicContact CG2-SD 4.19Å; Y375-M379 HydrophobicContact CD1-CG 4.28Å; Y375-M379 HydrophobicContact CD2-CG 3.96Å; Y375-M379 HydrophobicContact CD2-SD 4.49Å; Y375-M379 HydrophobicContact CE1-CG 3.89Å; Y375-M379 HydrophobicContact CE2-CG 3.52Å; Y375-M379 HydrophobicContact CE2-SD 3.72Å; Y375-M379 HydrophobicContact CG-CG 4.32Å; Y375-M379 VanDerWaalsContact CZ-CG 3.49Å; Y375-M379 WeakPolarHBondContact O-CB 3.17Å; Y375-M379 VanDerWaalsContact O-CG 3.3Å; Y375-M379 WeakPolarHBondContact O-CG 3.34Å; Y375-M379 PolarHBondContact O-N 2.94Å; Y376-M379 PolarHBondContact O-N 2.99Å; I377-M379 PolarHBondContact O-N 3.43Å; M379-F383 HydrophobicContact CE-CB 4.39Å; M379-F383 HydrophobicContact CE-CG 4.42Å; M379-F383 HydrophobicContact CG-CD2 4.45Å; M379-F383 HydrophobicContact SD-CB 4.26Å; M379-F383 HydrophobicContact SD-CD1 4.3Å; M379-F383 HydrophobicContact SD-CD2 3.49Å; M379-F383 WeakPolarHBondContact SD-CD2 3.34Å; M379-F383 HydrophobicContact SD-CE2 3.82Å; M379-F383 HydrophobicContact SD-CG 3.77Å; M379-F383 HydrophobicContact SD-CZ 4.4Å; M379-L384 PolarHBondContact O-N 2.67Å
380	R	78.1	Confident	78	Confident	106 Å²	106	48.2 Å²	48.2	40%	0.4	24%	0.243	S	C	.	.	I	π-helix	trans	-74.7	-43	-174.9	-173.6	58.1	173.1	-161.2	-6.2	113.5	F160 Y376 I377 F378	F160-R380 HydrophobicContact CZ-CB 4.16Å; F160-R380 HydrophobicContact CZ-CG 4.34Å; Y376-R380 WeakPolarHBondContact O-CB 3.45Å; Y376-R380 PolarHBondContact O-N 3.29Å; I377-R380 PolarHBondContact O-N 3.02Å; F378-R380 VanDerWaalsContact C-N 3.35Å; F378-R380 PolarHBondContact O-N 3.35Å
381	F	78.2	Confident	76.4	Confident	80 Å²	80	54.3 Å²	54.3	35%	0.351	27%	0.268	S	S	.	.	I	π-helix	trans	-101.7	-20.2	-169.4	-65.2	-76.5	0	0	0	114	F160 I377 P385 P410	F160-F381 AromaticContact CE2-CE2 3.85Å; F160-F381 HydrophobicContact CE2-CE2 3.85Å; F160-F381 HydrophobicContact CE2-CZ 4.28Å; F160-F381 HydrophobicContact CZ-CD2 4.41Å; F160-F381 AromaticContact CZ-CE2 3.67Å; F160-F381 HydrophobicContact CZ-CE2 3.67Å; F160-F381 HydrophobicContact CZ-CZ 4.48Å; I377-F381 HydrophobicContact CG2-CD2 3.9Å; I377-F381 WeakPolarHBondContact O-CB 3.43Å; I377-F381 WeakPolarHBondContact O-CD2 3.41Å; I377-F381 PolarHBondContact O-N 2.78Å; F381-P385 WeakPolarHBondContact O-CG 3.21Å; F381-P410 HydrophobicContact CB-CB 3.85Å; F381-P410 HydrophobicContact CB-CG 3.75Å; F381-P410 HydrophobicContact CD1-CB 4.39Å; F381-P410 HydrophobicContact CD1-CG 3.48Å; F381-P410 VanDerWaalsContact CD1-CG 3.48Å; F381-P410 HydrophobicContact CD2-CB 4.02Å; F381-P410 HydrophobicContact CD2-CG 3.89Å; F381-P410 HydrophobicContact CE1-CG 3.98Å; F381-P410 HydrophobicContact CE2-CG 4.33Å; F381-P410 HydrophobicContact CG-CB 3.84Å; F381-P410 HydrophobicContact CG-CG 3.43Å; F381-P410 VanDerWaalsContact CG-CG 3.43Å; F381-P410 HydrophobicContact CZ-CG 4.37Å
382	C	76	Confident	74.6	Confident	4 Å²	4	55.7 Å²	55.7	3%	0.027	28%	0.279	C	S	.	.	I	π-helix	trans	-108.6	-60.4	179	-51.7	0	0	0	0	111.2	F378 L384 P385 F386 I550	F378-C382 HydrophobicContact CD1-CB 4Å; F378-C382 VanDerWaalsContact CD1-SG 3.6Å; F378-C382 CarbonylContact O-C 3.57Å; F378-C382 VanDerWaalsContact O-CA 3.28Å; F378-C382 WeakPolarHBondContact O-CA 3.49Å; F378-C382 WeakPolarHBondContact O-CB 3.22Å; F378-C382 PolarHBondContact O-N 3.35Å; C382-L384 PolarHBondContact O-N 2.95Å; C382-P385 WeakPolarHBondContact O-CD 3.44Å; C382-F386 HydrophobicContact CB-CD2 4.13Å; C382-F386 HydrophobicContact CB-CE2 4.36Å; C382-F386 VanDerWaalsContact O-CB 3.29Å; C382-F386 WeakPolarHBondContact O-CB 3.48Å; C382-F386 WeakPolarHBondContact O-CD2 3.2Å; C382-F386 WeakPolarHBondContact O-CG 3.36Å; C382-F386 PolarHBondContact O-N 2.9Å; C382-F386 VanDerWaalsContact O-N 3.11Å; C382-I550 WeakPolarHBondContact SG-CG2 3.47Å
383	F	73.6	Confident	73.2	Confident	53 Å²	53	62.1 Å²	62.1	23%	0.232	30%	0.304	C	S	.	.	I	π-helix	trans	-61.2	-50.3	-172.3	-74.8	-96	0	0	0	112	I183 F378 M379 S387 Y558	I183-F383 HydrophobicContact CD1-CD1 4.33Å; I183-F383 HydrophobicContact CD1-CE1 4.43Å; I183-F383 HydrophobicContact CG2-CE1 3.93Å; I183-F383 HydrophobicContact CG2-CE2 4.44Å; I183-F383 HydrophobicContact CG2-CZ 3.75Å; F378-F383 HydrophobicContact CB-CD2 4.27Å; F378-F383 HydrophobicContact CB-CE2 4.04Å; F378-F383 WeakPolarHBondContact O-CD2 3.45Å; F378-F383 PolarHBondContact O-N 3.33Å; M379-F383 HydrophobicContact CE-CB 4.39Å; M379-F383 HydrophobicContact CE-CG 4.42Å; M379-F383 HydrophobicContact CG-CD2 4.45Å; M379-F383 HydrophobicContact SD-CB 4.26Å; M379-F383 HydrophobicContact SD-CD1 4.3Å; M379-F383 HydrophobicContact SD-CD2 3.49Å; M379-F383 WeakPolarHBondContact SD-CD2 3.34Å; M379-F383 HydrophobicContact SD-CE2 3.82Å; M379-F383 HydrophobicContact SD-CG 3.77Å; M379-F383 HydrophobicContact SD-CZ 4.4Å; F383-S387 WeakPolarHBondContact O-CB 3.35Å; F383-S387 PolarHBondContact O-N 3.39Å; F383-S387 PolarHBondContact O-OG 2.83Å; F383-Y558 WeakPolarHBondContact CD1-OH 3.4Å; F383-Y558 WeakPolarHBondContact CE1-OH 3.28Å
384	L	69.6	Low	72	Confident	86 Å²	86	69.5 Å²	69.5	45%	0.45	34%	0.336	S	S	.	.	H	α-helix	trans	-63.5	-49.6	-175.3	-170.2	66.8	0	0	0	112.9	M379 C382 S387	M379-L384 PolarHBondContact O-N 2.67Å; C382-L384 PolarHBondContact O-N 2.95Å; L384-S387 PolarHBondContact O-OG 2.99Å; L384-S387 VanDerWaalsContact O-OG 3.09Å
385	P	71.8	Confident	71	Confident	69 Å²	69	72.9 Å²	72.9	45%	0.448	35%	0.348	S	S	.	.	H	α-helix	trans	-72.2	-32.2	-179	-21	36.3	0	0	0	114.3	F381 C382	F381-P385 WeakPolarHBondContact O-CG 3.21Å; C382-P385 WeakPolarHBondContact O-CD 3.44Å
386	F	76.2	Confident	70.6	Confident	1 Å²	1	73.9 Å²	73.9	0%	0.004	36%	0.361	C	S	.	.	H	α-helix	trans	-91.8	-19.1	-174.4	-61.9	-63.2	0	0	0	114.2	C382 Q388 L389 T403 C407 M555 Y558	C382-F386 HydrophobicContact CB-CD2 4.13Å; C382-F386 HydrophobicContact CB-CE2 4.36Å; C382-F386 VanDerWaalsContact O-CB 3.29Å; C382-F386 WeakPolarHBondContact O-CB 3.48Å; C382-F386 WeakPolarHBondContact O-CD2 3.2Å; C382-F386 WeakPolarHBondContact O-CG 3.36Å; C382-F386 PolarHBondContact O-N 2.9Å; C382-F386 VanDerWaalsContact O-N 3.11Å; F386-Q388 PolarHBondContact O-N 3.08Å; F386-Q388 VanDerWaalsContact O-N 3.12Å; F386-L389 HydrophobicContact CD1-CD1 4.35Å; F386-L389 WeakPolarHBondContact O-CB 3.4Å; F386-L389 PolarHBondContact O-N 3.09Å; F386-T403 HydrophobicContact CD1-CG2 4.34Å; F386-T403 HydrophobicContact CE1-CG2 3.28Å; F386-T403 HydrophobicContact CZ-CG2 3.44Å; F386-T403 VanDerWaalsContact CZ-CG2 3.44Å; F386-C407 VanDerWaalsContact CZ-SG 3.54Å; F386-M555 HydrophobicContact CD1-CE 4.48Å; F386-M555 HydrophobicContact CD1-CG 3.64Å; F386-M555 HydrophobicContact CE1-CE 3.68Å; F386-M555 HydrophobicContact CE1-CG 3.39Å; F386-M555 HydrophobicContact CE1-SD 4.32Å; F386-M555 HydrophobicContact CZ-CG 4.37Å; F386-Y558 HydrophobicContact CB-CD2 3.38Å; F386-Y558 HydrophobicContact CB-CE2 3.67Å; F386-Y558 HydrophobicContact CB-CG 4.2Å; F386-Y558 HydrophobicContact CG-CD2 4.49Å
387	S	71.4	Confident	70.6	Confident	45 Å²	45	78.2 Å²	78.2	32%	0.315	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.1	179.7	61.5	0	0	0	0	114.1	F383 L384 N562	F383-S387 WeakPolarHBondContact O-CB 3.35Å; F383-S387 PolarHBondContact O-N 3.39Å; F383-S387 PolarHBondContact O-OG 2.83Å; L384-S387 PolarHBondContact O-OG 2.99Å; L384-S387 VanDerWaalsContact O-OG 3.09Å; S387-N562 PolarHBondContact O-ND2 2.96Å
388	Q	65.4	Low	70.6	Confident	127 Å²	127	86.3 Å²	86.3	59%	0.593	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-9.3	178.5	-60.7	-175	-4.9	0	0	113.4	F386 G390 K391	F386-Q388 PolarHBondContact O-N 3.08Å; F386-Q388 VanDerWaalsContact O-N 3.12Å; Q388-G390 PolarHBondContact O-N 3.47Å; Q388-K391 PolarHBondContact O-N 3.27Å; Q388-K391 VanDerWaalsContact O-N 3.12Å
389	L	64.9	Low	70.5	Confident	23 Å²	23	87.6 Å²	87.6	12%	0.12	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	121.3	-178.4	-150.6	108.5	0	0	0	109.4	F386 M555 N562	F386-L389 HydrophobicContact CD1-CD1 4.35Å; F386-L389 WeakPolarHBondContact O-CB 3.4Å; F386-L389 PolarHBondContact O-N 3.09Å; L389-M555 HydrophobicContact CD1-CE 4.42Å; L389-M555 HydrophobicContact CD2-CB 3.78Å; L389-M555 HydrophobicContact CD2-CG 3.72Å; L389-M555 HydrophobicContact CD2-SD 4.47Å; L389-N562 PolarHBondContact O-ND2 2.83Å
390	G	58	Low	70.8	Confident	35 Å²	35	89 Å²	89	36%	0.361	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.9	-20.4	-172.1	0	0	0	0	0	114.4	Q388	Q388-G390 PolarHBondContact O-N 3.47Å
391	K	59.1	Low	71.2	Confident	145 Å²	145	87.9 Å²	87.9	63%	0.63	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-30	176.7	-65.2	-173.2	179.1	-177.7	0	113.7	Q388	Q388-K391 PolarHBondContact O-N 3.27Å; Q388-K391 VanDerWaalsContact O-N 3.12Å
392	L	51.7	Low	71.5	Confident	120 Å²	120	90.1 Å²	90.1	63%	0.628	44%	0.442	S	S	*	.	S	Bend	trans	-141.4	104.5	-167.7	-65.2	166.8	0	0	0	111.1
393	K	56.2	Low	71.9	Confident	206 Å²	206	91.1 Å²	91.1	90%	0.896	45%	0.448	S	S	*	.	S	Bend	trans	75.5	143.2	170.8	-67.2	176.8	174.5	176.7	0	117.6
394	K	62.1	Low	72.5	Confident	160 Å²	160	89 Å²	89	70%	0.696	44%	0.44	S	S	*	.			trans	-45.3	145.1	176	-72.8	-177.2	177.6	-177.6	0	112	S396 S583	K394-S396 PolarHBondContact O-N 3.47Å; K394-S583 VanDerWaalsContact CE-CB 3.47Å; K394-S583 WeakPolarHBondContact CE-OG 3.28Å
395	F	67.4	Low	73.4	Confident	96 Å²	96	89.2 Å²	89.2	42%	0.421	45%	0.445	S	S	.	.			trans	-51.9	123.5	170.4	179.8	-95.9	0	0	0	110.1	Y400 I578	F395-Y400 HydrophobicContact CE2-CD2 4.33Å; F395-Y400 HydrophobicContact CE2-CG 4.37Å; F395-Y400 HydrophobicContact CZ-CD2 4.26Å; F395-Y400 AromaticContact CZ-CG 3.98Å; F395-Y400 HydrophobicContact CZ-CG 3.98Å; F395-I578 HydrophobicContact CD2-CG1 4.07Å; F395-I578 HydrophobicContact CE2-CD1 4.04Å; F395-I578 HydrophobicContact CE2-CG1 4.02Å
396	S	77.2	Confident	74.1	Confident	59 Å²	59	89 Å²	89	41%	0.413	45%	0.449	S	S	.	.			trans	-114.1	128	172.4	177.9	0	0	0	0	108.3	K394 K398 K399 Y400	K394-S396 PolarHBondContact O-N 3.47Å; S396-K398 PolarHBondContact O-N 3.49Å; S396-K398 VanDerWaalsContact O-N 3.16Å; S396-K399 WeakPolarHBondContact O-CA 3.04Å; S396-K399 WeakPolarHBondContact O-CB 3.19Å; S396-K399 PolarHBondContact O-N 2.9Å; S396-Y400 PolarHBondContact O-N 2.98Å
397	F	81.3	Confident	74.8	Confident	139 Å²	139	89.1 Å²	89.1	61%	0.61	45%	0.45	S	S	*	.	H	α-helix	trans	-55.6	-33.1	176.9	-173.6	-112.5	0	0	0	112.3	K399 Y400 I401	F397-K399 PolarHBondContact O-N 3.16Å; F397-Y400 HydrophobicContact CD2-CD1 4.28Å; F397-Y400 HydrophobicContact CE2-CD1 4.14Å; F397-Y400 WeakPolarHBondContact O-CB 3.38Å; F397-Y400 PolarHBondContact O-N 3.07Å; F397-I401 HydrophobicContact CD1-CD1 3.77Å; F397-I401 HydrophobicContact CD1-CG1 4.47Å; F397-I401 HydrophobicContact CE1-CD1 3.37Å; F397-I401 HydrophobicContact CE1-CG1 4.14Å; F397-I401 HydrophobicContact CZ-CD1 3.87Å; F397-I401 HydrophobicContact CZ-CG1 4.22Å; F397-I401 PolarHBondContact O-N 3.27Å
398	K	84.5	Confident	75.7	Confident	170 Å²	170	88.1 Å²	88.1	74%	0.739	44%	0.442	S	S	*	.	H	α-helix	trans	-61.4	-43.1	173	-177.6	177.5	178.7	178.4	0	112.3	S396 Y400 I401 L402	S396-K398 PolarHBondContact O-N 3.49Å; S396-K398 VanDerWaalsContact O-N 3.16Å; K398-Y400 VanDerWaalsContact C-N 3.34Å; K398-I401 PolarHBondContact O-N 3.44Å; K398-L402 PolarHBondContact O-N 3.49Å; K398-L402 VanDerWaalsContact O-N 3.13Å
399	K	79.8	Confident	76.9	Confident	103 Å²	103	88.1 Å²	88.1	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-65.5	-40.9	176.7	-172.3	174.4	-178.8	178.2	0	110.3	S396 F397 L402 T403	S396-K399 WeakPolarHBondContact O-CA 3.04Å; S396-K399 WeakPolarHBondContact O-CB 3.19Å; S396-K399 PolarHBondContact O-N 2.9Å; F397-K399 PolarHBondContact O-N 3.16Å; K399-L402 PolarHBondContact O-N 3.44Å; K399-T403 WeakPolarHBondContact O-CB 3.17Å; K399-T403 PolarHBondContact O-N 3.38Å; K399-T403 PolarHBondContact O-OG1 3.44Å
400	Y	83.5	Confident	78.1	Confident	42 Å²	42	87.5 Å²	87.5	17%	0.165	44%	0.443	C	S	.	.	H	α-helix	trans	-56.9	-52.6	174.3	171.8	-103.8	0	0	0	112.2	F395 S396 F397 K398 L402 T403 S404 Q548 L552 M555	F395-Y400 HydrophobicContact CE2-CD2 4.33Å; F395-Y400 HydrophobicContact CE2-CG 4.37Å; F395-Y400 HydrophobicContact CZ-CD2 4.26Å; F395-Y400 AromaticContact CZ-CG 3.98Å; F395-Y400 HydrophobicContact CZ-CG 3.98Å; S396-Y400 PolarHBondContact O-N 2.98Å; F397-Y400 HydrophobicContact CD2-CD1 4.28Å; F397-Y400 HydrophobicContact CE2-CD1 4.14Å; F397-Y400 WeakPolarHBondContact O-CB 3.38Å; F397-Y400 PolarHBondContact O-N 3.07Å; K398-Y400 VanDerWaalsContact C-N 3.34Å; Y400-L402 VanDerWaalsContact C-N 3.3Å; Y400-L402 PolarHBondContact O-N 2.85Å; Y400-T403 PolarHBondContact O-N 3.36Å; Y400-S404 WeakPolarHBondContact O-CB 3.28Å; Y400-S404 PolarHBondContact O-N 3.48Å; Y400-Q548 PolarHBondContact OH-OE1 2.68Å; Y400-L552 HydrophobicContact CE2-CD2 3.57Å; Y400-L552 HydrophobicContact CE2-CG 4.21Å; Y400-M555 HydrophobicContact CD2-CE 4.21Å; Y400-M555 HydrophobicContact CD2-SD 4.04Å
401	I	86.7	Confident	79.7	Confident	82 Å²	82	85.9 Å²	85.9	42%	0.421	43%	0.426	S	S	.	.	H	α-helix	trans	-57.4	-44.9	179.3	-69.2	170.2	0	0	0	111.2	F397 K398 T405	F397-I401 HydrophobicContact CD1-CD1 3.77Å; F397-I401 HydrophobicContact CD1-CG1 4.47Å; F397-I401 HydrophobicContact CE1-CD1 3.37Å; F397-I401 HydrophobicContact CE1-CG1 4.14Å; F397-I401 HydrophobicContact CZ-CD1 3.87Å; F397-I401 HydrophobicContact CZ-CG1 4.22Å; F397-I401 PolarHBondContact O-N 3.27Å; K398-I401 PolarHBondContact O-N 3.44Å; I401-T405 WeakPolarHBondContact O-CB 3.41Å; I401-T405 PolarHBondContact O-N 3.03Å; I401-T405 PolarHBondContact O-OG1 3.42Å
402	L	86	Confident	81.3	Confident	128 Å²	128	79 Å²	79	67%	0.67	40%	0.396	S	S	*	.	H	α-helix	trans	-62.2	-47.1	-179.4	-177.4	64.1	0	0	0	111.5	K398 K399 Y400 A406	K398-L402 PolarHBondContact O-N 3.49Å; K398-L402 VanDerWaalsContact O-N 3.13Å; K399-L402 PolarHBondContact O-N 3.44Å; Y400-L402 VanDerWaalsContact C-N 3.3Å; Y400-L402 PolarHBondContact O-N 2.85Å; L402-A406 WeakPolarHBondContact O-CB 3.42Å; L402-A406 PolarHBondContact O-N 3.38Å; L402-A406 VanDerWaalsContact O-N 3.07Å
403	T	83.8	Confident	83.2	Confident	24 Å²	24	75.3 Å²	75.3	15%	0.147	38%	0.377	C	S	.	.	H	α-helix	trans	-70	-41.4	-179.9	-55.9	0	0	0	0	112.1	F386 K399 Y400 T405 A406 C407 M555	F386-T403 HydrophobicContact CD1-CG2 4.34Å; F386-T403 HydrophobicContact CE1-CG2 3.28Å; F386-T403 HydrophobicContact CZ-CG2 3.44Å; F386-T403 VanDerWaalsContact CZ-CG2 3.44Å; K399-T403 WeakPolarHBondContact O-CB 3.17Å; K399-T403 PolarHBondContact O-N 3.38Å; K399-T403 PolarHBondContact O-OG1 3.44Å; Y400-T403 PolarHBondContact O-N 3.36Å; T403-T405 VanDerWaalsContact C-N 3.34Å; T403-T405 PolarHBondContact O-N 2.92Å; T403-A406 WeakPolarHBondContact O-CB 3.22Å; T403-A406 PolarHBondContact O-N 3.2Å; T403-A406 VanDerWaalsContact O-N 3.15Å; T403-C407 PolarHBondContact O-N 3.02Å; T403-C407 PolarHBondContact O-SG 2.96Å; T403-M555 HydrophobicContact CG2-CE 3.57Å
404	S	86.5	Confident	84.9	Confident	10 Å²	10	65.9 Å²	65.9	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-45.5	175	165.4	0	0	0	0	111.9	Y400 C407 T408 Q548	Y400-S404 WeakPolarHBondContact O-CB 3.28Å; Y400-S404 PolarHBondContact O-N 3.48Å; S404-C407 PolarHBondContact O-N 3.04Å; S404-T408 PolarHBondContact O-N 3.38Å; S404-T408 PolarHBondContact O-OG1 3.02Å; S404-T408 VanDerWaalsContact O-OG1 3.05Å; S404-Q548 PolarHBondContact OG-NE2 2.82Å; S404-Q548 PolarHBondContact OG-OE1 2.67Å
405	T	87.6	Confident	86.4	Confident	89 Å²	89	58.3 Å²	58.3	55%	0.546	30%	0.303	S	S	.	.	H	α-helix	trans	-64.7	-42.5	175.9	-53	0	0	0	0	110.8	I401 T403 C407 T408	I401-T405 WeakPolarHBondContact O-CB 3.41Å; I401-T405 PolarHBondContact O-N 3.03Å; I401-T405 PolarHBondContact O-OG1 3.42Å; T403-T405 VanDerWaalsContact C-N 3.34Å; T403-T405 PolarHBondContact O-N 2.92Å; T405-C407 VanDerWaalsContact C-N 3.28Å; T405-C407 PolarHBondContact O-N 2.58Å; T405-T408 WeakPolarHBondContact O-CB 3.41Å; T405-T408 PolarHBondContact O-N 3.16Å; T405-T408 PolarHBondContact O-OG1 3.38Å
406	A	87.5	Confident	87.7	Confident	64 Å²	64	55.6 Å²	55.6	53%	0.529	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-31.1	176.9	0	0	0	0	0	113.3	L402 T403 P410	L402-A406 WeakPolarHBondContact O-CB 3.42Å; L402-A406 PolarHBondContact O-N 3.38Å; L402-A406 VanDerWaalsContact O-N 3.07Å; T403-A406 WeakPolarHBondContact O-CB 3.22Å; T403-A406 PolarHBondContact O-N 3.2Å; T403-A406 VanDerWaalsContact O-N 3.15Å; A406-P410 WeakPolarHBondContact O-CD 3.42Å
407	C	89.5	Confident	88.5	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-80.2	-12.2	177.1	-68.3	0	0	0	0	114.2	F386 T403 S404 T405 G411 G547 C551	F386-C407 VanDerWaalsContact CZ-SG 3.54Å; T403-C407 PolarHBondContact O-N 3.02Å; T403-C407 PolarHBondContact O-SG 2.96Å; S404-C407 PolarHBondContact O-N 3.04Å; T405-C407 VanDerWaalsContact C-N 3.28Å; T405-C407 PolarHBondContact O-N 2.58Å; C407-G411 PolarHBondContact O-N 3.22Å; C407-G547 WeakPolarHBondContact O-CA 3.39Å; C407-C551 HydrophobicContact CB-CB 4.07Å
408	T	91.8	Very high	89.1	Confident	24 Å²	24	48.8 Å²	48.8	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-46.8	-175.8	-64.1	0	0	0	0	112.5	S404 T405 G412 F543 I544	S404-T408 PolarHBondContact O-N 3.38Å; S404-T408 PolarHBondContact O-OG1 3.02Å; S404-T408 VanDerWaalsContact O-OG1 3.05Å; T405-T408 WeakPolarHBondContact O-CB 3.41Å; T405-T408 PolarHBondContact O-N 3.16Å; T405-T408 PolarHBondContact O-OG1 3.38Å; T408-G412 PolarHBondContact O-N 2.85Å; T408-F543 HydrophobicContact CG2-CB 3.98Å; T408-I544 HydrophobicContact CG2-CG1 4.16Å
409	L	89.9	Confident	89.6	Confident	128 Å²	128	41.2 Å²	41.2	67%	0.67	23%	0.231	S	C	*	.	H	α-helix	trans	-69.8	-49.9	178.7	-70.8	173.9	0	0	0	112.8	G411 G412 L413 F543	L409-G411 PolarHBondContact O-N 2.79Å; L409-G412 PolarHBondContact O-N 3.39Å; L409-L413 WeakPolarHBondContact O-CB 3.34Å; L409-L413 PolarHBondContact O-N 3.15Å; L409-F543 HydrophobicContact CD2-CD1 4.34Å; L409-F543 HydrophobicContact CD2-CE1 4.36Å
410	P	90	Very high	90.3	Very high	10 Å²	10	37.9 Å²	37.9	7%	0.065	22%	0.216	C	C	.	.	H	α-helix	trans	-56.6	-39.1	173.9	-26.4	35.1	0	0	0	112.7	I377 F381 A406 L413 L414	I377-P410 HydrophobicContact CG2-CB 4Å; F381-P410 HydrophobicContact CB-CB 3.85Å; F381-P410 HydrophobicContact CB-CG 3.75Å; F381-P410 HydrophobicContact CD1-CB 4.39Å; F381-P410 HydrophobicContact CD1-CG 3.48Å; F381-P410 VanDerWaalsContact CD1-CG 3.48Å; F381-P410 HydrophobicContact CD2-CB 4.02Å; F381-P410 HydrophobicContact CD2-CG 3.89Å; F381-P410 HydrophobicContact CE1-CG 3.98Å; F381-P410 HydrophobicContact CE2-CG 4.33Å; F381-P410 HydrophobicContact CG-CB 3.84Å; F381-P410 HydrophobicContact CG-CG 3.43Å; F381-P410 VanDerWaalsContact CG-CG 3.43Å; F381-P410 HydrophobicContact CZ-CG 4.37Å; A406-P410 WeakPolarHBondContact O-CD 3.42Å; P410-L413 PolarHBondContact O-N 3.35Å; P410-L414 WeakPolarHBondContact O-CB 3.34Å; P410-L414 WeakPolarHBondContact O-CG 3.19Å; P410-L414 PolarHBondContact O-N 2.73Å
411	G	92	Very high	90.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-43.7	179	0	0	0	0	0	113.9	C407 L409 L413 L414 M415	C407-G411 PolarHBondContact O-N 3.22Å; L409-G411 PolarHBondContact O-N 2.79Å; G411-L413 VanDerWaalsContact C-N 3.29Å; G411-L413 PolarHBondContact O-N 3.42Å; G411-L414 PolarHBondContact O-N 3.01Å; G411-M415 PolarHBondContact O-N 2.86Å
412	G	92.5	Very high	91.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-37.3	171.8	0	0	0	0	0	112.7	T408 L409 M415 L416	T408-G412 PolarHBondContact O-N 2.85Å; L409-G412 PolarHBondContact O-N 3.39Å; G412-M415 WeakPolarHBondContact O-CB 3.38Å; G412-M415 PolarHBondContact O-N 2.82Å; G412-L416 WeakPolarHBondContact O-CG 3.5Å; G412-L416 PolarHBondContact O-N 3.45Å
413	L	90.8	Very high	91.8	Very high	44 Å²	44	32.4 Å²	32.4	23%	0.23	19%	0.187	C	C	.	.	H	α-helix	trans	-67.1	-44.8	175.8	-177.4	59	0	0	0	111.9	F153 F373 I377 L409 P410 G411 M415 L416 I417	F153-L413 HydrophobicContact CE1-CD1 3.9Å; F373-L413 HydrophobicContact CE1-CD1 4.43Å; F373-L413 HydrophobicContact CE1-CD2 4.27Å; F373-L413 HydrophobicContact CE1-CG 4.49Å; F373-L413 HydrophobicContact CZ-CD2 3.97Å; I377-L413 HydrophobicContact CD1-CD2 3.58Å; I377-L413 HydrophobicContact CD1-CG 3.84Å; I377-L413 HydrophobicContact CG1-CD2 4.35Å; L409-L413 WeakPolarHBondContact O-CB 3.34Å; L409-L413 PolarHBondContact O-N 3.15Å; P410-L413 PolarHBondContact O-N 3.35Å; G411-L413 VanDerWaalsContact C-N 3.29Å; G411-L413 PolarHBondContact O-N 3.42Å; L413-M415 VanDerWaalsContact C-N 3.3Å; L413-M415 PolarHBondContact O-N 2.69Å; L413-L416 PolarHBondContact O-N 2.96Å; L413-L416 VanDerWaalsContact O-N 3.17Å; L413-I417 HydrophobicContact CD1-CD1 4.1Å; L413-I417 HydrophobicContact CD1-CG1 4.36Å; L413-I417 HydrophobicContact CG-CD1 3.81Å; L413-I417 WeakPolarHBondContact O-CD1 3.35Å; L413-I417 VanDerWaalsContact O-CG1 3.29Å; L413-I417 WeakPolarHBondContact O-CG1 3.43Å; L413-I417 PolarHBondContact O-N 3.25Å
414	L	92.7	Very high	92.4	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-39.1	174.6	-77.6	168.7	0	0	0	112.1	I377 F378 P410 G411 L416 I417 A418 I550	I377-L414 HydrophobicContact CB-CD2 4.16Å; I377-L414 HydrophobicContact CB-CG 4.43Å; I377-L414 HydrophobicContact CD1-CD2 4.28Å; I377-L414 HydrophobicContact CG2-CD1 3.91Å; I377-L414 HydrophobicContact CG2-CD2 4.08Å; I377-L414 HydrophobicContact CG2-CG 3.79Å; F378-L414 HydrophobicContact CD2-CD1 4Å; F378-L414 HydrophobicContact CD2-CD2 3.96Å; F378-L414 HydrophobicContact CE1-CD1 4.24Å; F378-L414 HydrophobicContact CE2-CD1 3.61Å; F378-L414 HydrophobicContact CE2-CD2 3.76Å; F378-L414 HydrophobicContact CE2-CG 4.32Å; F378-L414 HydrophobicContact CG-CD1 4.46Å; F378-L414 HydrophobicContact CZ-CD1 3.74Å; P410-L414 WeakPolarHBondContact O-CB 3.34Å; P410-L414 WeakPolarHBondContact O-CG 3.19Å; P410-L414 PolarHBondContact O-N 2.73Å; G411-L414 PolarHBondContact O-N 3.01Å; L414-L416 PolarHBondContact O-N 3.49Å; L414-I417 PolarHBondContact O-N 2.98Å; L414-A418 WeakPolarHBondContact O-CB 3.45Å; L414-A418 PolarHBondContact O-N 2.94Å; L414-I550 HydrophobicContact CB-CD1 4.38Å; L414-I550 HydrophobicContact CD1-CD1 3.61Å
415	M	94.1	Very high	92.9	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-56.7	-48.9	172.9	177.5	-168.7	72.4	0	0	111.6	G411 G412 L413 A418 F419 W445 W458 W539 L542 F543 W546	G411-M415 PolarHBondContact O-N 2.86Å; G412-M415 WeakPolarHBondContact O-CB 3.38Å; G412-M415 PolarHBondContact O-N 2.82Å; L413-M415 VanDerWaalsContact C-N 3.3Å; L413-M415 PolarHBondContact O-N 2.69Å; M415-A418 PolarHBondContact O-N 2.76Å; M415-F419 WeakPolarHBondContact O-CB 3.36Å; M415-F419 PolarHBondContact O-N 3.37Å; M415-W445 HydrophobicContact CE-CH2 4.48Å; M415-W458 HydrophobicContact CG-CH2 3.63Å; M415-W458 HydrophobicContact CG-CZ2 4.38Å; M415-W458 HydrophobicContact CG-CZ3 4.37Å; M415-W458 HydrophobicContact SD-CH2 4.17Å; M415-W458 HydrophobicContact SD-CZ3 4.37Å; M415-W539 HydrophobicContact CE-CZ3 4.15Å; M415-L542 HydrophobicContact CE-CB 4.38Å; M415-L542 HydrophobicContact SD-CB 4.16Å; M415-F543 HydrophobicContact CE-CD2 4.5Å; M415-F543 HydrophobicContact CE-CE2 4.24Å; M415-W546 HydrophobicContact CB-CD2 3.57Å; M415-W546 HydrophobicContact CB-CE3 3.98Å; M415-W546 HydrophobicContact CB-CG 3.8Å; M415-W546 HydrophobicContact CB-CZ2 4.15Å; M415-W546 HydrophobicContact CB-CZ3 4.43Å; M415-W546 HydrophobicContact CG-CD2 3.92Å; M415-W546 VanDerWaalsContact CG-CE2 3.45Å; M415-W546 HydrophobicContact CG-CG 4.15Å; M415-W546 HydrophobicContact CG-CZ2 3.82Å; M415-W546 HydrophobicContact SD-CG 4.17Å; M415-W546 PolarHBondContact SD-NE1 2.84Å
416	L	93.6	Very high	93.4	Very high	39 Å²	39	30.9 Å²	30.9	20%	0.204	17%	0.168	C	C	.	.	H	α-helix	trans	-65.1	-42.2	-178.9	-69.1	174.2	0	0	0	111.9	F153 G412 L413 L414 F419 Y420 W445 W539 F543	F153-L416 HydrophobicContact CZ-CD1 4.38Å; G412-L416 WeakPolarHBondContact O-CG 3.5Å; G412-L416 PolarHBondContact O-N 3.45Å; L413-L416 PolarHBondContact O-N 2.96Å; L413-L416 VanDerWaalsContact O-N 3.17Å; L414-L416 PolarHBondContact O-N 3.49Å; L416-F419 PolarHBondContact O-N 2.89Å; L416-Y420 WeakPolarHBondContact O-CB 3.39Å; L416-Y420 PolarHBondContact O-N 2.95Å; L416-W445 HydrophobicContact CD2-CH2 3.78Å; L416-W445 HydrophobicContact CD2-CZ2 4.34Å; L416-W539 HydrophobicContact CD2-CH2 4.14Å; L416-W539 HydrophobicContact CD2-CZ3 4.1Å; L416-F543 HydrophobicContact CD1-CZ 4.34Å
417	I	93.3	Very high	93.8	Very high	10 Å²	10	28.7 Å²	28.7	5%	0.051	15%	0.147	C	C	.	.	H	α-helix	trans	-66.8	-44.3	177.6	-62.9	158.9	0	0	0	110.7	C370 F373 S374 I377 L413 L414 F419 Y420 S421	C370-I417 HydrophobicContact CB-CG2 3.63Å; F373-I417 HydrophobicContact CD1-CD1 3.27Å; F373-I417 HydrophobicContact CD1-CG1 3.95Å; F373-I417 HydrophobicContact CE1-CD1 3.38Å; F373-I417 HydrophobicContact CE1-CG1 4.11Å; F373-I417 HydrophobicContact CG-CD1 4.25Å; F373-I417 HydrophobicContact CZ-CD1 4.41Å; S374-I417 VanDerWaalsContact OG-CG2 3.3Å; S374-I417 WeakPolarHBondContact OG-CG2 3.33Å; I377-I417 HydrophobicContact CD1-CD1 3.38Å; L413-I417 HydrophobicContact CD1-CD1 4.1Å; L413-I417 HydrophobicContact CD1-CG1 4.36Å; L413-I417 HydrophobicContact CG-CD1 3.81Å; L413-I417 WeakPolarHBondContact O-CD1 3.35Å; L413-I417 VanDerWaalsContact O-CG1 3.29Å; L413-I417 WeakPolarHBondContact O-CG1 3.43Å; L413-I417 PolarHBondContact O-N 3.25Å; L414-I417 PolarHBondContact O-N 2.98Å; I417-F419 VanDerWaalsContact C-N 3.34Å; I417-F419 PolarHBondContact O-N 2.74Å; I417-Y420 PolarHBondContact O-N 2.67Å; I417-S421 WeakPolarHBondContact O-CB 3.17Å; I417-S421 PolarHBondContact O-N 3.49Å
418	A	94	Very high	94.2	Very high	45 Å²	45	28.5 Å²	28.5	37%	0.372	15%	0.145	S	C	.	.	H	α-helix	trans	-62.2	-42.8	177.9	0	0	0	0	0	111.3	L414 M415 F422	L414-A418 WeakPolarHBondContact O-CB 3.45Å; L414-A418 PolarHBondContact O-N 2.94Å; M415-A418 PolarHBondContact O-N 2.76Å; A418-F422 VanDerWaalsContact O-CB 3.28Å; A418-F422 WeakPolarHBondContact O-CB 3.17Å; A418-F422 PolarHBondContact O-N 3.37Å
419	F	96.2	Very high	94.5	Very high	12 Å²	12	27.3 Å²	27.3	5%	0.053	14%	0.138	C	C	.	.	I	π-helix	trans	-57.2	-53.3	172.5	168.9	-93.5	0	0	0	111.6	M415 L416 I417 L423 H424 Y442 W445 W446 W458	M415-F419 WeakPolarHBondContact O-CB 3.36Å; M415-F419 PolarHBondContact O-N 3.37Å; L416-F419 PolarHBondContact O-N 2.89Å; I417-F419 VanDerWaalsContact C-N 3.34Å; I417-F419 PolarHBondContact O-N 2.74Å; F419-L423 HydrophobicContact CD2-CB 4.25Å; F419-L423 HydrophobicContact CD2-CD1 3.61Å; F419-L423 HydrophobicContact CD2-CG 4.48Å; F419-L423 HydrophobicContact CE2-CB 4.17Å; F419-L423 HydrophobicContact CE2-CD1 3.85Å; F419-L423 WeakPolarHBondContact O-CA 3.35Å; F419-L423 WeakPolarHBondContact O-CB 3.5Å; F419-L423 PolarHBondContact O-N 3.01Å; F419-H424 PolarHBondContact O-N 3.25Å; F419-Y442 HydrophobicContact CE1-CE2 4.44Å; F419-Y442 HydrophobicContact CE2-CD1 4.07Å; F419-Y442 HydrophobicContact CE2-CD2 4.12Å; F419-Y442 AromaticContact CE2-CG 3.78Å; F419-Y442 HydrophobicContact CE2-CG 3.78Å; F419-Y442 AromaticContact CZ-CD1 3.89Å; F419-Y442 HydrophobicContact CZ-CD1 3.89Å; F419-Y442 AromaticContact CZ-CD2 3.52Å; F419-Y442 HydrophobicContact CZ-CD2 3.52Å; F419-Y442 HydrophobicContact CZ-CE1 4.09Å; F419-Y442 AromaticContact CZ-CE2 3.7Å; F419-Y442 HydrophobicContact CZ-CE2 3.7Å; F419-Y442 AromaticContact CZ-CG 3.61Å; F419-Y442 HydrophobicContact CZ-CG 3.61Å; F419-Y442 AromaticContact CZ-CZ 3.98Å; F419-W445 HydrophobicContact CD1-CZ2 4.03Å; F419-W445 HydrophobicContact CD2-CZ2 4.22Å; F419-W445 AromaticContact CD2-NE1 3.58Å; F419-W445 HydrophobicContact CE1-CZ2 4.19Å; F419-W445 AromaticContact CE1-NE1 3.65Å; F419-W445 AromaticContact CE2-CD1 3.74Å; F419-W445 AromaticContact CE2-CE2 3.94Å; F419-W445 HydrophobicContact CE2-CZ2 4.42Å; F419-W445 AromaticContact CE2-NE1 3Å; F419-W445 HydrophobicContact CG-CZ2 4.07Å; F419-W445 AromaticContact CZ-CD1 3.93Å; F419-W445 HydrophobicContact CZ-CZ2 4.4Å; F419-W445 AromaticContact CZ-NE1 3.05Å; F419-W446 HydrophobicContact CZ-CZ3 4.46Å; F419-W458 HydrophobicContact CB-CH2 3.57Å; F419-W458 HydrophobicContact CB-CZ2 3.93Å; F419-W458 HydrophobicContact CB-CZ3 4.28Å; F419-W458 HydrophobicContact CD2-CD2 4.31Å; F419-W458 HydrophobicContact CD2-CE3 4.15Å; F419-W458 AromaticContact CD2-CH2 3.87Å; F419-W458 HydrophobicContact CD2-CH2 3.87Å; F419-W458 HydrophobicContact CD2-CZ2 4.02Å; F419-W458 AromaticContact CD2-CZ3 3.94Å; F419-W458 HydrophobicContact CD2-CZ3 3.94Å; F419-W458 HydrophobicContact CG-CH2 4Å; F419-W458 HydrophobicContact CG-CZ2 4.42Å; F419-W458 HydrophobicContact CG-CZ3 4.26Å
420	Y	95.1	Very high	94.8	Very high	33 Å²	33	23.9 Å²	23.9	13%	0.129	12%	0.118	C	C	.	.	I	π-helix	trans	-63.8	-51.1	-177.2	-174.8	-95.9	0	0	0	111.6	L137 F141 Y150 Q366 L416 I417 F422 H424 S425	L137-Y420 HydrophobicContact CD2-CD2 3.56Å; L137-Y420 HydrophobicContact CD2-CE2 3.53Å; F141-Y420 AromaticContact CE2-CE2 3.72Å; F141-Y420 HydrophobicContact CE2-CE2 3.72Å; F141-Y420 AromaticContact CZ-CE2 3.7Å; F141-Y420 HydrophobicContact CZ-CE2 3.7Å; Y150-Y420 AromaticContact CE2-CZ 3.96Å; Y150-Y420 WeakPolarHBondContact CE2-OH 3.43Å; Q366-Y420 HydrophobicContact CB-CE1 4.41Å; Q366-Y420 PolarHBondContact OE1-OH 3.08Å; L416-Y420 WeakPolarHBondContact O-CB 3.39Å; L416-Y420 PolarHBondContact O-N 2.95Å; I417-Y420 PolarHBondContact O-N 2.67Å; Y420-F422 PolarHBondContact O-N 3.22Å; Y420-H424 HydrophobicContact CD2-CB 4.29Å; Y420-H424 AromaticContact CE2-CD2 3.49Å; Y420-H424 VanDerWaalsContact CE2-CD2 3.49Å; Y420-H424 WeakPolarHBondContact CE2-CD2 3.41Å; Y420-H424 AromaticContact CZ-CD2 3.76Å; Y420-H424 WeakPolarHBondContact O-CA 3.39Å; Y420-H424 WeakPolarHBondContact O-CB 3.42Å; Y420-H424 PolarHBondContact O-N 3.01Å; Y420-S425 WeakPolarHBondContact CE1-OG 3.42Å; Y420-S425 PolarHBondContact O-N 2.97Å
421	S	95.5	Very high	95.1	Very high	17 Å²	17	23.4 Å²	23.4	12%	0.119	12%	0.115	C	C	.	.	I	π-helix	trans	-60	-49.7	-178.5	-174.3	0	0	0	0	111.7	V367 I417 W426	V367-S421 WeakPolarHBondContact CG2-O 3.35Å; I417-S421 WeakPolarHBondContact O-CB 3.17Å; I417-S421 PolarHBondContact O-N 3.49Å; S421-W426 VanDerWaalsContact O-CB 3.31Å; S421-W426 WeakPolarHBondContact O-CB 3.35Å; S421-W426 PolarHBondContact O-N 3.14Å
422	F	95.6	Very high	95.4	Very high	112 Å²	112	23.5 Å²	23.5	49%	0.491	12%	0.115	S	C	.	.	I	π-helix	trans	-84.8	-58.8	-174.5	-170.8	-107.9	0	0	0	112.8	A418 Y420 W426 L427	A418-F422 VanDerWaalsContact O-CB 3.28Å; A418-F422 WeakPolarHBondContact O-CB 3.17Å; A418-F422 PolarHBondContact O-N 3.37Å; Y420-F422 PolarHBondContact O-N 3.22Å; F422-W426 HydrophobicContact CD2-CG 4.34Å; F422-W426 AromaticContact CE2-CD1 3.91Å; F422-W426 WeakPolarHBondContact O-CB 3.28Å; F422-L427 WeakPolarHBondContact O-CG 3.44Å; F422-L427 PolarHBondContact O-N 2.82Å
423	L	96.3	Very high	95.5	Very high	7 Å²	7	26.1 Å²	26.1	4%	0.037	13%	0.128	C	C	.	.	I	π-helix	trans	-76.6	-28.7	-171.4	-67.8	172.9	0	0	0	113.2	F419 L427 Y442 W458 N459	F419-L423 HydrophobicContact CD2-CB 4.25Å; F419-L423 HydrophobicContact CD2-CD1 3.61Å; F419-L423 HydrophobicContact CD2-CG 4.48Å; F419-L423 HydrophobicContact CE2-CB 4.17Å; F419-L423 HydrophobicContact CE2-CD1 3.85Å; F419-L423 WeakPolarHBondContact O-CA 3.35Å; F419-L423 WeakPolarHBondContact O-CB 3.5Å; F419-L423 PolarHBondContact O-N 3.01Å; L423-L427 HydrophobicContact CD2-CD1 3.88Å; L423-Y442 HydrophobicContact CB-CD1 4.02Å; L423-Y442 HydrophobicContact CB-CE1 4.49Å; L423-Y442 WeakPolarHBondContact O-CE1 3.4Å; L423-W458 WeakPolarHBondContact CD1-O 3.42Å; L423-N459 HydrophobicContact CD1-CB 4.11Å; L423-N459 HydrophobicContact CD2-CB 4.35Å
424	H	96.4	Very high	95.8	Very high	5 Å²	5	25.7 Å²	25.7	2%	0.023	13%	0.126	C	C	.	.	I	π-helix	trans	-92.2	-76.4	173.6	-173.8	71	0	0	0	111.3	T138 F419 Y420 N428 Y442	T138-H424 PolarHBondContact OG1-CE1 3Å; F419-H424 PolarHBondContact O-N 3.25Å; Y420-H424 HydrophobicContact CD2-CB 4.29Å; Y420-H424 AromaticContact CE2-CD2 3.49Å; Y420-H424 VanDerWaalsContact CE2-CD2 3.49Å; Y420-H424 WeakPolarHBondContact CE2-CD2 3.41Å; Y420-H424 AromaticContact CZ-CD2 3.76Å; Y420-H424 WeakPolarHBondContact O-CA 3.39Å; Y420-H424 WeakPolarHBondContact O-CB 3.42Å; Y420-H424 PolarHBondContact O-N 3.01Å; H424-N428 PolarHBondContact ND1-ND2 3.33Å; H424-N428 WeakPolarHBondContact O-CB 3.32Å; H424-N428 PolarHBondContact O-N 3.29Å; H424-N428 PolarHBondContact O-ND2 3.42Å; H424-Y442 HydrophobicContact CB-CE1 4.06Å; H424-Y442 AromaticContact ND1-CZ 3.81Å; H424-Y442 PolarHBondContact ND1-OH 3.43Å
425	S	96.7	Very high	95.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-66.7	-49.5	-165	-57	0	0	0	0	112.9	N363 Q366 Y420 N428 A429	N363-S425 WeakPolarHBondContact CB-O 3.43Å; N363-S425 WeakPolarHBondContact OD1-CA 3.41Å; Q366-S425 PolarHBondContact OE1-OG 3.17Å; Y420-S425 WeakPolarHBondContact CE1-OG 3.42Å; Y420-S425 PolarHBondContact O-N 2.97Å; S425-N428 PolarHBondContact O-N 2.84Å; S425-A429 WeakPolarHBondContact O-CB 3.28Å; S425-A429 PolarHBondContact O-N 3.03Å
426	W	97.4	Very high	96	Very high	87 Å²	87	29.7 Å²	29.7	33%	0.33	14%	0.141	S	C	.	.	I	π-helix	trans	-62.4	-51.2	-179.3	179.4	-95.1	0	0	0	112.3	F364 V367 S421 F422 N428 A429 F430	F364-W426 HydrophobicContact CD1-CE3 4.34Å; F364-W426 HydrophobicContact CD1-CZ3 4.36Å; F364-W426 AromaticContact CE1-CE3 3.95Å; F364-W426 HydrophobicContact CE1-CE3 3.95Å; F364-W426 AromaticContact CE1-CZ3 3.88Å; F364-W426 HydrophobicContact CE1-CZ3 3.88Å; V367-W426 HydrophobicContact CG1-CE3 4.23Å; V367-W426 HydrophobicContact CG2-CB 4.1Å; S421-W426 VanDerWaalsContact O-CB 3.31Å; S421-W426 WeakPolarHBondContact O-CB 3.35Å; S421-W426 PolarHBondContact O-N 3.14Å; F422-W426 HydrophobicContact CD2-CG 4.34Å; F422-W426 AromaticContact CE2-CD1 3.91Å; F422-W426 WeakPolarHBondContact O-CB 3.28Å; W426-N428 PolarHBondContact O-N 3.03Å; W426-A429 PolarHBondContact O-N 3.1Å; W426-F430 HydrophobicContact CD2-CD2 4.16Å; W426-F430 AromaticContact CD2-CE2 3.85Å; W426-F430 HydrophobicContact CD2-CE2 3.85Å; W426-F430 AromaticContact CE2-CD2 3.85Å; W426-F430 AromaticContact CE2-CE2 3.33Å; W426-F430 HydrophobicContact CE3-CE2 4.23Å; W426-F430 HydrophobicContact CG-CD2 4.41Å; W426-F430 AromaticContact CH2-CE2 3.74Å; W426-F430 HydrophobicContact CH2-CE2 3.74Å; W426-F430 HydrophobicContact CH2-CZ 4.19Å; W426-F430 HydrophobicContact CZ2-CD2 4.25Å; W426-F430 AromaticContact CZ2-CE2 3.28Å; W426-F430 HydrophobicContact CZ2-CE2 3.28Å; W426-F430 AromaticContact CZ2-CZ 3.71Å; W426-F430 HydrophobicContact CZ2-CZ 3.71Å; W426-F430 HydrophobicContact CZ3-CE2 4.19Å; W426-F430 AromaticContact NE1-CD2 3.87Å; W426-F430 AromaticContact NE1-CE2 3.75Å; W426-F430 WeakPolarHBondContact O-CD2 3.27Å; W426-F430 PolarHBondContact O-N 2.94Å; W426-F430 VanDerWaalsContact O-N 3.09Å
427	L	97.2	Very high	96	Very high	17 Å²	17	27.9 Å²	27.9	9%	0.089	13%	0.131	C	C	.	.	H	α-helix	trans	-66	-36.4	179.8	-65.7	-179.1	0	0	0	112.9	P341 F422 L423 F430 A431 F441 I461	P341-L427 HydrophobicContact CB-CB 4.4Å; P341-L427 HydrophobicContact CB-CD2 3.83Å; F422-L427 WeakPolarHBondContact O-CG 3.44Å; F422-L427 PolarHBondContact O-N 2.82Å; L423-L427 HydrophobicContact CD2-CD1 3.88Å; L427-F430 PolarHBondContact O-N 3.45Å; L427-A431 WeakPolarHBondContact O-CB 3.15Å; L427-A431 PolarHBondContact O-N 3.23Å; L427-F441 HydrophobicContact CB-CD2 3.53Å; L427-F441 HydrophobicContact CB-CE2 3.61Å; L427-F441 HydrophobicContact CB-CG 4.11Å; L427-F441 HydrophobicContact CB-CZ 4.24Å; L427-F441 HydrophobicContact CD1-CB 3.84Å; L427-F441 HydrophobicContact CD1-CD1 4.36Å; L427-F441 HydrophobicContact CD1-CD2 4.03Å; L427-F441 HydrophobicContact CD1-CG 3.81Å; L427-F441 HydrophobicContact CG-CD2 4.47Å; L427-I461 HydrophobicContact CD1-CD1 3.37Å
428	N	97.2	Very high	96	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.7	-37.4	174.8	-83.2	-75.1	0	0	0	112.3	S135 F359 H424 S425 W426 A431 E432 R439	S135-N428 PolarHBondContact OG-ND2 2.95Å; S135-N428 PolarHBondContact OG-OD1 3.15Å; F359-N428 HydrophobicContact CE1-CB 3.93Å; F359-N428 HydrophobicContact CZ-CB 4.05Å; H424-N428 PolarHBondContact ND1-ND2 3.33Å; H424-N428 WeakPolarHBondContact O-CB 3.32Å; H424-N428 PolarHBondContact O-N 3.29Å; H424-N428 PolarHBondContact O-ND2 3.42Å; S425-N428 PolarHBondContact O-N 2.84Å; W426-N428 PolarHBondContact O-N 3.03Å; N428-A431 PolarHBondContact O-N 3.13Å; N428-E432 WeakPolarHBondContact O-CB 3.29Å; N428-E432 PolarHBondContact O-N 2.95Å; N428-R439 WeakPolarHBondContact OD1-CD 3.35Å
429	A	97.1	Very high	96	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-50.2	174.3	0	0	0	0	0	111	N363 F364 S425 W426 A431 E432 M433	N363-A429 HydrophobicContact CB-CB 3.97Å; F364-A429 HydrophobicContact CD1-CB 4.25Å; F364-A429 HydrophobicContact CD2-CB 4.09Å; F364-A429 HydrophobicContact CE1-CB 3.96Å; F364-A429 HydrophobicContact CE2-CB 3.82Å; F364-A429 HydrophobicContact CG-CB 4.3Å; F364-A429 HydrophobicContact CZ-CB 3.74Å; S425-A429 WeakPolarHBondContact O-CB 3.28Å; S425-A429 PolarHBondContact O-N 3.03Å; W426-A429 PolarHBondContact O-N 3.1Å; A429-A431 PolarHBondContact O-N 3.26Å; A429-E432 PolarHBondContact O-N 3.43Å; A429-M433 VanDerWaalsContact O-CG 3.31Å; A429-M433 WeakPolarHBondContact O-CG 3.3Å; A429-M433 PolarHBondContact O-N 3.19Å
430	F	96.7	Very high	95.9	Very high	56 Å²	56	25 Å²	25	25%	0.246	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-39.3	176.3	-86	-95.9	0	0	0	113	F364 W426 L427 M433 L434	F364-F430 HydrophobicContact CE1-CE2 4.09Å; F364-F430 HydrophobicContact CZ-CD2 4.36Å; F364-F430 HydrophobicContact CZ-CE2 4.06Å; W426-F430 HydrophobicContact CD2-CD2 4.16Å; W426-F430 AromaticContact CD2-CE2 3.85Å; W426-F430 HydrophobicContact CD2-CE2 3.85Å; W426-F430 AromaticContact CE2-CD2 3.85Å; W426-F430 AromaticContact CE2-CE2 3.33Å; W426-F430 HydrophobicContact CE3-CE2 4.23Å; W426-F430 HydrophobicContact CG-CD2 4.41Å; W426-F430 AromaticContact CH2-CE2 3.74Å; W426-F430 HydrophobicContact CH2-CE2 3.74Å; W426-F430 HydrophobicContact CH2-CZ 4.19Å; W426-F430 HydrophobicContact CZ2-CD2 4.25Å; W426-F430 AromaticContact CZ2-CE2 3.28Å; W426-F430 HydrophobicContact CZ2-CE2 3.28Å; W426-F430 AromaticContact CZ2-CZ 3.71Å; W426-F430 HydrophobicContact CZ2-CZ 3.71Å; W426-F430 HydrophobicContact CZ3-CE2 4.19Å; W426-F430 AromaticContact NE1-CD2 3.87Å; W426-F430 AromaticContact NE1-CE2 3.75Å; W426-F430 WeakPolarHBondContact O-CD2 3.27Å; W426-F430 PolarHBondContact O-N 2.94Å; W426-F430 VanDerWaalsContact O-N 3.09Å; L427-F430 PolarHBondContact O-N 3.45Å; F430-M433 HydrophobicContact CB-CE 4.43Å; F430-M433 HydrophobicContact CD1-CE 3.92Å; F430-M433 HydrophobicContact CD2-CE 4.06Å; F430-M433 HydrophobicContact CE1-CE 4.13Å; F430-M433 HydrophobicContact CE2-CE 4.24Å; F430-M433 HydrophobicContact CG-CE 3.9Å; F430-M433 HydrophobicContact CZ-CE 4.29Å; F430-M433 PolarHBondContact O-N 3.33Å; F430-L434 WeakPolarHBondContact O-CB 3.28Å; F430-L434 WeakPolarHBondContact O-CG 3.46Å; F430-L434 PolarHBondContact O-N 2.94Å
431	A	97.1	Very high	95.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.7	-44.9	176.8	0	0	0	0	0	112	P341 L427 N428 A429 R435 F436 R439 F441	P341-A431 HydrophobicContact CG-CB 3.81Å; L427-A431 WeakPolarHBondContact O-CB 3.15Å; L427-A431 PolarHBondContact O-N 3.23Å; N428-A431 PolarHBondContact O-N 3.13Å; A429-A431 PolarHBondContact O-N 3.26Å; A431-R435 CarbonylContact O-C 3.49Å; A431-R435 PolarHBondContact O-N 2.93Å; A431-R435 VanDerWaalsContact O-N 3.07Å; A431-F436 HydrophobicContact CB-CB 4.18Å; A431-F436 HydrophobicContact CB-CD1 4.41Å; A431-F436 PolarHBondContact O-N 2.92Å; A431-R439 HydrophobicContact CB-CG 4.25Å; A431-F441 HydrophobicContact CB-CE2 4.31Å; A431-F441 HydrophobicContact CB-CZ 3.77Å
432	E	97.1	Very high	95.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-65.8	-46.5	177.9	-173.6	75.5	-142.1	0	0	111.2	I355 R356 F359 V360 N428 A429 L434 R435 R439	I355-E432 HydrophobicContact CG2-CG 4.32Å; R356-E432 HydrophobicContact CB-CG 4.45Å; R356-E432 WeakPolarHBondContact CB-OE1 3.48Å; R356-E432 IonicContact CZ-OE2 2.8Å; R356-E432 PolarHBondContact N-OE1 3.3Å; R356-E432 IonicContact NE-OE1 2.72Å; R356-E432 PolarHBondContact NE-OE1 3.02Å; R356-E432 IonicContact NE-OE2 3.63Å; R356-E432 PolarHBondContact NE-OE2 3.34Å; R356-E432 IonicContact NH2-OE2 3.62Å; R356-E432 PolarHBondContact NH2-OE2 3.07Å; F359-E432 HydrophobicContact CD1-CB 4Å; F359-E432 HydrophobicContact CD1-CG 3.93Å; F359-E432 HydrophobicContact CE1-CB 4.34Å; V360-E432 HydrophobicContact CG2-CB 3.81Å; V360-E432 HydrophobicContact CG2-CG 3.55Å; N428-E432 WeakPolarHBondContact O-CB 3.29Å; N428-E432 PolarHBondContact O-N 2.95Å; A429-E432 PolarHBondContact O-N 3.43Å; E432-L434 VanDerWaalsContact C-N 3.32Å; E432-L434 PolarHBondContact O-N 3.48Å; E432-R435 PolarHBondContact O-N 3.16Å; E432-R435 VanDerWaalsContact O-N 3.08Å; E432-R439 IonicContact OE1-NH2 2.7Å; E432-R439 IonicContact OE2-CZ 3.29Å; E432-R439 IonicContact OE2-NH1 3.48Å; E432-R439 PolarHBondContact OE2-NH1 2.96Å; E432-R439 IonicContact OE2-NH2 3.13Å; E432-R439 PolarHBondContact OE2-NH2 3.33Å
433	M	96.4	Very high	95.8	Very high	56 Å²	56	18.9 Å²	18.9	28%	0.276	8%	0.082	S	C	.	.	H	α-helix	trans	-58.4	-41.8	177	-72.8	-170.6	-57.1	0	0	112.6	I355 W357 V360 F364 A429 F430 R435	I355-M433 WeakPolarHBondContact CD1-O 3.23Å; W357-M433 HydrophobicContact CZ3-CG 4.43Å; V360-M433 HydrophobicContact CB-CG 4.43Å; V360-M433 HydrophobicContact CG1-CG 3.58Å; V360-M433 HydrophobicContact CG1-SD 3.9Å; V360-M433 HydrophobicContact CG2-CG 3.9Å; F364-M433 HydrophobicContact CE2-CE 3.88Å; F364-M433 HydrophobicContact CE2-SD 3.78Å; F364-M433 HydrophobicContact CZ-CE 3.59Å; F364-M433 HydrophobicContact CZ-SD 4.12Å; A429-M433 VanDerWaalsContact O-CG 3.31Å; A429-M433 WeakPolarHBondContact O-CG 3.3Å; A429-M433 PolarHBondContact O-N 3.19Å; F430-M433 HydrophobicContact CB-CE 4.43Å; F430-M433 HydrophobicContact CD1-CE 3.92Å; F430-M433 HydrophobicContact CD2-CE 4.06Å; F430-M433 HydrophobicContact CE1-CE 4.13Å; F430-M433 HydrophobicContact CE2-CE 4.24Å; F430-M433 HydrophobicContact CG-CE 3.9Å; F430-M433 HydrophobicContact CZ-CE 4.29Å; F430-M433 PolarHBondContact O-N 3.33Å; M433-R435 VanDerWaalsContact C-N 3.27Å; M433-R435 PolarHBondContact O-N 3.48Å
434	L	95.6	Very high	95.5	Very high	35 Å²	35	20.6 Å²	20.6	18%	0.183	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2.2	-179.9	-65.1	169.4	0	0	0	113.1	Y336 L339 F430 E432 F436	Y336-L434 HydrophobicContact CE2-CB 4.13Å; Y336-L434 WeakPolarHBondContact CE2-O 3.36Å; Y336-L434 PolarHBondContact OH-O 2.94Å; L339-L434 HydrophobicContact CB-CD1 3.77Å; L339-L434 HydrophobicContact CB-CD2 4.1Å; L339-L434 HydrophobicContact CD1-CD2 4.46Å; L339-L434 WeakPolarHBondContact O-CD1 3.48Å; F430-L434 WeakPolarHBondContact O-CB 3.28Å; F430-L434 WeakPolarHBondContact O-CG 3.46Å; F430-L434 PolarHBondContact O-N 2.94Å; E432-L434 VanDerWaalsContact C-N 3.32Å; E432-L434 PolarHBondContact O-N 3.48Å; L434-F436 PolarHBondContact O-N 3.35Å
435	R	96.3	Very high	95.4	Very high	89 Å²	89	20.8 Å²	20.8	34%	0.336	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	36.9	-172.7	-60.7	172.8	56.6	-175.9	-1.8	112.9	R351 T352 R353 I355 A431 E432 M433	R351-R435 CarbonylContact C-O 3.59Å; R351-R435 WeakPolarHBondContact CA-O 3.42Å; R351-R435 WeakPolarHBondContact CB-O 3.36Å; T352-R435 PolarHBondContact N-O 3.13Å; T352-R435 VanDerWaalsContact O-CZ 3.3Å; T352-R435 PolarHBondContact O-NE 3.29Å; T352-R435 PolarHBondContact O-NH2 3.32Å; T352-R435 VanDerWaalsContact OG1-CA 3.28Å; T352-R435 WeakPolarHBondContact OG1-CA 3.48Å; T352-R435 WeakPolarHBondContact OG1-CB 3.46Å; R353-R435 PolarHBondContact O-NH2 3.18Å; I355-R435 HydrophobicContact CD1-CG 4.09Å; I355-R435 HydrophobicContact CG1-CG 3.52Å; A431-R435 CarbonylContact O-C 3.49Å; A431-R435 PolarHBondContact O-N 2.93Å; A431-R435 VanDerWaalsContact O-N 3.07Å; E432-R435 PolarHBondContact O-N 3.16Å; E432-R435 VanDerWaalsContact O-N 3.08Å; M433-R435 VanDerWaalsContact C-N 3.27Å; M433-R435 PolarHBondContact O-N 3.48Å
436	F	96.2	Very high	95.2	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.009	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-79.8	124	175.2	-171.1	-109.5	0	0	0	110	Y130 Y336 A340 P341 T342 Y349 A431 L434 D438 F441	Y130-F436 HydrophobicContact CD1-CZ 4.14Å; Y130-F436 AromaticContact CE1-CZ 3.96Å; Y130-F436 HydrophobicContact CE1-CZ 3.96Å; Y336-F436 HydrophobicContact CE1-CD2 4.36Å; A340-F436 HydrophobicContact CB-CD2 4.33Å; P341-F436 HydrophobicContact CG-CD1 3.83Å; P341-F436 HydrophobicContact CG-CE1 4.32Å; P341-F436 HydrophobicContact CG-CG 4.35Å; T342-F436 HydrophobicContact CG2-CE2 4.18Å; T342-F436 HydrophobicContact CG2-CZ 3.96Å; Y349-F436 AromaticContact CD1-CE2 3.61Å; Y349-F436 HydrophobicContact CD1-CE2 3.61Å; Y349-F436 HydrophobicContact CD1-CZ 4.27Å; Y349-F436 HydrophobicContact CD2-CE2 4.49Å; Y349-F436 HydrophobicContact CE1-CE2 4.27Å; Y349-F436 HydrophobicContact CG-CD2 4.37Å; Y349-F436 AromaticContact CG-CE2 3.73Å; Y349-F436 HydrophobicContact CG-CE2 3.73Å; A431-F436 HydrophobicContact CB-CB 4.18Å; A431-F436 HydrophobicContact CB-CD1 4.41Å; A431-F436 PolarHBondContact O-N 2.92Å; L434-F436 PolarHBondContact O-N 3.35Å; F436-D438 WeakPolarHBondContact CD1-O 3.4Å; F436-D438 HydrophobicContact CE1-CB 4.12Å; F436-D438 WeakPolarHBondContact CE1-O 3.17Å; F436-D438 HydrophobicContact CZ-CB 4.28Å; F436-F441 HydrophobicContact CD1-CE1 4.41Å; F436-F441 HydrophobicContact CE1-CE1 4.21Å
437	G	92.7	Very high	94.9	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.01	11%	0.11	C	C	.	.			trans	-87.9	-24.2	-169.8	0	0	0	0	0	115.5	T132 R133 P350	T132-G437 CarbonylContact C-O 3.57Å; T132-G437 VanDerWaalsContact CA-O 3.3Å; T132-G437 WeakPolarHBondContact CA-O 3.46Å; R133-G437 PolarHBondContact N-O 2.93Å; R133-G437 VanDerWaalsContact O-O 3.06Å; P350-G437 WeakPolarHBondContact O-CA 3.5Å; P350-G437 PolarHBondContact O-N 3.19Å
438	D	93.6	Very high	94.6	Very high	4 Å²	4	23 Å²	23	2%	0.021	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-96	97.6	-177.2	-170.2	-0.7	0	0	0	111.5	Y130 R131 R133 P350 F436 L440	Y130-D438 WeakPolarHBondContact CA-OD2 3.45Å; Y130-D438 HydrophobicContact CD1-CB 3.82Å; Y130-D438 WeakPolarHBondContact CD1-OD2 3.2Å; R131-D438 WeakPolarHBondContact O-CA 3.23Å; R131-D438 WeakPolarHBondContact O-CB 3.36Å; R133-D438 WeakPolarHBondContact CG-OD1 3.44Å; R133-D438 IonicContact CZ-OD1 3.8Å; R133-D438 IonicContact NE-OD1 2.58Å; R133-D438 PolarHBondContact NE-OD1 3.19Å; R133-D438 IonicContact NE-OD2 3.56Å; R133-D438 IonicContact NH2-OD1 3.28Å; R133-D438 PolarHBondContact NH2-OD1 3.45Å; R133-D438 IonicContact NH2-OD2 3.4Å; R133-D438 PolarHBondContact NH2-OD2 2.77Å; R133-D438 VanDerWaalsContact NH2-OD2 3.13Å; P350-D438 HydrophobicContact CG-CB 4.08Å; F436-D438 WeakPolarHBondContact CD1-O 3.4Å; F436-D438 HydrophobicContact CE1-CB 4.12Å; F436-D438 WeakPolarHBondContact CE1-O 3.17Å; F436-D438 HydrophobicContact CZ-CB 4.28Å; D438-L440 PolarHBondContact OD1-N 3.14Å
439	R	94.2	Very high	94.3	Very high	1 Å²	1	25.1 Å²	25.1	0%	0.004	12%	0.12	C	C	.	.			trans	-99.1	22.7	-175	-53.1	179.3	-175.3	-167.5	0.6	113.7	R133 S135 N428 A431 E432 F441	R133-R439 VanDerWaalsContact O-CB 3.28Å; R133-R439 WeakPolarHBondContact O-CB 3.46Å; R133-R439 WeakPolarHBondContact O-CG 3.43Å; R133-R439 PolarHBondContact O-N 3.45Å; S135-R439 WeakPolarHBondContact CA-O 3.39Å; S135-R439 PolarHBondContact OG-O 3.5Å; N428-R439 WeakPolarHBondContact OD1-CD 3.35Å; A431-R439 HydrophobicContact CB-CG 4.25Å; E432-R439 IonicContact OE1-NH2 2.7Å; E432-R439 IonicContact OE2-CZ 3.29Å; E432-R439 IonicContact OE2-NH1 3.48Å; E432-R439 PolarHBondContact OE2-NH1 2.96Å; E432-R439 IonicContact OE2-NH2 3.13Å; E432-R439 PolarHBondContact OE2-NH2 3.33Å; R439-F441 HydrophobicContact CB-CE2 3.99Å; R439-F441 HydrophobicContact CB-CZ 4.01Å; R439-F441 HydrophobicContact CG-CE2 4.44Å; R439-F441 HydrophobicContact CG-CZ 4.2Å; R439-F441 PolarHBondContact O-N 3.04Å
440	L	93.5	Very high	94.1	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	13%	0.126	C	C	.	.			trans	-80.6	70.8	174.4	-165.8	73.4	0	0	0	111.3	W108 D111 R133 V136 D438 Y442 K443	W108-L440 HydrophobicContact CH2-CD1 4.45Å; W108-L440 HydrophobicContact CZ3-CD1 4.24Å; D111-L440 HydrophobicContact CB-CD2 4.03Å; R133-L440 HydrophobicContact CG-CB 4.46Å; V136-L440 HydrophobicContact CG2-CD1 3.73Å; D438-L440 PolarHBondContact OD1-N 3.14Å; L440-Y442 WeakPolarHBondContact CD1-O 3.46Å; L440-K443 HydrophobicContact CD1-CG 4.23Å; L440-K443 HydrophobicContact CD2-CG 4.43Å; L440-K443 HydrophobicContact CG-CG 4.41Å
441	F	95.4	Very high	93.7	Very high	3 Å²	3	24.5 Å²	24.5	1%	0.013	12%	0.119	C	C	.	.	S	Bend	trans	-79.9	-22.3	178.6	-50.3	-43.8	0	0	0	113	P341 L427 A431 F436 R439 V460 I461	P341-F441 HydrophobicContact CB-CE1 4.03Å; P341-F441 HydrophobicContact CB-CZ 4.17Å; P341-F441 HydrophobicContact CG-CE1 3.92Å; P341-F441 HydrophobicContact CG-CZ 3.84Å; L427-F441 HydrophobicContact CB-CD2 3.53Å; L427-F441 HydrophobicContact CB-CE2 3.61Å; L427-F441 HydrophobicContact CB-CG 4.11Å; L427-F441 HydrophobicContact CB-CZ 4.24Å; L427-F441 HydrophobicContact CD1-CB 3.84Å; L427-F441 HydrophobicContact CD1-CD1 4.36Å; L427-F441 HydrophobicContact CD1-CD2 4.03Å; L427-F441 HydrophobicContact CD1-CG 3.81Å; L427-F441 HydrophobicContact CG-CD2 4.47Å; A431-F441 HydrophobicContact CB-CE2 4.31Å; A431-F441 HydrophobicContact CB-CZ 3.77Å; F436-F441 HydrophobicContact CD1-CE1 4.41Å; F436-F441 HydrophobicContact CE1-CE1 4.21Å; R439-F441 HydrophobicContact CB-CE2 3.99Å; R439-F441 HydrophobicContact CB-CZ 4.01Å; R439-F441 HydrophobicContact CG-CE2 4.44Å; R439-F441 HydrophobicContact CG-CZ 4.2Å; R439-F441 PolarHBondContact O-N 3.04Å; F441-V460 WeakPolarHBondContact O-CB 3.42Å; F441-V460 PolarHBondContact O-N 2.92Å; F441-I461 HydrophobicContact CB-CD1 3.87Å; F441-I461 HydrophobicContact CB-CG1 4.32Å; F441-I461 HydrophobicContact CD1-CD1 3.57Å; F441-I461 HydrophobicContact CD1-CG1 4.01Å; F441-I461 HydrophobicContact CE1-CD1 4.44Å; F441-I461 HydrophobicContact CG-CD1 3.96Å
442	Y	95.4	Very high	93.3	Very high	1 Å²	1	26 Å²	26	0%	0.004	13%	0.129	C	C	.	.			trans	-151.6	163.4	177.3	56.3	-91.8	0	0	0	108.5	V136 L137 F419 L423 H424 L440 W446 T457 W458	V136-Y442 HydrophobicContact CB-CE2 4.14Å; V136-Y442 WeakPolarHBondContact CG2-O 3.4Å; L137-Y442 HydrophobicContact CB-CE2 4.13Å; L137-Y442 WeakPolarHBondContact CB-OH 3.41Å; F419-Y442 HydrophobicContact CE1-CE2 4.44Å; F419-Y442 HydrophobicContact CE2-CD1 4.07Å; F419-Y442 HydrophobicContact CE2-CD2 4.12Å; F419-Y442 AromaticContact CE2-CG 3.78Å; F419-Y442 HydrophobicContact CE2-CG 3.78Å; F419-Y442 AromaticContact CZ-CD1 3.89Å; F419-Y442 HydrophobicContact CZ-CD1 3.89Å; F419-Y442 AromaticContact CZ-CD2 3.52Å; F419-Y442 HydrophobicContact CZ-CD2 3.52Å; F419-Y442 HydrophobicContact CZ-CE1 4.09Å; F419-Y442 AromaticContact CZ-CE2 3.7Å; F419-Y442 HydrophobicContact CZ-CE2 3.7Å; F419-Y442 AromaticContact CZ-CG 3.61Å; F419-Y442 HydrophobicContact CZ-CG 3.61Å; F419-Y442 AromaticContact CZ-CZ 3.98Å; L423-Y442 HydrophobicContact CB-CD1 4.02Å; L423-Y442 HydrophobicContact CB-CE1 4.49Å; L423-Y442 WeakPolarHBondContact O-CE1 3.4Å; H424-Y442 HydrophobicContact CB-CE1 4.06Å; H424-Y442 AromaticContact ND1-CZ 3.81Å; H424-Y442 PolarHBondContact ND1-OH 3.43Å; L440-Y442 WeakPolarHBondContact CD1-O 3.46Å; Y442-W446 HydrophobicContact CD2-CZ3 4.35Å; Y442-W446 HydrophobicContact CE2-CH2 4.28Å; Y442-W446 HydrophobicContact CE2-CZ3 4.26Å; Y442-T457 CarbonylContact C-O 3.56Å; Y442-T457 WeakPolarHBondContact CA-O 3.16Å; Y442-W458 WeakPolarHBondContact CB-O 3.47Å
443	K	92.6	Very high	93	Very high	29 Å²	29	28.6 Å²	28.6	13%	0.126	15%	0.145	C	C	.	.			trans	-114.1	-171	172.1	-60.3	-178.7	-167.3	-164.3	0	109.4	M109 D111 L440 W445 T457 V460	M109-K443 HydrophobicContact CB-CD 4.46Å; M109-K443 WeakPolarHBondContact O-CE 3.35Å; M109-K443 PolarHBondContact O-NZ 2.98Å; M109-K443 HydrophobicContact SD-CB 4.42Å; D111-K443 IonicContact OD1-NZ 2.77Å; D111-K443 PolarHBondContact OD1-NZ 2.6Å; L440-K443 HydrophobicContact CD1-CG 4.23Å; L440-K443 HydrophobicContact CD2-CG 4.43Å; L440-K443 HydrophobicContact CG-CG 4.41Å; K443-W445 VanDerWaalsContact O-CD1 3.29Å; K443-W445 PolarHBondContact O-N 3.24Å; K443-T457 HydrophobicContact CB-CG2 3.83Å; K443-T457 HydrophobicContact CD-CG2 4.22Å; K443-T457 PolarHBondContact N-O 3.08Å; K443-V460 HydrophobicContact CD-CG2 4.47Å; K443-V460 HydrophobicContact CG-CG2 3.94Å
444	D	91.6	Very high	92.8	Very high	43 Å²	43	26.9 Å²	26.9	23%	0.23	14%	0.136	C	C	.	.			trans	-73	56.5	179.4	66.4	-32.9	0	0	0	113.4	M109 W446 N447	M109-D444 HydrophobicContact SD-CB 4.32Å; D444-W446 HydrophobicContact CB-CD2 4.47Å; D444-W446 HydrophobicContact CB-CZ2 3.84Å; D444-W446 PolarHBondContact O-N 3.23Å; D444-N447 WeakPolarHBondContact O-CB 3.35Å; D444-N447 PolarHBondContact O-N 3.48Å; D444-N447 PolarHBondContact OD2-ND2 3.32Å
445	W	93.8	Very high	92.6	Very high	8 Å²	8	27.4 Å²	27.4	3%	0.03	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-58.5	-22.3	-178	63.2	-98.1	0	0	0	113.6	M415 L416 F419 K443 N447 A448 W454 T457 W458 W539 L542	M415-W445 HydrophobicContact CE-CH2 4.48Å; L416-W445 HydrophobicContact CD2-CH2 3.78Å; L416-W445 HydrophobicContact CD2-CZ2 4.34Å; F419-W445 HydrophobicContact CD1-CZ2 4.03Å; F419-W445 HydrophobicContact CD2-CZ2 4.22Å; F419-W445 AromaticContact CD2-NE1 3.58Å; F419-W445 HydrophobicContact CE1-CZ2 4.19Å; F419-W445 AromaticContact CE1-NE1 3.65Å; F419-W445 AromaticContact CE2-CD1 3.74Å; F419-W445 AromaticContact CE2-CE2 3.94Å; F419-W445 HydrophobicContact CE2-CZ2 4.42Å; F419-W445 AromaticContact CE2-NE1 3Å; F419-W445 HydrophobicContact CG-CZ2 4.07Å; F419-W445 AromaticContact CZ-CD1 3.93Å; F419-W445 HydrophobicContact CZ-CZ2 4.4Å; F419-W445 AromaticContact CZ-NE1 3.05Å; K443-W445 VanDerWaalsContact O-CD1 3.29Å; K443-W445 PolarHBondContact O-N 3.24Å; W445-N447 PolarHBondContact O-N 2.97Å; W445-A448 WeakPolarHBondContact O-CB 3.36Å; W445-A448 PolarHBondContact O-N 3.24Å; W445-A448 VanDerWaalsContact O-N 3.15Å; W445-W454 AromaticContact CE3-NE1 3.77Å; W445-T457 VanDerWaalsContact CA-OG1 3.32Å; W445-T457 WeakPolarHBondContact CA-OG1 3.36Å; W445-T457 WeakPolarHBondContact CB-OG1 3.47Å; W445-W458 AromaticContact CD2-CE3 3.53Å; W445-W458 HydrophobicContact CD2-CE3 3.53Å; W445-W458 AromaticContact CD2-CZ3 3.86Å; W445-W458 HydrophobicContact CD2-CZ3 3.86Å; W445-W458 AromaticContact CE2-CE3 3.61Å; W445-W458 AromaticContact CE2-CZ3 3.58Å; W445-W458 AromaticContact CE3-CE3 3.82Å; W445-W458 HydrophobicContact CE3-CE3 3.82Å; W445-W458 AromaticContact CE3-CZ3 3.93Å; W445-W458 HydrophobicContact CE3-CZ3 3.93Å; W445-W458 AromaticContact CG-CE3 3.97Å; W445-W458 HydrophobicContact CG-CE3 3.97Å; W445-W458 HydrophobicContact CH2-CE3 4.27Å; W445-W458 AromaticContact CH2-CZ3 3.57Å; W445-W458 HydrophobicContact CH2-CZ3 3.57Å; W445-W458 AromaticContact CZ2-CE3 3.99Å; W445-W458 HydrophobicContact CZ2-CE3 3.99Å; W445-W458 HydrophobicContact CZ2-CH2 4.37Å; W445-W458 AromaticContact CZ2-CZ3 3.44Å; W445-W458 HydrophobicContact CZ2-CZ3 3.44Å; W445-W458 VanDerWaalsContact CZ2-CZ3 3.44Å; W445-W458 HydrophobicContact CZ3-CE3 4.17Å; W445-W458 AromaticContact CZ3-CZ3 3.8Å; W445-W458 HydrophobicContact CZ3-CZ3 3.8Å; W445-W458 AromaticContact NE1-CE3 3.99Å; W445-W539 AromaticContact CH2-CH2 3.53Å; W445-W539 HydrophobicContact CH2-CH2 3.53Å; W445-W539 HydrophobicContact CH2-CZ2 4.35Å; W445-W539 HydrophobicContact CH2-CZ3 4.03Å; W445-W539 AromaticContact CZ3-CH2 3.46Å; W445-W539 HydrophobicContact CZ3-CH2 3.46Å; W445-W539 VanDerWaalsContact CZ3-CH2 3.46Å; W445-W539 AromaticContact CZ3-CZ2 3.97Å; W445-W539 HydrophobicContact CZ3-CZ2 3.97Å; W445-W539 AromaticContact CZ3-CZ3 3.9Å; W445-W539 HydrophobicContact CZ3-CZ3 3.9Å; W445-L542 HydrophobicContact CZ3-CD1 4.48Å
446	W	92.5	Very high	92.3	Very high	52 Å²	52	29.4 Å²	29.4	20%	0.197	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-65.4	-21.9	174.5	48.7	84.2	0	0	0	113.3	V136 L140 F419 Y442 D444 N535 W539	V136-W446 HydrophobicContact CB-CH2 4.48Å; V136-W446 HydrophobicContact CG1-CH2 3.91Å; V136-W446 HydrophobicContact CG1-CZ2 3.97Å; L140-W446 HydrophobicContact CD2-CZ2 4.02Å; F419-W446 HydrophobicContact CZ-CZ3 4.46Å; Y442-W446 HydrophobicContact CD2-CZ3 4.35Å; Y442-W446 HydrophobicContact CE2-CH2 4.28Å; Y442-W446 HydrophobicContact CE2-CZ3 4.26Å; D444-W446 HydrophobicContact CB-CD2 4.47Å; D444-W446 HydrophobicContact CB-CZ2 3.84Å; D444-W446 PolarHBondContact O-N 3.23Å; W446-N535 PolarHBondContact O-ND2 3.35Å; W446-W539 HydrophobicContact CB-CH2 4.34Å; W446-W539 HydrophobicContact CB-CZ2 3.6Å; W446-W539 PolarHBondContact O-NE1 3.43Å
447	N	90.9	Very high	92.1	Very high	97 Å²	97	29.9 Å²	29.9	52%	0.519	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-91.6	1.3	175.2	-67.1	-30.3	0	0	0	113.1	D444 W445 T449	D444-N447 WeakPolarHBondContact O-CB 3.35Å; D444-N447 PolarHBondContact O-N 3.48Å; D444-N447 PolarHBondContact OD2-ND2 3.32Å; W445-N447 PolarHBondContact O-N 2.97Å; N447-T449 PolarHBondContact O-N 3.18Å
448	A	91.2	Very high	92.2	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	15%	0.153	C	C	.	.			trans	-62.7	133.7	-177.1	0	0	0	0	0	111.4	W445 V453 W454 N535 I538	W445-A448 WeakPolarHBondContact O-CB 3.36Å; W445-A448 PolarHBondContact O-N 3.24Å; W445-A448 VanDerWaalsContact O-N 3.15Å; A448-V453 HydrophobicContact CB-CB 4.24Å; A448-V453 HydrophobicContact CB-CG1 3.96Å; A448-W454 HydrophobicContact CB-CB 3.92Å; A448-N535 PolarHBondContact O-ND2 2.98Å; A448-I538 WeakPolarHBondContact O-CD1 3.32Å
449	T	91.3	Very high	92.3	Very high	45 Å²	45	33.3 Å²	33.3	28%	0.276	16%	0.161	S	C	.	.	S	Bend	trans	-103.5	-10	173.8	54.3	0	0	0	0	112.7	N447 G529 W534 N535	N447-T449 PolarHBondContact O-N 3.18Å; T449-G529 PolarHBondContact OG1-O 2.77Å; T449-W534 WeakPolarHBondContact O-CB 3.47Å; T449-N535 HydrophobicContact CG2-CB 4.49Å
450	T	91.5	Very high	92.3	Very high	21 Å²	21	33.3 Å²	33.3	13%	0.129	16%	0.161	C	C	.	.	S	Bend	trans	-135.1	151	176.4	62.6	0	0	0	0	110.5	S452 V453 W454 G529	T450-S452 PolarHBondContact O-N 2.89Å; T450-V453 PolarHBondContact O-N 2.79Å; T450-V453 WeakPolarHBondContact OG1-CG2 3.41Å; T450-V453 PolarHBondContact OG1-N 3.41Å; T450-W454 PolarHBondContact O-N 3.35Å; T450-G529 VanDerWaalsContact CG2-O 3.25Å; T450-G529 WeakPolarHBondContact CG2-O 3.18Å
451	F	89.8	Confident	92.5	Very high	21 Å²	21	33.9 Å²	33.9	9%	0.092	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-30.8	174.2	-84.9	-89.9	0	0	0	112.1	V453 W454 Y455 L524 I538 L541	F451-V453 VanDerWaalsContact C-N 3.35Å; F451-V453 PolarHBondContact O-N 3.15Å; F451-W454 HydrophobicContact CD1-CE3 4.11Å; F451-W454 PolarHBondContact O-N 3.47Å; F451-Y455 HydrophobicContact CB-CD2 4.37Å; F451-Y455 HydrophobicContact CB-CE2 4.35Å; F451-Y455 HydrophobicContact CD1-CE2 4.28Å; F451-Y455 WeakPolarHBondContact O-CD2 3.48Å; F451-Y455 PolarHBondContact O-N 3.48Å; F451-L524 HydrophobicContact CB-CB 4.16Å; F451-L524 HydrophobicContact CD2-CB 3.56Å; F451-L524 HydrophobicContact CD2-CD1 4.03Å; F451-L524 HydrophobicContact CD2-CD2 4.45Å; F451-L524 HydrophobicContact CD2-CG 4.22Å; F451-L524 HydrophobicContact CE1-CD1 4.44Å; F451-L524 HydrophobicContact CE2-CB 4.08Å; F451-L524 HydrophobicContact CE2-CD1 3.64Å; F451-L524 HydrophobicContact CE2-CD2 4.38Å; F451-L524 HydrophobicContact CE2-CG 4.25Å; F451-L524 HydrophobicContact CG-CB 3.84Å; F451-L524 HydrophobicContact CZ-CD1 3.86Å; F451-I538 HydrophobicContact CD2-CG1 4.11Å; F451-I538 HydrophobicContact CE2-CG1 3.82Å; F451-I538 HydrophobicContact CZ-CG1 4.38Å; F451-L541 HydrophobicContact CE2-CD1 3.7Å; F451-L541 HydrophobicContact CZ-CB 3.98Å; F451-L541 HydrophobicContact CZ-CD1 3.91Å
452	S	88	Confident	92.5	Very high	31 Å²	31	35.7 Å²	35.7	22%	0.217	18%	0.175	C	C	.	.	H	α-helix	trans	-59	-43.6	173.9	-170.6	0	0	0	0	112.5	T450 R456 F525	T450-S452 PolarHBondContact O-N 2.89Å; S452-R456 VanDerWaalsContact O-CD 3.28Å; S452-R456 WeakPolarHBondContact O-CD 3.3Å; S452-R456 WeakPolarHBondContact O-CG 3.45Å; S452-F525 WeakPolarHBondContact OG-CE2 3.06Å; S452-F525 WeakPolarHBondContact OG-CZ 3.47Å
453	V	90.6	Very high	92.4	Very high	57 Å²	57	37.4 Å²	37.4	35%	0.345	18%	0.183	S	C	.	.	H	α-helix	trans	-66.7	-48.7	173.6	173.7	0	0	0	0	109.9	A448 T450 F451 Y455 R456 T457	A448-V453 HydrophobicContact CB-CB 4.24Å; A448-V453 HydrophobicContact CB-CG1 3.96Å; T450-V453 PolarHBondContact O-N 2.79Å; T450-V453 WeakPolarHBondContact OG1-CG2 3.41Å; T450-V453 PolarHBondContact OG1-N 3.41Å; F451-V453 VanDerWaalsContact C-N 3.35Å; F451-V453 PolarHBondContact O-N 3.15Å; V453-Y455 PolarHBondContact O-N 3.25Å; V453-R456 WeakPolarHBondContact O-CB 3.48Å; V453-R456 PolarHBondContact O-N 3.49Å; V453-T457 HydrophobicContact CG1-CG2 3.94Å; V453-T457 WeakPolarHBondContact O-CG2 3.12Å; V453-T457 PolarHBondContact O-N 3.03Å; V453-T457 VanDerWaalsContact O-N 3.09Å; V453-T457 PolarHBondContact O-OG1 3.34Å
454	W	91.7	Very high	92.5	Very high	19 Å²	19	36 Å²	36	7%	0.072	18%	0.177	C	C	.	.	H	α-helix	trans	-53.5	-49.5	-177.9	180	81.1	0	0	0	113.2	W445 A448 T450 F451 R456 T457 W458 L542	W445-W454 AromaticContact CE3-NE1 3.77Å; A448-W454 HydrophobicContact CB-CB 3.92Å; T450-W454 PolarHBondContact O-N 3.35Å; F451-W454 HydrophobicContact CD1-CE3 4.11Å; F451-W454 PolarHBondContact O-N 3.47Å; W454-R456 PolarHBondContact O-N 2.77Å; W454-T457 WeakPolarHBondContact CA-OG1 3.46Å; W454-T457 PolarHBondContact O-N 3.27Å; W454-T457 VanDerWaalsContact O-N 3.11Å; W454-T457 PolarHBondContact O-OG1 3.02Å; W454-T457 VanDerWaalsContact O-OG1 3.09Å; W454-W458 HydrophobicContact CZ2-CB 4.47Å; W454-W458 HydrophobicContact CZ2-CD2 4.08Å; W454-W458 HydrophobicContact CZ2-CE3 4.07Å; W454-W458 HydrophobicContact CZ2-CG 4.24Å; W454-W458 AromaticContact NE1-CE3 3.78Å; W454-W458 WeakPolarHBondContact O-CB 3.39Å; W454-W458 PolarHBondContact O-N 3.03Å; W454-L542 HydrophobicContact CD2-CD2 4.38Å; W454-L542 HydrophobicContact CH2-CD2 3.93Å; W454-L542 HydrophobicContact CZ2-CD2 3.43Å; W454-L542 VanDerWaalsContact CZ2-CD2 3.43Å
455	Y	90.8	Very high	92.7	Very high	47 Å²	47	35 Å²	35	18%	0.184	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-31.6	178.1	-84.4	-65.8	0	0	0	113.3	F451 V453 F491 F517 F525	F451-Y455 HydrophobicContact CB-CD2 4.37Å; F451-Y455 HydrophobicContact CB-CE2 4.35Å; F451-Y455 HydrophobicContact CD1-CE2 4.28Å; F451-Y455 WeakPolarHBondContact O-CD2 3.48Å; F451-Y455 PolarHBondContact O-N 3.48Å; V453-Y455 PolarHBondContact O-N 3.25Å; Y455-F491 AromaticContact CD2-CE1 4Å; Y455-F491 HydrophobicContact CD2-CE1 4Å; Y455-F491 AromaticContact CD2-CZ 3.85Å; Y455-F491 HydrophobicContact CD2-CZ 3.85Å; Y455-F491 HydrophobicContact CE1-CE1 4.2Å; Y455-F491 AromaticContact CE2-CE1 3.58Å; Y455-F491 HydrophobicContact CE2-CE1 3.58Å; Y455-F491 AromaticContact CE2-CZ 3.86Å; Y455-F491 HydrophobicContact CE2-CZ 3.86Å; Y455-F491 HydrophobicContact CG-CZ 4.39Å; Y455-F491 AromaticContact CZ-CE1 3.7Å; Y455-F517 HydrophobicContact CE1-CD1 4.18Å; Y455-F517 AromaticContact CE1-CE1 3.94Å; Y455-F517 HydrophobicContact CE1-CE1 3.94Å; Y455-F525 HydrophobicContact CD2-CD2 4.37Å
456	R	90	Very high	92.8	Very high	131 Å²	131	35.6 Å²	35.6	49%	0.494	17%	0.174	S	C	.	.	H	α-helix	trans	-80.8	-24.6	179.7	-63	170.7	56.5	-173.9	-6	112.9	S452 V453 W454 H463	S452-R456 VanDerWaalsContact O-CD 3.28Å; S452-R456 WeakPolarHBondContact O-CD 3.3Å; S452-R456 WeakPolarHBondContact O-CG 3.45Å; V453-R456 WeakPolarHBondContact O-CB 3.48Å; V453-R456 PolarHBondContact O-N 3.49Å; W454-R456 PolarHBondContact O-N 2.77Å; R456-H463 WeakPolarHBondContact CG-NE2 3.29Å
457	T	93.4	Very high	92.8	Very high	11 Å²	11	34.7 Å²	34.7	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-104.3	-26.6	-170.5	52.7	0	0	0	0	113.6	Y442 K443 W445 V453 W454	Y442-T457 CarbonylContact C-O 3.56Å; Y442-T457 WeakPolarHBondContact CA-O 3.16Å; K443-T457 HydrophobicContact CB-CG2 3.83Å; K443-T457 HydrophobicContact CD-CG2 4.22Å; K443-T457 PolarHBondContact N-O 3.08Å; W445-T457 VanDerWaalsContact CA-OG1 3.32Å; W445-T457 WeakPolarHBondContact CA-OG1 3.36Å; W445-T457 WeakPolarHBondContact CB-OG1 3.47Å; V453-T457 HydrophobicContact CG1-CG2 3.94Å; V453-T457 WeakPolarHBondContact O-CG2 3.12Å; V453-T457 PolarHBondContact O-N 3.03Å; V453-T457 VanDerWaalsContact O-N 3.09Å; V453-T457 PolarHBondContact O-OG1 3.34Å; W454-T457 WeakPolarHBondContact CA-OG1 3.46Å; W454-T457 PolarHBondContact O-N 3.27Å; W454-T457 VanDerWaalsContact O-N 3.11Å; W454-T457 PolarHBondContact O-OG1 3.02Å; W454-T457 VanDerWaalsContact O-OG1 3.09Å
458	W	93.8	Very high	92.9	Very high	43 Å²	43	30.5 Å²	30.5	16%	0.163	15%	0.149	C	C	.	.	S	Bend	trans	-63.3	-54.1	-174.9	170.9	-94.8	0	0	0	113.2	M415 F419 L423 Y442 W445 W454	M415-W458 HydrophobicContact CG-CH2 3.63Å; M415-W458 HydrophobicContact CG-CZ2 4.38Å; M415-W458 HydrophobicContact CG-CZ3 4.37Å; M415-W458 HydrophobicContact SD-CH2 4.17Å; M415-W458 HydrophobicContact SD-CZ3 4.37Å; F419-W458 HydrophobicContact CB-CH2 3.57Å; F419-W458 HydrophobicContact CB-CZ2 3.93Å; F419-W458 HydrophobicContact CB-CZ3 4.28Å; F419-W458 HydrophobicContact CD2-CD2 4.31Å; F419-W458 HydrophobicContact CD2-CE3 4.15Å; F419-W458 AromaticContact CD2-CH2 3.87Å; F419-W458 HydrophobicContact CD2-CH2 3.87Å; F419-W458 HydrophobicContact CD2-CZ2 4.02Å; F419-W458 AromaticContact CD2-CZ3 3.94Å; F419-W458 HydrophobicContact CD2-CZ3 3.94Å; F419-W458 HydrophobicContact CG-CH2 4Å; F419-W458 HydrophobicContact CG-CZ2 4.42Å; F419-W458 HydrophobicContact CG-CZ3 4.26Å; L423-W458 WeakPolarHBondContact CD1-O 3.42Å; Y442-W458 WeakPolarHBondContact CB-O 3.47Å; W445-W458 AromaticContact CD2-CE3 3.53Å; W445-W458 HydrophobicContact CD2-CE3 3.53Å; W445-W458 AromaticContact CD2-CZ3 3.86Å; W445-W458 HydrophobicContact CD2-CZ3 3.86Å; W445-W458 AromaticContact CE2-CE3 3.61Å; W445-W458 AromaticContact CE2-CZ3 3.58Å; W445-W458 AromaticContact CE3-CE3 3.82Å; W445-W458 HydrophobicContact CE3-CE3 3.82Å; W445-W458 AromaticContact CE3-CZ3 3.93Å; W445-W458 HydrophobicContact CE3-CZ3 3.93Å; W445-W458 AromaticContact CG-CE3 3.97Å; W445-W458 HydrophobicContact CG-CE3 3.97Å; W445-W458 HydrophobicContact CH2-CE3 4.27Å; W445-W458 AromaticContact CH2-CZ3 3.57Å; W445-W458 HydrophobicContact CH2-CZ3 3.57Å; W445-W458 AromaticContact CZ2-CE3 3.99Å; W445-W458 HydrophobicContact CZ2-CE3 3.99Å; W445-W458 HydrophobicContact CZ2-CH2 4.37Å; W445-W458 AromaticContact CZ2-CZ3 3.44Å; W445-W458 HydrophobicContact CZ2-CZ3 3.44Å; W445-W458 VanDerWaalsContact CZ2-CZ3 3.44Å; W445-W458 HydrophobicContact CZ3-CE3 4.17Å; W445-W458 AromaticContact CZ3-CZ3 3.8Å; W445-W458 HydrophobicContact CZ3-CZ3 3.8Å; W445-W458 AromaticContact NE1-CE3 3.99Å; W454-W458 HydrophobicContact CZ2-CB 4.47Å; W454-W458 HydrophobicContact CZ2-CD2 4.08Å; W454-W458 HydrophobicContact CZ2-CE3 4.07Å; W454-W458 HydrophobicContact CZ2-CG 4.24Å; W454-W458 AromaticContact NE1-CE3 3.78Å; W454-W458 WeakPolarHBondContact O-CB 3.39Å; W454-W458 PolarHBondContact O-N 3.03Å
459	N	96.1	Very high	93	Very high	34 Å²	34	31.1 Å²	31.1	18%	0.182	15%	0.15	C	C	.	.			trans	-134.7	88.9	177.7	-178.4	-13.7	0	0	0	108.9	L423 I461 V462 H463	L423-N459 HydrophobicContact CD1-CB 4.11Å; L423-N459 HydrophobicContact CD2-CB 4.35Å; N459-I461 PolarHBondContact O-N 2.95Å; N459-I461 PolarHBondContact OD1-N 2.98Å; N459-V462 WeakPolarHBondContact ND2-CG2 3.31Å; N459-V462 PolarHBondContact O-N 3.27Å; N459-V462 PolarHBondContact OD1-N 2.67Å; N459-H463 VanDerWaalsContact O-CB 3.27Å; N459-H463 WeakPolarHBondContact O-CB 3.45Å; N459-H463 PolarHBondContact O-N 3.31Å
460	V	94.9	Very high	93.1	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-32.3	-176.3	173	0	0	0	0	110.9	F441 K443 D464	F441-V460 WeakPolarHBondContact O-CB 3.42Å; F441-V460 PolarHBondContact O-N 2.92Å; K443-V460 HydrophobicContact CD-CG2 4.47Å; K443-V460 HydrophobicContact CG-CG2 3.94Å; V460-D464 VanDerWaalsContact CG1-OD2 3.22Å; V460-D464 WeakPolarHBondContact CG1-OD2 3.1Å; V460-D464 WeakPolarHBondContact O-CB 3.46Å; V460-D464 PolarHBondContact O-N 2.88Å
461	I	96.2	Very high	93.1	Very high	15 Å²	15	31.8 Å²	31.8	8%	0.077	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-51.5	-179.5	-63.5	163.4	0	0	0	111.4	P341 L343 L427 F441 N459 W465	P341-I461 WeakPolarHBondContact O-CD1 3.4Å; L343-I461 HydrophobicContact CB-CG2 3.98Å; L343-I461 HydrophobicContact CD1-CG2 3.7Å; L343-I461 HydrophobicContact CG-CG2 3.49Å; L343-I461 VanDerWaalsContact CG-CG2 3.49Å; L427-I461 HydrophobicContact CD1-CD1 3.37Å; F441-I461 HydrophobicContact CB-CD1 3.87Å; F441-I461 HydrophobicContact CB-CG1 4.32Å; F441-I461 HydrophobicContact CD1-CD1 3.57Å; F441-I461 HydrophobicContact CD1-CG1 4.01Å; F441-I461 HydrophobicContact CE1-CD1 4.44Å; F441-I461 HydrophobicContact CG-CD1 3.96Å; N459-I461 PolarHBondContact O-N 2.95Å; N459-I461 PolarHBondContact OD1-N 2.98Å; I461-W465 PolarHBondContact O-N 3.41Å
462	V	96.3	Very high	93.1	Very high	42 Å²	42	33.5 Å²	33.5	26%	0.255	15%	0.154	S	C	.	.	H	α-helix	trans	-71.8	-41.9	180	172.8	0	0	0	0	110.5	M275 L343 N459 D464 W465 L466	M275-V462 HydrophobicContact CE-CG1 4.21Å; L343-V462 HydrophobicContact CD1-CG2 4.1Å; N459-V462 WeakPolarHBondContact ND2-CG2 3.31Å; N459-V462 PolarHBondContact O-N 3.27Å; N459-V462 PolarHBondContact OD1-N 2.67Å; V462-D464 VanDerWaalsContact C-N 3.29Å; V462-D464 PolarHBondContact O-N 2.89Å; V462-W465 PolarHBondContact O-N 3.48Å; V462-L466 HydrophobicContact CG1-CD1 3.92Å; V462-L466 HydrophobicContact CG1-CG 4.38Å; V462-L466 WeakPolarHBondContact O-CG 3.45Å; V462-L466 PolarHBondContact O-N 3.05Å
463	H	94.3	Very high	93.2	Very high	37 Å²	37	33.5 Å²	33.5	17%	0.171	15%	0.151	C	C	.	.	H	α-helix	trans	-57.9	-41.6	176.1	168.1	-98.8	0	0	0	112	K112 R456 N459 L466 Y467	K112-H463 PolarHBondContact NZ-CE1 3.37Å; R456-H463 WeakPolarHBondContact CG-NE2 3.29Å; N459-H463 VanDerWaalsContact O-CB 3.27Å; N459-H463 WeakPolarHBondContact O-CB 3.45Å; N459-H463 PolarHBondContact O-N 3.31Å; H463-L466 PolarHBondContact O-N 3.22Å; H463-Y467 WeakPolarHBondContact O-CB 3.4Å; H463-Y467 PolarHBondContact O-N 2.97Å
464	D	94.2	Very high	93.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.6	-35	178.9	-73.9	-19	0	0	0	112.9	K112 K128 V344 V460 V462 T468	K112-D464 WeakPolarHBondContact CE-OD1 3.37Å; K112-D464 IonicContact NZ-OD1 3.45Å; K112-D464 PolarHBondContact NZ-OD1 3.03Å; K128-D464 HydrophobicContact CD-CB 4.35Å; K128-D464 VanDerWaalsContact CD-OD2 3.26Å; K128-D464 WeakPolarHBondContact CD-OD2 3.31Å; K128-D464 VanDerWaalsContact CE-OD2 3.26Å; K128-D464 WeakPolarHBondContact CE-OD2 3.44Å; K128-D464 IonicContact NZ-OD2 3.56Å; K128-D464 PolarHBondContact NZ-OD2 3.5Å; V344-D464 HydrophobicContact CG2-CB 4.15Å; V460-D464 VanDerWaalsContact CG1-OD2 3.22Å; V460-D464 WeakPolarHBondContact CG1-OD2 3.1Å; V460-D464 WeakPolarHBondContact O-CB 3.46Å; V460-D464 PolarHBondContact O-N 2.88Å; V462-D464 VanDerWaalsContact C-N 3.29Å; V462-D464 PolarHBondContact O-N 2.89Å; D464-T468 WeakPolarHBondContact O-CB 3.47Å; D464-T468 PolarHBondContact O-N 2.86Å; D464-T468 PolarHBondContact O-OG1 3.17Å
465	W	96.3	Very high	92.9	Very high	22 Å²	22	31.9 Å²	31.9	8%	0.083	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-51.3	172.7	-172.7	95.3	0	0	0	110.9	M275 H278 L343 I461 V462 Y467 T468 Y469 I470	M275-W465 HydrophobicContact CB-CD2 4.24Å; M275-W465 HydrophobicContact CB-CG 4.41Å; M275-W465 HydrophobicContact CB-CZ2 4.13Å; M275-W465 HydrophobicContact CE-CB 3.77Å; M275-W465 HydrophobicContact CE-CD2 3.4Å; M275-W465 VanDerWaalsContact CE-CD2 3.4Å; M275-W465 HydrophobicContact CE-CE3 3.48Å; M275-W465 VanDerWaalsContact CE-CE3 3.48Å; M275-W465 HydrophobicContact CE-CG 3.52Å; M275-W465 HydrophobicContact CE-CZ3 4.26Å; M275-W465 HydrophobicContact CG-CD2 4.11Å; M275-W465 HydrophobicContact CG-CE3 4.44Å; M275-W465 HydrophobicContact CG-CH2 4.35Å; M275-W465 HydrophobicContact CG-CZ2 3.98Å; M275-W465 PolarHBondContact O-NE1 3.04Å; H278-W465 HydrophobicContact CB-CZ2 4.06Å; H278-W465 AromaticContact CD2-CZ2 3.6Å; L343-W465 HydrophobicContact CB-CB 3.96Å; L343-W465 HydrophobicContact CB-CG 4.16Å; L343-W465 HydrophobicContact CD1-CB 4.35Å; I461-W465 PolarHBondContact O-N 3.41Å; V462-W465 PolarHBondContact O-N 3.48Å; W465-Y467 VanDerWaalsContact C-N 3.35Å; W465-Y467 PolarHBondContact O-N 2.78Å; W465-T468 PolarHBondContact O-N 2.9Å; W465-Y469 HydrophobicContact CB-CD2 4.35Å; W465-Y469 AromaticContact CD1-CD2 3.32Å; W465-Y469 AromaticContact CD1-CE2 3.42Å; W465-Y469 VanDerWaalsContact CD1-CE2 3.42Å; W465-Y469 AromaticContact CD2-CD2 3.9Å; W465-Y469 HydrophobicContact CD2-CD2 3.9Å; W465-Y469 AromaticContact CE2-CD2 3.77Å; W465-Y469 AromaticContact CG-CD2 3.63Å; W465-Y469 HydrophobicContact CG-CD2 3.63Å; W465-Y469 HydrophobicContact CG-CE2 4.08Å; W465-Y469 AromaticContact NE1-CD2 3.4Å; W465-Y469 AromaticContact NE1-CE2 3.71Å; W465-Y469 WeakPolarHBondContact O-CB 3.2Å; W465-Y469 WeakPolarHBondContact O-CD2 3.21Å; W465-Y469 PolarHBondContact O-N 3.41Å; W465-I470 HydrophobicContact CE3-CG1 4.4Å; W465-I470 HydrophobicContact CH2-CD1 4.05Å; W465-I470 HydrophobicContact CH2-CG1 4.31Å; W465-I470 HydrophobicContact CZ3-CD1 3.99Å; W465-I470 HydrophobicContact CZ3-CG1 3.74Å
466	L	95.7	Very high	92.7	Very high	19 Å²	19	37.9 Å²	37.9	10%	0.099	17%	0.169	C	C	.	.	I	π-helix	trans	-60.6	-44.4	178.8	-71.2	169.9	0	0	0	111.6	V462 H463 I470 Y471 V490 L493	V462-L466 HydrophobicContact CG1-CD1 3.92Å; V462-L466 HydrophobicContact CG1-CG 4.38Å; V462-L466 WeakPolarHBondContact O-CG 3.45Å; V462-L466 PolarHBondContact O-N 3.05Å; H463-L466 PolarHBondContact O-N 3.22Å; L466-I470 HydrophobicContact CD2-CG1 4.26Å; L466-I470 WeakPolarHBondContact O-CA 3.17Å; L466-I470 VanDerWaalsContact O-CB 3.27Å; L466-I470 WeakPolarHBondContact O-CB 3.31Å; L466-I470 PolarHBondContact O-N 3.31Å; L466-Y471 PolarHBondContact O-N 3.4Å; L466-V490 HydrophobicContact CB-CG1 4.02Å; L466-V490 HydrophobicContact CD1-CG1 4.22Å; L466-V490 HydrophobicContact CD2-CG1 4.4Å; L466-V490 HydrophobicContact CG-CG1 4.45Å; L466-L493 HydrophobicContact CD2-CD2 4.32Å
467	Y	92.7	Very high	92.5	Very high	34 Å²	34	38.3 Å²	38.3	13%	0.133	18%	0.18	C	C	.	.	I	π-helix	trans	-63.9	-44.7	177.3	173.4	-99.3	0	0	0	111.6	K112 P126 H463 W465 Y471 R472	K112-Y467 HydrophobicContact CD-CD1 4.21Å; K112-Y467 HydrophobicContact CD-CE1 3.9Å; K112-Y467 VanDerWaalsContact NZ-CD1 3.28Å; P126-Y467 WeakPolarHBondContact O-CE1 3.34Å; P126-Y467 PolarHBondContact O-OH 3.25Å; H463-Y467 WeakPolarHBondContact O-CB 3.4Å; H463-Y467 PolarHBondContact O-N 2.97Å; W465-Y467 VanDerWaalsContact C-N 3.35Å; W465-Y467 PolarHBondContact O-N 2.78Å; Y467-Y471 AromaticContact CD2-CD1 3.71Å; Y467-Y471 HydrophobicContact CD2-CD1 3.71Å; Y467-Y471 HydrophobicContact CD2-CE1 4.3Å; Y467-Y471 HydrophobicContact CD2-CG 4.32Å; Y467-Y471 AromaticContact CE2-CD1 3.73Å; Y467-Y471 HydrophobicContact CE2-CD1 3.73Å; Y467-Y471 AromaticContact CE2-CE1 3.98Å; Y467-Y471 HydrophobicContact CE2-CE1 3.98Å; Y467-R472 HydrophobicContact CD1-CG 4.4Å; Y467-R472 HydrophobicContact CE1-CG 4.03Å; Y467-R472 HydrophobicContact CE2-CG 4.31Å; Y467-R472 WeakPolarHBondContact O-CB 3.47Å; Y467-R472 VanDerWaalsContact O-CG 3.25Å; Y467-R472 WeakPolarHBondContact O-CG 3.37Å; Y467-R472 PolarHBondContact O-N 3.4Å
468	T	91.7	Very high	92.1	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	20%	0.202	C	C	.	.	I	π-helix	trans	-73.9	-43.2	-173.4	-58.3	0	0	0	0	112.8	D464 W465	D464-T468 WeakPolarHBondContact O-CB 3.47Å; D464-T468 PolarHBondContact O-N 2.86Å; D464-T468 PolarHBondContact O-OG1 3.17Å; W465-T468 PolarHBondContact O-N 2.9Å
469	Y	93.8	Very high	91.2	Very high	14 Å²	14	42 Å²	42	6%	0.055	21%	0.208	C	C	.	.	I	π-helix	trans	-105.9	-18.7	-168.4	-58	-57.8	0	0	0	114	H278 A279 R282 V344 Y345 W465 D473	H278-Y469 AromaticContact CD2-CG 4Å; A279-Y469 WeakPolarHBondContact CA-OH 3.27Å; A279-Y469 HydrophobicContact CB-CE2 3.57Å; A279-Y469 VanDerWaalsContact CB-OH 3.28Å; A279-Y469 WeakPolarHBondContact CB-OH 3.47Å; A279-Y469 PolarHBondContact O-OH 2.95Å; R282-Y469 HydrophobicContact CB-CD1 4.14Å; R282-Y469 HydrophobicContact CB-CE1 4.08Å; R282-Y469 HydrophobicContact CG-CD1 3.66Å; R282-Y469 HydrophobicContact CG-CE1 3.87Å; V344-Y469 HydrophobicContact CG2-CE2 4.12Å; Y345-Y469 PolarHBondContact N-OH 3.41Å; W465-Y469 HydrophobicContact CB-CD2 4.35Å; W465-Y469 AromaticContact CD1-CD2 3.32Å; W465-Y469 AromaticContact CD1-CE2 3.42Å; W465-Y469 VanDerWaalsContact CD1-CE2 3.42Å; W465-Y469 AromaticContact CD2-CD2 3.9Å; W465-Y469 HydrophobicContact CD2-CD2 3.9Å; W465-Y469 AromaticContact CE2-CD2 3.77Å; W465-Y469 AromaticContact CG-CD2 3.63Å; W465-Y469 HydrophobicContact CG-CD2 3.63Å; W465-Y469 HydrophobicContact CG-CE2 4.08Å; W465-Y469 AromaticContact NE1-CD2 3.4Å; W465-Y469 AromaticContact NE1-CE2 3.71Å; W465-Y469 WeakPolarHBondContact O-CB 3.2Å; W465-Y469 WeakPolarHBondContact O-CD2 3.21Å; W465-Y469 PolarHBondContact O-N 3.41Å; Y469-D473 WeakPolarHBondContact O-CB 3.3Å
470	I	93.3	Very high	89.9	Confident	30 Å²	30	45.6 Å²	45.6	15%	0.154	22%	0.222	C	C	.	.	I	π-helix	trans	-109.1	-63.2	178.1	-49.6	-61.1	0	0	0	109.5	W465 L466 D473 I474 V490 L493	W465-I470 HydrophobicContact CE3-CG1 4.4Å; W465-I470 HydrophobicContact CH2-CD1 4.05Å; W465-I470 HydrophobicContact CH2-CG1 4.31Å; W465-I470 HydrophobicContact CZ3-CD1 3.99Å; W465-I470 HydrophobicContact CZ3-CG1 3.74Å; L466-I470 HydrophobicContact CD2-CG1 4.26Å; L466-I470 WeakPolarHBondContact O-CA 3.17Å; L466-I470 VanDerWaalsContact O-CB 3.27Å; L466-I470 WeakPolarHBondContact O-CB 3.31Å; L466-I470 PolarHBondContact O-N 3.31Å; I470-D473 PolarHBondContact O-N 3.47Å; I470-I474 HydrophobicContact CG2-CD1 3.71Å; I470-I474 WeakPolarHBondContact O-CB 3.23Å; I470-I474 WeakPolarHBondContact O-CG1 3.05Å; I470-I474 PolarHBondContact O-N 3.3Å; I470-V490 HydrophobicContact CB-CG2 4.06Å; I470-V490 HydrophobicContact CG2-CG2 3.71Å; I470-L493 HydrophobicContact CD1-CD2 3.85Å; I470-L493 HydrophobicContact CG1-CD2 3.85Å; I470-L493 HydrophobicContact CG2-CD2 4.29Å
471	Y	91.3	Very high	88.6	Confident	50 Å²	50	54.9 Å²	54.9	20%	0.196	27%	0.265	C	S	.	.	I	π-helix	trans	-61.7	-52.5	-174.7	-177.7	-96.5	0	0	0	112.7	L466 Y467 Q475 A486	L466-Y471 PolarHBondContact O-N 3.4Å; Y467-Y471 AromaticContact CD2-CD1 3.71Å; Y467-Y471 HydrophobicContact CD2-CD1 3.71Å; Y467-Y471 HydrophobicContact CD2-CE1 4.3Å; Y467-Y471 HydrophobicContact CD2-CG 4.32Å; Y467-Y471 AromaticContact CE2-CD1 3.73Å; Y467-Y471 HydrophobicContact CE2-CD1 3.73Å; Y467-Y471 AromaticContact CE2-CE1 3.98Å; Y467-Y471 HydrophobicContact CE2-CE1 3.98Å; Y471-Q475 VanDerWaalsContact CE1-CD 3.41Å; Y471-Q475 HydrophobicContact CE1-CG 4.38Å; Y471-Q475 VanDerWaalsContact CZ-CD 3.5Å; Y471-Q475 WeakPolarHBondContact O-CB 3.37Å; Y471-Q475 WeakPolarHBondContact O-CG 3.43Å; Y471-Q475 PolarHBondContact O-N 3.48Å; Y471-Q475 PolarHBondContact OH-NE2 2.92Å; Y471-A486 HydrophobicContact CD2-CB 3.66Å; Y471-A486 HydrophobicContact CE2-CB 3.85Å; Y471-A486 HydrophobicContact CG-CB 4.45Å
472	R	89.5	Confident	87.5	Confident	58 Å²	58	54.8 Å²	54.8	22%	0.219	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-40.3	-179.4	-75.5	179.4	72.8	-144.5	6	112.2	L125 Y467 Q475 F476	L125-R472 HydrophobicContact CB-CG 4.02Å; L125-R472 HydrophobicContact CD1-CB 4.22Å; L125-R472 HydrophobicContact CD1-CG 3.76Å; L125-R472 HydrophobicContact CG-CG 4.49Å; L125-R472 PolarHBondContact O-NH2 2.95Å; Y467-R472 HydrophobicContact CD1-CG 4.4Å; Y467-R472 HydrophobicContact CE1-CG 4.03Å; Y467-R472 HydrophobicContact CE2-CG 4.31Å; Y467-R472 WeakPolarHBondContact O-CB 3.47Å; Y467-R472 VanDerWaalsContact O-CG 3.25Å; Y467-R472 WeakPolarHBondContact O-CG 3.37Å; Y467-R472 PolarHBondContact O-N 3.4Å; R472-Q475 PolarHBondContact O-N 3.49Å; R472-F476 WeakPolarHBondContact O-CB 3.39Å; R472-F476 PolarHBondContact O-N 3.5Å
473	D	90.5	Very high	86.9	Confident	30 Å²	30	60.7 Å²	60.7	16%	0.16	28%	0.284	C	S	.	.	H	α-helix	trans	-69.1	-41.9	-179.2	-76.8	-6	0	0	0	111.3	R282 Y469 I470 Q475 F476 L477	R282-D473 IonicContact CZ-OD1 3.64Å; R282-D473 IonicContact CZ-OD2 3.05Å; R282-D473 IonicContact NE-OD1 2.67Å; R282-D473 IonicContact NE-OD2 2.89Å; R282-D473 PolarHBondContact NE-OD2 3.34Å; R282-D473 IonicContact NH2-OD1 3.43Å; R282-D473 PolarHBondContact NH2-OD1 2.9Å; R282-D473 IonicContact NH2-OD2 2.7Å; R282-D473 PolarHBondContact NH2-OD2 2.99Å; Y469-D473 WeakPolarHBondContact O-CB 3.3Å; I470-D473 PolarHBondContact O-N 3.47Å; D473-Q475 VanDerWaalsContact C-N 3.33Å; D473-Q475 PolarHBondContact O-N 2.93Å; D473-F476 WeakPolarHBondContact O-CB 3.33Å; D473-F476 PolarHBondContact O-N 3.02Å; D473-L477 VanDerWaalsContact O-CG 3.31Å; D473-L477 WeakPolarHBondContact O-CG 3.17Å; D473-L477 PolarHBondContact O-N 3.42Å
474	I	89.4	Confident	86.5	Confident	33 Å²	33	62.9 Å²	62.9	17%	0.169	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-42.9	172.8	-67.9	170	0	0	0	110.9	I470 F476 L477 I478 A486 A489	I470-I474 HydrophobicContact CG2-CD1 3.71Å; I470-I474 WeakPolarHBondContact O-CB 3.23Å; I470-I474 WeakPolarHBondContact O-CG1 3.05Å; I470-I474 PolarHBondContact O-N 3.3Å; I474-F476 VanDerWaalsContact C-N 3.27Å; I474-F476 PolarHBondContact O-N 3.28Å; I474-L477 PolarHBondContact O-N 2.86Å; I474-I478 HydrophobicContact CG2-CD1 3.72Å; I474-I478 HydrophobicContact CG2-CG1 4.3Å; I474-I478 PolarHBondContact O-N 3.21Å; I474-A486 HydrophobicContact CB-CB 4.2Å; I474-A486 HydrophobicContact CG2-CB 3.83Å; I474-A489 HydrophobicContact CD1-CB 3.61Å
475	Q	87.3	Confident	86.2	Confident	10 Å²	10	67.1 Å²	67.1	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-31.4	177.1	-76.4	-165.5	-24.2	0	0	113.4	L125 Y471 R472 D473 G479 A486	L125-Q475 HydrophobicContact CD1-CB 4.18Å; Y471-Q475 VanDerWaalsContact CE1-CD 3.41Å; Y471-Q475 HydrophobicContact CE1-CG 4.38Å; Y471-Q475 VanDerWaalsContact CZ-CD 3.5Å; Y471-Q475 WeakPolarHBondContact O-CB 3.37Å; Y471-Q475 WeakPolarHBondContact O-CG 3.43Å; Y471-Q475 PolarHBondContact O-N 3.48Å; Y471-Q475 PolarHBondContact OH-NE2 2.92Å; R472-Q475 PolarHBondContact O-N 3.49Å; D473-Q475 VanDerWaalsContact C-N 3.33Å; D473-Q475 PolarHBondContact O-N 2.93Å; Q475-G479 CarbonylContact O-C 3.55Å; Q475-G479 VanDerWaalsContact O-CA 3.26Å; Q475-G479 WeakPolarHBondContact O-CA 3.11Å; Q475-G479 PolarHBondContact O-N 2.91Å; Q475-G479 VanDerWaalsContact O-N 3.16Å; Q475-A486 HydrophobicContact CG-CB 3.93Å
476	F	85.7	Confident	85.8	Confident	173 Å²	173	66.1 Å²	66.1	76%	0.759	32%	0.318	S	S	*	.	H	α-helix	trans	-71.3	-40.9	174.1	-176.7	-98.1	0	0	0	111.5	R472 D473 I474	R472-F476 WeakPolarHBondContact O-CB 3.39Å; R472-F476 PolarHBondContact O-N 3.5Å; D473-F476 WeakPolarHBondContact O-CB 3.33Å; D473-F476 PolarHBondContact O-N 3.02Å; I474-F476 VanDerWaalsContact C-N 3.27Å; I474-F476 PolarHBondContact O-N 3.28Å
477	L	86.6	Confident	85.4	Confident	140 Å²	140	65.7 Å²	65.7	73%	0.733	32%	0.318	S	S	*	.	H	α-helix	trans	-74.4	-46.1	-178	-69.8	170	0	0	0	113.8	D473 I474	D473-L477 VanDerWaalsContact O-CG 3.31Å; D473-L477 WeakPolarHBondContact O-CG 3.17Å; D473-L477 PolarHBondContact O-N 3.42Å; I474-L477 PolarHBondContact O-N 2.86Å
478	I	85	Confident	85.3	Confident	101 Å²	101	65.5 Å²	65.5	52%	0.518	32%	0.32	S	S	.	.	H	α-helix	trans	-93.1	-15.4	-173.6	-55.1	-179.1	0	0	0	111.4	I474 S482 L485	I474-I478 HydrophobicContact CG2-CD1 3.72Å; I474-I478 HydrophobicContact CG2-CG1 4.3Å; I474-I478 PolarHBondContact O-N 3.21Å; I478-S482 WeakPolarHBondContact CG2-OG 3.21Å; I478-L485 HydrophobicContact CD1-CD2 3.53Å; I478-L485 HydrophobicContact CG2-CD2 4.41Å
479	G	75	Confident	85.3	Confident	29 Å²	29	66.9 Å²	66.9	30%	0.299	33%	0.332	S	S	.	.			trans	86.5	162.8	-173.3	0	0	0	0	0	113.1	Q475 H481 S482	Q475-G479 CarbonylContact O-C 3.55Å; Q475-G479 VanDerWaalsContact O-CA 3.26Å; Q475-G479 WeakPolarHBondContact O-CA 3.11Å; Q475-G479 PolarHBondContact O-N 2.91Å; Q475-G479 VanDerWaalsContact O-N 3.16Å; G479-H481 PolarHBondContact O-N 3.34Å; G479-H481 VanDerWaalsContact O-N 3.12Å; G479-S482 PolarHBondContact O-N 3.28Å; G479-S482 PolarHBondContact O-OG 3.35Å
480	K	68.4	Low	85.3	Confident	110 Å²	110	67.4 Å²	67.4	48%	0.478	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-66	-17.4	-166.1	-67.9	177.5	-174.3	154.2	0	115.5	S482 R483	K480-S482 PolarHBondContact O-N 3.43Å; K480-R483 WeakPolarHBondContact O-CG 3.28Å
481	H	67.2	Low	85.2	Confident	196 Å²	196	66.8 Å²	66.8	91%	0.907	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-69.1	-16.4	-179.1	-67.2	-67.6	0	0	0	112.8	G479 R483	G479-H481 PolarHBondContact O-N 3.34Å; G479-H481 VanDerWaalsContact O-N 3.12Å; H481-R483 PolarHBondContact O-N 3.07Å
482	S	74	Confident	85.3	Confident	13 Å²	13	71.7 Å²	71.7	9%	0.091	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-95.9	33.1	-174.2	71.7	0	0	0	0	114.5	I478 G479 K480 T484 L485 A486	I478-S482 WeakPolarHBondContact CG2-OG 3.21Å; G479-S482 PolarHBondContact O-N 3.28Å; G479-S482 PolarHBondContact O-OG 3.35Å; K480-S482 PolarHBondContact O-N 3.43Å; S482-T484 PolarHBondContact O-N 2.73Å; S482-L485 WeakPolarHBondContact O-CB 3.33Å; S482-L485 PolarHBondContact O-N 2.87Å; S482-L485 VanDerWaalsContact O-N 3.12Å; S482-A486 PolarHBondContact O-N 3.15Å
483	R	83.3	Confident	85.5	Confident	167 Å²	167	72.5 Å²	72.5	63%	0.63	36%	0.36	S	S	*	.	H	α-helix	trans	-55.2	-40	-177.7	-59.1	-164.9	174.5	166.6	-0.2	113.1	K480 H481 A487	K480-R483 WeakPolarHBondContact O-CG 3.28Å; H481-R483 PolarHBondContact O-N 3.07Å; R483-A487 WeakPolarHBondContact O-CB 3.19Å; R483-A487 PolarHBondContact O-N 3.26Å
484	T	84.8	Confident	85.7	Confident	83 Å²	83	72.1 Å²	72.1	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-64.3	-49.6	176.8	46.9	0	0	0	0	110.9	S482 A486 A487 T488 F526	S482-T484 PolarHBondContact O-N 2.73Å; T484-A486 VanDerWaalsContact C-N 3.33Å; T484-A486 PolarHBondContact O-N 3.41Å; T484-A487 CarbonylContact O-C 3.36Å; T484-A487 WeakPolarHBondContact O-CA 3.26Å; T484-A487 WeakPolarHBondContact O-CB 3.34Å; T484-A487 PolarHBondContact O-N 2.68Å; T484-T488 PolarHBondContact O-N 3.41Å; T484-T488 PolarHBondContact O-OG1 2.84Å; T484-F526 HydrophobicContact CG2-CE1 4.45Å
485	L	88.2	Confident	85.9	Confident	89 Å²	89	70.5 Å²	70.5	47%	0.466	35%	0.351	S	S	.	.	H	α-helix	trans	-57.3	-45.2	177.4	-176.8	65.9	0	0	0	112.1	I478 S482 A487 T488 A489	I478-L485 HydrophobicContact CD1-CD2 3.53Å; I478-L485 HydrophobicContact CG2-CD2 4.41Å; S482-L485 WeakPolarHBondContact O-CB 3.33Å; S482-L485 PolarHBondContact O-N 2.87Å; S482-L485 VanDerWaalsContact O-N 3.12Å; L485-A487 VanDerWaalsContact C-N 3.32Å; L485-A487 PolarHBondContact O-N 3.48Å; L485-T488 PolarHBondContact O-N 2.88Å; L485-A489 WeakPolarHBondContact O-CB 3.5Å; L485-A489 PolarHBondContact O-N 2.91Å
486	A	88.7	Confident	86.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-40.5	176	0	0	0	0	0	111.7	Y471 I474 Q475 S482 T484 V490	Y471-A486 HydrophobicContact CD2-CB 3.66Å; Y471-A486 HydrophobicContact CE2-CB 3.85Å; Y471-A486 HydrophobicContact CG-CB 4.45Å; I474-A486 HydrophobicContact CB-CB 4.2Å; I474-A486 HydrophobicContact CG2-CB 3.83Å; Q475-A486 HydrophobicContact CG-CB 3.93Å; S482-A486 PolarHBondContact O-N 3.15Å; T484-A486 VanDerWaalsContact C-N 3.33Å; T484-A486 PolarHBondContact O-N 3.41Å; A486-V490 WeakPolarHBondContact O-CG2 3.35Å; A486-V490 PolarHBondContact O-N 3.16Å
487	A	87.6	Confident	86.7	Confident	11 Å²	11	65.6 Å²	65.6	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-65.6	-47.3	174.5	0	0	0	0	0	111.7	R483 T484 L485 A489 V490 F491	R483-A487 WeakPolarHBondContact O-CB 3.19Å; R483-A487 PolarHBondContact O-N 3.26Å; T484-A487 CarbonylContact O-C 3.36Å; T484-A487 WeakPolarHBondContact O-CA 3.26Å; T484-A487 WeakPolarHBondContact O-CB 3.34Å; T484-A487 PolarHBondContact O-N 2.68Å; L485-A487 VanDerWaalsContact C-N 3.32Å; L485-A487 PolarHBondContact O-N 3.48Å; A487-A489 VanDerWaalsContact C-N 3.32Å; A487-A489 PolarHBondContact O-N 3.49Å; A487-V490 PolarHBondContact O-N 3.23Å; A487-V490 VanDerWaalsContact O-N 3.15Å; A487-F491 WeakPolarHBondContact O-CD2 3.41Å; A487-F491 PolarHBondContact O-N 3.38Å
488	T	90	Very high	87.1	Confident	30 Å²	30	62.3 Å²	62.3	18%	0.184	32%	0.323	C	S	.	.	H	α-helix	trans	-56.5	-46.1	177.5	-50.1	0	0	0	0	111.3	T484 L485 V490 F491 W492 Y522	T484-T488 PolarHBondContact O-N 3.41Å; T484-T488 PolarHBondContact O-OG1 2.84Å; L485-T488 PolarHBondContact O-N 2.88Å; T488-V490 VanDerWaalsContact C-N 3.34Å; T488-V490 PolarHBondContact O-N 3.36Å; T488-F491 PolarHBondContact O-N 3.44Å; T488-W492 HydrophobicContact CG2-CD2 4.44Å; T488-W492 HydrophobicContact CG2-CG 4.43Å; T488-W492 WeakPolarHBondContact O-CB 3.25Å; T488-W492 PolarHBondContact O-N 3.03Å; T488-Y522 HydrophobicContact CG2-CE2 4.32Å; T488-Y522 PolarHBondContact OG1-OH 3.26Å
489	A	92.2	Very high	87.6	Confident	38 Å²	38	58.2 Å²	58.2	31%	0.314	30%	0.301	S	S	.	.	H	α-helix	trans	-59.7	-43.4	177.4	0	0	0	0	0	112.2	I474 L485 A487 L493	I474-A489 HydrophobicContact CD1-CB 3.61Å; L485-A489 WeakPolarHBondContact O-CB 3.5Å; L485-A489 PolarHBondContact O-N 2.91Å; A487-A489 VanDerWaalsContact C-N 3.32Å; A487-A489 PolarHBondContact O-N 3.49Å; A489-L493 WeakPolarHBondContact O-CB 3.35Å; A489-L493 PolarHBondContact O-N 3.26Å
490	V	92.7	Very high	88.4	Confident	25 Å²	25	57.9 Å²	57.9	15%	0.152	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-45.5	176.6	171.6	0	0	0	0	111.4	L466 I470 A486 A487 T488 S494	L466-V490 HydrophobicContact CB-CG1 4.02Å; L466-V490 HydrophobicContact CD1-CG1 4.22Å; L466-V490 HydrophobicContact CD2-CG1 4.4Å; L466-V490 HydrophobicContact CG-CG1 4.45Å; I470-V490 HydrophobicContact CB-CG2 4.06Å; I470-V490 HydrophobicContact CG2-CG2 3.71Å; A486-V490 WeakPolarHBondContact O-CG2 3.35Å; A486-V490 PolarHBondContact O-N 3.16Å; A487-V490 PolarHBondContact O-N 3.23Å; A487-V490 VanDerWaalsContact O-N 3.15Å; T488-V490 VanDerWaalsContact C-N 3.34Å; T488-V490 PolarHBondContact O-N 3.36Å; V490-S494 VanDerWaalsContact O-CB 3.25Å; V490-S494 WeakPolarHBondContact O-CB 3.33Å; V490-S494 PolarHBondContact O-N 2.88Å
491	F	91.4	Very high	89.7	Confident	17 Å²	17	54.7 Å²	54.7	8%	0.075	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-46.9	179.1	-92.6	-81.8	0	0	0	111.9	Y455 A487 T488 S494 A495 Y522 F525	Y455-F491 AromaticContact CD2-CE1 4Å; Y455-F491 HydrophobicContact CD2-CE1 4Å; Y455-F491 AromaticContact CD2-CZ 3.85Å; Y455-F491 HydrophobicContact CD2-CZ 3.85Å; Y455-F491 HydrophobicContact CE1-CE1 4.2Å; Y455-F491 AromaticContact CE2-CE1 3.58Å; Y455-F491 HydrophobicContact CE2-CE1 3.58Å; Y455-F491 AromaticContact CE2-CZ 3.86Å; Y455-F491 HydrophobicContact CE2-CZ 3.86Å; Y455-F491 HydrophobicContact CG-CZ 4.39Å; Y455-F491 AromaticContact CZ-CE1 3.7Å; A487-F491 WeakPolarHBondContact O-CD2 3.41Å; A487-F491 PolarHBondContact O-N 3.38Å; T488-F491 PolarHBondContact O-N 3.44Å; F491-S494 PolarHBondContact O-N 3.39Å; F491-A495 VanDerWaalsContact O-CB 3.27Å; F491-A495 WeakPolarHBondContact O-CB 3.33Å; F491-A495 PolarHBondContact O-N 3.38Å; F491-Y522 HydrophobicContact CB-CD2 4.23Å; F491-Y522 HydrophobicContact CD2-CD2 4.07Å; F491-Y522 HydrophobicContact CG-CD2 4.09Å; F491-F525 HydrophobicContact CE2-CB 4.17Å; F491-F525 HydrophobicContact CE2-CD1 4.1Å; F491-F525 AromaticContact CE2-CD2 3.65Å; F491-F525 HydrophobicContact CE2-CD2 3.65Å; F491-F525 HydrophobicContact CE2-CE1 4.4Å; F491-F525 AromaticContact CE2-CE2 3.97Å; F491-F525 HydrophobicContact CE2-CE2 3.97Å; F491-F525 AromaticContact CE2-CG 3.7Å; F491-F525 HydrophobicContact CE2-CG 3.7Å; F491-F525 HydrophobicContact CE2-CZ 4.34Å; F491-F525 HydrophobicContact CZ-CB 3.82Å; F491-F525 AromaticContact CZ-CD2 3.45Å; F491-F525 HydrophobicContact CZ-CD2 3.45Å; F491-F525 VanDerWaalsContact CZ-CD2 3.45Å; F491-F525 HydrophobicContact CZ-CE2 4.1Å; F491-F525 AromaticContact CZ-CG 3.68Å; F491-F525 HydrophobicContact CZ-CG 3.68Å
492	W	92.7	Very high	90.9	Very high	153 Å²	153	47.6 Å²	47.6	58%	0.58	25%	0.247	S	C	*	.	H	α-helix	trans	-67.9	-42.5	-179.5	-77.8	26.6	0	0	0	112.2	T488 S494 A495 G496	T488-W492 HydrophobicContact CG2-CD2 4.44Å; T488-W492 HydrophobicContact CG2-CG 4.43Å; T488-W492 WeakPolarHBondContact O-CB 3.25Å; T488-W492 PolarHBondContact O-N 3.03Å; W492-S494 VanDerWaalsContact C-N 3.34Å; W492-S494 PolarHBondContact O-N 3.49Å; W492-A495 PolarHBondContact O-N 2.88Å; W492-G496 PolarHBondContact O-N 3.01Å
493	L	94.5	Very high	91.8	Very high	75 Å²	75	49 Å²	49	39%	0.393	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-47.5	174	179.1	65.9	0	0	0	110.7	L466 I470 A489 G496 V497	L466-L493 HydrophobicContact CD2-CD2 4.32Å; I470-L493 HydrophobicContact CD1-CD2 3.85Å; I470-L493 HydrophobicContact CG1-CD2 3.85Å; I470-L493 HydrophobicContact CG2-CD2 4.29Å; A489-L493 WeakPolarHBondContact O-CB 3.35Å; A489-L493 PolarHBondContact O-N 3.26Å; L493-G496 PolarHBondContact O-N 3.21Å; L493-V497 HydrophobicContact CD1-CG2 4.46Å; L493-V497 WeakPolarHBondContact O-CG2 3.45Å; L493-V497 PolarHBondContact O-N 2.89Å
494	S	94.5	Very high	92.1	Very high	21 Å²	21	41.5 Å²	41.5	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-47.3	179	-169	0	0	0	0	111.4	V490 F491 W492 G496 V497 H498	V490-S494 VanDerWaalsContact O-CB 3.25Å; V490-S494 WeakPolarHBondContact O-CB 3.33Å; V490-S494 PolarHBondContact O-N 2.88Å; F491-S494 PolarHBondContact O-N 3.39Å; W492-S494 VanDerWaalsContact C-N 3.34Å; W492-S494 PolarHBondContact O-N 3.49Å; S494-G496 VanDerWaalsContact C-N 3.35Å; S494-G496 PolarHBondContact O-N 2.85Å; S494-V497 PolarHBondContact O-N 3.43Å; S494-H498 PolarHBondContact O-N 3.48Å; S494-H498 PolarHBondContact O-ND1 2.83Å; S494-H498 PolarHBondContact OG-CE1 2.79Å
495	A	94.6	Very high	92.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-44.4	177.8	0	0	0	0	0	111.8	F491 W492 V497 H498 E499 F514 F517	F491-A495 VanDerWaalsContact O-CB 3.27Å; F491-A495 WeakPolarHBondContact O-CB 3.33Å; F491-A495 PolarHBondContact O-N 3.38Å; W492-A495 PolarHBondContact O-N 2.88Å; A495-V497 PolarHBondContact O-N 3.26Å; A495-H498 PolarHBondContact O-N 2.96Å; A495-E499 WeakPolarHBondContact O-CB 3.33Å; A495-E499 PolarHBondContact O-N 3.4Å; A495-F514 HydrophobicContact CB-CD2 3.7Å; A495-F514 HydrophobicContact CB-CE2 3.96Å; A495-F514 HydrophobicContact CB-CG 4.45Å; A495-F517 HydrophobicContact CB-CB 3.86Å
496	G	94.7	Very high	92.6	Very high	31 Å²	31	35.3 Å²	35.3	32%	0.32	19%	0.19	S	C	.	.	H	α-helix	trans	-62.9	-40.4	177.9	0	0	0	0	0	113.2	W492 L493 S494 Y500	W492-G496 PolarHBondContact O-N 3.01Å; L493-G496 PolarHBondContact O-N 3.21Å; S494-G496 VanDerWaalsContact C-N 3.35Å; S494-G496 PolarHBondContact O-N 2.85Å; G496-Y500 VanDerWaalsContact O-CB 3.29Å; G496-Y500 WeakPolarHBondContact O-CB 3.48Å; G496-Y500 PolarHBondContact O-N 3.42Å
497	V	95.1	Very high	92.6	Very high	48 Å²	48	38.6 Å²	38.6	29%	0.291	20%	0.202	S	C	.	.	H	α-helix	trans	-68.5	-39.3	177.4	172	0	0	0	0	111.9	V271 L493 S494 A495 Y500 I501	V271-V497 HydrophobicContact CG1-CG1 3.82Å; V271-V497 HydrophobicContact CG2-CG1 4.01Å; L493-V497 HydrophobicContact CD1-CG2 4.46Å; L493-V497 WeakPolarHBondContact O-CG2 3.45Å; L493-V497 PolarHBondContact O-N 2.89Å; S494-V497 PolarHBondContact O-N 3.43Å; A495-V497 PolarHBondContact O-N 3.26Å; V497-Y500 WeakPolarHBondContact O-CB 3.27Å; V497-Y500 PolarHBondContact O-N 3.45Å; V497-I501 HydrophobicContact CG1-CD1 4.23Å; V497-I501 WeakPolarHBondContact O-CG1 3.42Å; V497-I501 PolarHBondContact O-N 3.47Å
498	H	94.4	Very high	92.6	Very high	72 Å²	72	38.3 Å²	38.3	33%	0.333	20%	0.199	S	C	.	.	H	α-helix	trans	-66.3	-43.8	176.4	-73.8	87.7	0	0	0	111.8	S494 A495 Y500 I501 L502 L513	S494-H498 PolarHBondContact O-N 3.48Å; S494-H498 PolarHBondContact O-ND1 2.83Å; S494-H498 PolarHBondContact OG-CE1 2.79Å; A495-H498 PolarHBondContact O-N 2.96Å; H498-Y500 VanDerWaalsContact C-N 3.31Å; H498-Y500 PolarHBondContact O-N 3.19Å; H498-I501 PolarHBondContact O-N 3.4Å; H498-L502 PolarHBondContact O-N 2.93Å; H498-L502 VanDerWaalsContact O-N 3.14Å; H498-L513 HydrophobicContact CB-CD2 3.59Å; H498-L513 HydrophobicContact CB-CG 4.2Å
499	E	94.6	Very high	92.5	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.065	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-40	174.8	-168.3	63.1	-140.1	0	0	111.1	A495 I501 L502 M503 L510 P511 L513 F514 Y553	A495-E499 WeakPolarHBondContact O-CB 3.33Å; A495-E499 PolarHBondContact O-N 3.4Å; E499-I501 PolarHBondContact O-N 3Å; E499-L502 PolarHBondContact O-N 3.39Å; E499-M503 WeakPolarHBondContact O-CB 3.35Å; E499-M503 PolarHBondContact O-N 2.89Å; E499-L510 VanDerWaalsContact OE1-C 3.31Å; E499-P511 WeakPolarHBondContact OE1-CA 3.47Å; E499-P511 WeakPolarHBondContact OE2-CA 3.38Å; E499-L513 WeakPolarHBondContact OE2-CB 3.05Å; E499-L513 PolarHBondContact OE2-N 3.22Å; E499-F514 HydrophobicContact CB-CB 4.22Å; E499-F514 HydrophobicContact CG-CB 4.23Å; E499-F514 PolarHBondContact OE2-N 3.45Å; E499-Y553 PolarHBondContact OE2-OH 3.12Å
500	Y	93.8	Very high	92.4	Very high	23 Å²	23	37 Å²	37	9%	0.09	19%	0.187	C	C	.	.	H	α-helix	trans	-57	-48.5	174.2	165	-105.6	0	0	0	112.3	F246 F250 Q270 V271 G496 V497 H498 L502 M503 M504	F246-Y500 HydrophobicContact CE1-CE2 4.09Å; F246-Y500 HydrophobicContact CE2-CD1 4.26Å; F246-Y500 HydrophobicContact CE2-CD2 4.34Å; F246-Y500 AromaticContact CE2-CE1 3.73Å; F246-Y500 HydrophobicContact CE2-CE1 3.73Å; F246-Y500 AromaticContact CE2-CE2 3.83Å; F246-Y500 HydrophobicContact CE2-CE2 3.83Å; F246-Y500 AromaticContact CE2-CZ 3.5Å; F246-Y500 VanDerWaalsContact CE2-CZ 3.5Å; F246-Y500 HydrophobicContact CZ-CD1 4.49Å; F246-Y500 AromaticContact CZ-CD2 3.78Å; F246-Y500 HydrophobicContact CZ-CD2 3.78Å; F246-Y500 HydrophobicContact CZ-CE1 4.08Å; F246-Y500 AromaticContact CZ-CE2 3.29Å; F246-Y500 HydrophobicContact CZ-CE2 3.29Å; F246-Y500 HydrophobicContact CZ-CG 4.35Å; F246-Y500 AromaticContact CZ-CZ 3.46Å; F246-Y500 VanDerWaalsContact CZ-CZ 3.46Å; F250-Y500 HydrophobicContact CD2-CE2 4.41Å; Q270-Y500 PolarHBondContact OE1-OH 3.29Å; V271-Y500 HydrophobicContact CG2-CD1 4.45Å; V271-Y500 HydrophobicContact CG2-CE1 4.33Å; G496-Y500 VanDerWaalsContact O-CB 3.29Å; G496-Y500 WeakPolarHBondContact O-CB 3.48Å; G496-Y500 PolarHBondContact O-N 3.42Å; V497-Y500 WeakPolarHBondContact O-CB 3.27Å; V497-Y500 PolarHBondContact O-N 3.45Å; H498-Y500 VanDerWaalsContact C-N 3.31Å; H498-Y500 PolarHBondContact O-N 3.19Å; Y500-L502 VanDerWaalsContact C-N 3.33Å; Y500-L502 PolarHBondContact O-N 2.92Å; Y500-M503 HydrophobicContact CD2-CE 4.31Å; Y500-M503 PolarHBondContact O-N 3.47Å; Y500-M504 HydrophobicContact CD2-CG 3.86Å; Y500-M504 HydrophobicContact CE2-CG 3.42Å; Y500-M504 VanDerWaalsContact CE2-CG 3.42Å; Y500-M504 HydrophobicContact CE2-SD 4.05Å; Y500-M504 WeakPolarHBondContact O-CB 3.33Å; Y500-M504 VanDerWaalsContact O-CG 3.28Å; Y500-M504 WeakPolarHBondContact O-CG 3.26Å; Y500-M504 PolarHBondContact O-N 3.49Å
501	I	93.9	Very high	92.3	Very high	42 Å²	42	38.5 Å²	38.5	22%	0.215	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-44.2	179.5	-66.9	165.4	0	0	0	110.5	V271 V497 H498 E499 S505	V271-I501 HydrophobicContact CG2-CD1 4.2Å; V271-I501 HydrophobicContact CG2-CG1 4.24Å; V497-I501 HydrophobicContact CG1-CD1 4.23Å; V497-I501 WeakPolarHBondContact O-CG1 3.42Å; V497-I501 PolarHBondContact O-N 3.47Å; H498-I501 PolarHBondContact O-N 3.4Å; E499-I501 PolarHBondContact O-N 3Å; I501-S505 WeakPolarHBondContact O-CB 3.46Å; I501-S505 PolarHBondContact O-N 3.02Å; I501-S505 PolarHBondContact O-OG 3.5Å
502	L	92.6	Very high	92.3	Very high	48 Å²	48	38.6 Å²	38.6	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-67.6	-45.5	178.3	-70.7	-174.2	0	0	0	112.4	H498 E499 Y500 M504 S505 L506 L513 Y553	H498-L502 PolarHBondContact O-N 2.93Å; H498-L502 VanDerWaalsContact O-N 3.14Å; E499-L502 PolarHBondContact O-N 3.39Å; Y500-L502 VanDerWaalsContact C-N 3.33Å; Y500-L502 PolarHBondContact O-N 2.92Å; L502-M504 VanDerWaalsContact C-N 3.27Å; L502-M504 PolarHBondContact O-N 3.43Å; L502-S505 PolarHBondContact O-N 2.76Å; L502-S505 VanDerWaalsContact O-N 3.15Å; L502-L506 WeakPolarHBondContact O-CB 3.34Å; L502-L506 WeakPolarHBondContact O-CG 3.41Å; L502-L506 PolarHBondContact O-N 2.9Å; L502-L513 HydrophobicContact CD1-CB 4.06Å; L502-L513 HydrophobicContact CD1-CD2 3.43Å; L502-L513 VanDerWaalsContact CD1-CD2 3.43Å; L502-L513 HydrophobicContact CD1-CG 4.39Å; L502-L513 HydrophobicContact CG-CD2 4.22Å; L502-Y553 HydrophobicContact CD1-CD2 4.35Å; L502-Y553 HydrophobicContact CD1-CE1 4.28Å; L502-Y553 HydrophobicContact CD1-CE2 3.56Å; L502-Y553 WeakPolarHBondContact CD1-OH 3.28Å
503	M	92.6	Very high	92.3	Very high	43 Å²	43	31.8 Å²	31.8	21%	0.212	17%	0.174	C	C	.	.	H	α-helix	trans	-58.3	-41.5	178.3	178.9	-179.4	72.5	0	0	111.4	E499 Y500 R507 Y508 C509 F573	E499-M503 WeakPolarHBondContact O-CB 3.35Å; E499-M503 PolarHBondContact O-N 2.89Å; Y500-M503 HydrophobicContact CD2-CE 4.31Å; Y500-M503 PolarHBondContact O-N 3.47Å; M503-R507 WeakPolarHBondContact O-CA 3.43Å; M503-R507 PolarHBondContact O-N 3.32Å; M503-Y508 WeakPolarHBondContact CA-O 3.18Å; M503-C509 HydrophobicContact CG-CB 4.34Å; M503-C509 HydrophobicContact SD-CB 4.08Å; M503-F573 HydrophobicContact CG-CE1 3.8Å; M503-F573 HydrophobicContact CG-CZ 3.43Å; M503-F573 VanDerWaalsContact CG-CZ 3.43Å; M503-F573 HydrophobicContact SD-CE1 3.6Å; M503-F573 VanDerWaalsContact SD-CE1 3.6Å; M503-F573 HydrophobicContact SD-CZ 3.81Å
504	M	90.7	Very high	92.2	Very high	8 Å²	8	31.2 Å²	31.2	4%	0.039	17%	0.168	C	C	.	.	H	α-helix	trans	-67.3	-45.9	174.9	-70.8	-52.3	-63.7	0	0	112.1	F250 T253 T263 T267 Y500 L502 L506 R507	F250-M504 HydrophobicContact CD2-CE 3.43Å; F250-M504 VanDerWaalsContact CD2-CE 3.43Å; F250-M504 HydrophobicContact CD2-SD 3.28Å; F250-M504 WeakPolarHBondContact CD2-SD 3.25Å; F250-M504 HydrophobicContact CE2-CE 3.75Å; F250-M504 HydrophobicContact CE2-SD 3.23Å; F250-M504 WeakPolarHBondContact CE2-SD 3.25Å; F250-M504 HydrophobicContact CG-CE 4.17Å; F250-M504 HydrophobicContact CG-SD 4.49Å; F250-M504 HydrophobicContact CZ-SD 4.42Å; T253-M504 HydrophobicContact CG2-CE 4.21Å; T263-M504 VanDerWaalsContact CG2-C 3.47Å; T263-M504 HydrophobicContact CG2-CB 4.02Å; T263-M504 VanDerWaalsContact CG2-O 3.26Å; T263-M504 WeakPolarHBondContact CG2-O 3.21Å; T267-M504 HydrophobicContact CG2-CB 3.6Å; T267-M504 HydrophobicContact CG2-CG 4.04Å; Y500-M504 HydrophobicContact CD2-CG 3.86Å; Y500-M504 HydrophobicContact CE2-CG 3.42Å; Y500-M504 VanDerWaalsContact CE2-CG 3.42Å; Y500-M504 HydrophobicContact CE2-SD 4.05Å; Y500-M504 WeakPolarHBondContact O-CB 3.33Å; Y500-M504 VanDerWaalsContact O-CG 3.28Å; Y500-M504 WeakPolarHBondContact O-CG 3.26Å; Y500-M504 PolarHBondContact O-N 3.49Å; L502-M504 VanDerWaalsContact C-N 3.27Å; L502-M504 PolarHBondContact O-N 3.43Å; M504-L506 PolarHBondContact O-N 3.41Å; M504-R507 WeakPolarHBondContact O-CD 3.4Å; M504-R507 PolarHBondContact O-NE 3.4Å
505	S	92	Very high	92.1	Very high	9 Å²	9	34.7 Å²	34.7	6%	0.063	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-38.5	-177.6	-54.8	0	0	0	0	112.4	P260 A264 I501 L502	P260-S505 WeakPolarHBondContact CA-O 3.37Å; P260-S505 WeakPolarHBondContact CB-O 3.37Å; A264-S505 WeakPolarHBondContact CA-OG 3.37Å; A264-S505 WeakPolarHBondContact CB-OG 3.39Å; A264-S505 PolarHBondContact N-OG 2.9Å; I501-S505 WeakPolarHBondContact O-CB 3.46Å; I501-S505 PolarHBondContact O-N 3.02Å; I501-S505 PolarHBondContact O-OG 3.5Å; L502-S505 PolarHBondContact O-N 2.76Å; L502-S505 VanDerWaalsContact O-N 3.15Å
506	L	90.8	Very high	91.9	Very high	33 Å²	33	38.2 Å²	38.2	17%	0.173	20%	0.2	C	C	.	.	H	α-helix	trans	-97.2	-10.2	-174.3	-60.6	171.4	0	0	0	113.6	L502 M504 Y508 Y553 W557	L502-L506 WeakPolarHBondContact O-CB 3.34Å; L502-L506 WeakPolarHBondContact O-CG 3.41Å; L502-L506 PolarHBondContact O-N 2.9Å; M504-L506 PolarHBondContact O-N 3.41Å; L506-Y508 HydrophobicContact CB-CD1 4.05Å; L506-Y508 HydrophobicContact CB-CE1 3.68Å; L506-Y508 HydrophobicContact CB-CE2 4.28Å; L506-Y508 HydrophobicContact CD1-CE2 4.34Å; L506-Y508 WeakPolarHBondContact O-CD1 3.42Å; L506-Y508 PolarHBondContact O-N 3.43Å; L506-Y553 HydrophobicContact CD1-CD1 3.5Å; L506-Y553 VanDerWaalsContact CD1-CD1 3.5Å; L506-Y553 HydrophobicContact CD1-CE1 4.13Å; L506-Y553 HydrophobicContact CD1-CG 3.95Å; L506-W557 HydrophobicContact CB-CE3 4.46Å; L506-W557 HydrophobicContact CD2-CE3 3.97Å; L506-W557 HydrophobicContact CD2-CZ3 4.34Å; L506-W557 WeakPolarHBondContact O-CZ3 3.38Å
507	R	88.5	Confident	91.5	Very high	70 Å²	70	38.6 Å²	38.6	26%	0.264	19%	0.193	S	C	.	.	S	Bend	trans	60	26.5	-179.9	-52.1	-63.5	-174.7	153.2	13.5	114.9	T253 L258 M503 M504 F573	T253-R507 PolarHBondContact O-NH2 2.97Å; L258-R507 PolarHBondContact O-NH2 3.43Å; L258-R507 VanDerWaalsContact O-NH2 3.15Å; M503-R507 WeakPolarHBondContact O-CA 3.43Å; M503-R507 PolarHBondContact O-N 3.32Å; M504-R507 WeakPolarHBondContact O-CD 3.4Å; M504-R507 PolarHBondContact O-NE 3.4Å; R507-F573 WeakPolarHBondContact O-CD2 3.39Å; R507-F573 WeakPolarHBondContact O-CE2 3.41Å
508	Y	88.3	Confident	91	Very high	5 Å²	5	36.9 Å²	36.9	2%	0.02	18%	0.183	C	C	.	.	S	Bend	trans	-147.6	158.8	169.6	59.3	-104.4	0	0	0	110.4	M503 L506 L510 Y553 E556 W557 R560 F573	M503-Y508 WeakPolarHBondContact CA-O 3.18Å; L506-Y508 HydrophobicContact CB-CD1 4.05Å; L506-Y508 HydrophobicContact CB-CE1 3.68Å; L506-Y508 HydrophobicContact CB-CE2 4.28Å; L506-Y508 HydrophobicContact CD1-CE2 4.34Å; L506-Y508 WeakPolarHBondContact O-CD1 3.42Å; L506-Y508 PolarHBondContact O-N 3.43Å; Y508-L510 HydrophobicContact CD2-CB 3.93Å; Y508-L510 HydrophobicContact CE2-CB 3.79Å; Y508-Y553 AromaticContact CE2-CD1 3.97Å; Y508-Y553 HydrophobicContact CE2-CD1 3.97Å; Y508-Y553 HydrophobicContact CE2-CE1 4.44Å; Y508-Y553 PolarHBondContact OH-O 2.97Å; Y508-E556 HydrophobicContact CD2-CG 3.97Å; Y508-E556 HydrophobicContact CE1-CG 4.31Å; Y508-E556 HydrophobicContact CE2-CB 4.19Å; Y508-E556 HydrophobicContact CE2-CG 3.62Å; Y508-E556 HydrophobicContact CG-CG 4.49Å; Y508-W557 HydrophobicContact CE1-CB 4.24Å; Y508-W557 AromaticContact CE1-CE3 3.95Å; Y508-W557 HydrophobicContact CE1-CE3 3.95Å; Y508-R560 VanDerWaalsContact CB-CZ 3.46Å; Y508-F573 VanDerWaalsContact CA-CE2 3.44Å
509	C	88.7	Confident	90.7	Very high	19 Å²	19	37.4 Å²	37.4	13%	0.128	19%	0.191	C	C	.	.			trans	-99.7	113.8	175	-174.9	0	0	0	0	109.9	M503 F573 F574	M503-C509 HydrophobicContact CG-CB 4.34Å; M503-C509 HydrophobicContact SD-CB 4.08Å; C509-F573 HydrophobicContact CB-CD1 3.75Å; C509-F573 HydrophobicContact CB-CE1 3.51Å; C509-F573 HydrophobicContact CB-CZ 4.37Å; C509-F573 PolarHBondContact N-O 2.94Å; C509-F574 HydrophobicContact CB-CD1 3.73Å; C509-F574 HydrophobicContact CB-CE1 3.96Å
510	L	89.6	Confident	90.3	Very high	21 Å²	21	38.2 Å²	38.2	11%	0.11	20%	0.203	C	C	.	.			trans	-133	94	170.4	-178.5	69.5	0	0	0	108.1	E499 Y508 V512 L552 Y553 E556 P576	E499-L510 VanDerWaalsContact OE1-C 3.31Å; Y508-L510 HydrophobicContact CD2-CB 3.93Å; Y508-L510 HydrophobicContact CE2-CB 3.79Å; L510-V512 HydrophobicContact CD1-CG2 4.3Å; L510-V512 HydrophobicContact CD2-CG2 4Å; L510-V512 HydrophobicContact CG-CG2 3.78Å; L510-V512 PolarHBondContact O-N 3.21Å; L510-L552 HydrophobicContact CD2-CB 4.44Å; L510-Y553 HydrophobicContact CB-CD1 4.41Å; L510-Y553 HydrophobicContact CB-CE1 3.99Å; L510-Y553 HydrophobicContact CD2-CD1 4.09Å; L510-Y553 HydrophobicContact CD2-CE1 4.24Å; L510-Y553 HydrophobicContact CG-CE1 4.41Å; L510-Y553 WeakPolarHBondContact O-CE1 3.46Å; L510-Y553 PolarHBondContact O-OH 3.47Å; L510-E556 HydrophobicContact CD2-CB 3.93Å; L510-E556 HydrophobicContact CD2-CG 4.14Å; L510-P576 HydrophobicContact CD1-CB 4.38Å
511	P	90.3	Very high	90	Very high	56 Å²	56	37.3 Å²	37.3	36%	0.364	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	36.4	-166.1	32.2	-37.6	0	0	0	114.9	E499 F514 L515	E499-P511 WeakPolarHBondContact OE1-CA 3.47Å; E499-P511 WeakPolarHBondContact OE2-CA 3.38Å; P511-F514 HydrophobicContact CB-CB 4.17Å; P511-L515 WeakPolarHBondContact O-CB 3.48Å; P511-L515 VanDerWaalsContact O-CG 3.25Å; P511-L515 WeakPolarHBondContact O-CG 3.39Å; P511-L515 PolarHBondContact O-N 2.92Å
512	V	91.4	Very high	89.6	Confident	19 Å²	19	38 Å²	38	12%	0.115	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-45.7	179	169.3	0	0	0	0	110.3	L510 L515 F516 L552 Y553	L510-V512 HydrophobicContact CD1-CG2 4.3Å; L510-V512 HydrophobicContact CD2-CG2 4Å; L510-V512 HydrophobicContact CG-CG2 3.78Å; L510-V512 PolarHBondContact O-N 3.21Å; V512-L515 PolarHBondContact O-N 3.08Å; V512-F516 HydrophobicContact CG1-CD2 4.15Å; V512-F516 HydrophobicContact CG1-CE1 4.21Å; V512-F516 HydrophobicContact CG1-CE2 3.78Å; V512-F516 HydrophobicContact CG1-CZ 3.82Å; V512-F516 WeakPolarHBondContact O-CB 3.39Å; V512-F516 WeakPolarHBondContact O-CG 3.38Å; V512-F516 PolarHBondContact O-N 2.89Å; V512-L552 HydrophobicContact CB-CD1 4.5Å; V512-L552 HydrophobicContact CG1-CD1 3.75Å; V512-L552 HydrophobicContact CG2-CB 4.41Å; V512-L552 HydrophobicContact CG2-CD1 3.89Å; V512-Y553 HydrophobicContact CB-CE2 4.48Å
513	L	91.8	Very high	89.5	Confident	10 Å²	10	39.8 Å²	39.8	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-42.8	179.3	-176.6	55.1	0	0	0	111.2	H498 E499 L502 L515 F516 F517 M549 Y553	H498-L513 HydrophobicContact CB-CD2 3.59Å; H498-L513 HydrophobicContact CB-CG 4.2Å; E499-L513 WeakPolarHBondContact OE2-CB 3.05Å; E499-L513 PolarHBondContact OE2-N 3.22Å; L502-L513 HydrophobicContact CD1-CB 4.06Å; L502-L513 HydrophobicContact CD1-CD2 3.43Å; L502-L513 VanDerWaalsContact CD1-CD2 3.43Å; L502-L513 HydrophobicContact CD1-CG 4.39Å; L502-L513 HydrophobicContact CG-CD2 4.22Å; L513-L515 VanDerWaalsContact C-N 3.34Å; L513-L515 PolarHBondContact O-N 3.37Å; L513-F516 PolarHBondContact O-N 2.81Å; L513-F517 HydrophobicContact CD1-CD2 3.39Å; L513-F517 HydrophobicContact CD1-CE2 3.23Å; L513-F517 HydrophobicContact CD1-CG 4.5Å; L513-F517 HydrophobicContact CD1-CZ 4.24Å; L513-F517 HydrophobicContact CG-CD2 4.21Å; L513-F517 HydrophobicContact CG-CE2 4.3Å; L513-F517 PolarHBondContact O-N 2.93Å; L513-M549 HydrophobicContact CD1-SD 3.52Å; L513-M549 VanDerWaalsContact CD1-SD 3.52Å; L513-Y553 WeakPolarHBondContact CB-OH 3.1Å; L513-Y553 PolarHBondContact N-OH 2.67Å
514	F	93	Very high	89.3	Confident	63 Å²	63	40.1 Å²	40.1	28%	0.276	22%	0.216	S	C	.	.	H	α-helix	trans	-54.9	-48.3	173.1	-174.9	-90.9	0	0	0	111.7	A495 E499 P511 F517 S518	A495-F514 HydrophobicContact CB-CD2 3.7Å; A495-F514 HydrophobicContact CB-CE2 3.96Å; A495-F514 HydrophobicContact CB-CG 4.45Å; E499-F514 HydrophobicContact CB-CB 4.22Å; E499-F514 HydrophobicContact CG-CB 4.23Å; E499-F514 PolarHBondContact OE2-N 3.45Å; P511-F514 HydrophobicContact CB-CB 4.17Å; F514-F517 PolarHBondContact O-N 3.48Å; F514-S518 WeakPolarHBondContact CE1-OG 3.28Å; F514-S518 WeakPolarHBondContact O-CB 3.17Å; F514-S518 PolarHBondContact O-N 3.38Å; F514-S518 PolarHBondContact O-OG 2.86Å
515	L	92.1	Very high	89.1	Confident	94 Å²	94	42 Å²	42	49%	0.492	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-42.6	179	-70.7	172	0	0	0	112.4	P511 V512 L513 F517 V519 G520	P511-L515 WeakPolarHBondContact O-CB 3.48Å; P511-L515 VanDerWaalsContact O-CG 3.25Å; P511-L515 WeakPolarHBondContact O-CG 3.39Å; P511-L515 PolarHBondContact O-N 2.92Å; V512-L515 PolarHBondContact O-N 3.08Å; L513-L515 VanDerWaalsContact C-N 3.34Å; L513-L515 PolarHBondContact O-N 3.37Å; L515-F517 VanDerWaalsContact C-N 3.32Å; L515-F517 PolarHBondContact O-N 3Å; L515-V519 HydrophobicContact CD2-CG2 4.26Å; L515-V519 VanDerWaalsContact O-CB 3.31Å; L515-V519 WeakPolarHBondContact O-CB 3.31Å; L515-V519 PolarHBondContact O-N 3.39Å; L515-G520 PolarHBondContact O-N 2.98Å
516	F	90.8	Very high	88.8	Confident	75 Å²	75	46.4 Å²	46.4	33%	0.329	24%	0.242	S	C	.	.	I	π-helix	trans	-61.4	-39.8	177.4	-75.9	0.1	0	0	0	112.4	V512 L513 G520 G521 Q548 M549	V512-F516 HydrophobicContact CG1-CD2 4.15Å; V512-F516 HydrophobicContact CG1-CE1 4.21Å; V512-F516 HydrophobicContact CG1-CE2 3.78Å; V512-F516 HydrophobicContact CG1-CZ 3.82Å; V512-F516 WeakPolarHBondContact O-CB 3.39Å; V512-F516 WeakPolarHBondContact O-CG 3.38Å; V512-F516 PolarHBondContact O-N 2.89Å; L513-F516 PolarHBondContact O-N 2.81Å; F516-G520 CarbonylContact O-C 3.57Å; F516-G520 WeakPolarHBondContact O-CA 3.47Å; F516-G520 PolarHBondContact O-N 3.18Å; F516-G521 PolarHBondContact O-N 2.96Å; F516-Q548 HydrophobicContact CE2-CB 3.66Å; F516-Q548 HydrophobicContact CE2-CG 4.39Å; F516-Q548 HydrophobicContact CZ-CB 3.65Å; F516-Q548 HydrophobicContact CZ-CG 4.05Å; F516-M549 HydrophobicContact CD2-CG 4.09Å; F516-M549 HydrophobicContact CE2-CG 4.1Å
517	F	86.2	Confident	88.6	Confident	38 Å²	38	47.3 Å²	47.3	17%	0.167	25%	0.249	C	C	.	.	I	π-helix	trans	-80.2	-49	179.3	-86.1	-119.7	0	0	0	112.6	Y455 A495 L513 F514 L515 G521 Y522	Y455-F517 HydrophobicContact CE1-CD1 4.18Å; Y455-F517 AromaticContact CE1-CE1 3.94Å; Y455-F517 HydrophobicContact CE1-CE1 3.94Å; A495-F517 HydrophobicContact CB-CB 3.86Å; L513-F517 HydrophobicContact CD1-CD2 3.39Å; L513-F517 HydrophobicContact CD1-CE2 3.23Å; L513-F517 HydrophobicContact CD1-CG 4.5Å; L513-F517 HydrophobicContact CD1-CZ 4.24Å; L513-F517 HydrophobicContact CG-CD2 4.21Å; L513-F517 HydrophobicContact CG-CE2 4.3Å; L513-F517 PolarHBondContact O-N 2.93Å; F514-F517 PolarHBondContact O-N 3.48Å; L515-F517 VanDerWaalsContact C-N 3.32Å; L515-F517 PolarHBondContact O-N 3Å; F517-G521 WeakPolarHBondContact O-CA 3.36Å; F517-G521 PolarHBondContact O-N 3.42Å; F517-Y522 PolarHBondContact O-N 3.37Å
518	S	85.3	Confident	88.4	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.084	28%	0.278	C	S	.	.	I	π-helix	trans	-76.3	-28.2	-172.2	65.8	0	0	0	0	113.9	F514 Y522	F514-S518 WeakPolarHBondContact CE1-OG 3.28Å; F514-S518 WeakPolarHBondContact O-CB 3.17Å; F514-S518 PolarHBondContact O-N 3.38Å; F514-S518 PolarHBondContact O-OG 2.86Å; S518-Y522 WeakPolarHBondContact O-CB 3.37Å
519	V	87.6	Confident	88	Confident	84 Å²	84	52.9 Å²	52.9	51%	0.509	28%	0.28	S	S	.	.	I	π-helix	trans	-105.2	-62.4	177.6	-174.8	0	0	0	0	109.5	L515 V523	L515-V519 HydrophobicContact CD2-CG2 4.26Å; L515-V519 VanDerWaalsContact O-CB 3.31Å; L515-V519 WeakPolarHBondContact O-CB 3.31Å; L515-V519 PolarHBondContact O-N 3.39Å; V519-V523 WeakPolarHBondContact O-CB 3.29Å; V519-V523 VanDerWaalsContact O-CG2 3.24Å; V519-V523 WeakPolarHBondContact O-CG2 2.97Å; V519-V523 PolarHBondContact O-N 2.95Å
520	G	86.7	Confident	87.6	Confident	30 Å²	30	56.9 Å²	56.9	31%	0.309	31%	0.309	S	S	.	.	I	π-helix	trans	-62.2	-59.5	-176	0	0	0	0	0	112.6	L515 F516 Y522 V523 L524	L515-G520 PolarHBondContact O-N 2.98Å; F516-G520 CarbonylContact O-C 3.57Å; F516-G520 WeakPolarHBondContact O-CA 3.47Å; F516-G520 PolarHBondContact O-N 3.18Å; G520-Y522 VanDerWaalsContact C-N 3.34Å; G520-Y522 PolarHBondContact O-N 3.28Å; G520-V523 PolarHBondContact O-N 3.48Å; G520-L524 WeakPolarHBondContact O-CB 3.49Å; G520-L524 WeakPolarHBondContact O-CD1 3.42Å; G520-L524 WeakPolarHBondContact O-CG 3.16Å; G520-L524 PolarHBondContact O-N 3.47Å
521	G	86.3	Confident	87.5	Confident	4 Å²	4	57.9 Å²	57.9	4%	0.041	32%	0.324	C	S	.	.	I	π-helix	trans	-61.8	-39.2	-179.7	0	0	0	0	0	113	F516 F517 F525	F516-G521 PolarHBondContact O-N 2.96Å; F517-G521 WeakPolarHBondContact O-CA 3.36Å; F517-G521 PolarHBondContact O-N 3.42Å; G521-F525 WeakPolarHBondContact O-CB 3.38Å; G521-F525 PolarHBondContact O-N 3.26Å
522	Y	87.3	Confident	87.5	Confident	56 Å²	56	66.1 Å²	66.1	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-66	-46.3	177.6	-176.5	-101.7	0	0	0	112.7	T488 F491 F517 S518 G520 F525 F526	T488-Y522 HydrophobicContact CG2-CE2 4.32Å; T488-Y522 PolarHBondContact OG1-OH 3.26Å; F491-Y522 HydrophobicContact CB-CD2 4.23Å; F491-Y522 HydrophobicContact CD2-CD2 4.07Å; F491-Y522 HydrophobicContact CG-CD2 4.09Å; F517-Y522 PolarHBondContact O-N 3.37Å; S518-Y522 WeakPolarHBondContact O-CB 3.37Å; G520-Y522 VanDerWaalsContact C-N 3.34Å; G520-Y522 PolarHBondContact O-N 3.28Å; Y522-F525 WeakPolarHBondContact O-CB 3.47Å; Y522-F525 PolarHBondContact O-N 2.99Å; Y522-F526 HydrophobicContact CD1-CE2 4.21Å; Y522-F526 HydrophobicContact CD2-CE2 4.11Å; Y522-F526 AromaticContact CE1-CE2 3.76Å; Y522-F526 HydrophobicContact CE1-CE2 3.76Å; Y522-F526 AromaticContact CE2-CE2 3.65Å; Y522-F526 HydrophobicContact CE2-CE2 3.65Å; Y522-F526 HydrophobicContact CE2-CZ 4.07Å; Y522-F526 HydrophobicContact CG-CE2 4.37Å; Y522-F526 AromaticContact CZ-CE2 3.45Å; Y522-F526 VanDerWaalsContact CZ-CE2 3.45Å; Y522-F526 AromaticContact CZ-CZ 3.96Å; Y522-F526 WeakPolarHBondContact O-CD2 3.4Å
523	V	89.6	Confident	87.6	Confident	87 Å²	87	67.9 Å²	67.9	53%	0.527	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-46.9	176.2	170.8	0	0	0	0	110	V519 G520 F525 F526	V519-V523 WeakPolarHBondContact O-CB 3.29Å; V519-V523 VanDerWaalsContact O-CG2 3.24Å; V519-V523 WeakPolarHBondContact O-CG2 2.97Å; V519-V523 PolarHBondContact O-N 2.95Å; G520-V523 PolarHBondContact O-N 3.48Å; V523-F525 PolarHBondContact O-N 3.24Å; V523-F526 PolarHBondContact O-N 2.88Å
524	L	89	Confident	87.6	Confident	49 Å²	49	72.7 Å²	72.7	26%	0.257	39%	0.388	S	S	.	.	H	α-helix	trans	-66.3	-22.2	180	-68.2	169.5	0	0	0	113.3	F451 G520 F526 V527 L541	F451-L524 HydrophobicContact CB-CB 4.16Å; F451-L524 HydrophobicContact CD2-CB 3.56Å; F451-L524 HydrophobicContact CD2-CD1 4.03Å; F451-L524 HydrophobicContact CD2-CD2 4.45Å; F451-L524 HydrophobicContact CD2-CG 4.22Å; F451-L524 HydrophobicContact CE1-CD1 4.44Å; F451-L524 HydrophobicContact CE2-CB 4.08Å; F451-L524 HydrophobicContact CE2-CD1 3.64Å; F451-L524 HydrophobicContact CE2-CD2 4.38Å; F451-L524 HydrophobicContact CE2-CG 4.25Å; F451-L524 HydrophobicContact CG-CB 3.84Å; F451-L524 HydrophobicContact CZ-CD1 3.86Å; G520-L524 WeakPolarHBondContact O-CB 3.49Å; G520-L524 WeakPolarHBondContact O-CD1 3.42Å; G520-L524 WeakPolarHBondContact O-CG 3.16Å; G520-L524 PolarHBondContact O-N 3.47Å; L524-F526 VanDerWaalsContact C-N 3.3Å; L524-F526 PolarHBondContact O-N 3.11Å; L524-V527 PolarHBondContact O-N 3.42Å; L524-L541 HydrophobicContact CD1-CD1 4.19Å
525	F	86.1	Confident	87.7	Confident	49 Å²	49	71.3 Å²	71.3	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-63.5	-34.9	175.9	179.1	-96	0	0	0	112.7	S452 Y455 F491 G521 Y522 V523	S452-F525 WeakPolarHBondContact OG-CE2 3.06Å; S452-F525 WeakPolarHBondContact OG-CZ 3.47Å; Y455-F525 HydrophobicContact CD2-CD2 4.37Å; F491-F525 HydrophobicContact CE2-CB 4.17Å; F491-F525 HydrophobicContact CE2-CD1 4.1Å; F491-F525 AromaticContact CE2-CD2 3.65Å; F491-F525 HydrophobicContact CE2-CD2 3.65Å; F491-F525 HydrophobicContact CE2-CE1 4.4Å; F491-F525 AromaticContact CE2-CE2 3.97Å; F491-F525 HydrophobicContact CE2-CE2 3.97Å; F491-F525 AromaticContact CE2-CG 3.7Å; F491-F525 HydrophobicContact CE2-CG 3.7Å; F491-F525 HydrophobicContact CE2-CZ 4.34Å; F491-F525 HydrophobicContact CZ-CB 3.82Å; F491-F525 AromaticContact CZ-CD2 3.45Å; F491-F525 HydrophobicContact CZ-CD2 3.45Å; F491-F525 VanDerWaalsContact CZ-CD2 3.45Å; F491-F525 HydrophobicContact CZ-CE2 4.1Å; F491-F525 AromaticContact CZ-CG 3.68Å; F491-F525 HydrophobicContact CZ-CG 3.68Å; G521-F525 WeakPolarHBondContact O-CB 3.38Å; G521-F525 PolarHBondContact O-N 3.26Å; Y522-F525 WeakPolarHBondContact O-CB 3.47Å; Y522-F525 PolarHBondContact O-N 2.99Å; V523-F525 PolarHBondContact O-N 3.24Å
526	F	84.8	Confident	87.8	Confident	100 Å²	100	70.8 Å²	70.8	44%	0.439	38%	0.384	S	S	.	.	H	α-helix	trans	-85.4	-12.8	178.2	-63.3	-77.6	0	0	0	113.3	T484 Y522 V523 L524 Q528	T484-F526 HydrophobicContact CG2-CE1 4.45Å; Y522-F526 HydrophobicContact CD1-CE2 4.21Å; Y522-F526 HydrophobicContact CD2-CE2 4.11Å; Y522-F526 AromaticContact CE1-CE2 3.76Å; Y522-F526 HydrophobicContact CE1-CE2 3.76Å; Y522-F526 AromaticContact CE2-CE2 3.65Å; Y522-F526 HydrophobicContact CE2-CE2 3.65Å; Y522-F526 HydrophobicContact CE2-CZ 4.07Å; Y522-F526 HydrophobicContact CG-CE2 4.37Å; Y522-F526 AromaticContact CZ-CE2 3.45Å; Y522-F526 VanDerWaalsContact CZ-CE2 3.45Å; Y522-F526 AromaticContact CZ-CZ 3.96Å; Y522-F526 WeakPolarHBondContact O-CD2 3.4Å; V523-F526 PolarHBondContact O-N 2.88Å; L524-F526 VanDerWaalsContact C-N 3.3Å; L524-F526 PolarHBondContact O-N 3.11Å; F526-Q528 PolarHBondContact O-N 3.31Å
527	V	87.7	Confident	87.9	Confident	53 Å²	53	69 Å²	69	32%	0.321	38%	0.383	S	S	.	.			trans	-74.5	114.7	176.9	179.9	0	0	0	0	109.4	L524 W534	L524-V527 PolarHBondContact O-N 3.42Å; V527-W534 HydrophobicContact CG1-CH2 3.49Å; V527-W534 VanDerWaalsContact CG1-CH2 3.49Å; V527-W534 HydrophobicContact CG1-CZ2 4.46Å; V527-W534 HydrophobicContact CG1-CZ3 3.62Å
528	Q	83.4	Confident	88.2	Confident	184 Å²	184	67.5 Å²	67.5	86%	0.86	38%	0.377	S	S	*	.			trans	-95.5	106.1	175.8	-66.4	-171.4	-18.8	0	0	109.8	F526	F526-Q528 PolarHBondContact O-N 3.31Å
529	G	79.9	Confident	88.7	Confident	7 Å²	7	70.2 Å²	70.2	7%	0.072	39%	0.385	C	S	.	.			trans	-108.8	142.5	173.5	0	0	0	0	0	112	T449 T450 W534	T449-G529 PolarHBondContact OG1-O 2.77Å; T450-G529 VanDerWaalsContact CG2-O 3.25Å; T450-G529 WeakPolarHBondContact CG2-O 3.18Å; G529-W534 VanDerWaalsContact CA-CD2 3.42Å
530	S	81.6	Confident	89	Confident	103 Å²	103	70.7 Å²	70.7	72%	0.72	38%	0.384	S	S	*	.			trans	-131.1	141.1	173.9	66.5	0	0	0	0	111.1	W534	S530-W534 VanDerWaalsContact N-CD1 3.33Å
531	G	86.9	Confident	89.3	Confident	43 Å²	43	72.8 Å²	72.8	44%	0.443	39%	0.388	S	S	.	.	S	Bend	trans	102.5	175.2	179.4	0	0	0	0	0	114.9	G533 W534	G531-G533 PolarHBondContact O-N 2.9Å; G531-W534 PolarHBondContact O-N 3.12Å
532	R	90.6	Very high	89.7	Confident	228 Å²	228	73.1 Å²	73.1	86%	0.86	39%	0.388	S	S	*	.	H	α-helix	trans	-66.7	-35.3	-171.4	-63.4	179.8	-177.2	162.9	0.4	113.3	W534 N535 V536	R532-W534 VanDerWaalsContact C-N 3.28Å; R532-W534 PolarHBondContact O-N 3.27Å; R532-N535 WeakPolarHBondContact O-CB 2.95Å; R532-N535 PolarHBondContact O-N 3.46Å; R532-N535 VanDerWaalsContact O-N 3.15Å; R532-V536 PolarHBondContact O-N 3.32Å; R532-V536 VanDerWaalsContact O-N 3.08Å
533	G	93	Very high	90	Very high	57 Å²	57	72.6 Å²	72.6	59%	0.588	39%	0.387	S	S	*	.	H	α-helix	trans	-60.3	-36.6	179.4	0	0	0	0	0	113.1	G531 V536 A537	G531-G533 PolarHBondContact O-N 2.9Å; G533-V536 PolarHBondContact O-N 3.4Å; G533-A537 PolarHBondContact O-N 3.23Å
534	W	92.6	Very high	90.2	Very high	111 Å²	111	71.9 Å²	71.9	42%	0.42	38%	0.38	S	S	.	.	H	α-helix	trans	-69.5	-36.2	175.8	-75.9	98.9	0	0	0	113.1	T449 V527 G529 S530 G531 R532 A537 I538	T449-W534 WeakPolarHBondContact O-CB 3.47Å; V527-W534 HydrophobicContact CG1-CH2 3.49Å; V527-W534 VanDerWaalsContact CG1-CH2 3.49Å; V527-W534 HydrophobicContact CG1-CZ2 4.46Å; V527-W534 HydrophobicContact CG1-CZ3 3.62Å; G529-W534 VanDerWaalsContact CA-CD2 3.42Å; S530-W534 VanDerWaalsContact N-CD1 3.33Å; G531-W534 PolarHBondContact O-N 3.12Å; R532-W534 VanDerWaalsContact C-N 3.28Å; R532-W534 PolarHBondContact O-N 3.27Å; W534-A537 PolarHBondContact O-N 3.21Å; W534-I538 WeakPolarHBondContact O-CG1 3.41Å; W534-I538 PolarHBondContact O-N 2.02Å
535	N	93.4	Very high	90.4	Very high	34 Å²	34	70.4 Å²	70.4	18%	0.182	38%	0.376	C	S	.	.	H	α-helix	trans	-62.3	-45.2	172.5	-179.2	-92.6	0	0	0	111.1	W446 A448 T449 R532 A537 I538 W539	W446-N535 PolarHBondContact O-ND2 3.35Å; A448-N535 PolarHBondContact O-ND2 2.98Å; T449-N535 HydrophobicContact CG2-CB 4.49Å; R532-N535 WeakPolarHBondContact O-CB 2.95Å; R532-N535 PolarHBondContact O-N 3.46Å; R532-N535 VanDerWaalsContact O-N 3.15Å; N535-A537 VanDerWaalsContact C-N 3.33Å; N535-A537 PolarHBondContact O-N 2.72Å; N535-I538 PolarHBondContact O-N 3.25Å; N535-W539 VanDerWaalsContact O-CD1 3.24Å; N535-W539 PolarHBondContact O-N 3.44Å; N535-W539 PolarHBondContact OD1-NE1 2.88Å
536	V	94.4	Very high	90.7	Very high	83 Å²	83	71.8 Å²	71.8	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-60	-43.5	174.6	175.9	0	0	0	0	111.3	R532 G533 I538 W539 I540	R532-V536 PolarHBondContact O-N 3.32Å; R532-V536 VanDerWaalsContact O-N 3.08Å; G533-V536 PolarHBondContact O-N 3.4Å; V536-I538 VanDerWaalsContact C-N 3.34Å; V536-I538 PolarHBondContact O-N 3.33Å; V536-W539 PolarHBondContact O-N 2.87Å; V536-I540 HydrophobicContact CG1-CD1 3.93Å; V536-I540 HydrophobicContact CG1-CG1 4.47Å; V536-I540 WeakPolarHBondContact O-CG1 3.27Å; V536-I540 PolarHBondContact O-N 3.35Å
537	A	94.1	Very high	91.1	Very high	37 Å²	37	67 Å²	67	31%	0.306	36%	0.359	S	S	.	.	H	α-helix	trans	-60.3	-41.5	176.7	0	0	0	0	0	112.3	G533 W534 N535 I540 L541	G533-A537 PolarHBondContact O-N 3.23Å; W534-A537 PolarHBondContact O-N 3.21Å; N535-A537 VanDerWaalsContact C-N 3.33Å; N535-A537 PolarHBondContact O-N 2.72Å; A537-I540 PolarHBondContact O-N 3.47Å; A537-L541 WeakPolarHBondContact O-CB 3.38Å; A537-L541 VanDerWaalsContact O-CG 3.27Å; A537-L541 WeakPolarHBondContact O-CG 3.23Å; A537-L541 PolarHBondContact O-N 3.14Å
538	I	93	Very high	91.3	Very high	7 Å²	7	65.6 Å²	65.6	4%	0.036	35%	0.349	C	S	.	.	H	α-helix	trans	-60.5	-46.7	174.6	-73.7	169.5	0	0	0	110.8	A448 F451 W534 N535 V536 I540 L541 L542	A448-I538 WeakPolarHBondContact O-CD1 3.32Å; F451-I538 HydrophobicContact CD2-CG1 4.11Å; F451-I538 HydrophobicContact CE2-CG1 3.82Å; F451-I538 HydrophobicContact CZ-CG1 4.38Å; W534-I538 WeakPolarHBondContact O-CG1 3.41Å; W534-I538 PolarHBondContact O-N 2.02Å; N535-I538 PolarHBondContact O-N 3.25Å; V536-I538 VanDerWaalsContact C-N 3.34Å; V536-I538 PolarHBondContact O-N 3.33Å; I538-I540 PolarHBondContact O-N 2.86Å; I538-L541 PolarHBondContact O-N 3.41Å; I538-L542 HydrophobicContact CG2-CD1 3.79Å; I538-L542 HydrophobicContact CG2-CG 4.18Å; I538-L542 WeakPolarHBondContact O-CB 3.36Å; I538-L542 VanDerWaalsContact O-CG 3.28Å; I538-L542 WeakPolarHBondContact O-CG 3.26Å; I538-L542 PolarHBondContact O-N 2.88Å
539	W	94.6	Very high	91.7	Very high	69 Å²	69	58.1 Å²	58.1	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-44.7	177.5	-81.9	110.3	0	0	0	112.7	M415 L416 W445 W446 N535 V536 L542 F543	M415-W539 HydrophobicContact CE-CZ3 4.15Å; L416-W539 HydrophobicContact CD2-CH2 4.14Å; L416-W539 HydrophobicContact CD2-CZ3 4.1Å; W445-W539 AromaticContact CH2-CH2 3.53Å; W445-W539 HydrophobicContact CH2-CH2 3.53Å; W445-W539 HydrophobicContact CH2-CZ2 4.35Å; W445-W539 HydrophobicContact CH2-CZ3 4.03Å; W445-W539 AromaticContact CZ3-CH2 3.46Å; W445-W539 HydrophobicContact CZ3-CH2 3.46Å; W445-W539 VanDerWaalsContact CZ3-CH2 3.46Å; W445-W539 AromaticContact CZ3-CZ2 3.97Å; W445-W539 HydrophobicContact CZ3-CZ2 3.97Å; W445-W539 AromaticContact CZ3-CZ3 3.9Å; W445-W539 HydrophobicContact CZ3-CZ3 3.9Å; W446-W539 HydrophobicContact CB-CH2 4.34Å; W446-W539 HydrophobicContact CB-CZ2 3.6Å; W446-W539 PolarHBondContact O-NE1 3.43Å; N535-W539 VanDerWaalsContact O-CD1 3.24Å; N535-W539 PolarHBondContact O-N 3.44Å; N535-W539 PolarHBondContact OD1-NE1 2.88Å; V536-W539 PolarHBondContact O-N 2.87Å; W539-L542 PolarHBondContact O-N 2.75Å; W539-F543 HydrophobicContact CE3-CD2 4.2Å; W539-F543 AromaticContact CE3-CE2 3.71Å; W539-F543 HydrophobicContact CE3-CE2 3.71Å; W539-F543 AromaticContact CZ3-CE2 3.91Å; W539-F543 HydrophobicContact CZ3-CE2 3.91Å; W539-F543 WeakPolarHBondContact O-CD2 3.29Å; W539-F543 PolarHBondContact O-N 3.18Å
540	I	94.2	Very high	92.1	Very high	93 Å²	93	58.6 Å²	58.6	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-59.5	-48.5	175.8	-68.6	168.9	0	0	0	110.4	V536 A537 I538 L542 F543 I544	V536-I540 HydrophobicContact CG1-CD1 3.93Å; V536-I540 HydrophobicContact CG1-CG1 4.47Å; V536-I540 WeakPolarHBondContact O-CG1 3.27Å; V536-I540 PolarHBondContact O-N 3.35Å; A537-I540 PolarHBondContact O-N 3.47Å; I538-I540 PolarHBondContact O-N 2.86Å; I540-L542 PolarHBondContact O-N 3.13Å; I540-F543 PolarHBondContact O-N 2.83Å; I540-I544 HydrophobicContact CG2-CD1 3.61Å; I540-I544 HydrophobicContact CG2-CG1 4.37Å; I540-I544 WeakPolarHBondContact O-CB 3.4Å; I540-I544 VanDerWaalsContact O-CG1 3.29Å; I540-I544 WeakPolarHBondContact O-CG1 3.46Å; I540-I544 PolarHBondContact O-N 3.37Å
541	L	93.6	Very high	92.5	Very high	75 Å²	75	53.7 Å²	53.7	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-64.5	-38.2	-179.3	-72.1	169.6	0	0	0	112.6	F451 L524 A537 I538 G545	F451-L541 HydrophobicContact CE2-CD1 3.7Å; F451-L541 HydrophobicContact CZ-CB 3.98Å; F451-L541 HydrophobicContact CZ-CD1 3.91Å; L524-L541 HydrophobicContact CD1-CD1 4.19Å; A537-L541 WeakPolarHBondContact O-CB 3.38Å; A537-L541 VanDerWaalsContact O-CG 3.27Å; A537-L541 WeakPolarHBondContact O-CG 3.23Å; A537-L541 PolarHBondContact O-N 3.14Å; I538-L541 PolarHBondContact O-N 3.41Å; L541-G545 PolarHBondContact O-N 3.41Å
542	L	93.4	Very high	92.6	Very high	10 Å²	10	53 Å²	53	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-47.5	175.5	-72.7	174	0	0	0	111.2	M415 W445 W454 I538 W539 I540 G545 W546	M415-L542 HydrophobicContact CE-CB 4.38Å; M415-L542 HydrophobicContact SD-CB 4.16Å; W445-L542 HydrophobicContact CZ3-CD1 4.48Å; W454-L542 HydrophobicContact CD2-CD2 4.38Å; W454-L542 HydrophobicContact CH2-CD2 3.93Å; W454-L542 HydrophobicContact CZ2-CD2 3.43Å; W454-L542 VanDerWaalsContact CZ2-CD2 3.43Å; I538-L542 HydrophobicContact CG2-CD1 3.79Å; I538-L542 HydrophobicContact CG2-CG 4.18Å; I538-L542 WeakPolarHBondContact O-CB 3.36Å; I538-L542 VanDerWaalsContact O-CG 3.28Å; I538-L542 WeakPolarHBondContact O-CG 3.26Å; I538-L542 PolarHBondContact O-N 2.88Å; W539-L542 PolarHBondContact O-N 2.75Å; I540-L542 PolarHBondContact O-N 3.13Å; L542-G545 PolarHBondContact O-N 2.95Å; L542-W546 VanDerWaalsContact O-CD1 3.3Å; L542-W546 PolarHBondContact O-N 3.44Å
543	F	94.7	Very high	92.6	Very high	45 Å²	45	43 Å²	43	20%	0.197	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-46.6	178.8	-88.3	-122.8	0	0	0	111.4	T408 L409 M415 L416 W539 I540 G545 G547	T408-F543 HydrophobicContact CG2-CB 3.98Å; L409-F543 HydrophobicContact CD2-CD1 4.34Å; L409-F543 HydrophobicContact CD2-CE1 4.36Å; M415-F543 HydrophobicContact CE-CD2 4.5Å; M415-F543 HydrophobicContact CE-CE2 4.24Å; L416-F543 HydrophobicContact CD1-CZ 4.34Å; W539-F543 HydrophobicContact CE3-CD2 4.2Å; W539-F543 AromaticContact CE3-CE2 3.71Å; W539-F543 HydrophobicContact CE3-CE2 3.71Å; W539-F543 AromaticContact CZ3-CE2 3.91Å; W539-F543 HydrophobicContact CZ3-CE2 3.91Å; W539-F543 WeakPolarHBondContact O-CD2 3.29Å; W539-F543 PolarHBondContact O-N 3.18Å; I540-F543 PolarHBondContact O-N 2.83Å; F543-G545 PolarHBondContact O-N 3.33Å; F543-G547 PolarHBondContact O-N 3Å
544	I	93.6	Very high	92.3	Very high	73 Å²	73	41.2 Å²	41.2	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-46.4	177.2	-69.7	173.2	0	0	0	110.3	T408 I540 G547 Q548	T408-I544 HydrophobicContact CG2-CG1 4.16Å; I540-I544 HydrophobicContact CG2-CD1 3.61Å; I540-I544 HydrophobicContact CG2-CG1 4.37Å; I540-I544 WeakPolarHBondContact O-CB 3.4Å; I540-I544 VanDerWaalsContact O-CG1 3.29Å; I540-I544 WeakPolarHBondContact O-CG1 3.46Å; I540-I544 PolarHBondContact O-N 3.37Å; I544-G547 PolarHBondContact O-N 3.3Å; I544-Q548 HydrophobicContact CG2-CG 4.18Å; I544-Q548 VanDerWaalsContact O-CG 3.27Å; I544-Q548 WeakPolarHBondContact O-CG 3.29Å; I544-Q548 PolarHBondContact O-N 3.19Å; I544-Q548 PolarHBondContact O-NE2 3.41Å
545	G	93	Very high	92	Very high	17 Å²	17	36 Å²	36	18%	0.175	19%	0.188	C	C	.	.	H	α-helix	trans	-59.4	-48.7	-179.7	0	0	0	0	0	112.7	L541 L542 F543 Q548 M549	L541-G545 PolarHBondContact O-N 3.41Å; L542-G545 PolarHBondContact O-N 2.95Å; F543-G545 PolarHBondContact O-N 3.33Å; G545-Q548 PolarHBondContact O-N 2.82Å; G545-M549 WeakPolarHBondContact O-CG 2.87Å; G545-M549 PolarHBondContact O-N 3.46Å
546	W	93.2	Very high	91.7	Very high	79 Å²	79	34.4 Å²	34.4	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-65.6	-38.8	175.7	-81.4	84	0	0	0	113.1	M415 L542 M549 I550	M415-W546 HydrophobicContact CB-CD2 3.57Å; M415-W546 HydrophobicContact CB-CE3 3.98Å; M415-W546 HydrophobicContact CB-CG 3.8Å; M415-W546 HydrophobicContact CB-CZ2 4.15Å; M415-W546 HydrophobicContact CB-CZ3 4.43Å; M415-W546 HydrophobicContact CG-CD2 3.92Å; M415-W546 VanDerWaalsContact CG-CE2 3.45Å; M415-W546 HydrophobicContact CG-CG 4.15Å; M415-W546 HydrophobicContact CG-CZ2 3.82Å; M415-W546 HydrophobicContact SD-CG 4.17Å; M415-W546 PolarHBondContact SD-NE1 2.84Å; L542-W546 VanDerWaalsContact O-CD1 3.3Å; L542-W546 PolarHBondContact O-N 3.44Å; W546-M549 HydrophobicContact CB-CE 4.12Å; W546-M549 HydrophobicContact CD2-CE 3.52Å; W546-M549 HydrophobicContact CE3-CE 3.99Å; W546-M549 HydrophobicContact CG-CE 3.58Å; W546-M549 PolarHBondContact O-N 3.45Å; W546-I550 PolarHBondContact O-N 2.99Å; W546-I550 VanDerWaalsContact O-N 3.08Å
547	G	92.6	Very high	91.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-45.4	172.5	0	0	0	0	0	113.1	C407 F543 I544 C551	C407-G547 WeakPolarHBondContact O-CA 3.39Å; F543-G547 PolarHBondContact O-N 3Å; I544-G547 PolarHBondContact O-N 3.3Å; G547-C551 WeakPolarHBondContact O-CB 3.21Å; G547-C551 PolarHBondContact O-N 3.45Å
548	Q	91.8	Very high	90.8	Very high	23 Å²	23	33.3 Å²	33.3	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-43.8	177.2	-69.1	-29.3	-77	0	0	111.5	Y400 S404 F516 I544 G545 C551 L552	Y400-Q548 PolarHBondContact OH-OE1 2.68Å; S404-Q548 PolarHBondContact OG-NE2 2.82Å; S404-Q548 PolarHBondContact OG-OE1 2.67Å; F516-Q548 HydrophobicContact CE2-CB 3.66Å; F516-Q548 HydrophobicContact CE2-CG 4.39Å; F516-Q548 HydrophobicContact CZ-CB 3.65Å; F516-Q548 HydrophobicContact CZ-CG 4.05Å; I544-Q548 HydrophobicContact CG2-CG 4.18Å; I544-Q548 VanDerWaalsContact O-CG 3.27Å; I544-Q548 WeakPolarHBondContact O-CG 3.29Å; I544-Q548 PolarHBondContact O-N 3.19Å; I544-Q548 PolarHBondContact O-NE2 3.41Å; G545-Q548 PolarHBondContact O-N 2.82Å; Q548-C551 PolarHBondContact O-N 3.46Å; Q548-L552 HydrophobicContact CB-CD1 4.45Å; Q548-L552 WeakPolarHBondContact O-CB 3.3Å; Q548-L552 WeakPolarHBondContact O-CG 3.5Å; Q548-L552 PolarHBondContact O-N 2.95Å
549	M	90.6	Very high	90.4	Very high	26 Å²	26	33.1 Å²	33.1	13%	0.128	16%	0.158	C	C	.	.	H	α-helix	trans	-58.5	-52.7	178.2	-72.8	-173.5	-69	0	0	111	L513 F516 G545 W546 C551 L552 Y553	L513-M549 HydrophobicContact CD1-SD 3.52Å; L513-M549 VanDerWaalsContact CD1-SD 3.52Å; F516-M549 HydrophobicContact CD2-CG 4.09Å; F516-M549 HydrophobicContact CE2-CG 4.1Å; G545-M549 WeakPolarHBondContact O-CG 2.87Å; G545-M549 PolarHBondContact O-N 3.46Å; W546-M549 HydrophobicContact CB-CE 4.12Å; W546-M549 HydrophobicContact CD2-CE 3.52Å; W546-M549 HydrophobicContact CE3-CE 3.99Å; W546-M549 HydrophobicContact CG-CE 3.58Å; W546-M549 PolarHBondContact O-N 3.45Å; M549-C551 VanDerWaalsContact C-N 3.31Å; M549-C551 PolarHBondContact O-N 3.49Å; M549-L552 PolarHBondContact O-N 3.07Å; M549-Y553 HydrophobicContact CB-CD2 4.3Å; M549-Y553 HydrophobicContact CB-CE2 4.44Å; M549-Y553 WeakPolarHBondContact O-CB 3.39Å; M549-Y553 WeakPolarHBondContact O-CD2 3.17Å; M549-Y553 PolarHBondContact O-N 3.35Å
550	I	89.1	Confident	89.9	Confident	18 Å²	18	32.2 Å²	32.2	9%	0.092	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-43.4	179.8	-74.6	158.6	0	0	0	111.1	C382 L414 W546 S554	C382-I550 WeakPolarHBondContact SG-CG2 3.47Å; L414-I550 HydrophobicContact CB-CD1 4.38Å; L414-I550 HydrophobicContact CD1-CD1 3.61Å; W546-I550 PolarHBondContact O-N 2.99Å; W546-I550 VanDerWaalsContact O-N 3.08Å; I550-S554 WeakPolarHBondContact O-CB 3.08Å; I550-S554 PolarHBondContact O-N 2.93Å; I550-S554 PolarHBondContact O-OG 3.44Å
551	C	89.2	Confident	89.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.2	-55.4	178.8	-175.3	0	0	0	0	111.6	C407 G547 Q548 M549 S554 M555	C407-C551 HydrophobicContact CB-CB 4.07Å; G547-C551 WeakPolarHBondContact O-CB 3.21Å; G547-C551 PolarHBondContact O-N 3.45Å; Q548-C551 PolarHBondContact O-N 3.46Å; M549-C551 VanDerWaalsContact C-N 3.31Å; M549-C551 PolarHBondContact O-N 3.49Å; C551-S554 PolarHBondContact O-N 2.84Å; C551-M555 VanDerWaalsContact O-CB 3.31Å; C551-M555 WeakPolarHBondContact O-CB 3.41Å; C551-M555 WeakPolarHBondContact O-CG 3.18Å; C551-M555 PolarHBondContact O-N 3.29Å; C551-M555 WeakPolarHBondContact SG-CE 3.07Å
552	L	89.8	Confident	88.8	Confident	27 Å²	27	34.1 Å²	34.1	14%	0.141	16%	0.159	C	C	.	.	H	α-helix	trans	-67.6	-46.2	-173.2	-71.3	166.8	0	0	0	112.3	Y400 L510 V512 Q548 M549 M555 E556 I578	Y400-L552 HydrophobicContact CE2-CD2 3.57Å; Y400-L552 HydrophobicContact CE2-CG 4.21Å; L510-L552 HydrophobicContact CD2-CB 4.44Å; V512-L552 HydrophobicContact CB-CD1 4.5Å; V512-L552 HydrophobicContact CG1-CD1 3.75Å; V512-L552 HydrophobicContact CG2-CB 4.41Å; V512-L552 HydrophobicContact CG2-CD1 3.89Å; Q548-L552 HydrophobicContact CB-CD1 4.45Å; Q548-L552 WeakPolarHBondContact O-CB 3.3Å; Q548-L552 WeakPolarHBondContact O-CG 3.5Å; Q548-L552 PolarHBondContact O-N 2.95Å; M549-L552 PolarHBondContact O-N 3.07Å; L552-M555 PolarHBondContact O-N 3.09Å; L552-E556 WeakPolarHBondContact O-CB 3.43Å; L552-E556 PolarHBondContact O-N 3.34Å; L552-I578 HydrophobicContact CD2-CD1 4.34Å
553	Y	90.3	Very high	88.1	Confident	19 Å²	19	34.1 Å²	34.1	8%	0.075	16%	0.16	C	C	.	.	H	α-helix	trans	-67	-38.1	177.9	-72.6	-65.7	0	0	0	111.9	E499 L502 L506 Y508 L510 V512 L513 M549 W557	E499-Y553 PolarHBondContact OE2-OH 3.12Å; L502-Y553 HydrophobicContact CD1-CD2 4.35Å; L502-Y553 HydrophobicContact CD1-CE1 4.28Å; L502-Y553 HydrophobicContact CD1-CE2 3.56Å; L502-Y553 WeakPolarHBondContact CD1-OH 3.28Å; L506-Y553 HydrophobicContact CD1-CD1 3.5Å; L506-Y553 VanDerWaalsContact CD1-CD1 3.5Å; L506-Y553 HydrophobicContact CD1-CE1 4.13Å; L506-Y553 HydrophobicContact CD1-CG 3.95Å; Y508-Y553 AromaticContact CE2-CD1 3.97Å; Y508-Y553 HydrophobicContact CE2-CD1 3.97Å; Y508-Y553 HydrophobicContact CE2-CE1 4.44Å; Y508-Y553 PolarHBondContact OH-O 2.97Å; L510-Y553 HydrophobicContact CB-CD1 4.41Å; L510-Y553 HydrophobicContact CB-CE1 3.99Å; L510-Y553 HydrophobicContact CD2-CD1 4.09Å; L510-Y553 HydrophobicContact CD2-CE1 4.24Å; L510-Y553 HydrophobicContact CG-CE1 4.41Å; L510-Y553 WeakPolarHBondContact O-CE1 3.46Å; L510-Y553 PolarHBondContact O-OH 3.47Å; V512-Y553 HydrophobicContact CB-CE2 4.48Å; L513-Y553 WeakPolarHBondContact CB-OH 3.1Å; L513-Y553 PolarHBondContact N-OH 2.67Å; M549-Y553 HydrophobicContact CB-CD2 4.3Å; M549-Y553 HydrophobicContact CB-CE2 4.44Å; M549-Y553 WeakPolarHBondContact O-CB 3.39Å; M549-Y553 WeakPolarHBondContact O-CD2 3.17Å; M549-Y553 PolarHBondContact O-N 3.35Å; Y553-W557 VanDerWaalsContact O-CB 3.27Å; Y553-W557 WeakPolarHBondContact O-CB 3.38Å; Y553-W557 PolarHBondContact O-N 3.36Å
554	S	87.2	Confident	87.2	Confident	19 Å²	19	35 Å²	35	13%	0.133	17%	0.169	C	C	.	.	H	α-helix	trans	-66.8	-46.2	175.4	-57.7	0	0	0	0	111.3	I550 C551 E556 W557 Y558	I550-S554 WeakPolarHBondContact O-CB 3.08Å; I550-S554 PolarHBondContact O-N 2.93Å; I550-S554 PolarHBondContact O-OG 3.44Å; C551-S554 PolarHBondContact O-N 2.84Å; S554-E556 VanDerWaalsContact C-N 3.33Å; S554-E556 PolarHBondContact O-N 2.83Å; S554-W557 PolarHBondContact O-N 2.83Å; S554-Y558 WeakPolarHBondContact O-CD2 3.15Å; S554-Y558 PolarHBondContact O-N 3.29Å
555	M	85.4	Confident	86.3	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-44.8	177.9	-75.1	-176.7	171.7	0	0	111.8	F386 L389 Y400 T403 C551 L552 Y558 A559 I578	F386-M555 HydrophobicContact CD1-CE 4.48Å; F386-M555 HydrophobicContact CD1-CG 3.64Å; F386-M555 HydrophobicContact CE1-CE 3.68Å; F386-M555 HydrophobicContact CE1-CG 3.39Å; F386-M555 HydrophobicContact CE1-SD 4.32Å; F386-M555 HydrophobicContact CZ-CG 4.37Å; L389-M555 HydrophobicContact CD1-CE 4.42Å; L389-M555 HydrophobicContact CD2-CB 3.78Å; L389-M555 HydrophobicContact CD2-CG 3.72Å; L389-M555 HydrophobicContact CD2-SD 4.47Å; Y400-M555 HydrophobicContact CD2-CE 4.21Å; Y400-M555 HydrophobicContact CD2-SD 4.04Å; T403-M555 HydrophobicContact CG2-CE 3.57Å; C551-M555 VanDerWaalsContact O-CB 3.31Å; C551-M555 WeakPolarHBondContact O-CB 3.41Å; C551-M555 WeakPolarHBondContact O-CG 3.18Å; C551-M555 PolarHBondContact O-N 3.29Å; C551-M555 WeakPolarHBondContact SG-CE 3.07Å; L552-M555 PolarHBondContact O-N 3.09Å; M555-Y558 PolarHBondContact O-N 2.69Å; M555-A559 WeakPolarHBondContact O-CB 3.47Å; M555-A559 PolarHBondContact O-N 3.47Å; M555-I578 HydrophobicContact CB-CD1 3.5Å; M555-I578 HydrophobicContact CB-CG1 4.1Å; M555-I578 HydrophobicContact CG-CD1 4.18Å; M555-I578 HydrophobicContact SD-CD1 3.59Å; M555-I578 VanDerWaalsContact SD-CD1 3.59Å
556	E	87.5	Confident	85.2	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.5	-42.8	178.4	-177.2	64.6	-171.5	0	0	112.1	Y508 L510 L552 S554 Y558 A559 R560 P576 H577 I578	Y508-E556 HydrophobicContact CD2-CG 3.97Å; Y508-E556 HydrophobicContact CE1-CG 4.31Å; Y508-E556 HydrophobicContact CE2-CB 4.19Å; Y508-E556 HydrophobicContact CE2-CG 3.62Å; Y508-E556 HydrophobicContact CG-CG 4.49Å; L510-E556 HydrophobicContact CD2-CB 3.93Å; L510-E556 HydrophobicContact CD2-CG 4.14Å; L552-E556 WeakPolarHBondContact O-CB 3.43Å; L552-E556 PolarHBondContact O-N 3.34Å; S554-E556 VanDerWaalsContact C-N 3.33Å; S554-E556 PolarHBondContact O-N 2.83Å; E556-Y558 PolarHBondContact O-N 3.38Å; E556-A559 PolarHBondContact O-N 3.17Å; E556-R560 WeakPolarHBondContact O-CG 3.34Å; E556-R560 PolarHBondContact O-N 2.78Å; E556-R560 IonicContact OE1-CZ 2.73Å; E556-R560 IonicContact OE1-NE 3.82Å; E556-R560 PolarHBondContact OE1-NE 3.37Å; E556-R560 IonicContact OE1-NH2 3.49Å; E556-R560 PolarHBondContact OE1-NH2 2.91Å; E556-P576 WeakPolarHBondContact OE1-CA 3.42Å; E556-H577 VanDerWaalsContact CD-N 3.33Å; E556-H577 PolarHBondContact OE1-N 3.23Å; E556-H577 IonicContact OE1-ND1 3.25Å; E556-H577 PolarHBondContact OE2-N 3.13Å; E556-I578 WeakPolarHBondContact OE2-CB 3.45Å; E556-I578 WeakPolarHBondContact OE2-CG2 3.13Å; E556-I578 PolarHBondContact OE2-N 3.06Å
557	W	86.8	Confident	84.3	Confident	71 Å²	71	36.6 Å²	36.6	27%	0.269	19%	0.186	S	C	.	.	H	α-helix	trans	-57.5	-48.9	176.3	176.3	-88.4	0	0	0	111.8	F186 P260 L506 Y508 Y553 S554 R560 K561	F186-W557 HydrophobicContact CZ-CZ2 4.5Å; P260-W557 HydrophobicContact CG-CH2 3.39Å; P260-W557 HydrophobicContact CG-CZ2 4.06Å; P260-W557 HydrophobicContact CG-CZ3 3.85Å; L506-W557 HydrophobicContact CB-CE3 4.46Å; L506-W557 HydrophobicContact CD2-CE3 3.97Å; L506-W557 HydrophobicContact CD2-CZ3 4.34Å; L506-W557 WeakPolarHBondContact O-CZ3 3.38Å; Y508-W557 HydrophobicContact CE1-CB 4.24Å; Y508-W557 AromaticContact CE1-CE3 3.95Å; Y508-W557 HydrophobicContact CE1-CE3 3.95Å; Y553-W557 VanDerWaalsContact O-CB 3.27Å; Y553-W557 WeakPolarHBondContact O-CB 3.38Å; Y553-W557 PolarHBondContact O-N 3.36Å; S554-W557 PolarHBondContact O-N 2.83Å; W557-R560 PolarHBondContact O-N 2.8Å; W557-K561 PolarHBondContact O-N 3.37Å
558	Y	84.2	Confident	83.4	Confident	26 Å²	26	43.9 Å²	43.9	10%	0.102	22%	0.224	C	C	.	.	H	α-helix	trans	-72.7	-33.8	178.7	-75.8	-72.2	0	0	0	113.1	F383 F386 S554 M555 E556 R560 K561 N562	F383-Y558 WeakPolarHBondContact CD1-OH 3.4Å; F383-Y558 WeakPolarHBondContact CE1-OH 3.28Å; F386-Y558 HydrophobicContact CB-CD2 3.38Å; F386-Y558 HydrophobicContact CB-CE2 3.67Å; F386-Y558 HydrophobicContact CB-CG 4.2Å; F386-Y558 HydrophobicContact CG-CD2 4.49Å; S554-Y558 WeakPolarHBondContact O-CD2 3.15Å; S554-Y558 PolarHBondContact O-N 3.29Å; M555-Y558 PolarHBondContact O-N 2.69Å; E556-Y558 PolarHBondContact O-N 3.38Å; Y558-R560 VanDerWaalsContact C-N 3.34Å; Y558-K561 PolarHBondContact O-N 3.39Å; Y558-N562 WeakPolarHBondContact O-CB 3.16Å; Y558-N562 PolarHBondContact O-N 2.85Å; Y558-N562 PolarHBondContact O-ND2 2.9Å
559	A	83.3	Confident	82.7	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.033	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-43.8	173.9	0	0	0	0	0	111.1	M555 E556 K561 N562 C563 H577	M555-A559 WeakPolarHBondContact O-CB 3.47Å; M555-A559 PolarHBondContact O-N 3.47Å; E556-A559 PolarHBondContact O-N 3.17Å; A559-K561 VanDerWaalsContact C-N 3.3Å; A559-K561 PolarHBondContact O-N 2.83Å; A559-N562 PolarHBondContact O-N 2.98Å; A559-C563 WeakPolarHBondContact O-CB 3.47Å; A559-C563 PolarHBondContact O-N 3.49Å; A559-C563 PolarHBondContact O-SG 3.2Å; A559-H577 HydrophobicContact CB-CB 3.92Å
560	R	84.8	Confident	82.1	Confident	49 Å²	49	54.7 Å²	54.7	19%	0.185	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-31.8	175.5	-73	177.4	-176.4	-87.3	-4.3	113.5	Y508 E556 W557 Y558 N572 M575 H577	Y508-R560 VanDerWaalsContact CB-CZ 3.46Å; E556-R560 WeakPolarHBondContact O-CG 3.34Å; E556-R560 PolarHBondContact O-N 2.78Å; E556-R560 IonicContact OE1-CZ 2.73Å; E556-R560 IonicContact OE1-NE 3.82Å; E556-R560 PolarHBondContact OE1-NE 3.37Å; E556-R560 IonicContact OE1-NH2 3.49Å; E556-R560 PolarHBondContact OE1-NH2 2.91Å; W557-R560 PolarHBondContact O-N 2.8Å; Y558-R560 VanDerWaalsContact C-N 3.34Å; R560-N572 PolarHBondContact NH1-O 2.62Å; R560-M575 PolarHBondContact NH2-O 3.21Å; R560-H577 HydrophobicContact CG-CB 3.85Å; R560-H577 PolarHBondContact NH1-CE1 3.36Å; R560-H577 VanDerWaalsContact NH1-CE1 3.28Å; R560-H577 PolarHBondContact NH1-ND1 2.92Å
561	K	83.1	Confident	81.6	Confident	157 Å²	157	58.5 Å²	58.5	68%	0.683	30%	0.303	S	S	*	.	H	α-helix	trans	-75	-34.9	177.5	-168.7	173.5	-177.3	174.8	0	112.6	W557 Y558 A559	W557-K561 PolarHBondContact O-N 3.37Å; Y558-K561 PolarHBondContact O-N 3.39Å; A559-K561 VanDerWaalsContact C-N 3.3Å; A559-K561 PolarHBondContact O-N 2.83Å
562	N	81.4	Confident	81.1	Confident	51 Å²	51	60 Å²	60	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-96.9	-23.6	-172.8	-70.9	-35	0	0	0	113.8	S387 L389 Y558 A559	S387-N562 PolarHBondContact O-ND2 2.96Å; L389-N562 PolarHBondContact O-ND2 2.83Å; Y558-N562 WeakPolarHBondContact O-CB 3.16Å; Y558-N562 PolarHBondContact O-N 2.85Å; Y558-N562 PolarHBondContact O-ND2 2.9Å; A559-N562 PolarHBondContact O-N 2.98Å
563	C	78.5	Confident	80.6	Confident	11 Å²	11	62 Å²	62	7%	0.074	32%	0.318	C	S	.	.	S	Bend	trans	-104	145.4	-177.3	-53.1	0	0	0	0	111.1	A559 C581	A559-C563 WeakPolarHBondContact O-CB 3.47Å; A559-C563 PolarHBondContact O-N 3.49Å; A559-C563 PolarHBondContact O-SG 3.2Å; C563-C581 HydrophobicContact CB-CB 3.85Å; C563-C581 WeakPolarHBondContact CB-SG 3.27Å; C563-C581 WeakPolarHBondContact SG-CB 3.12Å; C563-C581 CovalentContact SG-SG 2.02Å; C563-C581 PolarHBondContact SG-SG 2.82Å
564	P	75.6	Confident	80.3	Confident	62 Å²	62	66.9 Å²	66.9	40%	0.403	34%	0.34	S	S	.	.			trans	-62.6	154.9	171.2	28.8	-34.7	0	0	0	110.6	V566 P582	P564-V566 PolarHBondContact O-N 3.4Å; P564-P582 HydrophobicContact CG-CG 4.13Å
565	P	73.9	Confident	80	Confident	80 Å²	80	68.8 Å²	68.8	52%	0.519	35%	0.348	S	S	.	.			trans	-57.3	133.3	176.1	25.4	-33.8	0	0	0	110.1	M567	P565-M567 VanDerWaalsContact C-N 3.32Å
566	V	71.7	Confident	79.8	Confident	52 Å²	52	70.5 Å²	70.5	32%	0.315	36%	0.359	S	S	.	.	S	Bend	trans	-72.3	-33.1	-177.4	-179.3	0	0	0	0	110.9	P564 N572 L580	P564-V566 PolarHBondContact O-N 3.4Å; V566-N572 PolarHBondContact N-OD1 2.83Å; V566-L580 HydrophobicContact CB-CB 4.5Å; V566-L580 HydrophobicContact CG1-CB 4Å; V566-L580 HydrophobicContact CG1-CD1 4.26Å; V566-L580 HydrophobicContact CG2-CB 3.75Å
567	M	73.7	Confident	79.4	Confident	72 Å²	72	70.6 Å²	70.6	36%	0.355	36%	0.359	S	S	.	.	S	Bend	trans	-137.6	152.3	-179.3	-71.3	-174.9	58.5	0	0	110.7	P565 L571 N572 M575	P565-M567 VanDerWaalsContact C-N 3.32Å; M567-L571 HydrophobicContact CE-CB 3.8Å; M567-L571 HydrophobicContact CE-CD1 3.53Å; M567-L571 HydrophobicContact CE-CG 4.32Å; M567-L571 HydrophobicContact SD-CB 4.36Å; M567-N572 WeakPolarHBondContact O-CB 3.3Å; M567-M575 HydrophobicContact SD-CE 4.15Å; M567-M575 HydrophobicContact SD-CG 4.03Å; M567-M575 HydrophobicContact SD-SD 4.45Å
568	D	73.9	Confident	79	Confident	152 Å²	152	68.1 Å²	68.1	81%	0.813	35%	0.351	S	S	*	.	S	Bend	trans	-78.3	145	171	-64.1	-42	0	0	0	111.5
569	G	77.8	Confident	78.7	Confident	59 Å²	59	72.6 Å²	72.6	61%	0.608	38%	0.375	S	S	*	.	S	Bend	trans	81.9	-162.7	173.6	0	0	0	0	0	115.6	L571 N572	G569-L571 PolarHBondContact O-N 3.23Å; G569-N572 WeakPolarHBondContact O-CB 3.18Å; G569-N572 PolarHBondContact O-N 3.48Å
570	Y	76.6	Confident	78.4	Confident	218 Å²	218	75.9 Å²	75.9	86%	0.855	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-65	-20.8	-171.4	-61.1	-73.1	0	0	0	114.2	N572 F573	Y570-N572 PolarHBondContact O-N 3.48Å; Y570-F573 WeakPolarHBondContact O-CB 3.36Å; Y570-F573 PolarHBondContact O-N 3.33Å
571	L	78.1	Confident	77.8	Confident	97 Å²	97	75.5 Å²	75.5	51%	0.508	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-66.1	-26.6	178.9	-68.6	174.7	0	0	0	112.2	M567 G569 F573 F574 M575	M567-L571 HydrophobicContact CE-CB 3.8Å; M567-L571 HydrophobicContact CE-CD1 3.53Å; M567-L571 HydrophobicContact CE-CG 4.32Å; M567-L571 HydrophobicContact SD-CB 4.36Å; G569-L571 PolarHBondContact O-N 3.23Å; L571-F573 PolarHBondContact O-N 2.94Å; L571-F573 VanDerWaalsContact O-N 3.1Å; L571-F574 PolarHBondContact O-N 3Å; L571-M575 WeakPolarHBondContact O-CG 3.09Å; L571-M575 PolarHBondContact O-N 3.37Å
572	N	78.7	Confident	76.7	Confident	32 Å²	32	70.8 Å²	70.8	17%	0.171	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-58.7	-25.5	175.6	-161.2	48	0	0	0	113	R560 V566 M567 G569 Y570 F574 M575 H577	R560-N572 PolarHBondContact NH1-O 2.62Å; V566-N572 PolarHBondContact N-OD1 2.83Å; M567-N572 WeakPolarHBondContact O-CB 3.3Å; G569-N572 WeakPolarHBondContact O-CB 3.18Å; G569-N572 PolarHBondContact O-N 3.48Å; Y570-N572 PolarHBondContact O-N 3.48Å; N572-F574 VanDerWaalsContact C-N 3.28Å; N572-F574 PolarHBondContact O-N 3.24Å; N572-M575 PolarHBondContact O-N 3.12Å; N572-H577 PolarHBondContact OD1-CE1 3.07Å; N572-H577 PolarHBondContact OD1-NE2 3.32Å
573	F	80.7	Confident	75.3	Confident	69 Å²	69	71.8 Å²	71.8	30%	0.303	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-64.8	-31.3	177.4	-173.4	-99.8	0	0	0	113.1	M503 R507 Y508 C509 Y570 L571	M503-F573 HydrophobicContact CG-CE1 3.8Å; M503-F573 HydrophobicContact CG-CZ 3.43Å; M503-F573 VanDerWaalsContact CG-CZ 3.43Å; M503-F573 HydrophobicContact SD-CE1 3.6Å; M503-F573 VanDerWaalsContact SD-CE1 3.6Å; M503-F573 HydrophobicContact SD-CZ 3.81Å; R507-F573 WeakPolarHBondContact O-CD2 3.39Å; R507-F573 WeakPolarHBondContact O-CE2 3.41Å; Y508-F573 VanDerWaalsContact CA-CE2 3.44Å; C509-F573 HydrophobicContact CB-CD1 3.75Å; C509-F573 HydrophobicContact CB-CE1 3.51Å; C509-F573 HydrophobicContact CB-CZ 4.37Å; C509-F573 PolarHBondContact N-O 2.94Å; Y570-F573 WeakPolarHBondContact O-CB 3.36Å; Y570-F573 PolarHBondContact O-N 3.33Å; L571-F573 PolarHBondContact O-N 2.94Å; L571-F573 VanDerWaalsContact O-N 3.1Å
574	F	83.1	Confident	73.8	Confident	122 Å²	122	75 Å²	75	54%	0.535	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-11.3	-178	-62.8	-81	0	0	0	113.3	C509 L571 N572	C509-F574 HydrophobicContact CB-CD1 3.73Å; C509-F574 HydrophobicContact CB-CE1 3.96Å; L571-F574 PolarHBondContact O-N 3Å; N572-F574 VanDerWaalsContact C-N 3.28Å; N572-F574 PolarHBondContact O-N 3.24Å
575	M	80.5	Confident	72	Confident	59 Å²	59	78.8 Å²	78.8	29%	0.291	43%	0.429	S	S	.	.	S	Bend	trans	-87.4	122.7	-175.6	-68.7	-61.5	155.4	0	0	111.9	R560 M567 L571 N572 H577 L580	R560-M575 PolarHBondContact NH2-O 3.21Å; M567-M575 HydrophobicContact SD-CE 4.15Å; M567-M575 HydrophobicContact SD-CG 4.03Å; M567-M575 HydrophobicContact SD-SD 4.45Å; L571-M575 WeakPolarHBondContact O-CG 3.09Å; L571-M575 PolarHBondContact O-N 3.37Å; N572-M575 PolarHBondContact O-N 3.12Å; M575-H577 PolarHBondContact O-N 2.74Å; M575-H577 PolarHBondContact O-ND1 3.38Å; M575-L580 HydrophobicContact CB-CD1 4.07Å; M575-L580 HydrophobicContact SD-CD1 4.23Å
576	P	81.7	Confident	70.5	Confident	37 Å²	37	85 Å²	85	24%	0.24	44%	0.444	C	S	.	.			trans	-74.2	110.3	-178	29.3	-34.1	0	0	0	111.6	L510 E556 I578 I579 L580	L510-P576 HydrophobicContact CD1-CB 4.38Å; E556-P576 WeakPolarHBondContact OE1-CA 3.42Å; P576-I578 VanDerWaalsContact C-N 3.27Å; P576-I578 HydrophobicContact CB-CG2 4.24Å; P576-I578 PolarHBondContact O-N 3.39Å; P576-I579 HydrophobicContact CG-CD1 4.29Å; P576-I579 PolarHBondContact O-N 2.97Å; P576-L580 HydrophobicContact CG-CD1 4.43Å; P576-L580 WeakPolarHBondContact O-CB 3.33Å; P576-L580 PolarHBondContact O-N 3.07Å
577	H	80.3	Confident	68.6	Low	3 Å²	3	88.4 Å²	88.4	1%	0.014	47%	0.465	C	S	.	.	H	α-helix	trans	-70.6	-25.1	-178.9	-72.4	51.9	0	0	0	112.3	E556 A559 R560 N572 M575 I579 L580 C581	E556-H577 VanDerWaalsContact CD-N 3.33Å; E556-H577 PolarHBondContact OE1-N 3.23Å; E556-H577 IonicContact OE1-ND1 3.25Å; E556-H577 PolarHBondContact OE2-N 3.13Å; A559-H577 HydrophobicContact CB-CB 3.92Å; R560-H577 HydrophobicContact CG-CB 3.85Å; R560-H577 PolarHBondContact NH1-CE1 3.36Å; R560-H577 VanDerWaalsContact NH1-CE1 3.28Å; R560-H577 PolarHBondContact NH1-ND1 2.92Å; N572-H577 PolarHBondContact OD1-CE1 3.07Å; N572-H577 PolarHBondContact OD1-NE2 3.32Å; M575-H577 PolarHBondContact O-N 2.74Å; M575-H577 PolarHBondContact O-ND1 3.38Å; H577-I579 PolarHBondContact O-N 3.34Å; H577-L580 PolarHBondContact O-N 2.72Å; H577-C581 VanDerWaalsContact O-CB 3.23Å; H577-C581 WeakPolarHBondContact O-CB 3.49Å; H577-C581 PolarHBondContact O-N 3.21Å
578	I	77.8	Confident	66.7	Low	19 Å²	19	87.8 Å²	87.8	10%	0.097	48%	0.477	C	S	.	.	H	α-helix	trans	-56.2	-34	175.4	-168.8	-177.9	0	0	0	112.9	F395 L552 M555 E556 P576	F395-I578 HydrophobicContact CD2-CG1 4.07Å; F395-I578 HydrophobicContact CE2-CD1 4.04Å; F395-I578 HydrophobicContact CE2-CG1 4.02Å; L552-I578 HydrophobicContact CD2-CD1 4.34Å; M555-I578 HydrophobicContact CB-CD1 3.5Å; M555-I578 HydrophobicContact CB-CG1 4.1Å; M555-I578 HydrophobicContact CG-CD1 4.18Å; M555-I578 HydrophobicContact SD-CD1 3.59Å; M555-I578 VanDerWaalsContact SD-CD1 3.59Å; E556-I578 WeakPolarHBondContact OE2-CB 3.45Å; E556-I578 WeakPolarHBondContact OE2-CG2 3.13Å; E556-I578 PolarHBondContact OE2-N 3.06Å; P576-I578 VanDerWaalsContact C-N 3.27Å; P576-I578 HydrophobicContact CB-CG2 4.24Å; P576-I578 PolarHBondContact O-N 3.39Å
579	I	77.7	Confident	64.7	Low	119 Å²	119	89.5 Å²	89.5	61%	0.61	48%	0.479	S	S	*	.	H	α-helix	trans	-94.3	-40.3	178.3	-64	162.1	0	0	0	110.9	P576 H577	P576-I579 HydrophobicContact CG-CD1 4.29Å; P576-I579 PolarHBondContact O-N 2.97Å; H577-I579 PolarHBondContact O-N 3.34Å
580	L	77.2	Confident	62.5	Low	73 Å²	73	96.9 Å²	96.9	38%	0.382	51%	0.512	S	S	.	.	H	α-helix	trans	-94.8	-2.4	-166.7	-65.3	169.1	0	0	0	114.5	V566 M575 P576 H577 P582	V566-L580 HydrophobicContact CB-CB 4.5Å; V566-L580 HydrophobicContact CG1-CB 4Å; V566-L580 HydrophobicContact CG1-CD1 4.26Å; V566-L580 HydrophobicContact CG2-CB 3.75Å; M575-L580 HydrophobicContact CB-CD1 4.07Å; M575-L580 HydrophobicContact SD-CD1 4.23Å; P576-L580 HydrophobicContact CG-CD1 4.43Å; P576-L580 WeakPolarHBondContact O-CB 3.33Å; P576-L580 PolarHBondContact O-N 3.07Å; H577-L580 PolarHBondContact O-N 2.72Å; L580-P582 WeakPolarHBondContact O-CD 2.87Å; L580-P582 VanDerWaalsContact O-N 3.08Å
581	C	71.5	Confident	61.8	Low	41 Å²	41	90.8 Å²	90.8	28%	0.277	50%	0.495	S	S	.	.			trans	-54	118.2	178.5	178.8	0	0	0	0	110.4	C563 H577 S583	C563-C581 HydrophobicContact CB-CB 3.85Å; C563-C581 WeakPolarHBondContact CB-SG 3.27Å; C563-C581 WeakPolarHBondContact SG-CB 3.12Å; C563-C581 CovalentContact SG-SG 2.02Å; C563-C581 PolarHBondContact SG-SG 2.82Å; H577-C581 VanDerWaalsContact O-CB 3.23Å; H577-C581 WeakPolarHBondContact O-CB 3.49Å; H577-C581 PolarHBondContact O-N 3.21Å; C581-S583 PolarHBondContact O-N 3.08Å
582	P	59.6	Low	60.9	Low	58 Å²	58	90.5 Å²	90.5	38%	0.377	49%	0.494	S	S	.	.			trans	-61.8	134.1	180	-4.2	10.9	0	0	0	109.1	P564 L580 T584	P564-P582 HydrophobicContact CG-CG 4.13Å; L580-P582 WeakPolarHBondContact O-CD 2.87Å; L580-P582 VanDerWaalsContact O-N 3.08Å; P582-T584 PolarHBondContact O-N 3.14Å
583	S	52.8	Low	59.9	Low	72 Å²	72	93.7 Å²	93.7	50%	0.503	51%	0.512	S	S	.	.			trans	-70	84.4	166.4	55.7	0	0	0	0	108.3	K394 C581 N585	K394-S583 VanDerWaalsContact CE-CB 3.47Å; K394-S583 WeakPolarHBondContact CE-OG 3.28Å; C581-S583 PolarHBondContact O-N 3.08Å; S583-N585 PolarHBondContact O-N 3.07Å; S583-N585 VanDerWaalsContact O-N 3.13Å
584	T	46.8	Very low	58.7	Low	78 Å²	78	95.2 Å²	95.2	48%	0.479	53%	0.525	S	S	.	.			trans	-70.3	109	167.9	46.1	0	0	0	0	107.2	P582 Y586	P582-T584 PolarHBondContact O-N 3.14Å; T584-Y586 PolarHBondContact O-N 2.92Å; T584-Y586 WeakPolarHBondContact OG1-CD2 3.34Å; T584-Y586 WeakPolarHBondContact OG1-CE2 2.97Å
585	N	38.2	Very low	57.2	Low	143 Å²	143	93.5 Å²	93.5	77%	0.765	52%	0.524	S	S	*	.			trans	-60.2	92.9	153	-86.8	-12.1	0	0	0	105.8	S583 T587	S583-N585 PolarHBondContact O-N 3.07Å; S583-N585 VanDerWaalsContact O-N 3.13Å; N585-T587 PolarHBondContact O-N 3.5Å
586	Y	42.1	Very low	55.7	Low	211 Å²	211	95.8 Å²	95.8	83%	0.827	54%	0.54	S	S	*	.			trans	-69	76.2	159.9	-88	-82.6	0	0	0	107.6	T584	T584-Y586 PolarHBondContact O-N 2.92Å; T584-Y586 WeakPolarHBondContact OG1-CD2 3.34Å; T584-Y586 WeakPolarHBondContact OG1-CE2 2.97Å
587	T	32	Very low	53.8	Low	122 Å²	122	100 Å²	100	75%	0.748	56%	0.561	S	S	*	*			trans	-115.7	89.6	160.1	49	0	0	0	0	105.2	N585	N585-T587 PolarHBondContact O-N 3.5Å
588	G	33.6	Very low	51.8	Low	59 Å²	59	107.5 Å²	107.5	61%	0.608	60%	0.603	S	S	*	*	S	Bend	trans	167.3	92.6	179.2	0	0	0	0	0	115.4
589	H	31.4	Very low	49.6	Very low	188 Å²	188	114.8 Å²	114.8	87%	0.87	65%	0.645	S	S	*	*			trans	73	104.6	153	-66.6	-77.8	0	0	0	121.1
590	V	32.2	Very low	47	Very low	214 Å²	214	114.5 Å²	114.5	100%	1.297	65%	0.649	S	S	*	*			trans	71.1	0	146.4	-168.2	0	0	0	0	118.2

Retrieved 590 of 590 residues in 333.1 ms (Link to these results)

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