A0A077ZLE6_TRITR Loading...

DUF1758 and DUF1759 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLE6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 559 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	38.7	Very low	36.4	Very low	211 Å²	211	124.6 Å²	124.6	100%	1.039	66%	0.656	S	S	*	*				0	-29.3	0	-68.5	-146.7	-149.6	0	0	113	N3 Q4	M1-N3 PolarHBondContact O-N 3.32Å; M1-Q4 PolarHBondContact O-N 3.26Å
2	L	33.7	Very low	36.6	Very low	142 Å²	142	120.6 Å²	120.6	74%	0.743	64%	0.64	S	S	*	*	H	α-helix	trans	-53.9	-43.7	177.8	-80	145.4	0	0	0	114.3	Q4 R5	L2-Q4 VanDerWaalsContact C-N 3.28Å; L2-Q4 PolarHBondContact O-N 3.35Å; L2-Q4 VanDerWaalsContact O-N 3.16Å; L2-R5 PolarHBondContact O-N 3.42Å; L2-R5 VanDerWaalsContact O-N 3.1Å
3	N	38.7	Very low	37.2	Very low	128 Å²	128	122 Å²	122	68%	0.684	64%	0.641	S	S	*	*	H	α-helix	trans	-62.7	-24.1	-179.6	-78.5	18.1	0	0	0	115.9	M1	M1-N3 PolarHBondContact O-N 3.32Å
4	Q	33.9	Very low	37.7	Very low	152 Å²	152	125.8 Å²	125.8	71%	0.71	64%	0.642	S	S	*	*	H	α-helix	trans	-79	-25.1	177.9	-81.7	-176	-15.7	0	0	112.4	M1 L2 L8	M1-Q4 PolarHBondContact O-N 3.26Å; L2-Q4 VanDerWaalsContact C-N 3.28Å; L2-Q4 PolarHBondContact O-N 3.35Å; L2-Q4 VanDerWaalsContact O-N 3.16Å; Q4-L8 PolarHBondContact O-N 2.91Å
5	R	30.7	Very low	37.9	Very low	194 Å²	194	124.1 Å²	124.1	73%	0.732	64%	0.635	S	S	*	*	H	α-helix	trans	-71.4	-40.8	177.9	-124.5	177.9	-176.5	174.1	1	111.2	L2 L8 N9	L2-R5 PolarHBondContact O-N 3.42Å; L2-R5 VanDerWaalsContact O-N 3.1Å; R5-L8 PolarHBondContact O-N 3.44Å; R5-N9 PolarHBondContact O-N 3.24Å; R5-N9 VanDerWaalsContact O-N 3.13Å
6	E	37.9	Very low	38.2	Very low	138 Å²	138	120.8 Å²	120.8	65%	0.645	62%	0.618	S	S	*	*	H	α-helix	trans	-66.1	-40.2	178.2	-71.1	179.6	168.6	0	0	112.5	L8 N9 G10	E6-L8 VanDerWaalsContact C-N 3.32Å; E6-L8 PolarHBondContact O-N 3.16Å; E6-N9 PolarHBondContact O-N 3.33Å; E6-G10 PolarHBondContact O-N 2.83Å
7	C	37.5	Very low	38.8	Very low	103 Å²	103	117.4 Å²	117.4	70%	0.696	61%	0.608	S	S	*	*	H	α-helix	trans	-64.8	-33.4	177.4	-72	0	0	0	0	113.4	G11	C7-G11 PolarHBondContact O-N 3.42Å
8	L	35.3	Very low	39.1	Very low	123 Å²	123	115.6 Å²	115.6	64%	0.644	60%	0.596	S	S	*	*	H	α-helix	trans	-75.1	-44.6	178.1	-80.9	163.2	0	0	0	111.7	Q4 R5 E6 G10 G11 V12	Q4-L8 PolarHBondContact O-N 2.91Å; R5-L8 PolarHBondContact O-N 3.44Å; E6-L8 VanDerWaalsContact C-N 3.32Å; E6-L8 PolarHBondContact O-N 3.16Å; L8-G10 VanDerWaalsContact C-N 3.35Å; L8-G10 PolarHBondContact O-N 3.14Å; L8-G11 PolarHBondContact O-N 3.13Å; L8-V12 PolarHBondContact O-N 3.42Å; L8-V12 VanDerWaalsContact O-N 3.16Å
9	N	38.2	Very low	39.2	Very low	107 Å²	107	115.1 Å²	115.1	57%	0.572	59%	0.594	S	S	*	*	H	α-helix	trans	-61.4	-43.6	176.4	-81.7	3.4	0	0	0	111.5	R5 E6 G11 V12 E13	R5-N9 PolarHBondContact O-N 3.24Å; R5-N9 VanDerWaalsContact O-N 3.13Å; E6-N9 PolarHBondContact O-N 3.33Å; N9-G11 VanDerWaalsContact C-N 3.26Å; N9-G11 PolarHBondContact O-N 3.36Å; N9-V12 PolarHBondContact O-N 2.86Å; N9-E13 PolarHBondContact O-N 2.92Å
10	G	37.9	Very low	39.5	Very low	39 Å²	39	117.1 Å²	117.1	40%	0.402	60%	0.598	S	S	.	*	H	α-helix	trans	-63.2	-30.3	177	0	0	0	0	0	113.8	E6 L8 R14	E6-G10 PolarHBondContact O-N 2.83Å; L8-G10 VanDerWaalsContact C-N 3.35Å; L8-G10 PolarHBondContact O-N 3.14Å; G10-R14 VanDerWaalsContact O-CB 3.26Å; G10-R14 WeakPolarHBondContact O-CB 3.45Å; G10-R14 PolarHBondContact O-N 3.47Å
11	G	38.5	Very low	39.8	Very low	34 Å²	34	117.8 Å²	117.8	35%	0.351	60%	0.599	S	S	.	*	H	α-helix	trans	-71.9	-40.7	175.9	0	0	0	0	0	113.3	C7 L8 N9 L15	C7-G11 PolarHBondContact O-N 3.42Å; L8-G11 PolarHBondContact O-N 3.13Å; N9-G11 VanDerWaalsContact C-N 3.26Å; N9-G11 PolarHBondContact O-N 3.36Å; G11-L15 PolarHBondContact O-N 3.25Å; G11-L15 VanDerWaalsContact O-N 3.11Å
12	V	38.8	Very low	40.1	Very low	76 Å²	76	114.7 Å²	114.7	46%	0.461	58%	0.581	S	S	.	*	H	α-helix	trans	-73	-42.6	179.3	177.9	0	0	0	0	111.2	L8 N9 R14 L15 L16	L8-V12 PolarHBondContact O-N 3.42Å; L8-V12 VanDerWaalsContact O-N 3.16Å; N9-V12 PolarHBondContact O-N 2.86Å; V12-R14 VanDerWaalsContact C-N 3.3Å; V12-R14 PolarHBondContact O-N 3.21Å; V12-L15 PolarHBondContact O-N 3.38Å; V12-L16 HydrophobicContact CG1-CD1 4Å; V12-L16 HydrophobicContact CG1-CG 4.43Å; V12-L16 WeakPolarHBondContact O-CB 3.42Å; V12-L16 WeakPolarHBondContact O-CG 3.35Å; V12-L16 PolarHBondContact O-N 3.07Å
13	E	44	Very low	40.3	Very low	139 Å²	139	110.6 Å²	110.6	65%	0.65	57%	0.568	S	S	*	*	H	α-helix	trans	-61.2	-40	174.8	-77.5	-177.3	165.5	0	0	111.6	N9 L16 S17	N9-E13 PolarHBondContact O-N 2.92Å; E13-L16 PolarHBondContact O-N 3.28Å; E13-S17 VanDerWaalsContact O-CB 3.29Å; E13-S17 WeakPolarHBondContact O-CB 3.19Å; E13-S17 PolarHBondContact O-N 2.86Å
14	R	43.5	Very low	40.6	Very low	175 Å²	175	108.4 Å²	108.4	66%	0.66	56%	0.562	S	S	*	*	H	α-helix	trans	-62.2	-45.9	175	-168.5	-178.5	-168	133.6	6.5	112.1	G10 V12 S17 E18	G10-R14 VanDerWaalsContact O-CB 3.26Å; G10-R14 WeakPolarHBondContact O-CB 3.45Å; G10-R14 PolarHBondContact O-N 3.47Å; V12-R14 VanDerWaalsContact C-N 3.3Å; V12-R14 PolarHBondContact O-N 3.21Å; R14-S17 PolarHBondContact O-N 2.85Å; R14-E18 IonicContact NE-OE1 3.83Å; R14-E18 PolarHBondContact NE-OE1 3.42Å; R14-E18 WeakPolarHBondContact O-CB 3.43Å; R14-E18 WeakPolarHBondContact O-CG 3.3Å; R14-E18 PolarHBondContact O-N 3.48Å
15	L	41.5	Very low	41.1	Very low	101 Å²	101	103.8 Å²	103.8	53%	0.529	55%	0.55	S	S	.	*	H	α-helix	trans	-63.8	-40.6	177.1	-81.1	166.2	0	0	0	112.4	G11 V12 L19	G11-L15 PolarHBondContact O-N 3.25Å; G11-L15 VanDerWaalsContact O-N 3.11Å; V12-L15 PolarHBondContact O-N 3.38Å; L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 WeakPolarHBondContact O-CG 3.37Å; L15-L19 PolarHBondContact O-N 2.81Å
16	L	43.1	Very low	41.6	Very low	70 Å²	70	96.3 Å²	96.3	37%	0.366	53%	0.533	S	S	.	.	H	α-helix	trans	-67.4	-37.7	175.8	-75.5	171.1	0	0	0	111.9	V12 E13 L19 K20 L200	V12-L16 HydrophobicContact CG1-CD1 4Å; V12-L16 HydrophobicContact CG1-CG 4.43Å; V12-L16 WeakPolarHBondContact O-CB 3.42Å; V12-L16 WeakPolarHBondContact O-CG 3.35Å; V12-L16 PolarHBondContact O-N 3.07Å; E13-L16 PolarHBondContact O-N 3.28Å; L16-L19 PolarHBondContact O-N 3.36Å; L16-K20 WeakPolarHBondContact O-CB 3.46Å; L16-K20 WeakPolarHBondContact O-CG 3.22Å; L16-K20 PolarHBondContact O-N 3.37Å; L16-L200 HydrophobicContact CD2-CD1 4.36Å
17	S	47.9	Very low	41.9	Very low	64 Å²	64	96.1 Å²	96.1	45%	0.448	53%	0.532	S	S	.	.	H	α-helix	trans	-69.1	-43.6	176.8	-152.3	0	0	0	0	111.2	E13 R14 L19 K20 E21	E13-S17 VanDerWaalsContact O-CB 3.29Å; E13-S17 WeakPolarHBondContact O-CB 3.19Å; E13-S17 PolarHBondContact O-N 2.86Å; R14-S17 PolarHBondContact O-N 2.85Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 3.49Å; S17-K20 PolarHBondContact O-N 3.17Å; S17-E21 WeakPolarHBondContact O-CB 3.46Å; S17-E21 WeakPolarHBondContact O-CG 3.39Å; S17-E21 PolarHBondContact O-N 2.99Å
18	E	43.7	Very low	42	Very low	84 Å²	84	96.9 Å²	96.9	39%	0.393	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-41.1	173.8	-74.7	173.6	-172	0	0	111.1	R14 E21 H22	R14-E18 IonicContact NE-OE1 3.83Å; R14-E18 PolarHBondContact NE-OE1 3.42Å; R14-E18 WeakPolarHBondContact O-CB 3.43Å; R14-E18 WeakPolarHBondContact O-CG 3.3Å; R14-E18 PolarHBondContact O-N 3.48Å; E18-E21 PolarHBondContact O-N 3.19Å; E18-H22 WeakPolarHBondContact O-CB 3.37Å; E18-H22 PolarHBondContact O-CD2 2.68Å; E18-H22 PolarHBondContact O-N 2.7Å
19	L	41.3	Very low	42.1	Very low	107 Å²	107	93.6 Å²	93.6	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-65.2	-40.7	174.8	-82.9	164	0	0	0	112.8	L15 L16 S17 A23	L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 WeakPolarHBondContact O-CG 3.37Å; L15-L19 PolarHBondContact O-N 2.81Å; L16-L19 PolarHBondContact O-N 3.36Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 3.49Å; L19-A23 WeakPolarHBondContact O-CB 3.39Å; L19-A23 PolarHBondContact O-N 3.48Å
20	K	44.8	Very low	42	Very low	154 Å²	154	94 Å²	94	67%	0.67	52%	0.517	S	S	*	.	H	α-helix	trans	-67.3	-42.1	175.2	-82.2	-178.4	176.9	179.5	0	111.9	L16 S17 H22 A23 C24	L16-K20 WeakPolarHBondContact O-CB 3.46Å; L16-K20 WeakPolarHBondContact O-CG 3.22Å; L16-K20 PolarHBondContact O-N 3.37Å; S17-K20 PolarHBondContact O-N 3.17Å; K20-H22 VanDerWaalsContact C-N 3.35Å; K20-A23 PolarHBondContact O-N 3.08Å; K20-C24 PolarHBondContact O-N 3.1Å
21	E	46.7	Very low	41.9	Very low	133 Å²	133	100.7 Å²	100.7	62%	0.621	53%	0.531	S	S	*	.	H	α-helix	trans	-62.2	-42.5	175.4	-79.9	-176.8	170.6	0	0	111.3	S17 E18 A23 C24 A25	S17-E21 WeakPolarHBondContact O-CB 3.46Å; S17-E21 WeakPolarHBondContact O-CG 3.39Å; S17-E21 PolarHBondContact O-N 2.99Å; E18-E21 PolarHBondContact O-N 3.19Å; E21-A23 PolarHBondContact O-N 3.48Å; E21-C24 PolarHBondContact O-N 2.92Å; E21-A25 WeakPolarHBondContact O-CB 3.03Å; E21-A25 PolarHBondContact O-N 3.42Å
22	H	43.8	Very low	41.6	Very low	145 Å²	145	106.7 Å²	106.7	67%	0.671	54%	0.543	S	S	*	.	H	α-helix	trans	-66.9	-33.8	174.9	-82.5	-65.6	0	0	0	113.1	E18 K20 G26	E18-H22 WeakPolarHBondContact O-CB 3.37Å; E18-H22 PolarHBondContact O-CD2 2.68Å; E18-H22 PolarHBondContact O-N 2.7Å; K20-H22 VanDerWaalsContact C-N 3.35Å; H22-G26 PolarHBondContact O-N 3.39Å
23	A	39.1	Very low	41.5	Very low	57 Å²	57	110.9 Å²	110.9	47%	0.471	56%	0.555	S	S	.	*	H	α-helix	trans	-66.6	-43.8	172.5	0	0	0	0	0	111.9	L19 K20 E21 G26 Q27	L19-A23 WeakPolarHBondContact O-CB 3.39Å; L19-A23 PolarHBondContact O-N 3.48Å; K20-A23 PolarHBondContact O-N 3.08Å; E21-A23 PolarHBondContact O-N 3.48Å; A23-G26 PolarHBondContact O-N 3.42Å; A23-Q27 PolarHBondContact O-N 3.3Å
24	C	44.4	Very low	41.4	Very low	81 Å²	81	110.4 Å²	110.4	55%	0.547	56%	0.556	S	S	.	*	H	α-helix	trans	-67.6	-39.9	176.5	-89.2	0	0	0	0	112.9	K20 E21 G26 Q27 H28	K20-C24 PolarHBondContact O-N 3.1Å; E21-C24 PolarHBondContact O-N 2.92Å; C24-G26 PolarHBondContact O-N 3.38Å; C24-Q27 PolarHBondContact O-N 3.39Å; C24-H28 PolarHBondContact O-N 2.96Å
25	A	43.6	Very low	41.2	Very low	56 Å²	56	109.4 Å²	109.4	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-60.6	-35.2	175.7	0	0	0	0	0	111.7	E21 H28 A29	E21-A25 WeakPolarHBondContact O-CB 3.03Å; E21-A25 PolarHBondContact O-N 3.42Å; A25-H28 PolarHBondContact O-N 3.49Å; A25-A29 PolarHBondContact O-N 2.79Å
26	G	42.4	Very low	41	Very low	36 Å²	36	111.4 Å²	111.4	37%	0.371	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-36.7	173	0	0	0	0	0	113.6	H22 A23 C24 L30	H22-G26 PolarHBondContact O-N 3.39Å; A23-G26 PolarHBondContact O-N 3.42Å; C24-G26 PolarHBondContact O-N 3.38Å; G26-L30 PolarHBondContact O-N 3.13Å
27	Q	43.1	Very low	40.5	Very low	135 Å²	135	118.2 Å²	118.2	63%	0.631	58%	0.584	S	S	*	*	H	α-helix	trans	-73.2	-37.1	175.6	-68.1	-176.6	-2.5	0	0	112	A23 C24 A29 L30 W31	A23-Q27 PolarHBondContact O-N 3.3Å; C24-Q27 PolarHBondContact O-N 3.39Å; Q27-A29 PolarHBondContact O-N 2.91Å; Q27-L30 WeakPolarHBondContact O-CB 3.4Å; Q27-L30 PolarHBondContact O-N 3.18Å; Q27-W31 PolarHBondContact O-N 3.25Å
28	H	41.4	Very low	39.8	Very low	118 Å²	118	120.2 Å²	120.2	55%	0.546	60%	0.598	S	S	.	*	H	α-helix	trans	-68.8	-34.6	177.4	-143.4	-129	0	0	0	112.1	C24 A25 L30 W31 W32	C24-H28 PolarHBondContact O-N 2.96Å; A25-H28 PolarHBondContact O-N 3.49Å; H28-L30 VanDerWaalsContact C-N 3.28Å; H28-L30 PolarHBondContact O-N 3.44Å; H28-W31 PolarHBondContact O-N 3.12Å; H28-W32 AromaticContact CE1-NE1 3.65Å; H28-W32 AromaticContact ND1-CD1 3.79Å; H28-W32 AromaticContact ND1-NE1 3.78Å; H28-W32 WeakPolarHBondContact O-CB 3.49Å; H28-W32 PolarHBondContact O-N 3.24Å
29	A	36.9	Very low	39.1	Very low	55 Å²	55	122.1 Å²	122.1	46%	0.455	62%	0.615	S	S	.	*	H	α-helix	trans	-64.9	-31.8	172.1	0	0	0	0	0	112.7	A25 Q27 K33	A25-A29 PolarHBondContact O-N 2.79Å; Q27-A29 PolarHBondContact O-N 2.91Å; A29-K33 WeakPolarHBondContact O-CB 3.49Å; A29-K33 WeakPolarHBondContact O-CG 3.38Å; A29-K33 PolarHBondContact O-N 3.43Å; A29-K33 VanDerWaalsContact O-N 3.08Å
30	L	36.7	Very low	38.4	Very low	114 Å²	114	123.5 Å²	123.5	60%	0.597	63%	0.628	S	S	*	*	H	α-helix	trans	-72	-40	172	-94.5	154.3	0	0	0	111.9	G26 Q27 H28 K33 L34	G26-L30 PolarHBondContact O-N 3.13Å; Q27-L30 WeakPolarHBondContact O-CB 3.4Å; Q27-L30 PolarHBondContact O-N 3.18Å; H28-L30 VanDerWaalsContact C-N 3.28Å; H28-L30 PolarHBondContact O-N 3.44Å; L30-K33 PolarHBondContact O-N 3.15Å; L30-L34 PolarHBondContact O-N 3.29Å
31	W	34.5	Very low	37.5	Very low	181 Å²	181	122.9 Å²	122.9	69%	0.686	64%	0.637	S	S	*	*	H	α-helix	trans	-66.4	-40.1	176.2	-118.6	76.2	0	0	0	112.7	Q27 H28 L34 K35	Q27-W31 PolarHBondContact O-N 3.25Å; H28-W31 PolarHBondContact O-N 3.12Å; W31-L34 PolarHBondContact O-N 2.69Å; W31-K35 PolarHBondContact O-N 3.3Å
32	W	33	Very low	36.5	Very low	160 Å²	160	125.4 Å²	125.4	61%	0.606	65%	0.648	S	S	*	*	H	α-helix	trans	-66.2	-39.7	172.9	-90	83.7	0	0	0	112.6	H28 L34 K35 H36	H28-W32 AromaticContact CE1-NE1 3.65Å; H28-W32 AromaticContact ND1-CD1 3.79Å; H28-W32 AromaticContact ND1-NE1 3.78Å; H28-W32 WeakPolarHBondContact O-CB 3.49Å; H28-W32 PolarHBondContact O-N 3.24Å; W32-L34 VanDerWaalsContact C-N 3.31Å; W32-L34 PolarHBondContact O-N 3.39Å; W32-K35 PolarHBondContact O-N 2.89Å; W32-H36 AromaticContact CZ3-NE2 3.87Å
33	K	36.4	Very low	35.6	Very low	164 Å²	164	124.6 Å²	124.6	71%	0.713	66%	0.657	S	S	*	*	H	α-helix	trans	-69.4	-26.7	174.8	-79.4	-171.7	177.9	-174	0	113.2	A29 L30	A29-K33 WeakPolarHBondContact O-CB 3.49Å; A29-K33 WeakPolarHBondContact O-CG 3.38Å; A29-K33 PolarHBondContact O-N 3.43Å; A29-K33 VanDerWaalsContact O-N 3.08Å; L30-K33 PolarHBondContact O-N 3.15Å
34	L	41.6	Very low	34.9	Very low	128 Å²	128	129.9 Å²	129.9	67%	0.67	68%	0.677	S	S	*	*	H	α-helix	trans	-76.6	-39.8	174	-109.4	80.5	0	0	0	112.4	L30 W31 W32 H36 R37	L30-L34 PolarHBondContact O-N 3.29Å; W31-L34 PolarHBondContact O-N 2.69Å; W32-L34 VanDerWaalsContact C-N 3.31Å; W32-L34 PolarHBondContact O-N 3.39Å; L34-H36 VanDerWaalsContact C-N 3.28Å; L34-H36 PolarHBondContact O-N 2.98Å; L34-R37 PolarHBondContact O-N 3.27Å
35	K	40.3	Very low	34	Very low	154 Å²	154	135 Å²	135	67%	0.67	69%	0.693	S	S	*	*	H	α-helix	trans	-69.8	-21	-173.8	-150.5	178.3	-175.8	-178.2	0	114.3	W31 W32	W31-K35 PolarHBondContact O-N 3.3Å; W32-K35 PolarHBondContact O-N 2.89Å
36	H	37.3	Very low	33.2	Very low	144 Å²	144	137.6 Å²	137.6	67%	0.667	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	13	177.5	-72.2	-66.5	0	0	0	114.9	W32 L34	W32-H36 AromaticContact CZ3-NE2 3.87Å; L34-H36 VanDerWaalsContact C-N 3.28Å; L34-H36 PolarHBondContact O-N 2.98Å
37	R	32.7	Very low	32.4	Very low	213 Å²	213	145 Å²	145	80%	0.804	73%	0.73	S	S	*	*			trans	-98.2	8.8	177.8	-124.4	-178.2	179.8	-168.9	-2.2	115.1	L34 T39	L34-R37 PolarHBondContact O-N 3.27Å; R37-T39 VanDerWaalsContact C-N 3.26Å; R37-T39 PolarHBondContact O-N 3.31Å
38	S	31.3	Very low	31.7	Very low	106 Å²	106	144 Å²	144	74%	0.741	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	14.3	-178.2	61.9	0	0	0	0	115.9
39	T	29.9	Very low	31.1	Very low	123 Å²	123	148.8 Å²	148.8	76%	0.755	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.1	14.4	-175.7	-24.4	0	0	0	0	115.9	R37	R37-T39 VanDerWaalsContact C-N 3.26Å; R37-T39 PolarHBondContact O-N 3.31Å
40	V	26.1	Very low	30.8	Very low	137 Å²	137	149.6 Å²	149.6	83%	0.83	77%	0.77	S	S	*	*			trans	-138	65	172.9	-164.7	0	0	0	0	110.6
41	V	27	Very low	30.5	Very low	141 Å²	141	151.8 Å²	151.8	86%	0.855	78%	0.782	S	S	*	*			trans	-128.5	68.3	164.1	-173.1	0	0	0	0	107.4
42	Q	25.5	Very low	30.5	Very low	186 Å²	186	149.2 Å²	149.2	87%	0.869	79%	0.789	S	S	*	*			trans	-153.9	90.3	168.7	-115.1	177.4	-3.5	0	0	107.3
43	C	23.7	Very low	30.5	Very low	127 Å²	127	147.9 Å²	147.9	86%	0.858	79%	0.793	S	S	*	*	S	Bend	trans	163.5	136	154.6	-92	0	0	0	0	107.1
44	L	24.6	Very low	30.5	Very low	168 Å²	168	144.5 Å²	144.5	88%	0.88	79%	0.79	S	S	*	*			trans	90.4	58.9	-174.1	-51.3	161.6	0	0	0	114.6
45	Q	25.7	Very low	30.6	Very low	189 Å²	189	142.7 Å²	142.7	88%	0.883	79%	0.793	S	S	*	*			trans	-90.4	114.1	142.9	-72.5	-167.2	-32.2	0	0	107.8
46	P	27.4	Very low	30.7	Very low	111 Å²	111	139 Å²	139	72%	0.721	79%	0.792	S	S	*	*			trans	-85.9	109.2	158.4	7.5	11.2	0	0	0	107.7	S48	P46-S48 PolarHBondContact O-N 2.84Å
47	E	25.6	Very low	30.8	Very low	191 Å²	191	136.9 Å²	136.9	89%	0.893	78%	0.782	S	S	*	*			trans	-59.9	115.9	160.4	-71	-177.9	140.6	0	0	108.8
48	S	28.7	Very low	31.2	Very low	113 Å²	113	130.7 Å²	130.7	79%	0.79	77%	0.772	S	S	*	*			trans	-151.4	97.8	153.3	50.6	0	0	0	0	109.6	P46	P46-S48 PolarHBondContact O-N 2.84Å
49	K	28.3	Very low	31.7	Very low	219 Å²	219	133 Å²	133	95%	0.952	77%	0.77	S	S	*	*			trans	-69.7	131.5	157.7	-67.3	174.2	175.3	174.4	0	107.3
50	G	29.8	Very low	32.2	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	77%	0.77	S	S	*	*			trans	169.1	84.4	171.9	0	0	0	0	0	116.9
51	L	31.9	Very low	32.8	Very low	160 Å²	160	138.3 Å²	138.3	84%	0.838	77%	0.766	S	S	*	*			trans	58.1	140	146.7	-101.4	69.1	0	0	0	122.7
52	P	34.3	Very low	33.4	Very low	127 Å²	127	139.6 Å²	139.6	83%	0.825	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-80.7	128.5	178.3	10.6	6.5	0	0	0	112.1
53	L	33.4	Very low	33.9	Very low	133 Å²	133	133.2 Å²	133.2	70%	0.696	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-89.1	131.1	-176.7	-71.3	151.9	0	0	0	111.8	E57	L53-E57 WeakPolarHBondContact CB-OE2 3.27Å; L53-E57 WeakPolarHBondContact CD1-OE2 3.49Å; L53-E57 VanDerWaalsContact CD2-CD 3.48Å; L53-E57 WeakPolarHBondContact CD2-OE1 3.46Å; L53-E57 WeakPolarHBondContact CD2-OE2 3.43Å; L53-E57 WeakPolarHBondContact CG-OE2 3.42Å
54	S	36.6	Very low	34.8	Very low	92 Å²	92	134.2 Å²	134.2	64%	0.643	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-76.3	161.2	-179.5	77.8	0	0	0	0	113	A56 E57	S54-A56 PolarHBondContact O-N 3.42Å; S54-E57 PolarHBondContact O-N 2.9Å
55	A	42.7	Very low	35.7	Very low	91 Å²	91	132.6 Å²	132.6	75%	0.752	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-11.7	-171.6	0	0	0	0	0	116.2	E57 S58	A55-E57 PolarHBondContact O-N 3.46Å; A55-S58 PolarHBondContact O-N 3.24Å
56	A	41.7	Very low	36.6	Very low	77 Å²	77	134.9 Å²	134.9	64%	0.636	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-18.6	178.9	0	0	0	0	0	113.6	S54	S54-A56 PolarHBondContact O-N 3.42Å
57	E	40.6	Very low	37.2	Very low	98 Å²	98	132.7 Å²	132.7	46%	0.458	73%	0.73	S	S	.	*	H	α-helix	trans	-84.7	-12.8	-178.9	-69.2	-173.2	158.2	0	0	114.8	L53 S54 A55 H59 K60 R61	L53-E57 WeakPolarHBondContact CB-OE2 3.27Å; L53-E57 WeakPolarHBondContact CD1-OE2 3.49Å; L53-E57 VanDerWaalsContact CD2-CD 3.48Å; L53-E57 WeakPolarHBondContact CD2-OE1 3.46Å; L53-E57 WeakPolarHBondContact CD2-OE2 3.43Å; L53-E57 WeakPolarHBondContact CG-OE2 3.42Å; S54-E57 PolarHBondContact O-N 2.9Å; A55-E57 PolarHBondContact O-N 3.46Å; E57-H59 VanDerWaalsContact C-N 3.25Å; E57-H59 PolarHBondContact O-N 3.03Å; E57-K60 PolarHBondContact O-N 3.41Å; E57-K60 VanDerWaalsContact O-N 3.14Å; E57-R61 PolarHBondContact O-N 3.48Å
58	S	41.3	Very low	38.1	Very low	84 Å²	84	129.6 Å²	129.6	59%	0.587	72%	0.719	S	S	*	*	H	α-helix	trans	-62.7	-34.6	177.1	-171.7	0	0	0	0	111.8	A55	A55-S58 PolarHBondContact O-N 3.24Å
59	H	40.5	Very low	38.8	Very low	153 Å²	153	132.6 Å²	132.6	71%	0.708	72%	0.72	S	S	*	*	H	α-helix	trans	-75.2	-28	176.2	-76.2	-78.3	0	0	0	113.4	E57	E57-H59 VanDerWaalsContact C-N 3.25Å; E57-H59 PolarHBondContact O-N 3.03Å
60	K	40.4	Very low	40.1	Very low	172 Å²	172	129 Å²	129	75%	0.748	71%	0.711	S	S	*	*	H	α-helix	trans	-73.9	-30	175.2	-105.1	179.9	177.5	177.4	0	112.9	E57 K62 G63 L64	E57-K60 PolarHBondContact O-N 3.41Å; E57-K60 VanDerWaalsContact O-N 3.14Å; K60-K62 VanDerWaalsContact C-N 3.33Å; K60-K62 PolarHBondContact O-N 2.83Å; K60-G63 PolarHBondContact O-N 2.98Å; K60-G63 VanDerWaalsContact O-N 3.13Å; K60-L64 PolarHBondContact O-N 2.73Å
61	R	39.4	Very low	41.4	Very low	201 Å²	201	133.5 Å²	133.5	76%	0.758	72%	0.717	S	S	*	*	H	α-helix	trans	-67.5	-27.5	174.8	-96.7	180	177.2	172	1	114	E57 G63 L64	E57-R61 PolarHBondContact O-N 3.48Å; R61-G63 PolarHBondContact O-N 3.29Å; R61-L64 PolarHBondContact O-N 3.5Å
62	K	38.7	Very low	43.1	Very low	167 Å²	167	134.7 Å²	134.7	73%	0.726	72%	0.715	S	S	*	*	H	α-helix	trans	-67.1	-24.5	171.8	-73.5	-170.6	178.5	-179.5	0	112.8	K60	K60-K62 VanDerWaalsContact C-N 3.33Å; K60-K62 PolarHBondContact O-N 2.83Å
63	G	37.9	Very low	45.3	Very low	52 Å²	52	134.9 Å²	134.9	54%	0.536	70%	0.7	S	S	.	*	H	α-helix	trans	-81.3	-37.3	175.7	0	0	0	0	0	113.9	K60 R61 L65 R66	K60-G63 PolarHBondContact O-N 2.98Å; K60-G63 VanDerWaalsContact O-N 3.13Å; R61-G63 PolarHBondContact O-N 3.29Å; G63-L65 PolarHBondContact O-N 3.19Å; G63-R66 PolarHBondContact O-N 3.32Å
64	L	40.8	Very low	47.9	Very low	148 Å²	148	134.8 Å²	134.8	78%	0.775	70%	0.7	S	S	*	*	H	α-helix	trans	-75.8	-21.1	-171.3	-147.4	82.1	0	0	0	114.2	K60 R61 R66	K60-L64 PolarHBondContact O-N 2.73Å; R61-L64 PolarHBondContact O-N 3.5Å; L64-R66 VanDerWaalsContact C-N 3.28Å; L64-R66 PolarHBondContact O-N 2.7Å
65	L	43.7	Very low	50.5	Low	135 Å²	135	132.7 Å²	132.7	71%	0.707	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-76.3	-9.9	178.4	-74.2	170.1	0	0	0	114.1	G63 G67	G63-L65 PolarHBondContact O-N 3.19Å; L65-G67 PolarHBondContact O-N 3.4Å
66	R	44.8	Very low	52.9	Low	236 Å²	236	129 Å²	129	89%	0.891	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-72.1	-11.3	174.8	-83.2	-173.8	175.3	-160	-0.8	113.8	G63 L64	G63-R66 PolarHBondContact O-N 3.32Å; L64-R66 VanDerWaalsContact C-N 3.28Å; L64-R66 PolarHBondContact O-N 2.7Å
67	G	39.8	Very low	55.6	Low	65 Å²	65	129.1 Å²	129.1	67%	0.67	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-97.4	-10.3	-172	0	0	0	0	0	116.5	L65 H69	L65-G67 PolarHBondContact O-N 3.4Å; G67-H69 VanDerWaalsContact C-N 3.32Å; G67-H69 PolarHBondContact O-N 2.97Å
68	L	44.4	Very low	58.3	Low	126 Å²	126	124.5 Å²	124.5	66%	0.66	62%	0.621	S	S	*	*			trans	-77.9	92.4	171.4	-74.3	168.4	0	0	0	107.3	L70	L68-L70 PolarHBondContact O-N 3.42Å
69	H	43.3	Very low	60.9	Low	177 Å²	177	124 Å²	124	82%	0.819	61%	0.612	S	S	*	*			trans	-67.3	70.1	172.9	-153	-72.3	0	0	0	108.8	G67	G67-H69 VanDerWaalsContact C-N 3.32Å; G67-H69 PolarHBondContact O-N 2.97Å
70	L	56.3	Low	63.6	Low	144 Å²	144	117.9 Å²	117.9	75%	0.754	59%	0.586	S	S	*	*			trans	-54.4	140.4	169.6	-70.8	164.5	0	0	0	107.3	L68 K72	L68-L70 PolarHBondContact O-N 3.42Å; L70-K72 PolarHBondContact O-N 2.94Å
71	L	56.6	Low	66.3	Low	165 Å²	165	112.1 Å²	112.1	86%	0.864	56%	0.563	S	S	*	*			trans	-46.2	141.2	172	-72.3	165.7	0	0	0	109.2	W73	L71-W73 PolarHBondContact O-N 3.36Å
72	K	67.4	Low	69	Low	186 Å²	186	103.5 Å²	103.5	81%	0.809	53%	0.533	S	S	*	.			trans	-50.6	110.9	175.9	-70.7	-176.6	-179.8	179.2	0	108.3	L70 N74	L70-K72 PolarHBondContact O-N 2.94Å; K72-N74 PolarHBondContact O-N 3.48Å
73	W	81.5	Confident	71.6	Confident	130 Å²	130	96.7 Å²	96.7	49%	0.492	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-65.9	128.9	176.9	176.6	90.1	0	0	0	108.3	L71 L75 P76 V96	L71-W73 PolarHBondContact O-N 3.36Å; W73-L75 HydrophobicContact CH2-CD1 4.06Å; W73-L75 HydrophobicContact CZ3-CB 4.47Å; W73-L75 HydrophobicContact CZ3-CD1 4.22Å; W73-P76 HydrophobicContact CH2-CG 4.45Å; W73-P76 HydrophobicContact CZ2-CG 4.2Å; W73-V96 HydrophobicContact CH2-CG2 4.19Å; W73-V96 HydrophobicContact CZ3-CG2 4.49Å
74	N	87.7	Confident	74.3	Confident	131 Å²	131	99 Å²	99	70%	0.701	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-96.3	143.2	178.3	-67.4	-49.8	0	0	0	109.5	K72	K72-N74 PolarHBondContact O-N 3.48Å
75	L	91.2	Very high	76.9	Confident	49 Å²	49	92.3 Å²	92.3	26%	0.257	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-58.9	125.1	173.7	-173.1	73.7	0	0	0	110	W73 F92 V96 Y110 S113 A114	W73-L75 HydrophobicContact CH2-CD1 4.06Å; W73-L75 HydrophobicContact CZ3-CB 4.47Å; W73-L75 HydrophobicContact CZ3-CD1 4.22Å; L75-F92 HydrophobicContact CD1-CD2 4.24Å; L75-F92 HydrophobicContact CD1-CE2 4.17Å; L75-V96 HydrophobicContact CD1-CG2 3.75Å; L75-Y110 HydrophobicContact CD1-CD1 4.33Å; L75-Y110 HydrophobicContact CD2-CD1 4.22Å; L75-S113 WeakPolarHBondContact CD2-OG 3.41Å; L75-A114 HydrophobicContact CD2-CB 3.94Å; L75-A114 HydrophobicContact CG-CB 4.09Å
76	P	93.7	Very high	79.2	Confident	13 Å²	13	88.7 Å²	88.7	8%	0.084	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-68.2	148.7	-179.9	30.3	-37.8	0	0	0	110.2	W73 F88 Q91 F92 A114	W73-P76 HydrophobicContact CH2-CG 4.45Å; W73-P76 HydrophobicContact CZ2-CG 4.2Å; P76-F88 HydrophobicContact CB-CD2 4.04Å; P76-F88 HydrophobicContact CB-CE2 4.47Å; P76-F88 HydrophobicContact CG-CD2 4.16Å; P76-F88 HydrophobicContact CG-CE2 4.22Å; P76-Q91 HydrophobicContact CB-CB 4.08Å; P76-Q91 HydrophobicContact CG-CB 3.89Å; P76-F92 HydrophobicContact CG-CB 4.19Å; P76-A114 WeakPolarHBondContact O-CB 3.08Å
77	V	97.1	Very high	81.5	Confident	80 Å²	80	80 Å²	80	49%	0.485	43%	0.426	S	S	.	.			trans	-112.4	131.3	-178.8	176.8	0	0	0	0	110.3	A114 K116	V77-A114 CarbonylContact C-O 3.56Å; V77-A114 VanDerWaalsContact CA-O 3.3Å; V77-A114 WeakPolarHBondContact CA-O 3.48Å; V77-K116 HydrophobicContact CG1-CD 3.63Å; V77-K116 HydrophobicContact CG1-CG 3.96Å
78	F	98.4	Very high	84.2	Confident	1 Å²	1	77.3 Å²	77.3	0%	0.004	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-108.1	117	175.3	-173	-123.2	0	0	0	111.9	N81 F85 F88 A114 L115 K116 A119 F144	F78-N81 WeakPolarHBondContact CE2-O 3.28Å; F78-F85 HydrophobicContact CD1-CD2 4.48Å; F78-F85 AromaticContact CE1-CD2 3.86Å; F78-F85 HydrophobicContact CE1-CD2 3.86Å; F78-F85 HydrophobicContact CE1-CE2 4.45Å; F78-F85 HydrophobicContact CE2-CB 3.87Å; F78-F85 AromaticContact CE2-CD2 3.91Å; F78-F85 HydrophobicContact CE2-CD2 3.91Å; F78-F85 HydrophobicContact CE2-CG 4.39Å; F78-F85 HydrophobicContact CZ-CB 4.05Å; F78-F85 AromaticContact CZ-CD2 3.57Å; F78-F85 HydrophobicContact CZ-CD2 3.57Å; F78-F85 HydrophobicContact CZ-CG 4.3Å; F78-F88 HydrophobicContact CB-CB 4.43Å; F78-F88 HydrophobicContact CB-CD1 3.69Å; F78-F88 HydrophobicContact CB-CD2 3.6Å; F78-F88 HydrophobicContact CB-CE1 3.75Å; F78-F88 HydrophobicContact CB-CE2 3.67Å; F78-F88 HydrophobicContact CB-CG 3.61Å; F78-F88 HydrophobicContact CB-CZ 3.73Å; F78-F88 HydrophobicContact CD1-CD1 4.4Å; F78-F88 HydrophobicContact CD1-CE1 4.41Å; F78-F88 HydrophobicContact CD2-CB 4Å; F78-F88 AromaticContact CD2-CD1 3.93Å; F78-F88 HydrophobicContact CD2-CD1 3.93Å; F78-F88 AromaticContact CD2-CG 3.94Å; F78-F88 HydrophobicContact CD2-CG 3.94Å; F78-F88 AromaticContact CG-CD1 3.75Å; F78-F88 HydrophobicContact CG-CD1 3.75Å; F78-F88 HydrophobicContact CG-CD2 4.46Å; F78-F88 HydrophobicContact CG-CE1 4.04Å; F78-F88 AromaticContact CG-CG 3.97Å; F78-F88 HydrophobicContact CG-CG 3.97Å; F78-A114 PolarHBondContact N-O 3.47Å; F78-L115 HydrophobicContact CB-CD2 4.08Å; F78-L115 HydrophobicContact CD1-CD2 3.94Å; F78-K116 PolarHBondContact O-N 2.9Å; F78-A119 HydrophobicContact CD1-CB 3.54Å; F78-A119 HydrophobicContact CE1-CB 3.63Å; F78-F144 HydrophobicContact CE1-CB 4.03Å; F78-F144 HydrophobicContact CE1-CD1 4.1Å; F78-F144 HydrophobicContact CE1-CD2 4.08Å; F78-F144 AromaticContact CE1-CG 3.81Å; F78-F144 HydrophobicContact CE1-CG 3.81Å; F78-F144 HydrophobicContact CZ-CB 3.9Å; F78-F144 HydrophobicContact CZ-CD1 4.14Å; F78-F144 HydrophobicContact CZ-CG 4.02Å
79	D	96.3	Very high	86.6	Confident	74 Å²	74	72 Å²	72	40%	0.396	37%	0.367	S	S	.	.			trans	-94.6	20.2	-176.8	64.1	-3.1	0	0	0	113.6	N81 K84	D79-N81 PolarHBondContact O-N 3.08Å; D79-N81 WeakPolarHBondContact OD1-CB 3.3Å; D79-N81 PolarHBondContact OD1-N 3.13Å; D79-K84 IonicContact OD1-NZ 3.29Å; D79-K84 IonicContact OD2-NZ 2.7Å; D79-K84 PolarHBondContact OD2-NZ 3.18Å
80	S	96.9	Very high	89	Confident	24 Å²	24	67.3 Å²	67.3	17%	0.168	35%	0.348	C	S	.	.	S	Bend	trans	68.5	6.7	-174.5	-45.5	0	0	0	0	115.5	V82 K116 A118 A119	S80-V82 PolarHBondContact O-N 3.45Å; S80-K116 PolarHBondContact OG-O 3.29Å; S80-A118 PolarHBondContact OG-N 2.94Å; S80-A118 VanDerWaalsContact OG-N 3.08Å; S80-A119 WeakPolarHBondContact OG-CB 3.39Å; S80-A119 PolarHBondContact OG-N 3.2Å
81	N	96.5	Very high	90.8	Very high	51 Å²	51	65 Å²	65	27%	0.273	33%	0.334	S	S	.	.			trans	-78.6	106.1	174.2	-175.7	-3.3	0	0	0	110.8	F78 D79 L83 K84 F85	F78-N81 WeakPolarHBondContact CE2-O 3.28Å; D79-N81 PolarHBondContact O-N 3.08Å; D79-N81 WeakPolarHBondContact OD1-CB 3.3Å; D79-N81 PolarHBondContact OD1-N 3.13Å; N81-L83 PolarHBondContact O-N 3.26Å; N81-L83 WeakPolarHBondContact OD1-CB 3.43Å; N81-L83 PolarHBondContact OD1-N 2.95Å; N81-L83 VanDerWaalsContact OD1-N 3.14Å; N81-K84 HydrophobicContact CB-CD 4.23Å; N81-K84 HydrophobicContact CB-CG 4.3Å; N81-K84 PolarHBondContact O-N 3.24Å; N81-F85 PolarHBondContact O-N 3.48Å
82	V	95.4	Very high	92.8	Very high	19 Å²	19	57.1 Å²	57.1	12%	0.115	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-52.7	-31.6	-179.8	-59.8	0	0	0	0	113.8	S80 K84 F85 F144 V149 I150 K153	S80-V82 PolarHBondContact O-N 3.45Å; V82-K84 PolarHBondContact O-N 2.69Å; V82-K84 VanDerWaalsContact O-N 3.16Å; V82-F85 WeakPolarHBondContact O-CB 3.37Å; V82-F85 PolarHBondContact O-N 3.5Å; V82-F85 VanDerWaalsContact O-N 3.09Å; V82-F144 HydrophobicContact CG1-CB 4.31Å; V82-F144 HydrophobicContact CG1-CD1 4.04Å; V82-V149 HydrophobicContact CG1-CG1 4.35Å; V82-I150 HydrophobicContact CB-CG1 4.27Å; V82-K153 HydrophobicContact CG2-CB 3.86Å; V82-K153 HydrophobicContact CG2-CG 3.75Å
83	L	94.4	Very high	94.1	Very high	25 Å²	25	51.1 Å²	51.1	13%	0.131	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-65.8	-17.4	177.6	-57.2	-177.3	0	0	0	113.3	N81 K153 H154 W181	N81-L83 PolarHBondContact O-N 3.26Å; N81-L83 WeakPolarHBondContact OD1-CB 3.43Å; N81-L83 PolarHBondContact OD1-N 2.95Å; N81-L83 VanDerWaalsContact OD1-N 3.14Å; L83-K153 HydrophobicContact CD1-CG 4.11Å; L83-K153 HydrophobicContact CD2-CB 3.69Å; L83-K153 HydrophobicContact CD2-CG 3.53Å; L83-K153 HydrophobicContact CG-CB 4.43Å; L83-K153 HydrophobicContact CG-CG 3.75Å; L83-H154 HydrophobicContact CD2-CB 4.49Å; L83-H154 WeakPolarHBondContact CD2-CD2 3.25Å; L83-H154 WeakPolarHBondContact CD2-NE2 3.47Å; L83-W181 HydrophobicContact CB-CH2 4.11Å; L83-W181 HydrophobicContact CB-CZ2 4.1Å; L83-W181 HydrophobicContact CD1-CH2 3.55Å; L83-W181 HydrophobicContact CD1-CZ2 4.33Å; L83-W181 HydrophobicContact CD1-CZ3 4.15Å; L83-W181 HydrophobicContact CG-CH2 4.48Å
84	K	94.2	Very high	94.7	Very high	99 Å²	99	48.7 Å²	48.7	43%	0.43	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-105.4	-2.9	177.5	-59.1	-179.9	-175	168.6	0	112.7	D79 N81 V82 V86 F88	D79-K84 IonicContact OD1-NZ 3.29Å; D79-K84 IonicContact OD2-NZ 2.7Å; D79-K84 PolarHBondContact OD2-NZ 3.18Å; N81-K84 HydrophobicContact CB-CD 4.23Å; N81-K84 HydrophobicContact CB-CG 4.3Å; N81-K84 PolarHBondContact O-N 3.24Å; V82-K84 PolarHBondContact O-N 2.69Å; V82-K84 VanDerWaalsContact O-N 3.16Å; K84-V86 PolarHBondContact O-N 2.88Å; K84-F88 WeakPolarHBondContact O-CB 3.5Å; K84-F88 PolarHBondContact O-N 3.06Å
85	F	95.3	Very high	94.9	Very high	9 Å²	9	43.1 Å²	43.1	4%	0.039	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-45.2	-170.9	-179	-91.3	0	0	0	112.3	F78 N81 V82 F88 W89 L140 K141 F144	F78-F85 HydrophobicContact CD1-CD2 4.48Å; F78-F85 AromaticContact CE1-CD2 3.86Å; F78-F85 HydrophobicContact CE1-CD2 3.86Å; F78-F85 HydrophobicContact CE1-CE2 4.45Å; F78-F85 HydrophobicContact CE2-CB 3.87Å; F78-F85 AromaticContact CE2-CD2 3.91Å; F78-F85 HydrophobicContact CE2-CD2 3.91Å; F78-F85 HydrophobicContact CE2-CG 4.39Å; F78-F85 HydrophobicContact CZ-CB 4.05Å; F78-F85 AromaticContact CZ-CD2 3.57Å; F78-F85 HydrophobicContact CZ-CD2 3.57Å; F78-F85 HydrophobicContact CZ-CG 4.3Å; N81-F85 PolarHBondContact O-N 3.48Å; V82-F85 WeakPolarHBondContact O-CB 3.37Å; V82-F85 PolarHBondContact O-N 3.5Å; V82-F85 VanDerWaalsContact O-N 3.09Å; F85-F88 HydrophobicContact CD2-CD1 4.42Å; F85-F88 WeakPolarHBondContact O-CB 3.4Å; F85-F88 PolarHBondContact O-N 3.15Å; F85-W89 HydrophobicContact CD1-CB 4.42Å; F85-W89 HydrophobicContact CE1-CB 4.03Å; F85-W89 HydrophobicContact CE1-CG 4.38Å; F85-W89 HydrophobicContact CZ-CB 4.33Å; F85-W89 HydrophobicContact CZ-CE3 4.41Å; F85-W89 WeakPolarHBondContact O-CB 3.46Å; F85-W89 PolarHBondContact O-N 3.31Å; F85-L140 HydrophobicContact CE2-CB 4.3Å; F85-K141 HydrophobicContact CZ-CG 4.2Å; F85-F144 HydrophobicContact CD2-CB 3.56Å; F85-F144 HydrophobicContact CE2-CB 3.92Å; F85-F144 HydrophobicContact CG-CB 4.14Å
86	V	92.1	Very high	95.2	Very high	59 Å²	59	41 Å²	41	36%	0.358	24%	0.238	S	C	.	.	H	α-helix	trans	-57.6	-54.8	-179.9	-179.5	0	0	0	0	110.6	K84 F88 W89 D90 I150	K84-V86 PolarHBondContact O-N 2.88Å; V86-F88 VanDerWaalsContact C-N 3.28Å; V86-F88 PolarHBondContact O-N 2.85Å; V86-W89 PolarHBondContact O-N 3.28Å; V86-W89 VanDerWaalsContact O-N 3.1Å; V86-D90 VanDerWaalsContact O-CG 3.28Å; V86-D90 PolarHBondContact O-N 3.04Å; V86-I150 HydrophobicContact CG2-CD1 4.04Å
87	A	92.1	Very high	95.3	Very high	54 Å²	54	42.9 Å²	42.9	45%	0.446	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-34.5	179.3	0	0	0	0	0	113.3	Q91	A87-Q91 VanDerWaalsContact O-CG 3.31Å; A87-Q91 WeakPolarHBondContact O-CG 3.46Å; A87-Q91 PolarHBondContact O-N 3.49Å; A87-Q91 PolarHBondContact O-NE2 2.91Å; A87-Q91 VanDerWaalsContact O-NE2 3.1Å
88	F	96.6	Very high	95.3	Very high	8 Å²	8	42 Å²	42	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-49.9	172.6	159.2	-103.5	0	0	0	111.3	P76 F78 K84 F85 V86 Q91 F92 L111 A114 L115	P76-F88 HydrophobicContact CB-CD2 4.04Å; P76-F88 HydrophobicContact CB-CE2 4.47Å; P76-F88 HydrophobicContact CG-CD2 4.16Å; P76-F88 HydrophobicContact CG-CE2 4.22Å; F78-F88 HydrophobicContact CB-CB 4.43Å; F78-F88 HydrophobicContact CB-CD1 3.69Å; F78-F88 HydrophobicContact CB-CD2 3.6Å; F78-F88 HydrophobicContact CB-CE1 3.75Å; F78-F88 HydrophobicContact CB-CE2 3.67Å; F78-F88 HydrophobicContact CB-CG 3.61Å; F78-F88 HydrophobicContact CB-CZ 3.73Å; F78-F88 HydrophobicContact CD1-CD1 4.4Å; F78-F88 HydrophobicContact CD1-CE1 4.41Å; F78-F88 HydrophobicContact CD2-CB 4Å; F78-F88 AromaticContact CD2-CD1 3.93Å; F78-F88 HydrophobicContact CD2-CD1 3.93Å; F78-F88 AromaticContact CD2-CG 3.94Å; F78-F88 HydrophobicContact CD2-CG 3.94Å; F78-F88 AromaticContact CG-CD1 3.75Å; F78-F88 HydrophobicContact CG-CD1 3.75Å; F78-F88 HydrophobicContact CG-CD2 4.46Å; F78-F88 HydrophobicContact CG-CE1 4.04Å; F78-F88 AromaticContact CG-CG 3.97Å; F78-F88 HydrophobicContact CG-CG 3.97Å; K84-F88 WeakPolarHBondContact O-CB 3.5Å; K84-F88 PolarHBondContact O-N 3.06Å; F85-F88 HydrophobicContact CD2-CD1 4.42Å; F85-F88 WeakPolarHBondContact O-CB 3.4Å; F85-F88 PolarHBondContact O-N 3.15Å; V86-F88 VanDerWaalsContact C-N 3.28Å; V86-F88 PolarHBondContact O-N 2.85Å; F88-Q91 PolarHBondContact O-N 2.88Å; F88-F92 HydrophobicContact CE2-CB 4.21Å; F88-F92 HydrophobicContact CE2-CD2 4.38Å; F88-F92 HydrophobicContact CZ-CB 4.21Å; F88-F92 HydrophobicContact CZ-CD2 4.31Å; F88-F92 HydrophobicContact CZ-CG 4.28Å; F88-F92 WeakPolarHBondContact O-CB 3Å; F88-F92 PolarHBondContact O-N 3.37Å; F88-L111 HydrophobicContact CZ-CD1 4.5Å; F88-A114 HydrophobicContact CE2-CB 4.05Å; F88-A114 HydrophobicContact CZ-CB 4.34Å; F88-L115 HydrophobicContact CE1-CD2 4.4Å; F88-L115 HydrophobicContact CZ-CD2 4.15Å
89	W	96.4	Very high	95.1	Very high	13 Å²	13	47.2 Å²	47.2	5%	0.049	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-44.4	-175.7	-174.9	-97.8	0	0	0	110.8	F85 V86 Q91 F92 E93 V137	F85-W89 HydrophobicContact CD1-CB 4.42Å; F85-W89 HydrophobicContact CE1-CB 4.03Å; F85-W89 HydrophobicContact CE1-CG 4.38Å; F85-W89 HydrophobicContact CZ-CB 4.33Å; F85-W89 HydrophobicContact CZ-CE3 4.41Å; F85-W89 WeakPolarHBondContact O-CB 3.46Å; F85-W89 PolarHBondContact O-N 3.31Å; V86-W89 PolarHBondContact O-N 3.28Å; V86-W89 VanDerWaalsContact O-N 3.1Å; W89-Q91 VanDerWaalsContact C-N 3.29Å; W89-Q91 PolarHBondContact O-N 3.28Å; W89-F92 HydrophobicContact CE3-CD1 4.42Å; W89-F92 HydrophobicContact CH2-CD1 4.32Å; W89-F92 AromaticContact CZ3-CD1 3.98Å; W89-F92 HydrophobicContact CZ3-CD1 3.98Å; W89-F92 HydrophobicContact CZ3-CE1 4.46Å; W89-F92 CarbonylContact O-C 3.46Å; W89-F92 PolarHBondContact O-N 3.38Å; W89-F92 VanDerWaalsContact O-N 3.15Å; W89-E93 PolarHBondContact NE1-OE1 3.46Å; W89-E93 VanDerWaalsContact NE1-OE1 3.13Å; W89-E93 WeakPolarHBondContact O-CA 3.26Å; W89-E93 WeakPolarHBondContact O-CB 3.31Å; W89-E93 PolarHBondContact O-N 2.88Å; W89-V137 HydrophobicContact CH2-CB 4.16Å; W89-V137 HydrophobicContact CH2-CG1 3.4Å; W89-V137 HydrophobicContact CH2-CG2 3.75Å; W89-V137 HydrophobicContact CZ2-CG1 3.85Å; W89-V137 HydrophobicContact CZ3-CG1 4.19Å; W89-V137 HydrophobicContact CZ3-CG2 4.34Å
90	D	93	Very high	95	Very high	79 Å²	79	51.5 Å²	51.5	42%	0.422	28%	0.28	S	S	.	.	H	α-helix	trans	-58.4	-42.3	177.9	-66.3	-10.1	0	0	0	111.7	V86 E93 A94	V86-D90 VanDerWaalsContact O-CG 3.28Å; V86-D90 PolarHBondContact O-N 3.04Å; D90-E93 PolarHBondContact O-N 3.07Å; D90-A94 WeakPolarHBondContact O-CB 3.14Å; D90-A94 PolarHBondContact O-N 3.39Å
91	Q	94.6	Very high	94.8	Very high	96 Å²	96	56.4 Å²	56.4	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-68.7	-43	176.4	-72.9	175.8	57.1	0	0	112.1	P76 A87 F88 W89 E93 G95	P76-Q91 HydrophobicContact CB-CB 4.08Å; P76-Q91 HydrophobicContact CG-CB 3.89Å; A87-Q91 VanDerWaalsContact O-CG 3.31Å; A87-Q91 WeakPolarHBondContact O-CG 3.46Å; A87-Q91 PolarHBondContact O-N 3.49Å; A87-Q91 PolarHBondContact O-NE2 2.91Å; A87-Q91 VanDerWaalsContact O-NE2 3.1Å; F88-Q91 PolarHBondContact O-N 2.88Å; W89-Q91 VanDerWaalsContact C-N 3.29Å; W89-Q91 PolarHBondContact O-N 3.28Å; Q91-E93 VanDerWaalsContact C-N 3.28Å; Q91-E93 PolarHBondContact O-N 2.96Å; Q91-G95 PolarHBondContact O-N 2.87Å
92	F	97.5	Very high	94.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.8	-34.7	177.5	-173.5	-90.8	0	0	0	111.2	L75 P76 F88 W89 V96 H97 L111 A114	L75-F92 HydrophobicContact CD1-CD2 4.24Å; L75-F92 HydrophobicContact CD1-CE2 4.17Å; P76-F92 HydrophobicContact CG-CB 4.19Å; F88-F92 HydrophobicContact CE2-CB 4.21Å; F88-F92 HydrophobicContact CE2-CD2 4.38Å; F88-F92 HydrophobicContact CZ-CB 4.21Å; F88-F92 HydrophobicContact CZ-CD2 4.31Å; F88-F92 HydrophobicContact CZ-CG 4.28Å; F88-F92 WeakPolarHBondContact O-CB 3Å; F88-F92 PolarHBondContact O-N 3.37Å; W89-F92 HydrophobicContact CE3-CD1 4.42Å; W89-F92 HydrophobicContact CH2-CD1 4.32Å; W89-F92 AromaticContact CZ3-CD1 3.98Å; W89-F92 HydrophobicContact CZ3-CD1 3.98Å; W89-F92 HydrophobicContact CZ3-CE1 4.46Å; W89-F92 CarbonylContact O-C 3.46Å; W89-F92 PolarHBondContact O-N 3.38Å; W89-F92 VanDerWaalsContact O-N 3.15Å; F92-V96 HydrophobicContact CD1-CB 4.48Å; F92-V96 HydrophobicContact CD2-CB 4.31Å; F92-V96 HydrophobicContact CD2-CG2 4.25Å; F92-V96 HydrophobicContact CE1-CB 4.12Å; F92-V96 HydrophobicContact CE1-CG1 4.19Å; F92-V96 HydrophobicContact CE2-CB 3.94Å; F92-V96 HydrophobicContact CE2-CG1 4.09Å; F92-V96 HydrophobicContact CE2-CG2 3.98Å; F92-V96 HydrophobicContact CZ-CB 3.82Å; F92-V96 HydrophobicContact CZ-CG1 3.65Å; F92-V96 HydrophobicContact CZ-CG2 4.35Å; F92-V96 WeakPolarHBondContact O-CA 3.42Å; F92-V96 WeakPolarHBondContact O-CB 3.1Å; F92-V96 PolarHBondContact O-N 2.89Å; F92-H97 HydrophobicContact CD1-CB 4.44Å; F92-H97 HydrophobicContact CE1-CB 4.48Å; F92-H97 PolarHBondContact O-N 3.47Å; F92-L111 HydrophobicContact CD1-CD1 4.29Å; F92-L111 HydrophobicContact CE1-CB 4.34Å; F92-L111 HydrophobicContact CE1-CD1 3.8Å; F92-L111 HydrophobicContact CE2-CB 4.2Å; F92-L111 HydrophobicContact CE2-CD1 4.07Å; F92-L111 HydrophobicContact CZ-CB 3.62Å; F92-L111 HydrophobicContact CZ-CD1 3.69Å; F92-L111 HydrophobicContact CZ-CG 4.24Å; F92-A114 HydrophobicContact CD2-CB 4.39Å; F92-A114 HydrophobicContact CE2-CB 4.38Å
93	E	96	Very high	94.8	Very high	59 Å²	59	57.3 Å²	57.3	28%	0.276	31%	0.309	S	S	.	.	I	π-helix	trans	-66.9	-52.5	-179.7	-176.3	156.3	-107.8	0	0	110.5	W89 D90 Q91 G95 H97 S98	W89-E93 PolarHBondContact NE1-OE1 3.46Å; W89-E93 VanDerWaalsContact NE1-OE1 3.13Å; W89-E93 WeakPolarHBondContact O-CA 3.26Å; W89-E93 WeakPolarHBondContact O-CB 3.31Å; W89-E93 PolarHBondContact O-N 2.88Å; D90-E93 PolarHBondContact O-N 3.07Å; Q91-E93 VanDerWaalsContact C-N 3.28Å; Q91-E93 PolarHBondContact O-N 2.96Å; E93-G95 PolarHBondContact O-N 3.37Å; E93-H97 HydrophobicContact CB-CB 4.28Å; E93-H97 HydrophobicContact CG-CB 4.2Å; E93-H97 PolarHBondContact O-N 2.88Å; E93-H97 IonicContact OE1-CD2 3.67Å; E93-H97 PolarHBondContact OE1-CD2 3.03Å; E93-S98 VanDerWaalsContact O-CB 3.3Å; E93-S98 WeakPolarHBondContact O-CB 3.48Å; E93-S98 PolarHBondContact O-N 2.89Å; E93-S98 PolarHBondContact O-OG 2.79Å
94	A	92.7	Very high	94.9	Very high	80 Å²	80	59.2 Å²	59.2	66%	0.661	32%	0.319	S	S	*	.	I	π-helix	trans	-64	-40	175.6	0	0	0	0	0	113	D90	D90-A94 WeakPolarHBondContact O-CB 3.14Å; D90-A94 PolarHBondContact O-N 3.39Å
95	G	92.9	Very high	95	Very high	14 Å²	14	55.8 Å²	55.8	14%	0.144	31%	0.31	C	S	.	.	I	π-helix	trans	-84.5	-24.5	-173.7	0	0	0	0	0	115.3	Q91 E93 R99	Q91-G95 PolarHBondContact O-N 2.87Å; E93-G95 PolarHBondContact O-N 3.37Å; G95-R99 WeakPolarHBondContact O-CD 3.42Å
96	V	96.5	Very high	95.1	Very high	4 Å²	4	58 Å²	58	2%	0.024	32%	0.324	C	S	.	.	I	π-helix	trans	-140.1	-55.3	-172.2	-176.6	0	0	0	0	112.8	W73 L75 F92 S98 R99 L102 K107 Y110	W73-V96 HydrophobicContact CH2-CG2 4.19Å; W73-V96 HydrophobicContact CZ3-CG2 4.49Å; L75-V96 HydrophobicContact CD1-CG2 3.75Å; F92-V96 HydrophobicContact CD1-CB 4.48Å; F92-V96 HydrophobicContact CD2-CB 4.31Å; F92-V96 HydrophobicContact CD2-CG2 4.25Å; F92-V96 HydrophobicContact CE1-CB 4.12Å; F92-V96 HydrophobicContact CE1-CG1 4.19Å; F92-V96 HydrophobicContact CE2-CB 3.94Å; F92-V96 HydrophobicContact CE2-CG1 4.09Å; F92-V96 HydrophobicContact CE2-CG2 3.98Å; F92-V96 HydrophobicContact CZ-CB 3.82Å; F92-V96 HydrophobicContact CZ-CG1 3.65Å; F92-V96 HydrophobicContact CZ-CG2 4.35Å; F92-V96 WeakPolarHBondContact O-CA 3.42Å; F92-V96 WeakPolarHBondContact O-CB 3.1Å; F92-V96 PolarHBondContact O-N 2.89Å; V96-S98 PolarHBondContact O-N 3.31Å; V96-R99 PolarHBondContact O-N 3.44Å; V96-L102 HydrophobicContact CG1-CD1 4.15Å; V96-K107 HydrophobicContact CG1-CB 4.12Å; V96-K107 HydrophobicContact CG1-CG 4.02Å; V96-Y110 HydrophobicContact CG1-CD2 4.17Å; V96-Y110 HydrophobicContact CG1-CG 4.35Å
97	H	97.3	Very high	95.4	Very high	52 Å²	52	55.9 Å²	55.9	24%	0.241	31%	0.31	C	S	.	.	I	π-helix	trans	-59.8	-46.4	-170.5	-171.8	56.6	0	0	0	112.6	F92 E93 R99 K107 Y133	F92-H97 HydrophobicContact CD1-CB 4.44Å; F92-H97 HydrophobicContact CE1-CB 4.48Å; F92-H97 PolarHBondContact O-N 3.47Å; E93-H97 HydrophobicContact CB-CB 4.28Å; E93-H97 HydrophobicContact CG-CB 4.2Å; E93-H97 PolarHBondContact O-N 2.88Å; E93-H97 IonicContact OE1-CD2 3.67Å; E93-H97 PolarHBondContact OE1-CD2 3.03Å; H97-R99 VanDerWaalsContact C-N 3.31Å; H97-R99 PolarHBondContact O-N 3.39Å; H97-K107 VanDerWaalsContact O-CE 3.28Å; H97-K107 WeakPolarHBondContact O-CE 3.34Å; H97-K107 PolarHBondContact O-NZ 3.19Å; H97-Y133 AromaticContact CE1-CE1 3.98Å; H97-Y133 AromaticContact ND1-CE1 3.57Å; H97-Y133 AromaticContact ND1-CZ 3.55Å; H97-Y133 PolarHBondContact ND1-OH 3.14Å
98	S	96.1	Very high	95.7	Very high	63 Å²	63	53.3 Å²	53.3	44%	0.441	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.9	-174.2	-61.1	0	0	0	0	113.9	E93 V96 Q100	E93-S98 VanDerWaalsContact O-CB 3.3Å; E93-S98 WeakPolarHBondContact O-CB 3.48Å; E93-S98 PolarHBondContact O-N 2.89Å; E93-S98 PolarHBondContact O-OG 2.79Å; V96-S98 PolarHBondContact O-N 3.31Å; S98-Q100 PolarHBondContact O-N 3.1Å; S98-Q100 PolarHBondContact O-NE2 3.1Å
99	R	93.6	Very high	95.7	Very high	110 Å²	110	56.6 Å²	56.6	42%	0.415	31%	0.309	S	S	.	.			trans	-73.2	112.8	178.8	-68.3	-173.9	69.8	-178.6	-0.5	110.2	G95 V96 H97 E101 L102 K107	G95-R99 WeakPolarHBondContact O-CD 3.42Å; V96-R99 PolarHBondContact O-N 3.44Å; H97-R99 VanDerWaalsContact C-N 3.31Å; H97-R99 PolarHBondContact O-N 3.39Å; R99-E101 VanDerWaalsContact C-N 3.32Å; R99-E101 WeakPolarHBondContact CA-OE2 3.38Å; R99-E101 WeakPolarHBondContact CB-OE2 3.44Å; R99-E101 IonicContact CZ-OE1 3.2Å; R99-E101 IonicContact NE-OE1 3.66Å; R99-E101 PolarHBondContact NE-OE1 3.42Å; R99-E101 IonicContact NH2-OE1 3.52Å; R99-E101 PolarHBondContact NH2-OE1 3.24Å; R99-L102 HydrophobicContact CB-CD1 3.97Å; R99-L102 HydrophobicContact CB-CG 4.04Å; R99-L102 PolarHBondContact O-N 3.04Å; R99-K107 WeakPolarHBondContact O-CE 3.18Å; R99-K107 PolarHBondContact O-NZ 3.17Å
100	Q	94.4	Very high	95.8	Very high	164 Å²	164	60.9 Å²	60.9	77%	0.766	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-21	-176.5	-60.4	-58.2	-35.1	0	0	112.6	S98 L102	S98-Q100 PolarHBondContact O-N 3.1Å; S98-Q100 PolarHBondContact O-NE2 3.1Å; Q100-L102 PolarHBondContact O-N 3.34Å
101	E	94.4	Very high	96	Very high	127 Å²	127	57.1 Å²	57.1	59%	0.593	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-13.1	175.6	68.8	-88.7	-146	0	0	113.5	R99	R99-E101 VanDerWaalsContact C-N 3.32Å; R99-E101 WeakPolarHBondContact CA-OE2 3.38Å; R99-E101 WeakPolarHBondContact CB-OE2 3.44Å; R99-E101 IonicContact CZ-OE1 3.2Å; R99-E101 IonicContact NE-OE1 3.66Å; R99-E101 PolarHBondContact NE-OE1 3.42Å; R99-E101 IonicContact NH2-OE1 3.52Å; R99-E101 PolarHBondContact NH2-OE1 3.24Å
102	L	94.5	Very high	96.2	Very high	29 Å²	29	54.4 Å²	54.4	15%	0.152	29%	0.293	C	S	.	.	S	Bend	trans	-96.3	127.7	177.7	-61.9	-178.6	0	0	0	109.9	V96 R99 Q100 T106 K107 Y110	V96-L102 HydrophobicContact CG1-CD1 4.15Å; R99-L102 HydrophobicContact CB-CD1 3.97Å; R99-L102 HydrophobicContact CB-CG 4.04Å; R99-L102 PolarHBondContact O-N 3.04Å; Q100-L102 PolarHBondContact O-N 3.34Å; L102-T106 HydrophobicContact CD2-CG2 4.24Å; L102-K107 HydrophobicContact CB-CG 3.87Å; L102-K107 VanDerWaalsContact O-CE 3.22Å; L102-K107 WeakPolarHBondContact O-CE 3.42Å; L102-Y110 HydrophobicContact CD1-CD2 4.46Å; L102-Y110 HydrophobicContact CD1-CE2 4.36Å
103	S	95.7	Very high	96.1	Very high	59 Å²	59	57.8 Å²	57.8	41%	0.413	32%	0.316	S	S	.	.			trans	-65	152	169.4	79.8	0	0	0	0	111	A105 T106 K107	S103-A105 PolarHBondContact O-N 2.82Å; S103-T106 WeakPolarHBondContact O-CA 3.27Å; S103-T106 WeakPolarHBondContact O-CB 3.38Å; S103-T106 PolarHBondContact O-N 3.02Å; S103-T106 PolarHBondContact OG-N 3.09Å; S103-T106 VanDerWaalsContact OG-N 3.16Å; S103-T106 PolarHBondContact OG-OG1 2.82Å; S103-K107 WeakPolarHBondContact O-CG 3.11Å; S103-K107 PolarHBondContact O-N 3.03Å
104	D	97.9	Very high	96.2	Very high	65 Å²	65	55 Å²	55	35%	0.348	30%	0.303	S	S	.	.	H	α-helix	trans	-61.2	-32.8	177.9	-74.4	-14	0	0	0	112.8	T106 K107 F108 Y133	D104-T106 PolarHBondContact O-N 2.83Å; D104-K107 PolarHBondContact O-N 3.21Å; D104-K107 IonicContact OD1-NZ 3.39Å; D104-F108 WeakPolarHBondContact O-CB 3.22Å; D104-F108 PolarHBondContact O-N 2.83Å; D104-Y133 HydrophobicContact CB-CD1 3.95Å; D104-Y133 HydrophobicContact CB-CG 4.2Å
105	A	96.1	Very high	96.5	Very high	28 Å²	28	51.4 Å²	51.4	23%	0.231	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-44.5	171.4	0	0	0	0	0	111.5	S103 F108 V109 S130	S103-A105 PolarHBondContact O-N 2.82Å; A105-F108 WeakPolarHBondContact O-CB 3.4Å; A105-F108 PolarHBondContact O-N 3.24Å; A105-V109 WeakPolarHBondContact O-CG2 3.35Å; A105-V109 PolarHBondContact O-N 3.37Å; A105-V109 VanDerWaalsContact O-N 3.08Å; A105-S130 PolarHBondContact N-OG 2.86Å
106	T	96.6	Very high	96.7	Very high	56 Å²	56	56.4 Å²	56.4	34%	0.344	29%	0.291	S	S	.	.	H	α-helix	trans	-65.3	-43.8	175.8	-50.5	0	0	0	0	111.5	L102 S103 D104 F108 V109 Y110	L102-T106 HydrophobicContact CD2-CG2 4.24Å; S103-T106 WeakPolarHBondContact O-CA 3.27Å; S103-T106 WeakPolarHBondContact O-CB 3.38Å; S103-T106 PolarHBondContact O-N 3.02Å; S103-T106 PolarHBondContact OG-N 3.09Å; S103-T106 VanDerWaalsContact OG-N 3.16Å; S103-T106 PolarHBondContact OG-OG1 2.82Å; D104-T106 PolarHBondContact O-N 2.83Å; T106-F108 PolarHBondContact O-N 3.09Å; T106-V109 WeakPolarHBondContact O-CB 3.31Å; T106-V109 PolarHBondContact O-N 3.07Å; T106-Y110 HydrophobicContact CG2-CD2 4.05Å; T106-Y110 HydrophobicContact CG2-CE2 3.69Å; T106-Y110 VanDerWaalsContact O-CD2 3.27Å; T106-Y110 WeakPolarHBondContact O-CD2 3.2Å; T106-Y110 PolarHBondContact O-N 3.36Å; T106-Y110 VanDerWaalsContact O-N 3.1Å
107	K	98.3	Very high	96.7	Very high	13 Å²	13	58.3 Å²	58.3	6%	0.057	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-36	174.1	-66.4	178.2	-176.4	170.5	0	111.2	V96 H97 R99 L102 S103 D104 Y110 L111 Y133	V96-K107 HydrophobicContact CG1-CB 4.12Å; V96-K107 HydrophobicContact CG1-CG 4.02Å; H97-K107 VanDerWaalsContact O-CE 3.28Å; H97-K107 WeakPolarHBondContact O-CE 3.34Å; H97-K107 PolarHBondContact O-NZ 3.19Å; R99-K107 WeakPolarHBondContact O-CE 3.18Å; R99-K107 PolarHBondContact O-NZ 3.17Å; L102-K107 HydrophobicContact CB-CG 3.87Å; L102-K107 VanDerWaalsContact O-CE 3.22Å; L102-K107 WeakPolarHBondContact O-CE 3.42Å; S103-K107 WeakPolarHBondContact O-CG 3.11Å; S103-K107 PolarHBondContact O-N 3.03Å; D104-K107 PolarHBondContact O-N 3.21Å; D104-K107 IonicContact OD1-NZ 3.39Å; K107-Y110 PolarHBondContact O-N 3.31Å; K107-L111 WeakPolarHBondContact O-CB 3.28Å; K107-L111 PolarHBondContact O-N 3.24Å; K107-Y133 HydrophobicContact CB-CD1 4.41Å; K107-Y133 HydrophobicContact CB-CD2 4.07Å; K107-Y133 HydrophobicContact CB-CE1 4Å; K107-Y133 HydrophobicContact CB-CE2 3.62Å; K107-Y133 HydrophobicContact CB-CG 4.43Å; K107-Y133 HydrophobicContact CD-CE1 3.81Å
108	F	98.2	Very high	96.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-70.1	-37.8	178.1	-164.3	-170.1	0	0	0	112.9	D104 A105 T106 Y110 L111 K112 L126 P127 L128 N132 Y133 A136	D104-F108 WeakPolarHBondContact O-CB 3.22Å; D104-F108 PolarHBondContact O-N 2.83Å; A105-F108 WeakPolarHBondContact O-CB 3.4Å; A105-F108 PolarHBondContact O-N 3.24Å; T106-F108 PolarHBondContact O-N 3.09Å; F108-Y110 VanDerWaalsContact C-N 3.34Å; F108-Y110 PolarHBondContact O-N 3.47Å; F108-L111 HydrophobicContact CD2-CB 4.34Å; F108-L111 HydrophobicContact CD2-CD2 4.29Å; F108-L111 PolarHBondContact O-N 3.26Å; F108-K112 HydrophobicContact CD2-CG 4Å; F108-K112 HydrophobicContact CE2-CD 4.15Å; F108-K112 HydrophobicContact CE2-CG 3.69Å; F108-K112 HydrophobicContact CZ-CD 4.43Å; F108-K112 HydrophobicContact CZ-CG 4.44Å; F108-K112 PolarHBondContact O-N 3.1Å; F108-L126 HydrophobicContact CE1-CB 4.12Å; F108-L126 HydrophobicContact CZ-CB 3.79Å; F108-L126 HydrophobicContact CZ-CD1 4.26Å; F108-P127 VanDerWaalsContact CE1-O 3.3Å; F108-P127 WeakPolarHBondContact CE1-O 3.31Å; F108-L128 HydrophobicContact CB-CD2 4.24Å; F108-L128 HydrophobicContact CD1-CD2 3.91Å; F108-L128 HydrophobicContact CD2-CD2 4.4Å; F108-L128 HydrophobicContact CE1-CD2 4.38Å; F108-L128 HydrophobicContact CG-CD2 3.91Å; F108-N132 HydrophobicContact CD1-CB 4.32Å; F108-N132 HydrophobicContact CE1-CB 3.74Å; F108-Y133 HydrophobicContact CB-CD2 3.8Å; F108-Y133 HydrophobicContact CB-CG 4.38Å; F108-Y133 HydrophobicContact CD2-CD2 4.42Å; F108-Y133 HydrophobicContact CG-CD2 4.29Å; F108-A136 HydrophobicContact CD2-CB 4.15Å; F108-A136 HydrophobicContact CE2-CB 3.44Å; F108-A136 VanDerWaalsContact CE2-CB 3.44Å; F108-A136 HydrophobicContact CZ-CB 3.72Å
109	V	97.3	Very high	96.8	Very high	77 Å²	77	54.3 Å²	54.3	47%	0.467	29%	0.291	S	S	.	.	H	α-helix	trans	-58.3	-48.8	171.7	174.2	0	0	0	0	110.3	A105 T106 L111 K112 S113 L128	A105-V109 WeakPolarHBondContact O-CG2 3.35Å; A105-V109 PolarHBondContact O-N 3.37Å; A105-V109 VanDerWaalsContact O-N 3.08Å; T106-V109 WeakPolarHBondContact O-CB 3.31Å; T106-V109 PolarHBondContact O-N 3.07Å; V109-L111 PolarHBondContact O-N 3Å; V109-K112 PolarHBondContact O-N 3.03Å; V109-S113 PolarHBondContact O-N 3.47Å; V109-S113 PolarHBondContact O-OG 3.08Å; V109-L128 HydrophobicContact CG2-CD1 4.24Å; V109-L128 HydrophobicContact CG2-CD2 3.97Å
110	Y	97.6	Very high	97	Very high	103 Å²	103	51.8 Å²	51.8	40%	0.404	29%	0.285	S	S	.	.	H	α-helix	trans	-60.6	-45.9	175.9	-75.9	-60.4	0	0	0	111.9	L75 V96 L102 T106 K107 F108 K112 S113 A114	L75-Y110 HydrophobicContact CD1-CD1 4.33Å; L75-Y110 HydrophobicContact CD2-CD1 4.22Å; V96-Y110 HydrophobicContact CG1-CD2 4.17Å; V96-Y110 HydrophobicContact CG1-CG 4.35Å; L102-Y110 HydrophobicContact CD1-CD2 4.46Å; L102-Y110 HydrophobicContact CD1-CE2 4.36Å; T106-Y110 HydrophobicContact CG2-CD2 4.05Å; T106-Y110 HydrophobicContact CG2-CE2 3.69Å; T106-Y110 VanDerWaalsContact O-CD2 3.27Å; T106-Y110 WeakPolarHBondContact O-CD2 3.2Å; T106-Y110 PolarHBondContact O-N 3.36Å; T106-Y110 VanDerWaalsContact O-N 3.1Å; K107-Y110 PolarHBondContact O-N 3.31Å; F108-Y110 VanDerWaalsContact C-N 3.34Å; F108-Y110 PolarHBondContact O-N 3.47Å; Y110-K112 PolarHBondContact O-N 3.39Å; Y110-S113 WeakPolarHBondContact CA-OG 3.3Å; Y110-S113 PolarHBondContact O-N 3.19Å; Y110-S113 PolarHBondContact O-OG 2.85Å; Y110-A114 WeakPolarHBondContact O-CB 3.05Å; Y110-A114 PolarHBondContact O-N 2.78Å
111	L	98.4	Very high	97.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-53.9	177.7	-175.9	61.9	0	0	0	110.7	F88 F92 K107 F108 V109 S113 A114 L115 Y133 A136 V137 L140	F88-L111 HydrophobicContact CZ-CD1 4.5Å; F92-L111 HydrophobicContact CD1-CD1 4.29Å; F92-L111 HydrophobicContact CE1-CB 4.34Å; F92-L111 HydrophobicContact CE1-CD1 3.8Å; F92-L111 HydrophobicContact CE2-CB 4.2Å; F92-L111 HydrophobicContact CE2-CD1 4.07Å; F92-L111 HydrophobicContact CZ-CB 3.62Å; F92-L111 HydrophobicContact CZ-CD1 3.69Å; F92-L111 HydrophobicContact CZ-CG 4.24Å; K107-L111 WeakPolarHBondContact O-CB 3.28Å; K107-L111 PolarHBondContact O-N 3.24Å; F108-L111 HydrophobicContact CD2-CB 4.34Å; F108-L111 HydrophobicContact CD2-CD2 4.29Å; F108-L111 PolarHBondContact O-N 3.26Å; V109-L111 PolarHBondContact O-N 3Å; L111-S113 VanDerWaalsContact C-N 3.29Å; L111-S113 PolarHBondContact O-N 2.93Å; L111-A114 WeakPolarHBondContact O-CB 3.37Å; L111-A114 PolarHBondContact O-N 2.72Å; L111-L115 HydrophobicContact CD1-CD1 4.48Å; L111-L115 HydrophobicContact CD1-CD2 4.5Å; L111-L115 HydrophobicContact CG-CD1 4.21Å; L111-L115 VanDerWaalsContact O-CG 3.27Å; L111-L115 WeakPolarHBondContact O-CG 3.4Å; L111-L115 PolarHBondContact O-N 3.4Å; L111-Y133 HydrophobicContact CB-CE2 4.3Å; L111-Y133 HydrophobicContact CD2-CD2 4.26Å; L111-Y133 HydrophobicContact CD2-CE2 3.96Å; L111-A136 HydrophobicContact CD2-CB 4.06Å; L111-V137 HydrophobicContact CD2-CG2 4.11Å; L111-L140 HydrophobicContact CD1-CD1 3.69Å; L111-L140 HydrophobicContact CD2-CD1 3.86Å; L111-L140 HydrophobicContact CG-CD1 4.04Å
112	K	97.5	Very high	97.3	Very high	39 Å²	39	45.6 Å²	45.6	17%	0.17	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-39.3	178.6	-76.1	-164.1	-179.9	-174.7	0	112.8	F108 V109 Y110 A114 L115 L120 V123 T124 L126 L128	F108-K112 HydrophobicContact CD2-CG 4Å; F108-K112 HydrophobicContact CE2-CD 4.15Å; F108-K112 HydrophobicContact CE2-CG 3.69Å; F108-K112 HydrophobicContact CZ-CD 4.43Å; F108-K112 HydrophobicContact CZ-CG 4.44Å; F108-K112 PolarHBondContact O-N 3.1Å; V109-K112 PolarHBondContact O-N 3.03Å; Y110-K112 PolarHBondContact O-N 3.39Å; K112-A114 VanDerWaalsContact C-N 3.25Å; K112-A114 PolarHBondContact O-N 2.93Å; K112-L115 PolarHBondContact O-N 3.36Å; K112-L120 HydrophobicContact CB-CD1 4.4Å; K112-V123 WeakPolarHBondContact CE-O 3.32Å; K112-V123 HydrophobicContact CG-CG2 4.33Å; K112-V123 PolarHBondContact NZ-O 3.19Å; K112-T124 PolarHBondContact NZ-O 2.86Å; K112-L126 PolarHBondContact NZ-O 3.1Å; K112-L128 HydrophobicContact CD-CD2 3.9Å; K112-L128 HydrophobicContact CD-CG 4.45Å; K112-L128 HydrophobicContact CG-CD2 4.45Å
113	S	96.8	Very high	97.5	Very high	71 Å²	71	44.2 Å²	44.2	50%	0.497	25%	0.253	S	S	.	.	H	α-helix	trans	-67.4	-25.2	178	73.5	0	0	0	0	113.7	L75 V109 Y110 L111	L75-S113 WeakPolarHBondContact CD2-OG 3.41Å; V109-S113 PolarHBondContact O-N 3.47Å; V109-S113 PolarHBondContact O-OG 3.08Å; Y110-S113 WeakPolarHBondContact CA-OG 3.3Å; Y110-S113 PolarHBondContact O-N 3.19Å; Y110-S113 PolarHBondContact O-OG 2.85Å; L111-S113 VanDerWaalsContact C-N 3.29Å; L111-S113 PolarHBondContact O-N 2.93Å
114	A	97.9	Very high	97.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-80.4	-19.7	176.7	0	0	0	0	0	113.4	L75 P76 V77 F78 F88 F92 Y110 L111 K112	L75-A114 HydrophobicContact CD2-CB 3.94Å; L75-A114 HydrophobicContact CG-CB 4.09Å; P76-A114 WeakPolarHBondContact O-CB 3.08Å; V77-A114 CarbonylContact C-O 3.56Å; V77-A114 VanDerWaalsContact CA-O 3.3Å; V77-A114 WeakPolarHBondContact CA-O 3.48Å; F78-A114 PolarHBondContact N-O 3.47Å; F88-A114 HydrophobicContact CE2-CB 4.05Å; F88-A114 HydrophobicContact CZ-CB 4.34Å; F92-A114 HydrophobicContact CD2-CB 4.39Å; F92-A114 HydrophobicContact CE2-CB 4.38Å; Y110-A114 WeakPolarHBondContact O-CB 3.05Å; Y110-A114 PolarHBondContact O-N 2.78Å; L111-A114 WeakPolarHBondContact O-CB 3.37Å; L111-A114 PolarHBondContact O-N 2.72Å; K112-A114 VanDerWaalsContact C-N 3.25Å; K112-A114 PolarHBondContact O-N 2.93Å
115	L	98.5	Very high	97.3	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-92.3	144.5	-173.3	-59.8	170	0	0	0	112.4	F78 F88 L111 K112 A119 L120 V123 L140	F78-L115 HydrophobicContact CB-CD2 4.08Å; F78-L115 HydrophobicContact CD1-CD2 3.94Å; F88-L115 HydrophobicContact CE1-CD2 4.4Å; F88-L115 HydrophobicContact CZ-CD2 4.15Å; L111-L115 HydrophobicContact CD1-CD1 4.48Å; L111-L115 HydrophobicContact CD1-CD2 4.5Å; L111-L115 HydrophobicContact CG-CD1 4.21Å; L111-L115 VanDerWaalsContact O-CG 3.27Å; L111-L115 WeakPolarHBondContact O-CG 3.4Å; L111-L115 PolarHBondContact O-N 3.4Å; K112-L115 PolarHBondContact O-N 3.36Å; L115-A119 HydrophobicContact CD2-CB 4.07Å; L115-L120 HydrophobicContact CB-CB 3.86Å; L115-L120 HydrophobicContact CB-CD1 4.29Å; L115-V123 HydrophobicContact CD1-CG2 3.54Å; L115-L140 HydrophobicContact CD1-CD1 3.91Å; L115-L140 HydrophobicContact CD1-CD2 4.09Å; L115-L140 HydrophobicContact CD2-CD1 3.99Å; L115-L140 HydrophobicContact CD2-CD2 3.94Å
116	K	97.5	Very high	97.3	Very high	120 Å²	120	46 Å²	46	52%	0.522	28%	0.275	S	S	.	.			trans	-135.8	154	172.1	-64	-175.2	179.8	177.6	0	111.2	V77 F78 S80	V77-K116 HydrophobicContact CG1-CD 3.63Å; V77-K116 HydrophobicContact CG1-CG 3.96Å; F78-K116 PolarHBondContact O-N 2.9Å; S80-K116 PolarHBondContact OG-O 3.29Å
117	G	96.7	Very high	97.3	Very high	43 Å²	43	47.3 Å²	47.3	44%	0.443	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	-141.3	176.6	0	0	0	0	0	112.9	A119 L120 E121	G117-A119 PolarHBondContact O-N 3Å; G117-A119 VanDerWaalsContact O-N 3.09Å; G117-L120 PolarHBondContact O-N 2.66Å; G117-E121 PolarHBondContact O-N 2.69Å
118	A	97	Very high	97.1	Very high	31 Å²	31	51.2 Å²	51.2	26%	0.256	31%	0.305	S	S	.	.	H	α-helix	trans	-57.1	-27	-175.4	0	0	0	0	0	114.3	S80 A122 F144	S80-A118 PolarHBondContact OG-N 2.94Å; S80-A118 VanDerWaalsContact OG-N 3.08Å; A118-A122 WeakPolarHBondContact O-CB 3.18Å; A118-A122 PolarHBondContact O-N 2.64Å; A118-F144 HydrophobicContact CB-CZ 4.33Å
119	A	97.9	Very high	96.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-72.7	-39.7	177.1	0	0	0	0	0	112.2	F78 S80 L115 G117 L140 F144	F78-A119 HydrophobicContact CD1-CB 3.54Å; F78-A119 HydrophobicContact CE1-CB 3.63Å; S80-A119 WeakPolarHBondContact OG-CB 3.39Å; S80-A119 PolarHBondContact OG-N 3.2Å; L115-A119 HydrophobicContact CD2-CB 4.07Å; G117-A119 PolarHBondContact O-N 3Å; G117-A119 VanDerWaalsContact O-N 3.09Å; A119-L140 HydrophobicContact CB-CD2 4.02Å; A119-F144 HydrophobicContact CB-CD2 4.36Å; A119-F144 HydrophobicContact CB-CE2 3.75Å; A119-F144 HydrophobicContact CB-CZ 3.84Å
120	L	98.3	Very high	96.8	Very high	57 Å²	57	53.2 Å²	53.2	30%	0.298	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-49.2	171.9	178.3	58.5	0	0	0	109.7	K112 L115 G117 A122 V123 T124	K112-L120 HydrophobicContact CB-CD1 4.4Å; L115-L120 HydrophobicContact CB-CB 3.86Å; L115-L120 HydrophobicContact CB-CD1 4.29Å; G117-L120 PolarHBondContact O-N 2.66Å; L120-A122 PolarHBondContact O-N 3.02Å; L120-A122 VanDerWaalsContact O-N 3.14Å; L120-V123 CarbonylContact O-C 3.57Å; L120-V123 WeakPolarHBondContact O-CG2 3.4Å; L120-V123 PolarHBondContact O-N 2.7Å; L120-T124 PolarHBondContact O-N 3.3Å; L120-T124 PolarHBondContact O-OG1 3.21Å
121	E	97.7	Very high	96.8	Very high	139 Å²	139	52 Å²	52	65%	0.65	33%	0.331	S	S	*	.	H	α-helix	trans	-52.9	-37	177.9	-69.4	170.5	-170.6	0	0	112.9	G117 V123	G117-E121 PolarHBondContact O-N 2.69Å; E121-V123 PolarHBondContact O-N 3.45Å
122	A	97.1	Very high	96.7	Very high	23 Å²	23	53.6 Å²	53.6	19%	0.19	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-27.7	178.5	0	0	0	0	0	113.8	A118 L120 I139 R143	A118-A122 WeakPolarHBondContact O-CB 3.18Å; A118-A122 PolarHBondContact O-N 2.64Å; L120-A122 PolarHBondContact O-N 3.02Å; L120-A122 VanDerWaalsContact O-N 3.14Å; A122-I139 HydrophobicContact CB-CG2 3.82Å; A122-R143 VanDerWaalsContact CB-NH1 3.34Å
123	V	97.5	Very high	96.8	Very high	0 Å²	0	52 Å²	52	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-120.2	-2.6	-175	-55.8	0	0	0	0	113.2	K112 L115 L120 E121 G125 L126 A136 I139 L140	K112-V123 WeakPolarHBondContact CE-O 3.32Å; K112-V123 HydrophobicContact CG-CG2 4.33Å; K112-V123 PolarHBondContact NZ-O 3.19Å; L115-V123 HydrophobicContact CD1-CG2 3.54Å; L120-V123 CarbonylContact O-C 3.57Å; L120-V123 WeakPolarHBondContact O-CG2 3.4Å; L120-V123 PolarHBondContact O-N 2.7Å; E121-V123 PolarHBondContact O-N 3.45Å; V123-G125 VanDerWaalsContact C-N 3.26Å; V123-G125 PolarHBondContact O-N 3.4Å; V123-L126 HydrophobicContact CB-CD1 4.34Å; V123-L126 WeakPolarHBondContact O-CB 3.44Å; V123-L126 PolarHBondContact O-N 3.22Å; V123-L126 VanDerWaalsContact O-N 3.12Å; V123-A136 HydrophobicContact CB-CB 4.26Å; V123-A136 HydrophobicContact CG1-CB 3.93Å; V123-I139 HydrophobicContact CG1-CB 4.4Å; V123-I139 HydrophobicContact CG1-CG2 4.11Å; V123-L140 HydrophobicContact CG1-CG 4.29Å
124	T	95.4	Very high	96.8	Very high	81 Å²	81	51.2 Å²	51.2	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-55.2	-42.8	-177.9	-65	0	0	0	0	111.7	K112 L120 L126	K112-T124 PolarHBondContact NZ-O 2.86Å; L120-T124 PolarHBondContact O-N 3.3Å; L120-T124 PolarHBondContact O-OG1 3.21Å; T124-L126 PolarHBondContact O-N 3.37Å
125	G	94.4	Very high	96.9	Very high	75 Å²	75	54.2 Å²	54.2	77%	0.773	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-8	-177.7	0	0	0	0	0	115.5	V123 P127	V123-G125 VanDerWaalsContact C-N 3.26Å; V123-G125 PolarHBondContact O-N 3.4Å; G125-P127 WeakPolarHBondContact O-CD 3.39Å
126	L	96.2	Very high	96.9	Very high	34 Å²	34	54 Å²	54	18%	0.178	35%	0.347	C	S	.	.	S	Bend	trans	-84	122.9	177.5	-65.4	179	0	0	0	110.6	F108 K112 V123 T124 N132 V135 A136 I139	F108-L126 HydrophobicContact CE1-CB 4.12Å; F108-L126 HydrophobicContact CZ-CB 3.79Å; F108-L126 HydrophobicContact CZ-CD1 4.26Å; K112-L126 PolarHBondContact NZ-O 3.1Å; V123-L126 HydrophobicContact CB-CD1 4.34Å; V123-L126 WeakPolarHBondContact O-CB 3.44Å; V123-L126 PolarHBondContact O-N 3.22Å; V123-L126 VanDerWaalsContact O-N 3.12Å; T124-L126 PolarHBondContact O-N 3.37Å; L126-N132 HydrophobicContact CB-CB 4.35Å; L126-V135 HydrophobicContact CD1-CB 4.49Å; L126-V135 HydrophobicContact CD1-CG1 4.22Å; L126-V135 HydrophobicContact CD2-CG1 4.44Å; L126-A136 HydrophobicContact CD1-CB 3.82Å; L126-I139 HydrophobicContact CD1-CD1 3.91Å
127	P	96.2	Very high	96.9	Very high	83 Å²	83	48.6 Å²	48.6	54%	0.539	32%	0.324	S	S	.	.			trans	-56.2	143	172.8	-26.3	33.6	0	0	0	112.4	F108 G125 T129 N132	F108-P127 VanDerWaalsContact CE1-O 3.3Å; F108-P127 WeakPolarHBondContact CE1-O 3.31Å; G125-P127 WeakPolarHBondContact O-CD 3.39Å; P127-T129 HydrophobicContact CB-CG2 4.13Å; P127-T129 PolarHBondContact O-N 3.26Å; P127-N132 WeakPolarHBondContact CD-ND2 3.22Å; P127-N132 WeakPolarHBondContact O-CB 3.2Å; P127-N132 PolarHBondContact O-ND2 3.08Å
128	L	94.6	Very high	97	Very high	95 Å²	95	50.8 Å²	50.8	50%	0.497	33%	0.326	S	S	.	.	S	Bend	trans	-70.3	76.1	177.8	-78.3	169.9	0	0	0	111.3	F108 V109 K112	F108-L128 HydrophobicContact CB-CD2 4.24Å; F108-L128 HydrophobicContact CD1-CD2 3.91Å; F108-L128 HydrophobicContact CD2-CD2 4.4Å; F108-L128 HydrophobicContact CE1-CD2 4.38Å; F108-L128 HydrophobicContact CG-CD2 3.91Å; V109-L128 HydrophobicContact CG2-CD1 4.24Å; V109-L128 HydrophobicContact CG2-CD2 3.97Å; K112-L128 HydrophobicContact CD-CD2 3.9Å; K112-L128 HydrophobicContact CD-CG 4.45Å; K112-L128 HydrophobicContact CG-CD2 4.45Å
129	T	95.1	Very high	97	Very high	60 Å²	60	51.9 Å²	51.9	37%	0.368	33%	0.327	S	S	.	.			trans	-125.6	156.5	178.1	66.6	0	0	0	0	110.2	P127 A131 N132 Y133	P127-T129 HydrophobicContact CB-CG2 4.13Å; P127-T129 PolarHBondContact O-N 3.26Å; T129-A131 VanDerWaalsContact C-N 3.29Å; T129-A131 PolarHBondContact O-N 3.14Å; T129-N132 PolarHBondContact O-N 3.36Å; T129-N132 PolarHBondContact OG1-N 2.98Å; T129-N132 PolarHBondContact OG1-ND2 2.65Å; T129-Y133 PolarHBondContact O-N 3.39Å
130	S	95.6	Very high	97	Very high	59 Å²	59	51.9 Å²	51.9	41%	0.413	33%	0.327	S	S	.	.	H	α-helix	trans	-56.7	-42.5	176.6	-57.9	0	0	0	0	112.2	A105 N132 Y133	A105-S130 PolarHBondContact N-OG 2.86Å; S130-N132 VanDerWaalsContact C-N 3.3Å; S130-N132 PolarHBondContact O-N 3.29Å; S130-Y133 WeakPolarHBondContact O-CB 3.44Å; S130-Y133 PolarHBondContact O-N 3.16Å
131	A	96.1	Very high	96.9	Very high	77 Å²	77	52.6 Å²	52.6	64%	0.636	33%	0.328	S	S	*	.	H	α-helix	trans	-62.2	-34.9	-179.7	0	0	0	0	0	113.3	T129 Y133	T129-A131 VanDerWaalsContact C-N 3.29Å; T129-A131 PolarHBondContact O-N 3.14Å; A131-Y133 VanDerWaalsContact C-N 3.32Å; A131-Y133 PolarHBondContact O-N 3.06Å
132	N	97.8	Very high	96.7	Very high	34 Å²	34	51.2 Å²	51.2	18%	0.182	33%	0.325	C	S	.	.	H	α-helix	trans	-80.8	-11.3	-177.4	-72.4	-26.1	0	0	0	113.6	F108 L126 P127 T129 S130 V135 A136	F108-N132 HydrophobicContact CD1-CB 4.32Å; F108-N132 HydrophobicContact CE1-CB 3.74Å; L126-N132 HydrophobicContact CB-CB 4.35Å; P127-N132 WeakPolarHBondContact CD-ND2 3.22Å; P127-N132 WeakPolarHBondContact O-CB 3.2Å; P127-N132 PolarHBondContact O-ND2 3.08Å; T129-N132 PolarHBondContact O-N 3.36Å; T129-N132 PolarHBondContact OG1-N 2.98Å; T129-N132 PolarHBondContact OG1-ND2 2.65Å; S130-N132 VanDerWaalsContact C-N 3.3Å; S130-N132 PolarHBondContact O-N 3.29Å; N132-V135 PolarHBondContact O-N 3.44Å; N132-A136 WeakPolarHBondContact O-CB 3.41Å; N132-A136 PolarHBondContact O-N 3.4Å
133	Y	98.5	Very high	96.6	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.02	34%	0.339	C	S	.	.	H	α-helix	trans	-61.4	-50.5	178.8	176.2	-117	0	0	0	111.7	H97 D104 K107 F108 L111 T129 S130 A131 V135 A136 V137	H97-Y133 AromaticContact CE1-CE1 3.98Å; H97-Y133 AromaticContact ND1-CE1 3.57Å; H97-Y133 AromaticContact ND1-CZ 3.55Å; H97-Y133 PolarHBondContact ND1-OH 3.14Å; D104-Y133 HydrophobicContact CB-CD1 3.95Å; D104-Y133 HydrophobicContact CB-CG 4.2Å; K107-Y133 HydrophobicContact CB-CD1 4.41Å; K107-Y133 HydrophobicContact CB-CD2 4.07Å; K107-Y133 HydrophobicContact CB-CE1 4Å; K107-Y133 HydrophobicContact CB-CE2 3.62Å; K107-Y133 HydrophobicContact CB-CG 4.43Å; K107-Y133 HydrophobicContact CD-CE1 3.81Å; F108-Y133 HydrophobicContact CB-CD2 3.8Å; F108-Y133 HydrophobicContact CB-CG 4.38Å; F108-Y133 HydrophobicContact CD2-CD2 4.42Å; F108-Y133 HydrophobicContact CG-CD2 4.29Å; L111-Y133 HydrophobicContact CB-CE2 4.3Å; L111-Y133 HydrophobicContact CD2-CD2 4.26Å; L111-Y133 HydrophobicContact CD2-CE2 3.96Å; T129-Y133 PolarHBondContact O-N 3.39Å; S130-Y133 WeakPolarHBondContact O-CB 3.44Å; S130-Y133 PolarHBondContact O-N 3.16Å; A131-Y133 VanDerWaalsContact C-N 3.32Å; A131-Y133 PolarHBondContact O-N 3.06Å; Y133-V135 VanDerWaalsContact C-N 3.31Å; Y133-V135 PolarHBondContact O-N 3.21Å; Y133-A136 WeakPolarHBondContact O-CB 3.47Å; Y133-A136 PolarHBondContact O-N 3.44Å; Y133-A136 VanDerWaalsContact O-N 3.13Å; Y133-V137 HydrophobicContact CD2-CG2 4.28Å; Y133-V137 HydrophobicContact CE1-CG2 4.19Å; Y133-V137 HydrophobicContact CE2-CG2 3.83Å; Y133-V137 WeakPolarHBondContact O-CG2 3.43Å; Y133-V137 PolarHBondContact O-N 3.2Å
134	A	97.7	Very high	96.6	Very high	54 Å²	54	56.9 Å²	56.9	45%	0.446	34%	0.342	S	S	.	.	H	α-helix	trans	-58.3	-44.8	178.2	0	0	0	0	0	111.3	A136 V137 D138	A134-A136 VanDerWaalsContact C-N 3.33Å; A134-A136 PolarHBondContact O-N 3.14Å; A134-V137 WeakPolarHBondContact O-CB 3.06Å; A134-V137 PolarHBondContact O-N 3.1Å; A134-D138 PolarHBondContact O-N 3.41Å
135	V	98.4	Very high	96.4	Very high	64 Å²	64	54 Å²	54	39%	0.388	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-43	176.2	-177.1	0	0	0	0	111.6	L126 N132 Y133 D138 I139	L126-V135 HydrophobicContact CD1-CB 4.49Å; L126-V135 HydrophobicContact CD1-CG1 4.22Å; L126-V135 HydrophobicContact CD2-CG1 4.44Å; N132-V135 PolarHBondContact O-N 3.44Å; Y133-V135 VanDerWaalsContact C-N 3.31Å; Y133-V135 PolarHBondContact O-N 3.21Å; V135-D138 PolarHBondContact O-N 2.78Å; V135-I139 HydrophobicContact CG1-CD1 4.04Å; V135-I139 VanDerWaalsContact O-CG1 3.26Å; V135-I139 WeakPolarHBondContact O-CG1 3.43Å; V135-I139 PolarHBondContact O-N 2.98Å
136	A	98.4	Very high	96.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-41	177.4	0	0	0	0	0	112.1	F108 L111 V123 L126 N132 Y133 A134 I139 L140	F108-A136 HydrophobicContact CD2-CB 4.15Å; F108-A136 HydrophobicContact CE2-CB 3.44Å; F108-A136 VanDerWaalsContact CE2-CB 3.44Å; F108-A136 HydrophobicContact CZ-CB 3.72Å; L111-A136 HydrophobicContact CD2-CB 4.06Å; V123-A136 HydrophobicContact CB-CB 4.26Å; V123-A136 HydrophobicContact CG1-CB 3.93Å; L126-A136 HydrophobicContact CD1-CB 3.82Å; N132-A136 WeakPolarHBondContact O-CB 3.41Å; N132-A136 PolarHBondContact O-N 3.4Å; Y133-A136 WeakPolarHBondContact O-CB 3.47Å; Y133-A136 PolarHBondContact O-N 3.44Å; Y133-A136 VanDerWaalsContact O-N 3.13Å; A134-A136 VanDerWaalsContact C-N 3.33Å; A134-A136 PolarHBondContact O-N 3.14Å; A136-I139 PolarHBondContact O-N 3.38Å; A136-L140 VanDerWaalsContact O-CG 3.31Å; A136-L140 WeakPolarHBondContact O-CG 3.49Å; A136-L140 PolarHBondContact O-N 3.41Å; A136-L140 VanDerWaalsContact O-N 3.08Å
137	V	98.5	Very high	95.9	Very high	6 Å²	6	56.1 Å²	56.1	4%	0.036	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-46	175	170.1	0	0	0	0	110.8	W89 L111 Y133 A134 I139 L140 K141	W89-V137 HydrophobicContact CH2-CB 4.16Å; W89-V137 HydrophobicContact CH2-CG1 3.4Å; W89-V137 HydrophobicContact CH2-CG2 3.75Å; W89-V137 HydrophobicContact CZ2-CG1 3.85Å; W89-V137 HydrophobicContact CZ3-CG1 4.19Å; W89-V137 HydrophobicContact CZ3-CG2 4.34Å; L111-V137 HydrophobicContact CD2-CG2 4.11Å; Y133-V137 HydrophobicContact CD2-CG2 4.28Å; Y133-V137 HydrophobicContact CE1-CG2 4.19Å; Y133-V137 HydrophobicContact CE2-CG2 3.83Å; Y133-V137 WeakPolarHBondContact O-CG2 3.43Å; Y133-V137 PolarHBondContact O-N 3.2Å; A134-V137 WeakPolarHBondContact O-CB 3.06Å; A134-V137 PolarHBondContact O-N 3.1Å; V137-I139 PolarHBondContact O-N 3.49Å; V137-L140 PolarHBondContact O-N 3.09Å; V137-K141 HydrophobicContact CG1-CD 4.03Å; V137-K141 HydrophobicContact CG1-CG 4.38Å; V137-K141 PolarHBondContact O-N 3.27Å
138	D	98.1	Very high	95.5	Very high	90 Å²	90	55 Å²	55	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-42.8	178.8	-71.9	-18.8	0	0	0	111.8	A134 V135 L140 K141 N142	A134-D138 PolarHBondContact O-N 3.41Å; V135-D138 PolarHBondContact O-N 2.78Å; D138-L140 VanDerWaalsContact C-N 3.3Å; D138-L140 PolarHBondContact O-N 3.15Å; D138-K141 PolarHBondContact O-N 2.92Å; D138-N142 WeakPolarHBondContact O-CB 3.13Å; D138-N142 VanDerWaalsContact O-CG 3.25Å; D138-N142 PolarHBondContact O-N 3.23Å; D138-N142 PolarHBondContact O-ND2 3.48Å
139	I	98.2	Very high	95.4	Very high	53 Å²	53	52.8 Å²	52.8	27%	0.272	30%	0.298	S	S	.	.	H	α-helix	trans	-57.4	-45.1	174.3	-72.2	167.5	0	0	0	110.7	A122 V123 L126 V135 A136 V137 R143	A122-I139 HydrophobicContact CB-CG2 3.82Å; V123-I139 HydrophobicContact CG1-CB 4.4Å; V123-I139 HydrophobicContact CG1-CG2 4.11Å; L126-I139 HydrophobicContact CD1-CD1 3.91Å; V135-I139 HydrophobicContact CG1-CD1 4.04Å; V135-I139 VanDerWaalsContact O-CG1 3.26Å; V135-I139 WeakPolarHBondContact O-CG1 3.43Å; V135-I139 PolarHBondContact O-N 2.98Å; A136-I139 PolarHBondContact O-N 3.38Å; V137-I139 PolarHBondContact O-N 3.49Å; I139-R143 WeakPolarHBondContact O-CB 3.43Å; I139-R143 PolarHBondContact O-N 2.9Å
140	L	98.2	Very high	95.2	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-47.3	-179	-71.1	170.1	0	0	0	112.1	F85 L111 L115 A119 V123 A136 V137 D138 R143 F144 G145	F85-L140 HydrophobicContact CE2-CB 4.3Å; L111-L140 HydrophobicContact CD1-CD1 3.69Å; L111-L140 HydrophobicContact CD2-CD1 3.86Å; L111-L140 HydrophobicContact CG-CD1 4.04Å; L115-L140 HydrophobicContact CD1-CD1 3.91Å; L115-L140 HydrophobicContact CD1-CD2 4.09Å; L115-L140 HydrophobicContact CD2-CD1 3.99Å; L115-L140 HydrophobicContact CD2-CD2 3.94Å; A119-L140 HydrophobicContact CB-CD2 4.02Å; V123-L140 HydrophobicContact CG1-CG 4.29Å; A136-L140 VanDerWaalsContact O-CG 3.31Å; A136-L140 WeakPolarHBondContact O-CG 3.49Å; A136-L140 PolarHBondContact O-N 3.41Å; A136-L140 VanDerWaalsContact O-N 3.08Å; V137-L140 PolarHBondContact O-N 3.09Å; D138-L140 VanDerWaalsContact C-N 3.3Å; D138-L140 PolarHBondContact O-N 3.15Å; L140-R143 PolarHBondContact O-N 2.78Å; L140-F144 HydrophobicContact CD2-CD2 4.02Å; L140-F144 HydrophobicContact CD2-CE2 4.06Å; L140-F144 PolarHBondContact O-N 2.92Å; L140-G145 PolarHBondContact O-N 3.31Å
141	K	96.1	Very high	95	Very high	72 Å²	72	48.7 Å²	48.7	31%	0.313	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-46	177.8	-73.7	-175.7	175.4	-178.7	0	111	F85 V137 D138 R143 G145 R146	F85-K141 HydrophobicContact CZ-CG 4.2Å; V137-K141 HydrophobicContact CG1-CD 4.03Å; V137-K141 HydrophobicContact CG1-CG 4.38Å; V137-K141 PolarHBondContact O-N 3.27Å; D138-K141 PolarHBondContact O-N 2.92Å; K141-R143 PolarHBondContact O-N 3.26Å; K141-G145 CarbonylContact O-C 3.56Å; K141-G145 WeakPolarHBondContact O-CA 3.2Å; K141-G145 PolarHBondContact O-N 3.22Å; K141-R146 PolarHBondContact O-N 3.27Å
142	N	93.4	Very high	94.9	Very high	111 Å²	111	47.3 Å²	47.3	59%	0.594	25%	0.249	S	C	*	.	H	α-helix	trans	-68.7	-32.5	179.7	-72.6	-35.2	0	0	0	113.5	D138 R146	D138-N142 WeakPolarHBondContact O-CB 3.13Å; D138-N142 VanDerWaalsContact O-CG 3.25Å; D138-N142 PolarHBondContact O-N 3.23Å; D138-N142 PolarHBondContact O-ND2 3.48Å; N142-R146 WeakPolarHBondContact O-CD 3.49Å; N142-R146 VanDerWaalsContact O-CG 3.28Å; N142-R146 WeakPolarHBondContact O-CG 3.48Å
143	R	94.9	Very high	94.7	Very high	129 Å²	129	50.1 Å²	50.1	49%	0.487	26%	0.26	S	S	.	.	H	α-helix	trans	-88	-34.9	-177.5	-172.1	170.1	178.1	177.8	-2.3	113.6	A122 I139 L140 K141	A122-R143 VanDerWaalsContact CB-NH1 3.34Å; I139-R143 WeakPolarHBondContact O-CB 3.43Å; I139-R143 PolarHBondContact O-N 2.9Å; L140-R143 PolarHBondContact O-N 2.78Å; K141-R143 PolarHBondContact O-N 3.26Å
144	F	96.4	Very high	94.5	Very high	12 Å²	12	50.2 Å²	50.2	5%	0.053	26%	0.26	C	S	.	.	H	α-helix	trans	-124.9	-22.9	-171	-56.2	-80.2	0	0	0	114.4	F78 V82 F85 A118 A119 L140	F78-F144 HydrophobicContact CE1-CB 4.03Å; F78-F144 HydrophobicContact CE1-CD1 4.1Å; F78-F144 HydrophobicContact CE1-CD2 4.08Å; F78-F144 AromaticContact CE1-CG 3.81Å; F78-F144 HydrophobicContact CE1-CG 3.81Å; F78-F144 HydrophobicContact CZ-CB 3.9Å; F78-F144 HydrophobicContact CZ-CD1 4.14Å; F78-F144 HydrophobicContact CZ-CG 4.02Å; V82-F144 HydrophobicContact CG1-CB 4.31Å; V82-F144 HydrophobicContact CG1-CD1 4.04Å; F85-F144 HydrophobicContact CD2-CB 3.56Å; F85-F144 HydrophobicContact CE2-CB 3.92Å; F85-F144 HydrophobicContact CG-CB 4.14Å; A118-F144 HydrophobicContact CB-CZ 4.33Å; A119-F144 HydrophobicContact CB-CD2 4.36Å; A119-F144 HydrophobicContact CB-CE2 3.75Å; A119-F144 HydrophobicContact CB-CZ 3.84Å; L140-F144 HydrophobicContact CD2-CD2 4.02Å; L140-F144 HydrophobicContact CD2-CE2 4.06Å; L140-F144 PolarHBondContact O-N 2.92Å
145	G	92.3	Very high	94.3	Very high	20 Å²	20	48.1 Å²	48.1	21%	0.206	24%	0.242	C	C	.	.			trans	-94.3	5.9	-176.3	0	0	0	0	0	115.5	L140 K141 P147	L140-G145 PolarHBondContact O-N 3.31Å; K141-G145 CarbonylContact O-C 3.56Å; K141-G145 WeakPolarHBondContact O-CA 3.2Å; K141-G145 PolarHBondContact O-N 3.22Å; G145-P147 WeakPolarHBondContact O-CD 3.35Å
146	R	90.5	Very high	94.1	Very high	92 Å²	92	46.7 Å²	46.7	35%	0.347	23%	0.233	S	C	.	.			trans	-66.1	120.5	179.1	-84	-176.6	60.7	170.8	1.5	111.7	K141 N142 D148 V149 I150	K141-R146 PolarHBondContact O-N 3.27Å; N142-R146 WeakPolarHBondContact O-CD 3.49Å; N142-R146 VanDerWaalsContact O-CG 3.28Å; N142-R146 WeakPolarHBondContact O-CG 3.48Å; R146-D148 VanDerWaalsContact C-N 3.31Å; R146-D148 WeakPolarHBondContact CB-OD1 3.45Å; R146-D148 IonicContact CZ-OD1 3.93Å; R146-D148 IonicContact CZ-OD2 3.03Å; R146-D148 IonicContact NE-OD1 2.7Å; R146-D148 PolarHBondContact NE-OD1 3.29Å; R146-D148 IonicContact NE-OD2 3.11Å; R146-D148 IonicContact NH2-OD1 2.78Å; R146-D148 PolarHBondContact NH2-OD1 2.7Å; R146-D148 IonicContact NH2-OD2 2.85Å; R146-D148 PolarHBondContact NH2-OD2 2.96Å; R146-D148 PolarHBondContact O-N 2.96Å; R146-V149 HydrophobicContact CB-CB 4.04Å; R146-V149 HydrophobicContact CB-CG2 3.77Å; R146-V149 PolarHBondContact O-N 3.16Å; R146-I150 WeakPolarHBondContact O-CG1 3.25Å; R146-I150 PolarHBondContact O-N 2.97Å; R146-I150 VanDerWaalsContact O-N 3.1Å
147	P	88.2	Confident	93.9	Very high	63 Å²	63	48.1 Å²	48.1	41%	0.409	24%	0.243	S	C	.	.	H	α-helix	trans	-55.9	-43	-179	-27.5	35.4	0	0	0	113.2	G145 V149 I150 I151	G145-P147 WeakPolarHBondContact O-CD 3.35Å; P147-V149 VanDerWaalsContact C-N 3.34Å; P147-V149 PolarHBondContact O-N 3.48Å; P147-I150 PolarHBondContact O-N 3.42Å; P147-I151 WeakPolarHBondContact O-CB 3.32Å; P147-I151 WeakPolarHBondContact O-CD1 3.36Å; P147-I151 VanDerWaalsContact O-CG1 3.22Å; P147-I151 WeakPolarHBondContact O-CG1 3.38Å; P147-I151 PolarHBondContact O-N 3.14Å
148	D	88.8	Confident	93.6	Very high	58 Å²	58	49.9 Å²	49.9	31%	0.31	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-39.7	-179.2	64.9	-55.6	0	0	0	112.5	R146 Q152	R146-D148 VanDerWaalsContact C-N 3.31Å; R146-D148 WeakPolarHBondContact CB-OD1 3.45Å; R146-D148 IonicContact CZ-OD1 3.93Å; R146-D148 IonicContact CZ-OD2 3.03Å; R146-D148 IonicContact NE-OD1 2.7Å; R146-D148 PolarHBondContact NE-OD1 3.29Å; R146-D148 IonicContact NE-OD2 3.11Å; R146-D148 IonicContact NH2-OD1 2.78Å; R146-D148 PolarHBondContact NH2-OD1 2.7Å; R146-D148 IonicContact NH2-OD2 2.85Å; R146-D148 PolarHBondContact NH2-OD2 2.96Å; R146-D148 PolarHBondContact O-N 2.96Å; D148-Q152 VanDerWaalsContact O-CB 3.25Å; D148-Q152 WeakPolarHBondContact O-CB 3.37Å; D148-Q152 PolarHBondContact O-N 3.3Å
149	V	91.3	Very high	93.2	Very high	49 Å²	49	51.1 Å²	51.1	30%	0.297	26%	0.258	S	S	.	.	H	α-helix	trans	-67.5	-41.6	176.6	177.4	0	0	0	0	111	V82 R146 P147 K153	V82-V149 HydrophobicContact CG1-CG1 4.35Å; R146-V149 HydrophobicContact CB-CB 4.04Å; R146-V149 HydrophobicContact CB-CG2 3.77Å; R146-V149 PolarHBondContact O-N 3.16Å; P147-V149 VanDerWaalsContact C-N 3.34Å; P147-V149 PolarHBondContact O-N 3.48Å; V149-K153 WeakPolarHBondContact O-CB 3.44Å; V149-K153 PolarHBondContact O-N 2.93Å
150	I	92.5	Very high	92.9	Very high	22 Å²	22	54.5 Å²	54.5	11%	0.113	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-48.6	179	-66.1	168.1	0	0	0	110.3	V82 V86 R146 P147 Q152 K153 H154	V82-I150 HydrophobicContact CB-CG1 4.27Å; V86-I150 HydrophobicContact CG2-CD1 4.04Å; R146-I150 WeakPolarHBondContact O-CG1 3.25Å; R146-I150 PolarHBondContact O-N 2.97Å; R146-I150 VanDerWaalsContact O-N 3.1Å; P147-I150 PolarHBondContact O-N 3.42Å; I150-Q152 PolarHBondContact O-N 3.27Å; I150-K153 PolarHBondContact O-N 3.47Å; I150-K153 VanDerWaalsContact O-N 3.16Å; I150-H154 PolarHBondContact O-CD2 3.32Å; I150-H154 PolarHBondContact O-N 3.18Å
151	I	91.5	Very high	92.4	Very high	12 Å²	12	56.3 Å²	56.3	6%	0.062	29%	0.286	C	S	.	.	H	α-helix	trans	-57.4	-51.4	177.1	-69.4	159.8	0	0	0	110.2	P147 K153 H154 I155 F186 T194 E198	P147-I151 WeakPolarHBondContact O-CB 3.32Å; P147-I151 WeakPolarHBondContact O-CD1 3.36Å; P147-I151 VanDerWaalsContact O-CG1 3.22Å; P147-I151 WeakPolarHBondContact O-CG1 3.38Å; P147-I151 PolarHBondContact O-N 3.14Å; I151-K153 VanDerWaalsContact C-N 3.26Å; I151-K153 PolarHBondContact O-N 3.39Å; I151-H154 PolarHBondContact O-N 2.96Å; I151-I155 HydrophobicContact CG2-CD1 3.81Å; I151-I155 WeakPolarHBondContact O-CG1 3.33Å; I151-I155 PolarHBondContact O-N 3.11Å; I151-F186 HydrophobicContact CG2-CE1 4.11Å; I151-T194 HydrophobicContact CD1-CG2 3.68Å; I151-T194 HydrophobicContact CG1-CG2 3.84Å; I151-T194 HydrophobicContact CG2-CG2 4.2Å; I151-E198 HydrophobicContact CD1-CB 4.2Å
152	Q	92.4	Very high	91.9	Very high	47 Å²	47	56.6 Å²	56.6	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-39.1	178.7	-172.1	179.6	-62.8	0	0	111.4	D148 I150 I155 V156 A202 K205	D148-Q152 VanDerWaalsContact O-CB 3.25Å; D148-Q152 WeakPolarHBondContact O-CB 3.37Å; D148-Q152 PolarHBondContact O-N 3.3Å; I150-Q152 PolarHBondContact O-N 3.27Å; Q152-I155 PolarHBondContact O-N 2.83Å; Q152-V156 HydrophobicContact CG-CG2 4.5Å; Q152-V156 VanDerWaalsContact O-CG2 3.3Å; Q152-V156 WeakPolarHBondContact O-CG2 3.34Å; Q152-V156 PolarHBondContact O-N 3.48Å; Q152-A202 HydrophobicContact CB-CB 4.27Å; Q152-A202 HydrophobicContact CG-CB 4.42Å; Q152-K205 VanDerWaalsContact OE1-NZ 3.13Å
153	K	94.5	Very high	91.6	Very high	94 Å²	94	57 Å²	57	41%	0.409	30%	0.304	S	S	.	.	H	α-helix	trans	-67	-40.3	178.2	-171.6	64.6	175.7	176.9	0	112.2	V82 L83 V149 I150 I151 V156 S157	V82-K153 HydrophobicContact CG2-CB 3.86Å; V82-K153 HydrophobicContact CG2-CG 3.75Å; L83-K153 HydrophobicContact CD1-CG 4.11Å; L83-K153 HydrophobicContact CD2-CB 3.69Å; L83-K153 HydrophobicContact CD2-CG 3.53Å; L83-K153 HydrophobicContact CG-CB 4.43Å; L83-K153 HydrophobicContact CG-CG 3.75Å; V149-K153 WeakPolarHBondContact O-CB 3.44Å; V149-K153 PolarHBondContact O-N 2.93Å; I150-K153 PolarHBondContact O-N 3.47Å; I150-K153 VanDerWaalsContact O-N 3.16Å; I151-K153 VanDerWaalsContact C-N 3.26Å; I151-K153 PolarHBondContact O-N 3.39Å; K153-V156 PolarHBondContact O-N 3.18Å; K153-S157 WeakPolarHBondContact O-CB 3.39Å; K153-S157 PolarHBondContact O-N 3.39Å; K153-S157 PolarHBondContact O-OG 3.11Å; K153-S157 VanDerWaalsContact O-OG 3.11Å
154	H	94.2	Very high	91	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.028	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-43.7	172.7	-83.7	-80.4	0	0	0	111.6	L83 I150 I151 S157 L158 H182 A185 F186	L83-H154 HydrophobicContact CD2-CB 4.49Å; L83-H154 WeakPolarHBondContact CD2-CD2 3.25Å; L83-H154 WeakPolarHBondContact CD2-NE2 3.47Å; I150-H154 PolarHBondContact O-CD2 3.32Å; I150-H154 PolarHBondContact O-N 3.18Å; I151-H154 PolarHBondContact O-N 2.96Å; H154-S157 PolarHBondContact O-N 2.76Å; H154-L158 WeakPolarHBondContact O-CG 2.83Å; H154-L158 PolarHBondContact O-N 3.24Å; H154-H182 AromaticContact CE1-ND1 3.84Å; H154-H182 AromaticContact CG-ND1 3.85Å; H154-H182 AromaticContact ND1-CG 3.73Å; H154-H182 AromaticContact ND1-ND1 2.98Å; H154-H182 PolarHBondContact ND1-ND1 2.95Å; H154-A185 WeakPolarHBondContact CE1-CB 3.5Å; H154-A185 WeakPolarHBondContact NE2-CB 3.38Å; H154-F186 HydrophobicContact CB-CE1 3.62Å; H154-F186 HydrophobicContact CB-CE2 4.48Å; H154-F186 HydrophobicContact CB-CZ 3.49Å; H154-F186 VanDerWaalsContact CB-CZ 3.49Å
155	I	93.7	Very high	90.2	Very high	10 Å²	10	57 Å²	57	5%	0.051	33%	0.331	C	S	.	.	H	α-helix	trans	-62.7	-48.1	177.7	-70.2	167.9	0	0	0	111.1	I151 Q152 S157 L158 L159 F186 M199 A202 I203 L206	I151-I155 HydrophobicContact CG2-CD1 3.81Å; I151-I155 WeakPolarHBondContact O-CG1 3.33Å; I151-I155 PolarHBondContact O-N 3.11Å; Q152-I155 PolarHBondContact O-N 2.83Å; I155-S157 VanDerWaalsContact C-N 3.31Å; I155-S157 PolarHBondContact O-N 2.98Å; I155-L158 WeakPolarHBondContact O-CB 3.38Å; I155-L158 PolarHBondContact O-N 2.84Å; I155-L159 HydrophobicContact CG2-CD1 3.87Å; I155-L159 HydrophobicContact CG2-CG 4.34Å; I155-L159 VanDerWaalsContact O-CG 3.32Å; I155-L159 WeakPolarHBondContact O-CG 3.34Å; I155-L159 PolarHBondContact O-N 3.38Å; I155-F186 HydrophobicContact CG1-CE1 4.37Å; I155-F186 HydrophobicContact CG1-CZ 3.8Å; I155-M199 HydrophobicContact CD1-CB 4.14Å; I155-M199 HydrophobicContact CD1-CG 4.47Å; I155-A202 HydrophobicContact CD1-CB 3.48Å; I155-A202 VanDerWaalsContact CD1-CB 3.48Å; I155-I203 HydrophobicContact CD1-CG1 4.47Å; I155-I203 HydrophobicContact CG2-CG1 3.92Å; I155-L206 HydrophobicContact CG2-CD1 3.96Å
156	V	93.8	Very high	89.6	Confident	34 Å²	34	61 Å²	61	21%	0.206	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-44.6	176.3	170.8	0	0	0	0	110.6	Q152 K153 L158 L159 D160 L206	Q152-V156 HydrophobicContact CG-CG2 4.5Å; Q152-V156 VanDerWaalsContact O-CG2 3.3Å; Q152-V156 WeakPolarHBondContact O-CG2 3.34Å; Q152-V156 PolarHBondContact O-N 3.48Å; K153-V156 PolarHBondContact O-N 3.18Å; V156-L158 VanDerWaalsContact C-N 3.32Å; V156-L158 PolarHBondContact O-N 3.12Å; V156-L159 PolarHBondContact O-N 3.11Å; V156-D160 VanDerWaalsContact CG1-OD2 3.29Å; V156-D160 WeakPolarHBondContact CG1-OD2 3.21Å; V156-D160 VanDerWaalsContact O-CB 3.29Å; V156-D160 WeakPolarHBondContact O-CB 3.45Å; V156-D160 VanDerWaalsContact O-CG 3.29Å; V156-D160 PolarHBondContact O-N 2.67Å; V156-L206 HydrophobicContact CG2-CD1 3.74Å; V156-L206 HydrophobicContact CG2-CD2 3.93Å; V156-L206 HydrophobicContact CG2-CG 4.48Å
157	S	94.9	Very high	89	Confident	30 Å²	30	61.4 Å²	61.4	21%	0.21	37%	0.367	C	S	.	.	H	α-helix	trans	-65.7	-31.1	177.7	-66.7	0	0	0	0	114	K153 H154 I155 L161 H182	K153-S157 WeakPolarHBondContact O-CB 3.39Å; K153-S157 PolarHBondContact O-N 3.39Å; K153-S157 PolarHBondContact O-OG 3.11Å; K153-S157 VanDerWaalsContact O-OG 3.11Å; H154-S157 PolarHBondContact O-N 2.76Å; I155-S157 VanDerWaalsContact C-N 3.31Å; I155-S157 PolarHBondContact O-N 2.98Å; S157-L161 PolarHBondContact O-N 2.8Å; S157-H182 WeakPolarHBondContact CB-CE1 3.36Å
158	L	91.7	Very high	89	Confident	44 Å²	44	60.2 Å²	60.2	23%	0.23	36%	0.36	C	S	.	.	H	α-helix	trans	-68.3	-46.1	171.4	-82	167.5	0	0	0	111.7	H154 I155 V156 D160 L161 L179 H182 F186	H154-L158 WeakPolarHBondContact O-CG 2.83Å; H154-L158 PolarHBondContact O-N 3.24Å; I155-L158 WeakPolarHBondContact O-CB 3.38Å; I155-L158 PolarHBondContact O-N 2.84Å; V156-L158 VanDerWaalsContact C-N 3.32Å; V156-L158 PolarHBondContact O-N 3.12Å; L158-D160 VanDerWaalsContact C-N 3.34Å; L158-L161 WeakPolarHBondContact O-CB 3.42Å; L158-L161 PolarHBondContact O-N 2.86Å; L158-L179 HydrophobicContact CD2-CD2 3.77Å; L158-H182 HydrophobicContact CD1-CB 3.79Å; L158-H182 HydrophobicContact CD2-CB 3.67Å; L158-H182 HydrophobicContact CG-CB 3.53Å; L158-F186 HydrophobicContact CD1-CE2 3.73Å; L158-F186 HydrophobicContact CD1-CZ 4.2Å
159	L	90	Very high	89.1	Confident	115 Å²	115	61.1 Å²	61.1	60%	0.602	38%	0.376	S	S	*	.	H	α-helix	trans	-68.1	-33.3	-179.6	-66.5	174.9	0	0	0	112.5	I155 V156 L161 L206	I155-L159 HydrophobicContact CG2-CD1 3.87Å; I155-L159 HydrophobicContact CG2-CG 4.34Å; I155-L159 VanDerWaalsContact O-CG 3.32Å; I155-L159 WeakPolarHBondContact O-CG 3.34Å; I155-L159 PolarHBondContact O-N 3.38Å; V156-L159 PolarHBondContact O-N 3.11Å; L159-L161 VanDerWaalsContact C-N 3.31Å; L159-L206 HydrophobicContact CD1-CD1 4.07Å
160	D	91.5	Very high	89.1	Confident	124 Å²	124	66.6 Å²	66.6	66%	0.663	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-4.3	177.6	-70.2	-19.6	0	0	0	113	V156 L158 P162	V156-D160 VanDerWaalsContact CG1-OD2 3.29Å; V156-D160 WeakPolarHBondContact CG1-OD2 3.21Å; V156-D160 VanDerWaalsContact O-CB 3.29Å; V156-D160 WeakPolarHBondContact O-CB 3.45Å; V156-D160 VanDerWaalsContact O-CG 3.29Å; V156-D160 PolarHBondContact O-N 2.67Å; L158-D160 VanDerWaalsContact C-N 3.34Å; D160-P162 WeakPolarHBondContact O-CD 3.4Å
161	L	88.7	Confident	89	Confident	39 Å²	39	72 Å²	72	20%	0.204	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-68	122.1	-179	-163.9	71.5	0	0	0	109.5	S157 L158 L159 H175 K178 L179	S157-L161 PolarHBondContact O-N 2.8Å; L158-L161 WeakPolarHBondContact O-CB 3.42Å; L158-L161 PolarHBondContact O-N 2.86Å; L159-L161 VanDerWaalsContact C-N 3.31Å; L161-H175 VanDerWaalsContact CD2-CE1 3.42Å; L161-H175 WeakPolarHBondContact CD2-CE1 3.09Å; L161-K178 HydrophobicContact CD1-CB 4.06Å; L161-K178 HydrophobicContact CD1-CG 4.41Å; L161-K178 HydrophobicContact CD2-CB 4.14Å; L161-L179 HydrophobicContact CD2-CD2 3.61Å; L161-L179 HydrophobicContact CD2-CG 3.88Å
162	P	85.5	Confident	89	Confident	77 Å²	77	75.6 Å²	75.6	50%	0.5	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66.8	145.8	-176.4	26.5	-34.2	0	0	0	111.1	D160 C164 H175	D160-P162 WeakPolarHBondContact O-CD 3.4Å; P162-C164 PolarHBondContact O-N 2.83Å; P162-H175 PolarHBondContact O-CE1 3.31Å
163	P	86	Confident	89.1	Confident	119 Å²	119	82 Å²	82	77%	0.773	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-58	137.5	175.4	-24	33.3	0	0	0	112	A165	P163-A165 VanDerWaalsContact C-N 3.34Å; P163-A165 PolarHBondContact O-N 2.97Å
164	C	83.7	Confident	88.9	Confident	43 Å²	43	83.1 Å²	83.1	29%	0.291	47%	0.465	S	S	.	.			trans	-75.7	85.9	171.8	-170.3	0	0	0	0	110.3	P162 Q166 H175	P162-C164 PolarHBondContact O-N 2.83Å; C164-Q166 VanDerWaalsContact C-N 3.3Å; C164-Q166 PolarHBondContact O-N 3.01Å; C164-H175 HydrophobicContact CB-CB 4.1Å
165	A	78.7	Confident	88.8	Confident	99 Å²	99	85 Å²	85	82%	0.818	47%	0.474	S	S	*	.			trans	-75.6	-13.2	-174.9	0	0	0	0	0	114.8	P163	P163-A165 VanDerWaalsContact C-N 3.34Å; P163-A165 PolarHBondContact O-N 2.97Å
166	Q	79.3	Confident	88.8	Confident	104 Å²	104	89.5 Å²	89.5	49%	0.486	49%	0.494	S	S	.	.	S	Bend	trans	-120.5	133.1	-172.4	-68.5	178	-4.3	0	0	111.2	C164 S168 R171	C164-Q166 VanDerWaalsContact C-N 3.3Å; C164-Q166 PolarHBondContact O-N 3.01Å; Q166-S168 PolarHBondContact O-N 3.35Å; Q166-R171 VanDerWaalsContact OE1-NE 3.13Å
167	A	78.7	Confident	88.9	Confident	101 Å²	101	91.9 Å²	91.9	84%	0.835	51%	0.506	S	S	*	.			trans	-80.9	35.1	-176.3	0	0	0	0	0	113.9
168	S	88	Confident	88.9	Confident	37 Å²	37	94.1 Å²	94.1	26%	0.259	51%	0.512	S	S	.	.			trans	-85.2	135.4	172.8	74.2	0	0	0	0	110.5	Q166 E170 R171 L172	Q166-S168 PolarHBondContact O-N 3.35Å; S168-E170 PolarHBondContact O-N 2.98Å; S168-R171 PolarHBondContact O-N 3.32Å; S168-R171 VanDerWaalsContact O-N 3.11Å; S168-R171 VanDerWaalsContact OG-CB 3.28Å; S168-R171 WeakPolarHBondContact OG-CB 3.13Å; S168-R171 WeakPolarHBondContact OG-CD 3.35Å; S168-R171 WeakPolarHBondContact OG-CG 3.33Å; S168-R171 PolarHBondContact OG-N 3.43Å; S168-L172 WeakPolarHBondContact O-CG 3.23Å; S168-L172 PolarHBondContact O-N 3.36Å
169	A	91.3	Very high	88.9	Confident	78 Å²	78	95.2 Å²	95.2	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-56.6	-37.8	-179.7	0	0	0	0	0	112.4	R173	A169-R173 VanDerWaalsContact O-CB 3.27Å; A169-R173 WeakPolarHBondContact O-CB 3.2Å; A169-R173 PolarHBondContact O-N 3.2Å
170	E	91.4	Very high	89.1	Confident	163 Å²	163	92.2 Å²	92.2	76%	0.762	50%	0.501	S	S	*	.	H	α-helix	trans	-62	-47	176.1	-172.7	-169.8	166.9	0	0	112.2	S168 R173 H174	S168-E170 PolarHBondContact O-N 2.98Å; E170-R173 PolarHBondContact O-N 2.94Å; E170-H174 WeakPolarHBondContact O-CB 3.43Å; E170-H174 PolarHBondContact O-N 2.91Å
171	R	88.8	Confident	89	Confident	135 Å²	135	91.3 Å²	91.3	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-69.1	-40.7	179.8	-73.5	179.9	170.6	108.2	-2.7	111.6	Q166 S168 R173 H174 H175	Q166-R171 VanDerWaalsContact OE1-NE 3.13Å; S168-R171 PolarHBondContact O-N 3.32Å; S168-R171 VanDerWaalsContact O-N 3.11Å; S168-R171 VanDerWaalsContact OG-CB 3.28Å; S168-R171 WeakPolarHBondContact OG-CB 3.13Å; S168-R171 WeakPolarHBondContact OG-CD 3.35Å; S168-R171 WeakPolarHBondContact OG-CG 3.33Å; S168-R171 PolarHBondContact OG-N 3.43Å; R171-R173 VanDerWaalsContact C-N 3.34Å; R171-H174 PolarHBondContact O-N 3.23Å; R171-H175 WeakPolarHBondContact O-CB 3.44Å; R171-H175 PolarHBondContact O-N 2.93Å
172	L	92.5	Very high	89.2	Confident	88 Å²	88	89.8 Å²	89.8	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-43	174.6	-72.8	170.9	0	0	0	111.2	S168 H175 H176	S168-L172 WeakPolarHBondContact O-CG 3.23Å; S168-L172 PolarHBondContact O-N 3.36Å; L172-H175 PolarHBondContact O-N 3.39Å; L172-H176 WeakPolarHBondContact O-CB 3.4Å; L172-H176 PolarHBondContact O-N 3.48Å
173	R	94.1	Very high	89.4	Confident	182 Å²	182	88.7 Å²	88.7	69%	0.687	47%	0.472	S	S	*	.	H	α-helix	trans	-63.2	-47.8	175.9	-174.4	169.7	-62.2	-143.3	-0.7	111.5	A169 E170 R171 H175 H176 D177	A169-R173 VanDerWaalsContact O-CB 3.27Å; A169-R173 WeakPolarHBondContact O-CB 3.2Å; A169-R173 PolarHBondContact O-N 3.2Å; E170-R173 PolarHBondContact O-N 2.94Å; R171-R173 VanDerWaalsContact C-N 3.34Å; R173-H175 VanDerWaalsContact C-N 3.32Å; R173-H175 PolarHBondContact O-N 2.94Å; R173-H176 WeakPolarHBondContact O-CB 3.01Å; R173-H176 PolarHBondContact O-N 3.48Å; R173-D177 WeakPolarHBondContact O-CB 3.4Å; R173-D177 PolarHBondContact O-N 2.99Å
174	H	90.8	Very high	89.4	Confident	117 Å²	117	89.5 Å²	89.5	54%	0.542	46%	0.46	S	S	.	.	H	α-helix	trans	-57.6	-45.4	176.1	-176.5	79.1	0	0	0	112.1	E170 R171 D177 K178	E170-H174 WeakPolarHBondContact O-CB 3.43Å; E170-H174 PolarHBondContact O-N 2.91Å; R171-H174 PolarHBondContact O-N 3.23Å; H174-D177 PolarHBondContact O-N 2.87Å; H174-K178 VanDerWaalsContact O-CG 3.29Å; H174-K178 WeakPolarHBondContact O-CG 3.22Å; H174-K178 PolarHBondContact O-N 3.3Å; H174-K178 VanDerWaalsContact O-N 3.08Å
175	H	92.5	Very high	89.5	Confident	46 Å²	46	89.1 Å²	89.1	21%	0.213	46%	0.46	C	S	.	.	H	α-helix	trans	-66.2	-44.5	179	-168.7	78.5	0	0	0	111.9	L161 P162 C164 R171 L172 R173 D177 K178 L179	L161-H175 VanDerWaalsContact CD2-CE1 3.42Å; L161-H175 WeakPolarHBondContact CD2-CE1 3.09Å; P162-H175 PolarHBondContact O-CE1 3.31Å; C164-H175 HydrophobicContact CB-CB 4.1Å; R171-H175 WeakPolarHBondContact O-CB 3.44Å; R171-H175 PolarHBondContact O-N 2.93Å; L172-H175 PolarHBondContact O-N 3.39Å; R173-H175 VanDerWaalsContact C-N 3.32Å; R173-H175 PolarHBondContact O-N 2.94Å; H175-D177 PolarHBondContact O-N 3.22Å; H175-K178 PolarHBondContact O-N 3.17Å; H175-L179 WeakPolarHBondContact O-CG 3.45Å; H175-L179 PolarHBondContact O-N 3.31Å
176	H	94.1	Very high	89.7	Confident	104 Å²	104	85.3 Å²	85.3	48%	0.481	43%	0.425	S	S	.	.	H	α-helix	trans	-54.9	-50.1	172.9	166.8	-86.7	0	0	0	111.4	L172 R173 K178 L179 I180	L172-H176 WeakPolarHBondContact O-CB 3.4Å; L172-H176 PolarHBondContact O-N 3.48Å; R173-H176 WeakPolarHBondContact O-CB 3.01Å; R173-H176 PolarHBondContact O-N 3.48Å; H176-K178 VanDerWaalsContact C-N 3.28Å; H176-K178 PolarHBondContact O-N 2.96Å; H176-L179 PolarHBondContact O-N 3.48Å; H176-I180 WeakPolarHBondContact O-CB 3.49Å; H176-I180 WeakPolarHBondContact O-CG1 3.47Å; H176-I180 PolarHBondContact O-N 3.44Å
177	D	95.1	Very high	89.5	Confident	85 Å²	85	89 Å²	89	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-64.9	-34.2	-177.1	-64.8	-14.3	0	0	0	111.5	R173 H174 H175 W181	R173-D177 WeakPolarHBondContact O-CB 3.4Å; R173-D177 PolarHBondContact O-N 2.99Å; H174-D177 PolarHBondContact O-N 2.87Å; H175-D177 PolarHBondContact O-N 3.22Å; D177-W181 VanDerWaalsContact O-CB 3.23Å; D177-W181 WeakPolarHBondContact O-CB 3.17Å; D177-W181 PolarHBondContact O-N 3.3Å
178	K	94.3	Very high	88.9	Confident	77 Å²	77	90.7 Å²	90.7	34%	0.335	43%	0.425	S	S	.	.	H	α-helix	trans	-65.6	-48.4	172.3	-70.9	-68.3	-179.6	-175	0	112.4	L161 H174 H175 H176 W181 H182	L161-K178 HydrophobicContact CD1-CB 4.06Å; L161-K178 HydrophobicContact CD1-CG 4.41Å; L161-K178 HydrophobicContact CD2-CB 4.14Å; H174-K178 VanDerWaalsContact O-CG 3.29Å; H174-K178 WeakPolarHBondContact O-CG 3.22Å; H174-K178 PolarHBondContact O-N 3.3Å; H174-K178 VanDerWaalsContact O-N 3.08Å; H175-K178 PolarHBondContact O-N 3.17Å; H176-K178 VanDerWaalsContact C-N 3.28Å; H176-K178 PolarHBondContact O-N 2.96Å; K178-W181 PolarHBondContact O-N 3.07Å; K178-H182 PolarHBondContact O-CD2 2.77Å; K178-H182 PolarHBondContact O-N 2.9Å
179	L	92.9	Very high	87.6	Confident	66 Å²	66	91 Å²	91	35%	0.346	42%	0.424	S	S	.	.	H	α-helix	trans	-59	-49.6	176.9	-71.3	173.2	0	0	0	110.8	L158 L161 H175 H176 W181 H182 V183	L158-L179 HydrophobicContact CD2-CD2 3.77Å; L161-L179 HydrophobicContact CD2-CD2 3.61Å; L161-L179 HydrophobicContact CD2-CG 3.88Å; H175-L179 WeakPolarHBondContact O-CG 3.45Å; H175-L179 PolarHBondContact O-N 3.31Å; H176-L179 PolarHBondContact O-N 3.48Å; L179-W181 VanDerWaalsContact C-N 3.33Å; L179-W181 PolarHBondContact O-N 3.07Å; L179-H182 PolarHBondContact O-N 3.4Å; L179-V183 WeakPolarHBondContact O-CG2 3.28Å; L179-V183 PolarHBondContact O-N 3.19Å
180	I	92.6	Very high	85.8	Confident	52 Å²	52	93 Å²	93	27%	0.267	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-41.1	178.9	-70.2	-64.2	0	0	0	111.6	H176 H182 V183 R184	H176-I180 WeakPolarHBondContact O-CB 3.49Å; H176-I180 WeakPolarHBondContact O-CG1 3.47Å; H176-I180 PolarHBondContact O-N 3.44Å; I180-H182 VanDerWaalsContact C-N 3.33Å; I180-H182 PolarHBondContact O-N 3.25Å; I180-V183 PolarHBondContact O-N 3.44Å; I180-R184 HydrophobicContact CG2-CG 4.06Å; I180-R184 VanDerWaalsContact CG2-CZ 3.43Å; I180-R184 VanDerWaalsContact CG2-NE 3.31Å; I180-R184 WeakPolarHBondContact O-CB 3.37Å; I180-R184 WeakPolarHBondContact O-CG 3.44Å; I180-R184 PolarHBondContact O-N 2.83Å
181	W	91	Very high	84.2	Confident	106 Å²	106	89.6 Å²	89.6	40%	0.402	43%	0.43	S	S	.	.	H	α-helix	trans	-57.8	-45.5	177.2	175.2	53.8	0	0	0	112	L83 D177 K178 L179 A185	L83-W181 HydrophobicContact CB-CH2 4.11Å; L83-W181 HydrophobicContact CB-CZ2 4.1Å; L83-W181 HydrophobicContact CD1-CH2 3.55Å; L83-W181 HydrophobicContact CD1-CZ2 4.33Å; L83-W181 HydrophobicContact CD1-CZ3 4.15Å; L83-W181 HydrophobicContact CG-CH2 4.48Å; D177-W181 VanDerWaalsContact O-CB 3.23Å; D177-W181 WeakPolarHBondContact O-CB 3.17Å; D177-W181 PolarHBondContact O-N 3.3Å; K178-W181 PolarHBondContact O-N 3.07Å; L179-W181 VanDerWaalsContact C-N 3.33Å; L179-W181 PolarHBondContact O-N 3.07Å; W181-A185 PolarHBondContact O-N 3.5Å
182	H	91.9	Very high	83.1	Confident	6 Å²	6	88 Å²	88	3%	0.028	42%	0.424	C	S	.	.	H	α-helix	trans	-71.2	-39.4	177.7	-65.9	-68.8	0	0	0	112.8	H154 S157 L158 K178 L179 I180 A185 F186	H154-H182 AromaticContact CE1-ND1 3.84Å; H154-H182 AromaticContact CG-ND1 3.85Å; H154-H182 AromaticContact ND1-CG 3.73Å; H154-H182 AromaticContact ND1-ND1 2.98Å; H154-H182 PolarHBondContact ND1-ND1 2.95Å; S157-H182 WeakPolarHBondContact CB-CE1 3.36Å; L158-H182 HydrophobicContact CD1-CB 3.79Å; L158-H182 HydrophobicContact CD2-CB 3.67Å; L158-H182 HydrophobicContact CG-CB 3.53Å; K178-H182 PolarHBondContact O-CD2 2.77Å; K178-H182 PolarHBondContact O-N 2.9Å; L179-H182 PolarHBondContact O-N 3.4Å; I180-H182 VanDerWaalsContact C-N 3.33Å; I180-H182 PolarHBondContact O-N 3.25Å; H182-A185 PolarHBondContact O-N 3.43Å; H182-F186 WeakPolarHBondContact O-CD2 3.46Å
183	V	89	Confident	82.1	Confident	54 Å²	54	91.1 Å²	91.1	33%	0.327	44%	0.436	S	S	.	.	H	α-helix	trans	-67	-38	179	172.2	0	0	0	0	111.9	L179 I180 A185 F186	L179-V183 WeakPolarHBondContact O-CG2 3.28Å; L179-V183 PolarHBondContact O-N 3.19Å; I180-V183 PolarHBondContact O-N 3.44Å; V183-A185 VanDerWaalsContact C-N 3.32Å; V183-A185 PolarHBondContact O-N 3.4Å; V183-F186 PolarHBondContact O-N 2.87Å
184	R	87.8	Confident	81.4	Confident	137 Å²	137	83.4 Å²	83.4	52%	0.517	41%	0.409	S	S	.	.	H	α-helix	trans	-63.4	-38	176.6	-78.8	-178.1	-176	162.3	2.9	112.2	I180 F186 R187 E188	I180-R184 HydrophobicContact CG2-CG 4.06Å; I180-R184 VanDerWaalsContact CG2-CZ 3.43Å; I180-R184 VanDerWaalsContact CG2-NE 3.31Å; I180-R184 WeakPolarHBondContact O-CB 3.37Å; I180-R184 WeakPolarHBondContact O-CG 3.44Å; I180-R184 PolarHBondContact O-N 2.83Å; R184-F186 PolarHBondContact O-N 3.27Å; R184-F186 VanDerWaalsContact O-N 3.11Å; R184-R187 PolarHBondContact O-N 3.31Å; R184-E188 WeakPolarHBondContact O-CB 3.44Å; R184-E188 PolarHBondContact O-N 3.29Å
185	A	85.6	Confident	81.2	Confident	35 Å²	35	81 Å²	81	29%	0.289	40%	0.403	S	S	.	.	H	α-helix	trans	-59	-26	178.4	0	0	0	0	0	113.5	H154 W181 H182 V183	H154-A185 WeakPolarHBondContact CE1-CB 3.5Å; H154-A185 WeakPolarHBondContact NE2-CB 3.38Å; W181-A185 PolarHBondContact O-N 3.5Å; H182-A185 PolarHBondContact O-N 3.43Å; V183-A185 VanDerWaalsContact C-N 3.32Å; V183-A185 PolarHBondContact O-N 3.4Å
186	F	82.9	Confident	80.9	Confident	18 Å²	18	82 Å²	82	8%	0.079	42%	0.419	C	S	.	.	H	α-helix	trans	-80.3	-29.7	173.9	-59.1	-44.7	0	0	0	113.9	I151 H154 I155 L158 H182 V183 R184 T194 M199	I151-F186 HydrophobicContact CG2-CE1 4.11Å; H154-F186 HydrophobicContact CB-CE1 3.62Å; H154-F186 HydrophobicContact CB-CE2 4.48Å; H154-F186 HydrophobicContact CB-CZ 3.49Å; H154-F186 VanDerWaalsContact CB-CZ 3.49Å; I155-F186 HydrophobicContact CG1-CE1 4.37Å; I155-F186 HydrophobicContact CG1-CZ 3.8Å; L158-F186 HydrophobicContact CD1-CE2 3.73Å; L158-F186 HydrophobicContact CD1-CZ 4.2Å; H182-F186 WeakPolarHBondContact O-CD2 3.46Å; V183-F186 PolarHBondContact O-N 2.87Å; R184-F186 PolarHBondContact O-N 3.27Å; R184-F186 VanDerWaalsContact O-N 3.11Å; F186-T194 HydrophobicContact CD1-CG2 4.04Å; F186-T194 WeakPolarHBondContact O-CB 3.46Å; F186-T194 PolarHBondContact O-N 3.15Å; F186-T194 VanDerWaalsContact O-N 3.14Å; F186-T194 PolarHBondContact O-OG1 3.23Å; F186-M199 HydrophobicContact CB-CE 3.43Å; F186-M199 VanDerWaalsContact CB-CE 3.43Å; F186-M199 HydrophobicContact CD1-CE 3.99Å; F186-M199 HydrophobicContact CD2-CE 3.9Å; F186-M199 HydrophobicContact CD2-SD 4.36Å; F186-M199 HydrophobicContact CG-CE 3.51Å; F186-M199 HydrophobicContact CG-SD 4.44Å
187	R	74.6	Confident	80.6	Confident	181 Å²	181	79 Å²	79	68%	0.683	41%	0.413	S	S	*	.	H	α-helix	trans	-89.1	-40	-176.4	-67.1	-175.5	177.9	-166.5	-1.2	112.9	R184	R184-R187 PolarHBondContact O-N 3.31Å
188	E	65.3	Low	80.4	Confident	137 Å²	137	76.4 Å²	76.4	64%	0.64	40%	0.398	S	S	*	.			trans	-100.8	23.1	-165.2	-65.3	-178.3	178	0	0	113.2	R184 P190	R184-E188 WeakPolarHBondContact O-CB 3.44Å; R184-E188 PolarHBondContact O-N 3.29Å; E188-P190 WeakPolarHBondContact O-CD 3.46Å
189	N	61.3	Low	80.1	Confident	45 Å²	45	75.2 Å²	75.2	24%	0.241	39%	0.394	C	S	.	.			trans	-77.1	105.6	166.7	177.8	-1	0	0	0	108.4	A191 R192	N189-A191 PolarHBondContact O-N 2.81Å; N189-A191 PolarHBondContact OD1-N 3.37Å; N189-R192 WeakPolarHBondContact CB-O 3.49Å; N189-R192 VanDerWaalsContact CG-O 3.26Å; N189-R192 PolarHBondContact ND2-O 3.13Å; N189-R192 CarbonylContact O-C 3.58Å; N189-R192 PolarHBondContact O-N 2.97Å
190	P	53.1	Low	80.1	Confident	118 Å²	118	74.2 Å²	74.2	77%	0.766	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.1	-172.7	27.4	-34.2	0	0	0	112.7	E188	E188-P190 WeakPolarHBondContact O-CD 3.46Å
191	A	57.4	Low	80.1	Confident	93 Å²	93	72.5 Å²	72.5	77%	0.769	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-28.6	179.6	0	0	0	0	0	113.1	N189	N189-A191 PolarHBondContact O-N 2.81Å; N189-A191 PolarHBondContact OD1-N 3.37Å
192	R	66.4	Low	80.2	Confident	101 Å²	101	67.7 Å²	67.7	38%	0.381	36%	0.363	S	S	.	.			trans	-164.4	113.5	-173.1	-176.9	177	174.1	157.6	1.8	110.7	N189 T194 E198 E226	N189-R192 WeakPolarHBondContact CB-O 3.49Å; N189-R192 VanDerWaalsContact CG-O 3.26Å; N189-R192 PolarHBondContact ND2-O 3.13Å; N189-R192 CarbonylContact O-C 3.58Å; N189-R192 PolarHBondContact O-N 2.97Å; R192-T194 PolarHBondContact O-N 2.82Å; R192-E198 IonicContact CZ-OE1 3.97Å; R192-E198 IonicContact NE-OE1 2.69Å; R192-E198 PolarHBondContact NE-OE1 2.89Å; R192-E198 IonicContact NH2-OE1 3.65Å; R192-E198 PolarHBondContact NH2-OE1 2.99Å; R192-E226 IonicContact CZ-OE1 2.82Å; R192-E226 IonicContact NH1-OE1 2.75Å; R192-E226 PolarHBondContact NH1-OE1 2.95Å; R192-E226 IonicContact NH1-OE2 3.93Å; R192-E226 IonicContact NH2-OE1 3.22Å; R192-E226 PolarHBondContact NH2-OE1 3.23Å
193	Q	70.4	Confident	80.2	Confident	154 Å²	154	70.2 Å²	70.2	72%	0.72	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-63.1	130.3	170.1	-71.3	179.1	37.7	0	0	109.4	T195	Q193-T195 PolarHBondContact O-N 3.23Å
194	T	80.8	Confident	80.5	Confident	19 Å²	19	69.2 Å²	69.2	12%	0.117	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-65.8	123.3	175.2	-57.4	0	0	0	0	108.9	I151 F186 R192 E198 M199	I151-T194 HydrophobicContact CD1-CG2 3.68Å; I151-T194 HydrophobicContact CG1-CG2 3.84Å; I151-T194 HydrophobicContact CG2-CG2 4.2Å; F186-T194 HydrophobicContact CD1-CG2 4.04Å; F186-T194 WeakPolarHBondContact O-CB 3.46Å; F186-T194 PolarHBondContact O-N 3.15Å; F186-T194 VanDerWaalsContact O-N 3.14Å; F186-T194 PolarHBondContact O-OG1 3.23Å; R192-T194 PolarHBondContact O-N 2.82Å; T194-E198 VanDerWaalsContact CA-OE2 3.25Å; T194-E198 WeakPolarHBondContact CA-OE2 3.49Å; T194-E198 HydrophobicContact CG2-CB 4.24Å; T194-E198 WeakPolarHBondContact CG2-OE2 3.33Å; T194-M199 HydrophobicContact CG2-CE 3.57Å; T194-M199 HydrophobicContact CG2-CG 3.85Å
195	T	85.9	Confident	80.7	Confident	66 Å²	66	63.2 Å²	63.2	41%	0.405	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-80.7	156	-179.4	69.6	0	0	0	0	110.8	Q193 A197 E198 M199	Q193-T195 PolarHBondContact O-N 3.23Å; T195-A197 PolarHBondContact O-N 2.96Å; T195-E198 PolarHBondContact N-OE2 3.49Å; T195-E198 PolarHBondContact O-N 3.31Å; T195-E198 WeakPolarHBondContact OG1-CG 3.25Å; T195-E198 PolarHBondContact OG1-N 3.04Å; T195-E198 PolarHBondContact OG1-OE2 3.35Å; T195-M199 PolarHBondContact O-N 3.46Å
196	A	86.5	Confident	81	Confident	68 Å²	68	63.6 Å²	63.6	56%	0.562	35%	0.346	S	S	*	.	H	α-helix	trans	-58.7	-33.4	171.8	0	0	0	0	0	111.7	M199 L200	A196-M199 PolarHBondContact O-N 3.4Å; A196-L200 WeakPolarHBondContact O-CB 3.24Å; A196-L200 VanDerWaalsContact O-CG 3.22Å; A196-L200 WeakPolarHBondContact O-CG 3.48Å; A196-L200 PolarHBondContact O-N 2.92Å
197	A	88.7	Confident	81.3	Confident	41 Å²	41	69.7 Å²	69.7	34%	0.339	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-41.7	178.4	0	0	0	0	0	112.6	T195 L200 L201	T195-A197 PolarHBondContact O-N 2.96Å; A197-L200 PolarHBondContact O-N 3.17Å; A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 PolarHBondContact O-N 3.4Å
198	E	89.5	Confident	82	Confident	31 Å²	31	63.2 Å²	63.2	15%	0.145	35%	0.352	C	S	.	.	H	α-helix	trans	-64.9	-40.7	175.6	-69.7	163.4	159.6	0	0	111.9	I151 R192 T194 T195 L201 A202	I151-E198 HydrophobicContact CD1-CB 4.2Å; R192-E198 IonicContact CZ-OE1 3.97Å; R192-E198 IonicContact NE-OE1 2.69Å; R192-E198 PolarHBondContact NE-OE1 2.89Å; R192-E198 IonicContact NH2-OE1 3.65Å; R192-E198 PolarHBondContact NH2-OE1 2.99Å; T194-E198 VanDerWaalsContact CA-OE2 3.25Å; T194-E198 WeakPolarHBondContact CA-OE2 3.49Å; T194-E198 HydrophobicContact CG2-CB 4.24Å; T194-E198 WeakPolarHBondContact CG2-OE2 3.33Å; T195-E198 PolarHBondContact N-OE2 3.49Å; T195-E198 PolarHBondContact O-N 3.31Å; T195-E198 WeakPolarHBondContact OG1-CG 3.25Å; T195-E198 PolarHBondContact OG1-N 3.04Å; T195-E198 PolarHBondContact OG1-OE2 3.35Å; E198-L201 PolarHBondContact O-N 2.9Å; E198-A202 PolarHBondContact O-N 3.41Å
199	M	88.8	Confident	83	Confident	51 Å²	51	66.1 Å²	66.1	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-64.7	-45.8	176.1	-62.1	-177.5	-163.1	0	0	111.3	I155 F186 T194 T195 A196 L201 A202 I203	I155-M199 HydrophobicContact CD1-CB 4.14Å; I155-M199 HydrophobicContact CD1-CG 4.47Å; F186-M199 HydrophobicContact CB-CE 3.43Å; F186-M199 VanDerWaalsContact CB-CE 3.43Å; F186-M199 HydrophobicContact CD1-CE 3.99Å; F186-M199 HydrophobicContact CD2-CE 3.9Å; F186-M199 HydrophobicContact CD2-SD 4.36Å; F186-M199 HydrophobicContact CG-CE 3.51Å; F186-M199 HydrophobicContact CG-SD 4.44Å; T194-M199 HydrophobicContact CG2-CE 3.57Å; T194-M199 HydrophobicContact CG2-CG 3.85Å; T195-M199 PolarHBondContact O-N 3.46Å; A196-M199 PolarHBondContact O-N 3.4Å; M199-L201 VanDerWaalsContact C-N 3.34Å; M199-L201 PolarHBondContact O-N 3.27Å; M199-A202 PolarHBondContact O-N 3.26Å; M199-I203 VanDerWaalsContact O-CG1 3.31Å; M199-I203 WeakPolarHBondContact O-CG1 3.3Å; M199-I203 PolarHBondContact O-N 3.31Å
200	L	92.1	Very high	84.4	Confident	46 Å²	46	71.1 Å²	71.1	24%	0.241	38%	0.379	C	S	.	.	H	α-helix	trans	-62.1	-42.2	176.8	-72.2	171.4	0	0	0	111	L16 A196 A197 A202 I203 C204 L229	L16-L200 HydrophobicContact CD2-CD1 4.36Å; A196-L200 WeakPolarHBondContact O-CB 3.24Å; A196-L200 VanDerWaalsContact O-CG 3.22Å; A196-L200 WeakPolarHBondContact O-CG 3.48Å; A196-L200 PolarHBondContact O-N 2.92Å; A197-L200 PolarHBondContact O-N 3.17Å; L200-A202 PolarHBondContact O-N 3.4Å; L200-I203 PolarHBondContact O-N 3.21Å; L200-C204 VanDerWaalsContact O-CB 3.3Å; L200-C204 WeakPolarHBondContact O-CB 3.22Å; L200-C204 PolarHBondContact O-N 2.86Å; L200-C204 PolarHBondContact O-SG 3.27Å; L200-L229 HydrophobicContact CB-CD1 4.36Å; L200-L229 HydrophobicContact CB-CD2 4.18Å; L200-L229 HydrophobicContact CD1-CD2 4.34Å
201	L	93.4	Very high	86.2	Confident	15 Å²	15	70 Å²	70	8%	0.079	36%	0.362	C	S	.	.	H	α-helix	trans	-57	-49.9	175.1	174.9	59.5	0	0	0	111	A197 E198 M199 I203 C204 K205 W216 A227 L229 F232	A197-L201 WeakPolarHBondContact O-CB 3.39Å; A197-L201 PolarHBondContact O-N 3.4Å; E198-L201 PolarHBondContact O-N 2.9Å; M199-L201 VanDerWaalsContact C-N 3.34Å; M199-L201 PolarHBondContact O-N 3.27Å; L201-I203 VanDerWaalsContact C-N 3.33Å; L201-I203 PolarHBondContact O-N 3.31Å; L201-C204 PolarHBondContact O-N 3.11Å; L201-K205 HydrophobicContact CD1-CD 4.28Å; L201-K205 HydrophobicContact CD1-CG 4.26Å; L201-K205 HydrophobicContact CG-CD 4.23Å; L201-K205 WeakPolarHBondContact O-CB 3.3Å; L201-K205 VanDerWaalsContact O-CG 3.25Å; L201-K205 WeakPolarHBondContact O-CG 3.32Å; L201-K205 PolarHBondContact O-N 3.21Å; L201-W216 HydrophobicContact CD1-CZ2 4.01Å; L201-A227 HydrophobicContact CD2-CB 4.11Å; L201-A227 WeakPolarHBondContact CD2-O 3.19Å; L201-L229 HydrophobicContact CB-CD1 4.28Å; L201-F232 HydrophobicContact CD1-CB 3.44Å; L201-F232 VanDerWaalsContact CD1-CB 3.44Å; L201-F232 HydrophobicContact CD1-CD1 4.43Å; L201-F232 HydrophobicContact CD1-CD2 3.94Å; L201-F232 HydrophobicContact CD1-CG 3.68Å
202	A	92.6	Very high	87.7	Confident	5 Å²	5	67.2 Å²	67.2	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-40.9	177.1	0	0	0	0	0	112.5	Q152 I155 E198 M199 L200 L206	Q152-A202 HydrophobicContact CB-CB 4.27Å; Q152-A202 HydrophobicContact CG-CB 4.42Å; I155-A202 HydrophobicContact CD1-CB 3.48Å; I155-A202 VanDerWaalsContact CD1-CB 3.48Å; E198-A202 PolarHBondContact O-N 3.41Å; M199-A202 PolarHBondContact O-N 3.26Å; L200-A202 PolarHBondContact O-N 3.4Å; A202-L206 VanDerWaalsContact O-CG 3.3Å; A202-L206 WeakPolarHBondContact O-CG 3.31Å; A202-L206 PolarHBondContact O-N 2.98Å; A202-L206 VanDerWaalsContact O-N 3.15Å
203	I	93.1	Very high	89	Confident	60 Å²	60	65.6 Å²	65.6	31%	0.308	33%	0.328	S	S	.	.	H	α-helix	trans	-65.2	-47.4	175.7	-67.9	166.3	0	0	0	111	I155 M199 L200 L201 K205 L206 Q207	I155-I203 HydrophobicContact CD1-CG1 4.47Å; I155-I203 HydrophobicContact CG2-CG1 3.92Å; M199-I203 VanDerWaalsContact O-CG1 3.31Å; M199-I203 WeakPolarHBondContact O-CG1 3.3Å; M199-I203 PolarHBondContact O-N 3.31Å; L200-I203 PolarHBondContact O-N 3.21Å; L201-I203 VanDerWaalsContact C-N 3.33Å; L201-I203 PolarHBondContact O-N 3.31Å; I203-K205 VanDerWaalsContact C-N 3.32Å; I203-K205 PolarHBondContact O-N 3.41Å; I203-L206 WeakPolarHBondContact O-CA 3.47Å; I203-L206 WeakPolarHBondContact O-CB 3.3Å; I203-L206 PolarHBondContact O-N 3.2Å; I203-Q207 WeakPolarHBondContact O-CG 3.45Å; I203-Q207 PolarHBondContact O-N 3.34Å
204	C	93.8	Very high	90.1	Very high	32 Å²	32	64 Å²	64	22%	0.216	32%	0.319	C	S	.	.	H	α-helix	trans	-59.9	-41.7	178.8	-73.6	0	0	0	0	111.5	L200 L201 L206 Q207 F232	L200-C204 VanDerWaalsContact O-CB 3.3Å; L200-C204 WeakPolarHBondContact O-CB 3.22Å; L200-C204 PolarHBondContact O-N 2.86Å; L200-C204 PolarHBondContact O-SG 3.27Å; L201-C204 PolarHBondContact O-N 3.11Å; C204-L206 VanDerWaalsContact C-N 3.29Å; C204-L206 PolarHBondContact O-N 2.95Å; C204-Q207 PolarHBondContact O-N 2.86Å; C204-F232 HydrophobicContact CB-CD1 4.02Å; C204-F232 HydrophobicContact CB-CE1 3.51Å; C204-F232 HydrophobicContact CB-CZ 4.05Å
205	K	93.2	Very high	90.7	Very high	12 Å²	12	68.4 Å²	68.4	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-41.2	171.2	-71.7	171.8	66.1	175.9	0	111.8	Q152 L201 I203 Q207 M208 R213 E217 F232	Q152-K205 VanDerWaalsContact OE1-NZ 3.13Å; L201-K205 HydrophobicContact CD1-CD 4.28Å; L201-K205 HydrophobicContact CD1-CG 4.26Å; L201-K205 HydrophobicContact CG-CD 4.23Å; L201-K205 WeakPolarHBondContact O-CB 3.3Å; L201-K205 VanDerWaalsContact O-CG 3.25Å; L201-K205 WeakPolarHBondContact O-CG 3.32Å; L201-K205 PolarHBondContact O-N 3.21Å; I203-K205 VanDerWaalsContact C-N 3.32Å; I203-K205 PolarHBondContact O-N 3.41Å; K205-Q207 VanDerWaalsContact C-N 3.31Å; K205-Q207 PolarHBondContact O-N 3.23Å; K205-M208 PolarHBondContact O-N 2.88Å; K205-R213 PolarHBondContact O-NE 2.78Å; K205-R213 PolarHBondContact O-NH2 3.12Å; K205-E217 WeakPolarHBondContact CE-OE1 3.28Å; K205-E217 IonicContact NZ-OE1 2.89Å; K205-E217 PolarHBondContact NZ-OE1 2.96Å; K205-E217 IonicContact NZ-OE2 3.13Å; K205-E217 PolarHBondContact NZ-OE2 3.46Å; K205-F232 HydrophobicContact CG-CD2 4.28Å; K205-F232 HydrophobicContact CG-CE2 3.98Å
206	L	90.6	Very high	91.1	Very high	43 Å²	43	65.3 Å²	65.3	23%	0.225	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-26.3	180	-70.6	171.2	0	0	0	113.4	I155 V156 L159 A202 I203 C204 M208 R213	I155-L206 HydrophobicContact CG2-CD1 3.96Å; V156-L206 HydrophobicContact CG2-CD1 3.74Å; V156-L206 HydrophobicContact CG2-CD2 3.93Å; V156-L206 HydrophobicContact CG2-CG 4.48Å; L159-L206 HydrophobicContact CD1-CD1 4.07Å; A202-L206 VanDerWaalsContact O-CG 3.3Å; A202-L206 WeakPolarHBondContact O-CG 3.31Å; A202-L206 PolarHBondContact O-N 2.98Å; A202-L206 VanDerWaalsContact O-N 3.15Å; I203-L206 WeakPolarHBondContact O-CA 3.47Å; I203-L206 WeakPolarHBondContact O-CB 3.3Å; I203-L206 PolarHBondContact O-N 3.2Å; C204-L206 VanDerWaalsContact C-N 3.29Å; C204-L206 PolarHBondContact O-N 2.95Å; L206-M208 VanDerWaalsContact C-N 3.27Å; L206-M208 PolarHBondContact O-N 2.9Å; L206-R213 VanDerWaalsContact CA-NH2 3.34Å; L206-R213 PolarHBondContact O-NH2 3.25Å
207	Q	90.4	Very high	91.4	Very high	146 Å²	146	64.9 Å²	64.9	68%	0.682	30%	0.301	S	S	*	.	H	α-helix	trans	-72.9	-18.1	174	-64.5	-63.1	-44.5	0	0	113.2	I203 C204 K205	I203-Q207 WeakPolarHBondContact O-CG 3.45Å; I203-Q207 PolarHBondContact O-N 3.34Å; C204-Q207 PolarHBondContact O-N 2.86Å; K205-Q207 VanDerWaalsContact C-N 3.31Å; K205-Q207 PolarHBondContact O-N 3.23Å
208	M	88.7	Confident	91.5	Very high	45 Å²	45	67 Å²	67	22%	0.222	31%	0.306	C	S	.	.	S	Bend	trans	-81.3	145.6	180	-63.1	-58.2	105.1	0	0	112.4	K205 L206 L212 R213 F232 L236	K205-M208 PolarHBondContact O-N 2.88Å; L206-M208 VanDerWaalsContact C-N 3.27Å; L206-M208 PolarHBondContact O-N 2.9Å; M208-L212 HydrophobicContact CB-CB 4.23Å; M208-L212 HydrophobicContact SD-CD1 4.26Å; M208-R213 PolarHBondContact O-NH2 3.33Å; M208-F232 HydrophobicContact CG-CE2 4.48Å; M208-F232 HydrophobicContact CG-CZ 3.86Å; M208-L236 HydrophobicContact SD-CD2 3.76Å
209	R	87.2	Confident	91.6	Very high	197 Å²	197	67.4 Å²	67.4	74%	0.743	31%	0.309	S	S	*	.			trans	-62.7	153.9	168.9	-70.6	-172.4	176.8	-176.3	1.7	110.6	F211 L212 R213	R209-F211 VanDerWaalsContact C-N 3.28Å; R209-F211 HydrophobicContact CB-CD1 3.88Å; R209-F211 HydrophobicContact CB-CE1 3.88Å; R209-F211 PolarHBondContact O-N 3.47Å; R209-F211 VanDerWaalsContact O-N 3.13Å; R209-L212 PolarHBondContact O-N 2.85Å; R209-L212 VanDerWaalsContact O-N 3.07Å; R209-R213 PolarHBondContact O-N 2.82Å
210	H	88.9	Confident	91.6	Very high	150 Å²	150	65.9 Å²	65.9	69%	0.694	30%	0.303	S	S	*	.	H	α-helix	trans	-49.3	-43.7	-176.8	177.1	-89.1	0	0	0	113.8	L212 R213 K214	H210-L212 PolarHBondContact O-N 3.43Å; H210-R213 PolarHBondContact O-N 3.29Å; H210-K214 WeakPolarHBondContact O-CB 3.32Å; H210-K214 PolarHBondContact O-N 3.08Å
211	F	90.9	Very high	91.4	Very high	96 Å²	96	71.9 Å²	71.9	42%	0.421	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-38.3	-177.6	80.7	-87.1	0	0	0	113.1	R209 R215	R209-F211 VanDerWaalsContact C-N 3.28Å; R209-F211 HydrophobicContact CB-CD1 3.88Å; R209-F211 HydrophobicContact CB-CE1 3.88Å; R209-F211 PolarHBondContact O-N 3.47Å; R209-F211 VanDerWaalsContact O-N 3.13Å; F211-R215 WeakPolarHBondContact O-CG 3.29Å; F211-R215 PolarHBondContact O-N 2.93Å; F211-R215 VanDerWaalsContact O-N 3.09Å
212	L	90.3	Very high	91.2	Very high	33 Å²	33	76.3 Å²	76.3	17%	0.173	36%	0.355	C	S	.	.	H	α-helix	trans	-71.9	-41.6	175.3	-71.8	176.7	0	0	0	110.9	M208 R209 H210 K214 R215 W216 F235 Q239	M208-L212 HydrophobicContact CB-CB 4.23Å; M208-L212 HydrophobicContact SD-CD1 4.26Å; R209-L212 PolarHBondContact O-N 2.85Å; R209-L212 VanDerWaalsContact O-N 3.07Å; H210-L212 PolarHBondContact O-N 3.43Å; L212-K214 VanDerWaalsContact C-N 3.31Å; L212-K214 PolarHBondContact O-N 2.75Å; L212-R215 PolarHBondContact O-N 3.14Å; L212-W216 PolarHBondContact O-N 2.86Å; L212-F235 WeakPolarHBondContact O-CZ 3.41Å; L212-Q239 HydrophobicContact CD2-CB 4.37Å; L212-Q239 HydrophobicContact CD2-CG 4.03Å
213	R	92.9	Very high	90.8	Very high	68 Å²	68	82.1 Å²	82.1	26%	0.257	38%	0.376	S	S	.	.	H	α-helix	trans	-59.9	-43.5	174.6	-168.4	-177.7	-55.9	156.2	8.8	111.1	K205 L206 M208 R209 H210 W216 E217	K205-R213 PolarHBondContact O-NE 2.78Å; K205-R213 PolarHBondContact O-NH2 3.12Å; L206-R213 VanDerWaalsContact CA-NH2 3.34Å; L206-R213 PolarHBondContact O-NH2 3.25Å; M208-R213 PolarHBondContact O-NH2 3.33Å; R209-R213 PolarHBondContact O-N 2.82Å; H210-R213 PolarHBondContact O-N 3.29Å; R213-W216 WeakPolarHBondContact O-CB 3.29Å; R213-W216 PolarHBondContact O-N 3.49Å; R213-E217 WeakPolarHBondContact O-CG 3.33Å; R213-E217 PolarHBondContact O-N 3.14Å
214	K	93.3	Very high	90.1	Very high	120 Å²	120	88.5 Å²	88.5	52%	0.522	40%	0.401	S	S	.	.	H	α-helix	trans	-58.7	-49.9	175.3	-177.9	-178.8	175.1	-175.5	0	111.3	H210 L212 W216 E217 D218	H210-K214 WeakPolarHBondContact O-CB 3.32Å; H210-K214 PolarHBondContact O-N 3.08Å; L212-K214 VanDerWaalsContact C-N 3.31Å; L212-K214 PolarHBondContact O-N 2.75Å; K214-W216 PolarHBondContact O-N 2.79Å; K214-E217 PolarHBondContact O-N 2.79Å; K214-E217 VanDerWaalsContact O-N 3.15Å; K214-D218 VanDerWaalsContact O-CG 3.23Å; K214-D218 PolarHBondContact O-N 2.67Å
215	R	93.5	Very high	89.5	Confident	111 Å²	111	93.5 Å²	93.5	42%	0.419	42%	0.422	S	S	.	.	H	α-helix	trans	-57.2	-38.8	176	-77	-176.3	177	172.7	0.8	112.5	F211 L212 D218 D219 F235	F211-R215 WeakPolarHBondContact O-CG 3.29Å; F211-R215 PolarHBondContact O-N 2.93Å; F211-R215 VanDerWaalsContact O-N 3.09Å; L212-R215 PolarHBondContact O-N 3.14Å; R215-D218 PolarHBondContact O-N 3.09Å; R215-D219 WeakPolarHBondContact O-CB 3.38Å; R215-D219 PolarHBondContact O-N 3.11Å; R215-F235 HydrophobicContact CB-CE2 3.98Å; R215-F235 HydrophobicContact CB-CZ 3.87Å
216	W	94.3	Very high	89.1	Confident	2 Å²	2	99 Å²	99	1%	0.008	45%	0.447	C	S	.	.	H	α-helix	trans	-63.8	-48.9	174.6	166.8	-103.3	0	0	0	112.1	L201 L212 R213 K214 D218 D219 V220 A227 S231 F232 F235	L201-W216 HydrophobicContact CD1-CZ2 4.01Å; L212-W216 PolarHBondContact O-N 2.86Å; R213-W216 WeakPolarHBondContact O-CB 3.29Å; R213-W216 PolarHBondContact O-N 3.49Å; K214-W216 PolarHBondContact O-N 2.79Å; W216-D218 VanDerWaalsContact C-N 3.27Å; W216-D218 PolarHBondContact O-N 3.18Å; W216-D219 PolarHBondContact O-N 3.3Å; W216-V220 HydrophobicContact CD2-CG2 3.85Å; W216-V220 VanDerWaalsContact CE2-CG2 3.4Å; W216-V220 HydrophobicContact CE3-CG2 4.16Å; W216-V220 HydrophobicContact CH2-CG2 3.76Å; W216-V220 HydrophobicContact CZ2-CG2 3.4Å; W216-V220 HydrophobicContact CZ3-CG2 4.1Å; W216-V220 WeakPolarHBondContact O-CG2 3.19Å; W216-V220 PolarHBondContact O-N 2.93Å; W216-A227 HydrophobicContact CZ2-CB 4.01Å; W216-S231 WeakPolarHBondContact CH2-OG 3.48Å; W216-F232 AromaticContact CD2-CD2 3.63Å; W216-F232 HydrophobicContact CD2-CD2 3.63Å; W216-F232 HydrophobicContact CD2-CE2 4.19Å; W216-F232 AromaticContact CE2-CD2 3.66Å; W216-F232 AromaticContact CE3-CD2 3.91Å; W216-F232 HydrophobicContact CE3-CD2 3.91Å; W216-F232 HydrophobicContact CG-CD2 4.12Å; W216-F232 HydrophobicContact CG-CE2 4.21Å; W216-F232 VanDerWaalsContact CH2-CA 3.47Å; W216-F232 HydrophobicContact CH2-CB 3.71Å; W216-F232 HydrophobicContact CH2-CD2 4.17Å; W216-F232 HydrophobicContact CH2-CG 4.47Å; W216-F232 HydrophobicContact CZ2-CB 3.96Å; W216-F232 AromaticContact CZ2-CD2 3.91Å; W216-F232 HydrophobicContact CZ2-CD2 3.91Å; W216-F232 HydrophobicContact CZ2-CG 4.45Å; W216-F232 VanDerWaalsContact CZ3-CA 3.5Å; W216-F232 HydrophobicContact CZ3-CB 4.11Å; W216-F232 HydrophobicContact CZ3-CD2 4.19Å; W216-F235 HydrophobicContact CB-CD1 4.21Å; W216-F235 HydrophobicContact CB-CE1 3.8Å; W216-F235 HydrophobicContact CB-CE2 4.24Å; W216-F235 HydrophobicContact CB-CZ 3.81Å; W216-F235 HydrophobicContact CD2-CD1 4.47Å; W216-F235 HydrophobicContact CE3-CB 3.58Å; W216-F235 AromaticContact CE3-CD1 3.81Å; W216-F235 HydrophobicContact CE3-CD1 3.81Å; W216-F235 AromaticContact CE3-CD2 3.98Å; W216-F235 HydrophobicContact CE3-CD2 3.98Å; W216-F235 AromaticContact CE3-CG 3.51Å; W216-F235 HydrophobicContact CE3-CG 3.51Å; W216-F235 HydrophobicContact CZ3-CB 3.63Å; W216-F235 HydrophobicContact CZ3-CG 4.11Å
217	E	92.8	Very high	89	Confident	59 Å²	59	98.4 Å²	98.4	28%	0.276	45%	0.449	S	S	.	.	H	α-helix	trans	-62.4	-37	177.6	-57.4	-56.5	165.3	0	0	111.7	K205 R213 K214 F221	K205-E217 WeakPolarHBondContact CE-OE1 3.28Å; K205-E217 IonicContact NZ-OE1 2.89Å; K205-E217 PolarHBondContact NZ-OE1 2.96Å; K205-E217 IonicContact NZ-OE2 3.13Å; K205-E217 PolarHBondContact NZ-OE2 3.46Å; R213-E217 WeakPolarHBondContact O-CG 3.33Å; R213-E217 PolarHBondContact O-N 3.14Å; K214-E217 PolarHBondContact O-N 2.79Å; K214-E217 VanDerWaalsContact O-N 3.15Å; E217-F221 VanDerWaalsContact O-CB 3.31Å; E217-F221 WeakPolarHBondContact O-CB 3.44Å; E217-F221 PolarHBondContact O-N 3.46Å
218	D	91.9	Very high	89.1	Confident	84 Å²	84	94.2 Å²	94.2	45%	0.449	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-42	175.7	-66.8	-24.3	0	0	0	111	K214 R215 W216 T222	K214-D218 VanDerWaalsContact O-CG 3.23Å; K214-D218 PolarHBondContact O-N 2.67Å; R215-D218 PolarHBondContact O-N 3.09Å; W216-D218 VanDerWaalsContact C-N 3.27Å; W216-D218 PolarHBondContact O-N 3.18Å; D218-T222 WeakPolarHBondContact O-CB 3.27Å; D218-T222 PolarHBondContact O-N 3.21Å; D218-T222 PolarHBondContact O-OG1 3.47Å
219	D	90.2	Very high	89.3	Confident	40 Å²	40	93.1 Å²	93.1	21%	0.214	43%	0.429	C	S	.	.	H	α-helix	trans	-65.5	-47.1	176.4	-176.1	70.9	0	0	0	111.8	R215 W216 F221 T222 R223 F235	R215-D219 WeakPolarHBondContact O-CB 3.38Å; R215-D219 PolarHBondContact O-N 3.11Å; W216-D219 PolarHBondContact O-N 3.3Å; D219-F221 VanDerWaalsContact C-N 3.33Å; D219-F221 PolarHBondContact O-N 2.94Å; D219-T222 PolarHBondContact O-N 3.2Å; D219-T222 VanDerWaalsContact O-N 3.1Å; D219-R223 VanDerWaalsContact CG-NE 3.32Å; D219-R223 WeakPolarHBondContact O-CG 3.41Å; D219-R223 PolarHBondContact O-N 3.04Å; D219-R223 IonicContact OD1-CZ 2.69Å; D219-R223 IonicContact OD1-NE 3.43Å; D219-R223 PolarHBondContact OD1-NE 2.8Å; D219-R223 IonicContact OD1-NH2 3.94Å; D219-R223 PolarHBondContact OD1-NH2 2.87Å; D219-R223 IonicContact OD2-CZ 2.66Å; D219-R223 IonicContact OD2-NE 2.68Å; D219-R223 PolarHBondContact OD2-NE 3.31Å; D219-R223 IonicContact OD2-NH2 3.24Å; D219-R223 PolarHBondContact OD2-NH2 3.34Å; D219-F235 HydrophobicContact CB-CD2 4.48Å
220	V	89.9	Confident	89.6	Confident	20 Å²	20	89.8 Å²	89.8	12%	0.121	42%	0.421	C	S	.	.	H	α-helix	trans	-59	-44.5	175.9	171.2	0	0	0	0	111.2	W216 T222 K224 A227	W216-V220 HydrophobicContact CD2-CG2 3.85Å; W216-V220 VanDerWaalsContact CE2-CG2 3.4Å; W216-V220 HydrophobicContact CE3-CG2 4.16Å; W216-V220 HydrophobicContact CH2-CG2 3.76Å; W216-V220 HydrophobicContact CZ2-CG2 3.4Å; W216-V220 HydrophobicContact CZ3-CG2 4.1Å; W216-V220 WeakPolarHBondContact O-CG2 3.19Å; W216-V220 PolarHBondContact O-N 2.93Å; V220-T222 VanDerWaalsContact C-N 3.26Å; V220-T222 PolarHBondContact O-N 3.43Å; V220-K224 PolarHBondContact O-N 3.35Å; V220-A227 HydrophobicContact CG1-CB 4.05Å; V220-A227 HydrophobicContact CG2-CB 3.99Å
221	F	86.6	Confident	89.9	Confident	171 Å²	171	84.1 Å²	84.1	75%	0.75	40%	0.399	S	S	*	.	H	α-helix	trans	-63.2	-35.4	177.5	-175.1	-96.5	0	0	0	112.2	E217 D219	E217-F221 VanDerWaalsContact O-CB 3.31Å; E217-F221 WeakPolarHBondContact O-CB 3.44Å; E217-F221 PolarHBondContact O-N 3.46Å; D219-F221 VanDerWaalsContact C-N 3.33Å; D219-F221 PolarHBondContact O-N 2.94Å
222	T	89.8	Confident	90.1	Very high	108 Å²	108	79.7 Å²	79.7	66%	0.663	38%	0.379	S	S	*	.	H	α-helix	trans	-73.9	-43.1	-179	-57.6	0	0	0	0	112.2	D218 D219 V220 K224	D218-T222 WeakPolarHBondContact O-CB 3.27Å; D218-T222 PolarHBondContact O-N 3.21Å; D218-T222 PolarHBondContact O-OG1 3.47Å; D219-T222 PolarHBondContact O-N 3.2Å; D219-T222 VanDerWaalsContact O-N 3.1Å; V220-T222 VanDerWaalsContact C-N 3.26Å; V220-T222 PolarHBondContact O-N 3.43Å; T222-K224 VanDerWaalsContact C-N 3.28Å; T222-K224 PolarHBondContact O-N 2.95Å
223	R	84	Confident	90.4	Very high	127 Å²	127	83.5 Å²	83.5	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-65.1	-30.6	-179.4	-69.4	178.8	-169	-98.2	-7.7	112.9	D219 E225	D219-R223 VanDerWaalsContact CG-NE 3.32Å; D219-R223 WeakPolarHBondContact O-CG 3.41Å; D219-R223 PolarHBondContact O-N 3.04Å; D219-R223 IonicContact OD1-CZ 2.69Å; D219-R223 IonicContact OD1-NE 3.43Å; D219-R223 PolarHBondContact OD1-NE 2.8Å; D219-R223 IonicContact OD1-NH2 3.94Å; D219-R223 PolarHBondContact OD1-NH2 2.87Å; D219-R223 IonicContact OD2-CZ 2.66Å; D219-R223 IonicContact OD2-NE 2.68Å; D219-R223 PolarHBondContact OD2-NE 3.31Å; D219-R223 IonicContact OD2-NH2 3.24Å; D219-R223 PolarHBondContact OD2-NH2 3.34Å; R223-E225 HydrophobicContact CB-CB 4.26Å; R223-E225 HydrophobicContact CB-CG 4.47Å; R223-E225 PolarHBondContact O-N 3.21Å; R223-E225 VanDerWaalsContact O-N 3.07Å
224	K	78.3	Confident	90.5	Very high	194 Å²	194	85 Å²	85	84%	0.843	40%	0.404	S	S	*	.			trans	55.6	16.3	-171.5	-56.7	-179.1	-179.8	177.3	0	113.9	V220 T222	V220-K224 PolarHBondContact O-N 3.35Å; T222-K224 VanDerWaalsContact C-N 3.28Å; T222-K224 PolarHBondContact O-N 2.95Å
225	E	82.1	Confident	90.6	Very high	138 Å²	138	79.6 Å²	79.6	65%	0.645	38%	0.381	S	S	*	.	S	Bend	trans	-96.7	161.7	176.1	-70.9	172.4	-179.9	0	0	110.1	R223 A227	R223-E225 HydrophobicContact CB-CB 4.26Å; R223-E225 HydrophobicContact CB-CG 4.47Å; R223-E225 PolarHBondContact O-N 3.21Å; R223-E225 VanDerWaalsContact O-N 3.07Å; E225-A227 PolarHBondContact O-N 3.41Å
226	E	83.8	Confident	90.7	Very high	126 Å²	126	76.2 Å²	76.2	59%	0.589	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-68.6	124.4	175.2	-175.5	164.7	-154.9	0	0	110.8	R192 T228	R192-E226 IonicContact CZ-OE1 2.82Å; R192-E226 IonicContact NH1-OE1 2.75Å; R192-E226 PolarHBondContact NH1-OE1 2.95Å; R192-E226 IonicContact NH1-OE2 3.93Å; R192-E226 IonicContact NH2-OE1 3.22Å; R192-E226 PolarHBondContact NH2-OE1 3.23Å; E226-T228 PolarHBondContact O-N 2.75Å
227	A	89.4	Confident	90.8	Very high	32 Å²	32	83.4 Å²	83.4	26%	0.264	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-70.4	118.4	180	0	0	0	0	0	111	L201 W216 V220 E225	L201-A227 HydrophobicContact CD2-CB 4.11Å; L201-A227 WeakPolarHBondContact CD2-O 3.19Å; W216-A227 HydrophobicContact CZ2-CB 4.01Å; V220-A227 HydrophobicContact CG1-CB 4.05Å; V220-A227 HydrophobicContact CG2-CB 3.99Å; E225-A227 PolarHBondContact O-N 3.41Å
228	T	92.3	Very high	91	Very high	57 Å²	57	83.2 Å²	83.2	35%	0.35	40%	0.401	S	S	.	.			trans	-110.8	165.5	177.4	65.7	0	0	0	0	111.9	E226 E230 S231 F232	E226-T228 PolarHBondContact O-N 2.75Å; T228-E230 VanDerWaalsContact CB-OE2 3.32Å; T228-E230 WeakPolarHBondContact CB-OE2 3.49Å; T228-E230 PolarHBondContact O-N 3.25Å; T228-E230 PolarHBondContact OG1-OE2 3.47Å; T228-S231 PolarHBondContact N-OG 2.98Å; T228-S231 PolarHBondContact O-N 3.4Å; T228-S231 PolarHBondContact O-OG 2.88Å; T228-S231 WeakPolarHBondContact OG1-CB 3.39Å; T228-S231 PolarHBondContact OG1-N 3.46Å; T228-S231 VanDerWaalsContact OG1-N 3.1Å; T228-S231 PolarHBondContact OG1-OG 3.07Å; T228-F232 PolarHBondContact O-N 2.9Å; T228-F232 VanDerWaalsContact O-N 3.14Å
229	L	92	Very high	91.1	Very high	23 Å²	23	80.5 Å²	80.5	12%	0.12	39%	0.386	C	S	.	.	H	α-helix	trans	-64.2	-34.6	175.2	-172.8	62.8	0	0	0	111.3	L200 L201 F232 F233	L200-L229 HydrophobicContact CB-CD1 4.36Å; L200-L229 HydrophobicContact CB-CD2 4.18Å; L200-L229 HydrophobicContact CD1-CD2 4.34Å; L201-L229 HydrophobicContact CB-CD1 4.28Å; L229-F232 WeakPolarHBondContact O-CB 3.29Å; L229-F232 PolarHBondContact O-N 2.95Å; L229-F233 HydrophobicContact CD1-CE2 3.88Å; L229-F233 HydrophobicContact CD1-CZ 4.16Å; L229-F233 HydrophobicContact CD2-CE2 4.02Å; L229-F233 HydrophobicContact CG-CD2 4.09Å; L229-F233 HydrophobicContact CG-CE2 3.58Å; L229-F233 HydrophobicContact CG-CZ 4.33Å; L229-F233 VanDerWaalsContact O-CD2 3.24Å; L229-F233 WeakPolarHBondContact O-CD2 3.25Å; L229-F233 PolarHBondContact O-N 3.43Å
230	E	94.1	Very high	91.3	Very high	126 Å²	126	82.4 Å²	82.4	59%	0.589	40%	0.398	S	S	*	.	H	α-helix	trans	-64.7	-48.1	177.4	-63.5	67.9	-148	0	0	110.9	T228 F232 F233 E234	T228-E230 VanDerWaalsContact CB-OE2 3.32Å; T228-E230 WeakPolarHBondContact CB-OE2 3.49Å; T228-E230 PolarHBondContact O-N 3.25Å; T228-E230 PolarHBondContact OG1-OE2 3.47Å; E230-F232 PolarHBondContact O-N 3.17Å; E230-F233 PolarHBondContact O-N 3.1Å; E230-F233 VanDerWaalsContact O-N 3.17Å; E230-E234 PolarHBondContact O-N 2.87Å
231	S	94.7	Very high	91.6	Very high	32 Å²	32	86.2 Å²	86.2	22%	0.224	42%	0.415	C	S	.	.	H	α-helix	trans	-61.7	-32.6	176.2	65.9	0	0	0	0	112.3	W216 T228 E234 F235	W216-S231 WeakPolarHBondContact CH2-OG 3.48Å; T228-S231 PolarHBondContact N-OG 2.98Å; T228-S231 PolarHBondContact O-N 3.4Å; T228-S231 PolarHBondContact O-OG 2.88Å; T228-S231 WeakPolarHBondContact OG1-CB 3.39Å; T228-S231 PolarHBondContact OG1-N 3.46Å; T228-S231 VanDerWaalsContact OG1-N 3.1Å; T228-S231 PolarHBondContact OG1-OG 3.07Å; S231-E234 PolarHBondContact O-N 2.91Å; S231-F235 WeakPolarHBondContact O-CB 3.28Å; S231-F235 PolarHBondContact O-N 2.97Å
232	F	95.9	Very high	91.9	Very high	3 Å²	3	81 Å²	81	1%	0.013	40%	0.397	C	S	.	.	H	α-helix	trans	-68.9	-40.4	174.8	-179.2	-97.5	0	0	0	112.9	L201 C204 K205 M208 W216 T228 L229 E230 E234 F235 L236	L201-F232 HydrophobicContact CD1-CB 3.44Å; L201-F232 VanDerWaalsContact CD1-CB 3.44Å; L201-F232 HydrophobicContact CD1-CD1 4.43Å; L201-F232 HydrophobicContact CD1-CD2 3.94Å; L201-F232 HydrophobicContact CD1-CG 3.68Å; C204-F232 HydrophobicContact CB-CD1 4.02Å; C204-F232 HydrophobicContact CB-CE1 3.51Å; C204-F232 HydrophobicContact CB-CZ 4.05Å; K205-F232 HydrophobicContact CG-CD2 4.28Å; K205-F232 HydrophobicContact CG-CE2 3.98Å; M208-F232 HydrophobicContact CG-CE2 4.48Å; M208-F232 HydrophobicContact CG-CZ 3.86Å; W216-F232 AromaticContact CD2-CD2 3.63Å; W216-F232 HydrophobicContact CD2-CD2 3.63Å; W216-F232 HydrophobicContact CD2-CE2 4.19Å; W216-F232 AromaticContact CE2-CD2 3.66Å; W216-F232 AromaticContact CE3-CD2 3.91Å; W216-F232 HydrophobicContact CE3-CD2 3.91Å; W216-F232 HydrophobicContact CG-CD2 4.12Å; W216-F232 HydrophobicContact CG-CE2 4.21Å; W216-F232 VanDerWaalsContact CH2-CA 3.47Å; W216-F232 HydrophobicContact CH2-CB 3.71Å; W216-F232 HydrophobicContact CH2-CD2 4.17Å; W216-F232 HydrophobicContact CH2-CG 4.47Å; W216-F232 HydrophobicContact CZ2-CB 3.96Å; W216-F232 AromaticContact CZ2-CD2 3.91Å; W216-F232 HydrophobicContact CZ2-CD2 3.91Å; W216-F232 HydrophobicContact CZ2-CG 4.45Å; W216-F232 VanDerWaalsContact CZ3-CA 3.5Å; W216-F232 HydrophobicContact CZ3-CB 4.11Å; W216-F232 HydrophobicContact CZ3-CD2 4.19Å; T228-F232 PolarHBondContact O-N 2.9Å; T228-F232 VanDerWaalsContact O-N 3.14Å; L229-F232 WeakPolarHBondContact O-CB 3.29Å; L229-F232 PolarHBondContact O-N 2.95Å; E230-F232 PolarHBondContact O-N 3.17Å; F232-E234 VanDerWaalsContact C-N 3.35Å; F232-F235 WeakPolarHBondContact O-CB 3.28Å; F232-F235 PolarHBondContact O-N 3.32Å; F232-L236 HydrophobicContact CD1-CD1 4.09Å; F232-L236 HydrophobicContact CD1-CG 4.4Å; F232-L236 HydrophobicContact CE1-CD1 3.45Å; F232-L236 VanDerWaalsContact CE1-CD1 3.45Å; F232-L236 HydrophobicContact CE1-CG 3.94Å; F232-L236 HydrophobicContact CZ-CD1 3.99Å; F232-L236 HydrophobicContact CZ-CD2 4.31Å; F232-L236 HydrophobicContact CZ-CG 4.14Å; F232-L236 WeakPolarHBondContact O-CG 3.29Å; F232-L236 PolarHBondContact O-N 3.36Å
233	F	96.5	Very high	91.9	Very high	113 Å²	113	80 Å²	80	50%	0.496	39%	0.385	S	S	.	.	H	α-helix	trans	-68	-36.5	175.1	-73	-52.3	0	0	0	112.2	L229 E230 L236 R237	L229-F233 HydrophobicContact CD1-CE2 3.88Å; L229-F233 HydrophobicContact CD1-CZ 4.16Å; L229-F233 HydrophobicContact CD2-CE2 4.02Å; L229-F233 HydrophobicContact CG-CD2 4.09Å; L229-F233 HydrophobicContact CG-CE2 3.58Å; L229-F233 HydrophobicContact CG-CZ 4.33Å; L229-F233 VanDerWaalsContact O-CD2 3.24Å; L229-F233 WeakPolarHBondContact O-CD2 3.25Å; L229-F233 PolarHBondContact O-N 3.43Å; E230-F233 PolarHBondContact O-N 3.1Å; E230-F233 VanDerWaalsContact O-N 3.17Å; F233-L236 HydrophobicContact CD1-CD1 4.37Å; F233-L236 PolarHBondContact O-N 3.2Å; F233-R237 WeakPolarHBondContact O-CB 3.42Å; F233-R237 PolarHBondContact O-N 3.38Å
234	E	95.4	Very high	92.3	Very high	98 Å²	98	78.3 Å²	78.3	46%	0.458	38%	0.382	S	S	.	.	H	α-helix	trans	-66	-39.1	174	-169.7	61.6	-170.4	0	0	111.8	E230 S231 F232 L236 R237 T238	E230-E234 PolarHBondContact O-N 2.87Å; S231-E234 PolarHBondContact O-N 2.91Å; F232-E234 VanDerWaalsContact C-N 3.35Å; E234-L236 PolarHBondContact O-N 3.45Å; E234-R237 WeakPolarHBondContact O-CB 3.44Å; E234-R237 PolarHBondContact O-N 3.07Å; E234-R237 IonicContact OE2-NH1 3.53Å; E234-T238 PolarHBondContact O-N 3.25Å; E234-T238 PolarHBondContact O-OG1 2.94Å
235	F	95.8	Very high	92.9	Very high	8 Å²	8	72 Å²	72	4%	0.035	36%	0.363	C	S	.	.	H	α-helix	trans	-57.4	-48.2	169.3	164.9	-95.2	0	0	0	111.5	L212 R215 W216 D219 S231 F232 R237 T238 Q239	L212-F235 WeakPolarHBondContact O-CZ 3.41Å; R215-F235 HydrophobicContact CB-CE2 3.98Å; R215-F235 HydrophobicContact CB-CZ 3.87Å; W216-F235 HydrophobicContact CB-CD1 4.21Å; W216-F235 HydrophobicContact CB-CE1 3.8Å; W216-F235 HydrophobicContact CB-CE2 4.24Å; W216-F235 HydrophobicContact CB-CZ 3.81Å; W216-F235 HydrophobicContact CD2-CD1 4.47Å; W216-F235 HydrophobicContact CE3-CB 3.58Å; W216-F235 AromaticContact CE3-CD1 3.81Å; W216-F235 HydrophobicContact CE3-CD1 3.81Å; W216-F235 AromaticContact CE3-CD2 3.98Å; W216-F235 HydrophobicContact CE3-CD2 3.98Å; W216-F235 AromaticContact CE3-CG 3.51Å; W216-F235 HydrophobicContact CE3-CG 3.51Å; W216-F235 HydrophobicContact CZ3-CB 3.63Å; W216-F235 HydrophobicContact CZ3-CG 4.11Å; D219-F235 HydrophobicContact CB-CD2 4.48Å; S231-F235 WeakPolarHBondContact O-CB 3.28Å; S231-F235 PolarHBondContact O-N 2.97Å; F232-F235 WeakPolarHBondContact O-CB 3.28Å; F232-F235 PolarHBondContact O-N 3.32Å; F235-R237 VanDerWaalsContact C-N 3.32Å; F235-R237 PolarHBondContact O-N 3.48Å; F235-T238 WeakPolarHBondContact O-CB 3.22Å; F235-T238 PolarHBondContact O-N 2.93Å; F235-Q239 HydrophobicContact CD1-CG 4.33Å; F235-Q239 HydrophobicContact CD2-CG 4.4Å; F235-Q239 HydrophobicContact CE1-CG 3.82Å; F235-Q239 HydrophobicContact CE2-CG 3.92Å; F235-Q239 HydrophobicContact CZ-CG 3.6Å; F235-Q239 WeakPolarHBondContact O-CG 3.48Å; F235-Q239 PolarHBondContact O-N 3.25Å
236	L	95.9	Very high	93	Very high	39 Å²	39	69 Å²	69	20%	0.204	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-39.4	178.6	-73.8	-176.4	0	0	0	112.3	M208 F232 F233 E234 T238 Q239 V240	M208-L236 HydrophobicContact SD-CD2 3.76Å; F232-L236 HydrophobicContact CD1-CD1 4.09Å; F232-L236 HydrophobicContact CD1-CG 4.4Å; F232-L236 HydrophobicContact CE1-CD1 3.45Å; F232-L236 VanDerWaalsContact CE1-CD1 3.45Å; F232-L236 HydrophobicContact CE1-CG 3.94Å; F232-L236 HydrophobicContact CZ-CD1 3.99Å; F232-L236 HydrophobicContact CZ-CD2 4.31Å; F232-L236 HydrophobicContact CZ-CG 4.14Å; F232-L236 WeakPolarHBondContact O-CG 3.29Å; F232-L236 PolarHBondContact O-N 3.36Å; F233-L236 HydrophobicContact CD1-CD1 4.37Å; F233-L236 PolarHBondContact O-N 3.2Å; E234-L236 PolarHBondContact O-N 3.45Å; L236-T238 VanDerWaalsContact C-N 3.34Å; L236-Q239 PolarHBondContact O-N 3.17Å; L236-V240 WeakPolarHBondContact O-CG2 3.35Å; L236-V240 PolarHBondContact O-N 3.04Å
237	R	96.5	Very high	92.8	Very high	153 Å²	153	69.6 Å²	69.6	58%	0.577	35%	0.354	S	S	*	.	H	α-helix	trans	-58	-48.2	173.8	-170.7	-175	-152.8	175.6	5.7	111	F233 E234 F235 Q239 V240 E241	F233-R237 WeakPolarHBondContact O-CB 3.42Å; F233-R237 PolarHBondContact O-N 3.38Å; E234-R237 WeakPolarHBondContact O-CB 3.44Å; E234-R237 PolarHBondContact O-N 3.07Å; E234-R237 IonicContact OE2-NH1 3.53Å; F235-R237 VanDerWaalsContact C-N 3.32Å; F235-R237 PolarHBondContact O-N 3.48Å; R237-Q239 VanDerWaalsContact C-N 3.3Å; R237-Q239 PolarHBondContact O-N 3.49Å; R237-V240 WeakPolarHBondContact O-CB 3.42Å; R237-V240 PolarHBondContact O-N 3.32Å; R237-V240 VanDerWaalsContact O-N 3.07Å; R237-E241 IonicContact NE-OE1 3.78Å; R237-E241 PolarHBondContact O-N 2.88Å
238	T	96	Very high	92.4	Very high	55 Å²	55	76.4 Å²	76.4	34%	0.337	37%	0.373	S	S	.	.	H	α-helix	trans	-57.3	-43.7	175.3	-55.3	0	0	0	0	111.2	E234 F235 L236 V240 E241 V242	E234-T238 PolarHBondContact O-N 3.25Å; E234-T238 PolarHBondContact O-OG1 2.94Å; F235-T238 WeakPolarHBondContact O-CB 3.22Å; F235-T238 PolarHBondContact O-N 2.93Å; L236-T238 VanDerWaalsContact C-N 3.34Å; T238-V240 VanDerWaalsContact C-N 3.33Å; T238-V240 PolarHBondContact O-N 3.43Å; T238-E241 PolarHBondContact O-N 3.05Å; T238-V242 VanDerWaalsContact O-CG2 3.28Å; T238-V242 WeakPolarHBondContact O-CG2 3.41Å; T238-V242 PolarHBondContact O-N 3.3Å
239	Q	94.7	Very high	91.4	Very high	28 Å²	28	78.1 Å²	78.1	13%	0.131	38%	0.384	C	S	.	.	H	α-helix	trans	-64.9	-35.6	177.3	-62.5	-51.9	-62.7	0	0	112.6	L212 F235 L236 R237 E243	L212-Q239 HydrophobicContact CD2-CB 4.37Å; L212-Q239 HydrophobicContact CD2-CG 4.03Å; F235-Q239 HydrophobicContact CD1-CG 4.33Å; F235-Q239 HydrophobicContact CD2-CG 4.4Å; F235-Q239 HydrophobicContact CE1-CG 3.82Å; F235-Q239 HydrophobicContact CE2-CG 3.92Å; F235-Q239 HydrophobicContact CZ-CG 3.6Å; F235-Q239 WeakPolarHBondContact O-CG 3.48Å; F235-Q239 PolarHBondContact O-N 3.25Å; L236-Q239 PolarHBondContact O-N 3.17Å; R237-Q239 VanDerWaalsContact C-N 3.3Å; R237-Q239 PolarHBondContact O-N 3.49Å; Q239-E243 WeakPolarHBondContact O-CG 3.42Å; Q239-E243 PolarHBondContact O-N 3.08Å; Q239-E243 VanDerWaalsContact O-N 3.1Å
240	V	94.8	Very high	89.8	Confident	79 Å²	79	80.9 Å²	80.9	48%	0.479	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-48	174.1	170.7	0	0	0	0	110.7	L236 R237 T238 V242 E243 E244	L236-V240 WeakPolarHBondContact O-CG2 3.35Å; L236-V240 PolarHBondContact O-N 3.04Å; R237-V240 WeakPolarHBondContact O-CB 3.42Å; R237-V240 PolarHBondContact O-N 3.32Å; R237-V240 VanDerWaalsContact O-N 3.07Å; T238-V240 VanDerWaalsContact C-N 3.33Å; T238-V240 PolarHBondContact O-N 3.43Å; V240-V242 VanDerWaalsContact C-N 3.32Å; V240-V242 PolarHBondContact O-N 3.36Å; V240-E243 PolarHBondContact O-N 3.03Å; V240-E244 HydrophobicContact CG1-CG 4.36Å; V240-E244 WeakPolarHBondContact O-CG 3.31Å; V240-E244 PolarHBondContact O-N 3.34Å
241	E	95.9	Very high	87.9	Confident	100 Å²	100	78.1 Å²	78.1	47%	0.467	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-38.4	179.8	-69.9	174.6	-171	0	0	112.4	R237 T238 E244 S245	R237-E241 IonicContact NE-OE1 3.78Å; R237-E241 PolarHBondContact O-N 2.88Å; T238-E241 PolarHBondContact O-N 3.05Å; E241-E244 PolarHBondContact O-N 2.91Å; E241-S245 VanDerWaalsContact O-CB 3.31Å; E241-S245 WeakPolarHBondContact O-CB 3.43Å; E241-S245 PolarHBondContact O-N 3.49Å; E241-S245 PolarHBondContact O-OG 3.28Å
242	V	92.7	Very high	86	Confident	62 Å²	62	81.3 Å²	81.3	38%	0.376	43%	0.429	S	S	.	.	H	α-helix	trans	-60.4	-49.2	172.8	168.6	0	0	0	0	110.8	T238 V240 E244 S245 V246	T238-V242 VanDerWaalsContact O-CG2 3.28Å; T238-V242 WeakPolarHBondContact O-CG2 3.41Å; T238-V242 PolarHBondContact O-N 3.3Å; V240-V242 VanDerWaalsContact C-N 3.32Å; V240-V242 PolarHBondContact O-N 3.36Å; V242-E244 PolarHBondContact O-N 3.42Å; V242-S245 PolarHBondContact O-N 3.48Å; V242-V246 WeakPolarHBondContact O-CG2 3.32Å; V242-V246 PolarHBondContact O-N 3.17Å
243	E	88.9	Confident	83.9	Confident	87 Å²	87	90 Å²	90	41%	0.407	46%	0.463	S	S	.	.	H	α-helix	trans	-65.2	-37.5	179.7	-72.4	-68.4	163.6	0	0	112.5	Q239 V240 K247	Q239-E243 WeakPolarHBondContact O-CG 3.42Å; Q239-E243 PolarHBondContact O-N 3.08Å; Q239-E243 VanDerWaalsContact O-N 3.1Å; V240-E243 PolarHBondContact O-N 3.03Å; E243-K247 VanDerWaalsContact O-CG 3.28Å; E243-K247 WeakPolarHBondContact O-CG 3.45Å; E243-K247 PolarHBondContact O-N 3.44Å; E243-K247 VanDerWaalsContact O-N 3.09Å
244	E	93.3	Very high	81.9	Confident	91 Å²	91	92.1 Å²	92.1	43%	0.425	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-40	173.7	-72.5	-174.3	170.5	0	0	112.1	V240 E241 V242 K247 R248	V240-E244 HydrophobicContact CG1-CG 4.36Å; V240-E244 WeakPolarHBondContact O-CG 3.31Å; V240-E244 PolarHBondContact O-N 3.34Å; E241-E244 PolarHBondContact O-N 2.91Å; V242-E244 PolarHBondContact O-N 3.42Å; E244-K247 PolarHBondContact O-N 3.08Å; E244-R248 WeakPolarHBondContact O-CG 3.48Å; E244-R248 PolarHBondContact O-N 2.72Å; E244-R248 VanDerWaalsContact O-N 3.12Å; E244-R248 IonicContact OE2-NH2 3.12Å
245	S	90.3	Very high	79.8	Confident	61 Å²	61	95.7 Å²	95.7	43%	0.427	49%	0.489	S	S	.	.	H	α-helix	trans	-64.9	-45.5	177.2	-61.4	0	0	0	0	111.6	E241 V242 K247 R248 T249	E241-S245 VanDerWaalsContact O-CB 3.31Å; E241-S245 WeakPolarHBondContact O-CB 3.43Å; E241-S245 PolarHBondContact O-N 3.49Å; E241-S245 PolarHBondContact O-OG 3.28Å; V242-S245 PolarHBondContact O-N 3.48Å; S245-K247 VanDerWaalsContact C-N 3.32Å; S245-K247 PolarHBondContact O-N 3.31Å; S245-R248 PolarHBondContact O-N 3.27Å; S245-T249 PolarHBondContact O-N 3.1Å; S245-T249 PolarHBondContact O-OG1 2.99Å
246	V	84.8	Confident	77.5	Confident	76 Å²	76	100.3 Å²	100.3	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-59.7	-44	175.9	171.6	0	0	0	0	110.9	V242 R248 T249 V250	V242-V246 WeakPolarHBondContact O-CG2 3.32Å; V242-V246 PolarHBondContact O-N 3.17Å; V246-R248 VanDerWaalsContact C-N 3.33Å; V246-R248 PolarHBondContact O-N 2.84Å; V246-T249 PolarHBondContact O-N 3.07Å; V246-V250 HydrophobicContact CG1-CG2 4.22Å; V246-V250 WeakPolarHBondContact O-CG2 3.41Å; V246-V250 PolarHBondContact O-N 3.2Å
247	K	79.7	Confident	75.4	Confident	138 Å²	138	108 Å²	108	60%	0.6	55%	0.551	S	S	*	*	H	α-helix	trans	-60.4	-40	177.9	-76.4	173.1	-174.4	172.5	0	112.8	E243 E244 S245 T249 G251	E243-K247 VanDerWaalsContact O-CG 3.28Å; E243-K247 WeakPolarHBondContact O-CG 3.45Å; E243-K247 PolarHBondContact O-N 3.44Å; E243-K247 VanDerWaalsContact O-N 3.09Å; E244-K247 PolarHBondContact O-N 3.08Å; S245-K247 VanDerWaalsContact C-N 3.32Å; S245-K247 PolarHBondContact O-N 3.31Å; K247-T249 VanDerWaalsContact C-N 3.35Å; K247-G251 PolarHBondContact O-N 3.31Å; K247-G251 VanDerWaalsContact O-N 3.1Å
248	R	81.2	Confident	73	Confident	175 Å²	175	107.9 Å²	107.9	66%	0.66	56%	0.562	S	S	*	*	H	α-helix	trans	-62.8	-41.4	177.5	-69.4	173.6	-160.7	172.4	8.4	111.5	E244 S245 V246	E244-R248 WeakPolarHBondContact O-CG 3.48Å; E244-R248 PolarHBondContact O-N 2.72Å; E244-R248 VanDerWaalsContact O-N 3.12Å; E244-R248 IonicContact OE2-NH2 3.12Å; S245-R248 PolarHBondContact O-N 3.27Å; V246-R248 VanDerWaalsContact C-N 3.33Å; V246-R248 PolarHBondContact O-N 2.84Å
249	T	69.7	Low	70.7	Confident	93 Å²	93	110.5 Å²	110.5	57%	0.571	58%	0.578	S	S	*	*	H	α-helix	trans	-67.9	-45.7	179.4	-50.2	0	0	0	0	112.1	S245 V246 K247 G251 S252 Y253	S245-T249 PolarHBondContact O-N 3.1Å; S245-T249 PolarHBondContact O-OG1 2.99Å; V246-T249 PolarHBondContact O-N 3.07Å; K247-T249 VanDerWaalsContact C-N 3.35Å; T249-G251 VanDerWaalsContact C-N 3.31Å; T249-G251 PolarHBondContact O-N 2.75Å; T249-S252 PolarHBondContact O-N 2.83Å; T249-Y253 PolarHBondContact O-N 2.91Å
250	V	58.3	Low	68.3	Low	81 Å²	81	115.1 Å²	115.1	49%	0.491	61%	0.61	S	S	.	*	H	α-helix	trans	-70.7	-27.4	-177.1	-176.6	0	0	0	0	112	V246 S252	V246-V250 HydrophobicContact CG1-CG2 4.22Å; V246-V250 WeakPolarHBondContact O-CG2 3.41Å; V246-V250 PolarHBondContact O-N 3.2Å; V250-S252 VanDerWaalsContact C-N 3.33Å; V250-S252 PolarHBondContact O-N 2.76Å
251	G	55.9	Low	65.7	Low	68 Å²	68	120.9 Å²	120.9	70%	0.701	63%	0.625	S	S	*	*	H	α-helix	trans	-67.8	-28	175.5	0	0	0	0	0	114.4	K247 T249	K247-G251 PolarHBondContact O-N 3.31Å; K247-G251 VanDerWaalsContact O-N 3.1Å; T249-G251 VanDerWaalsContact C-N 3.31Å; T249-G251 PolarHBondContact O-N 2.75Å
252	S	53.8	Low	63.2	Low	99 Å²	99	123.1 Å²	123.1	69%	0.692	64%	0.639	S	S	*	*	H	α-helix	trans	-102.3	-30.3	-177.5	-173.7	0	0	0	0	113.4	T249 V250	T249-S252 PolarHBondContact O-N 2.83Å; V250-S252 VanDerWaalsContact C-N 3.33Å; V250-S252 PolarHBondContact O-N 2.76Å
253	Y	51.6	Low	60.7	Low	186 Å²	186	129.7 Å²	129.7	73%	0.729	66%	0.663	S	S	*	*			trans	-107.9	55.2	-176.5	-98.3	-97.7	0	0	0	112.9	T249 K255	T249-Y253 PolarHBondContact O-N 2.91Å; Y253-K255 PolarHBondContact O-N 2.93Å
254	Q	54.7	Low	58.4	Low	157 Å²	157	133.7 Å²	133.7	73%	0.734	68%	0.681	S	S	*	*			trans	-86.7	68.9	158.6	-69.6	-173.2	0.4	0	0	109.4	P256	Q254-P256 VanDerWaalsContact O-CD 3.31Å; Q254-P256 WeakPolarHBondContact O-CD 3.36Å
255	K	51.2	Low	55.8	Low	174 Å²	174	136.8 Å²	136.8	76%	0.757	70%	0.701	S	S	*	*			trans	-78.4	113.6	155.9	-115	179.8	-178.9	176.4	0	105.6	Y253 F257	Y253-K255 PolarHBondContact O-N 2.93Å; K255-F257 PolarHBondContact O-N 2.84Å; K255-F257 VanDerWaalsContact O-N 3.08Å
256	P	48.4	Very low	53.4	Low	105 Å²	105	138.8 Å²	138.8	68%	0.682	71%	0.711	S	S	*	*			trans	-55.5	123.1	167.2	-12.1	25.5	0	0	0	105.8	Q254 N258	Q254-P256 VanDerWaalsContact O-CD 3.31Å; Q254-P256 WeakPolarHBondContact O-CD 3.36Å; P256-N258 PolarHBondContact O-N 2.8Å
257	F	51.6	Low	51.2	Low	200 Å²	200	138.9 Å²	138.9	88%	0.877	73%	0.727	S	S	*	*			trans	-58.4	98.2	164	-102.3	-95.7	0	0	0	105.8	K255 V259	K255-F257 PolarHBondContact O-N 2.84Å; K255-F257 VanDerWaalsContact O-N 3.08Å; F257-V259 PolarHBondContact O-N 3.38Å
258	N	46.1	Very low	49.3	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	74%	0.738	S	S	*	*			trans	-78.6	72.3	-177.9	-138	-4.9	0	0	0	105.7	P256 P260	P256-N258 PolarHBondContact O-N 2.8Å; N258-P260 WeakPolarHBondContact O-CD 3.43Å
259	V	47.8	Very low	47.4	Very low	110 Å²	110	143.3 Å²	143.3	67%	0.667	75%	0.748	S	S	*	*			trans	-62.8	123.2	162.9	-173.3	0	0	0	0	104.6	F257 Y261	F257-V259 PolarHBondContact O-N 3.38Å; V259-Y261 PolarHBondContact O-N 3.38Å
260	P	43.2	Very low	45.9	Very low	124 Å²	124	150.6 Å²	150.6	81%	0.805	77%	0.765	S	S	*	*			trans	-70.2	77.4	-175.8	28	-33.2	0	0	0	109.4	N258	N258-P260 WeakPolarHBondContact O-CD 3.43Å
261	Y	40.1	Very low	45.1	Very low	200 Å²	200	154 Å²	154	78%	0.784	78%	0.779	S	S	*	*			trans	-84.9	121.7	165.5	-171.9	-96.5	0	0	0	107.2	V259 K263	V259-Y261 PolarHBondContact O-N 3.38Å; Y261-K263 PolarHBondContact O-N 3.39Å
262	L	43.4	Very low	44.3	Very low	148 Å²	148	154.1 Å²	154.1	78%	0.775	77%	0.773	S	S	*	*			trans	-33.9	106.4	177.1	-72.8	153.4	0	0	0	110.9	Q264	L262-Q264 VanDerWaalsContact C-N 3.3Å; L262-Q264 PolarHBondContact O-N 2.9Å
263	K	40.3	Very low	43.7	Very low	199 Å²	199	155.4 Å²	155.4	87%	0.865	78%	0.777	S	S	*	*			trans	-68.8	89.6	-178.3	-136.8	-177.8	-172.6	-177	0	107.6	Y261 N265	Y261-K263 PolarHBondContact O-N 3.39Å; K263-N265 PolarHBondContact O-N 3.37Å
264	Q	41.2	Very low	43.2	Very low	171 Å²	171	151.9 Å²	151.9	80%	0.799	78%	0.775	S	S	*	*			trans	-65.9	108.7	163	-79.8	-169.9	-21.9	0	0	107.1	L262 T266	L262-Q264 VanDerWaalsContact C-N 3.3Å; L262-Q264 PolarHBondContact O-N 2.9Å; Q264-T266 PolarHBondContact O-N 2.92Å
265	N	37.6	Very low	42.6	Very low	156 Å²	156	148.1 Å²	148.1	83%	0.834	77%	0.771	S	S	*	*			trans	-68.9	75.9	-174.2	-152	17.4	0	0	0	109.5	K263	K263-N265 PolarHBondContact O-N 3.37Å
266	T	41.1	Very low	42.1	Very low	103 Å²	103	147.7 Å²	147.7	63%	0.632	77%	0.773	S	S	*	*			trans	-101.7	96.5	167.2	56.8	0	0	0	0	106.9	Q264 R268	Q264-T266 PolarHBondContact O-N 2.92Å; T266-R268 VanDerWaalsContact C-N 3.34Å; T266-R268 PolarHBondContact O-N 2.88Å
267	G	37.7	Very low	41.7	Very low	78 Å²	78	150.5 Å²	150.5	80%	0.804	78%	0.782	S	S	*	*			trans	-56	98.4	172.4	0	0	0	0	0	109.1
268	R	40.9	Very low	41.1	Very low	223 Å²	223	148.8 Å²	148.8	84%	0.842	78%	0.776	S	S	*	*			trans	-109.5	93.7	167.4	-76.6	-175.2	175.4	176.4	0.3	106.5	T266 R270	T266-R268 VanDerWaalsContact C-N 3.34Å; T266-R268 PolarHBondContact O-N 2.88Å; R268-R270 PolarHBondContact O-N 2.8Å
269	E	41.7	Very low	40.7	Very low	184 Å²	184	147.3 Å²	147.3	86%	0.86	77%	0.773	S	S	*	*			trans	-43.3	126.6	166.7	-100.3	174.8	148	0	0	110.2	I271	E269-I271 PolarHBondContact O-N 2.85Å
270	R	37.3	Very low	40.1	Very low	246 Å²	246	147.2 Å²	147.2	93%	0.928	78%	0.778	S	S	*	*			trans	-76.8	85.9	-176.2	-175.4	178.4	162.8	179	-5	107.9	R268 A272	R268-R270 PolarHBondContact O-N 2.8Å; R270-A272 PolarHBondContact O-N 2.8Å
271	I	41.8	Very low	40.1	Very low	153 Å²	153	145.7 Å²	145.7	79%	0.785	77%	0.766	S	S	*	*			trans	-68.4	105.6	176.4	-56.1	176.1	0	0	0	108.3	E269	E269-I271 PolarHBondContact O-N 2.85Å
272	A	38.8	Very low	40.3	Very low	70 Å²	70	139 Å²	139	58%	0.579	75%	0.748	S	S	*	*			trans	-60.9	139.3	178.4	0	0	0	0	0	111.4	R270 T274	R270-A272 PolarHBondContact O-N 2.8Å; A272-T274 PolarHBondContact O-N 3Å
273	T	41.5	Very low	40.5	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	37.1	-166.1	-39	0	0	0	0	113.9
274	T	40.4	Very low	41	Very low	112 Å²	112	134 Å²	134	69%	0.687	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-22.6	177.2	32.5	0	0	0	0	113.3	A272 M276 L277	A272-T274 PolarHBondContact O-N 3Å; T274-M276 PolarHBondContact O-N 2.84Å; T274-M276 VanDerWaalsContact O-N 3.08Å; T274-L277 PolarHBondContact O-N 2.84Å
275	A	42.6	Very low	41.5	Very low	79 Å²	79	128.4 Å²	128.4	65%	0.653	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-9.3	-178.4	0	0	0	0	0	114.9	L277	A275-L277 VanDerWaalsContact C-N 3.3Å; A275-L277 PolarHBondContact O-N 2.9Å
276	M	40.3	Very low	42.3	Very low	164 Å²	164	126.8 Å²	126.8	81%	0.808	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-11.2	176.5	-93.9	-164.4	72.1	0	0	114.7	T274	T274-M276 PolarHBondContact O-N 2.84Å; T274-M276 VanDerWaalsContact O-N 3.08Å
277	L	39.5	Very low	43.3	Very low	165 Å²	165	125 Å²	125	86%	0.864	68%	0.683	S	S	*	*	S	Bend	trans	-104.3	-12.4	-179.8	-72.8	169.7	0	0	0	114.5	T274 A275	T274-L277 PolarHBondContact O-N 2.84Å; A275-L277 VanDerWaalsContact C-N 3.3Å; A275-L277 PolarHBondContact O-N 2.9Å
278	Q	39	Very low	44.6	Very low	163 Å²	163	121.4 Å²	121.4	76%	0.762	65%	0.646	S	S	*	*			trans	-116.8	64.8	-179.4	-66.3	-164.5	-32.5	0	0	111.6	S280	Q278-S280 PolarHBondContact O-N 2.92Å
279	T	37.9	Very low	45.6	Very low	120 Å²	120	111.5 Å²	111.5	74%	0.736	61%	0.611	S	S	*	*			trans	-78.7	79.1	157.2	57.7	0	0	0	0	107.9	V281	T279-V281 PolarHBondContact O-N 3.35Å
280	S	36.7	Very low	46.4	Very low	109 Å²	109	105.4 Å²	105.4	76%	0.762	58%	0.583	S	S	*	*			trans	-58.2	119.6	158.6	42.2	0	0	0	0	107.8	Q278 S282	Q278-S280 PolarHBondContact O-N 2.92Å; S280-S282 PolarHBondContact O-N 2.65Å; S280-S282 VanDerWaalsContact O-N 3.15Å
281	V	42.6	Very low	47.8	Very low	92 Å²	92	95 Å²	95	56%	0.558	55%	0.548	S	S	*	.			trans	-76.2	100.1	-175.4	179.6	0	0	0	0	108	T279 T285	T279-V281 PolarHBondContact O-N 3.35Å; V281-T285 HydrophobicContact CG1-CG2 4.17Å
282	S	44.9	Very low	48.8	Very low	58 Å²	58	91.9 Å²	91.9	41%	0.406	54%	0.54	S	S	.	.			trans	-70.1	137	166.5	-175.3	0	0	0	0	109.2	S280 E284 T285	S280-S282 PolarHBondContact O-N 2.65Å; S280-S282 VanDerWaalsContact O-N 3.15Å; S282-E284 PolarHBondContact O-N 3.38Å; S282-T285 VanDerWaalsContact O-CG2 3.31Å; S282-T285 WeakPolarHBondContact O-CG2 3.33Å; S282-T285 PolarHBondContact O-N 2.96Å; S282-T285 PolarHBondContact O-OG1 3.34Å
283	P	47.8	Very low	49.9	Very low	100 Å²	100	92.8 Å²	92.8	65%	0.649	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-63.3	-1	-179.5	23.2	-32.4	0	0	0	115.1	T285 R295	P283-T285 PolarHBondContact O-N 3.37Å; P283-R295 PolarHBondContact O-NH2 3.49Å
284	E	48.9	Very low	50.7	Low	143 Å²	143	91.2 Å²	91.2	67%	0.668	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-63.6	-9.4	166.6	-66.5	172.3	-179.2	0	0	113.2	S282 H286 L287	S282-E284 PolarHBondContact O-N 3.38Å; E284-H286 PolarHBondContact O-N 3.11Å; E284-L287 PolarHBondContact O-N 3.24Å
285	T	51.8	Low	51.9	Low	54 Å²	54	93.9 Å²	93.9	33%	0.331	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-68.7	0.1	-176.1	49.6	0	0	0	0	116.9	V281 S282 P283	V281-T285 HydrophobicContact CG1-CG2 4.17Å; S282-T285 VanDerWaalsContact O-CG2 3.31Å; S282-T285 WeakPolarHBondContact O-CG2 3.33Å; S282-T285 PolarHBondContact O-N 2.96Å; S282-T285 PolarHBondContact O-OG1 3.34Å; P283-T285 PolarHBondContact O-N 3.37Å
286	H	54.6	Low	53.1	Low	121 Å²	121	93 Å²	93	56%	0.56	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-95.4	0.3	177.5	-70.5	-79.8	0	0	0	114.3	E284 R295	E284-H286 PolarHBondContact O-N 3.11Å; H286-R295 HydrophobicContact CB-CG 4.36Å; H286-R295 VanDerWaalsContact CB-NH1 3.3Å
287	L	62.7	Low	54.3	Low	66 Å²	66	88.5 Å²	88.5	35%	0.346	48%	0.482	S	S	.	.	S	Bend	trans	-70.3	143.7	171.9	-66.6	169.1	0	0	0	110.9	E284 P289 R295	E284-L287 PolarHBondContact O-N 3.24Å; L287-P289 WeakPolarHBondContact O-CD 3.43Å; L287-R295 HydrophobicContact CD2-CG 4.29Å
288	C	64.4	Low	55.7	Low	2 Å²	2	80.9 Å²	80.9	1%	0.014	44%	0.442	C	S	.	.			trans	-59.9	125.4	178.7	176.7	0	0	0	0	110.5	I290 C291 S292 D294 H296	C288-I290 PolarHBondContact O-N 2.75Å; C288-C291 PolarHBondContact O-N 2.79Å; C288-S292 WeakPolarHBondContact O-CA 3.32Å; C288-S292 PolarHBondContact O-N 2.88Å; C288-D294 WeakPolarHBondContact CB-O 3.48Å; C288-D294 PolarHBondContact N-O 2.81Å; C288-H296 VanDerWaalsContact CB-CE1 3.47Å; C288-H296 WeakPolarHBondContact CB-CE1 3.37Å; C288-H296 WeakPolarHBondContact CB-NE2 3.37Å; C288-H296 PolarHBondContact SG-NE2 2.92Å
289	P	61.7	Low	56.9	Low	16 Å²	16	73.3 Å²	73.3	10%	0.104	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-16.7	-177.4	-27.1	29.7	0	0	0	117	L287 F298 H319 V321 R328	L287-P289 WeakPolarHBondContact O-CD 3.43Å; P289-F298 HydrophobicContact CB-CD2 4.18Å; P289-F298 HydrophobicContact CB-CE2 4.23Å; P289-F298 HydrophobicContact CG-CD2 3.8Å; P289-F298 HydrophobicContact CG-CE2 4.26Å; P289-H319 HydrophobicContact CB-CB 3.85Å; P289-H319 PolarHBondContact O-CE1 3.4Å; P289-H319 VanDerWaalsContact O-CE1 3.29Å; P289-H319 PolarHBondContact O-ND1 2.82Å; P289-V321 HydrophobicContact CG-CG1 3.82Å; P289-R328 HydrophobicContact CG-CG 4.06Å
290	I	60.3	Low	58.4	Low	55 Å²	55	74.3 Å²	74.3	28%	0.282	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-43.5	-172.2	-59.8	175	0	0	0	111.8	C288 F298 T315	C288-I290 PolarHBondContact O-N 2.75Å; I290-F298 HydrophobicContact CD1-CD2 4.15Å; I290-F298 HydrophobicContact CD1-CE2 3.62Å; I290-F298 HydrophobicContact CD1-CZ 4.25Å; I290-F298 HydrophobicContact CG1-CD2 4.3Å; I290-F298 HydrophobicContact CG1-CE2 3.81Å; I290-T315 HydrophobicContact CD1-CG2 3.86Å; I290-T315 HydrophobicContact CG1-CG2 4.43Å
291	C	65.3	Low	60.1	Low	29 Å²	29	71.3 Å²	71.3	20%	0.196	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-16.1	-179	57.9	0	0	0	0	113.8	C288 T293 H296 R301	C288-C291 PolarHBondContact O-N 2.79Å; C291-T293 WeakPolarHBondContact CB-OG1 3.39Å; C291-T293 WeakPolarHBondContact O-CG2 3.41Å; C291-T293 PolarHBondContact O-N 3.22Å; C291-T293 PolarHBondContact SG-OG1 3.22Å; C291-H296 PolarHBondContact SG-CE1 3.22Å; C291-R301 PolarHBondContact SG-NH2 3.25Å
292	S	62.7	Low	61.7	Low	86 Å²	86	71.1 Å²	71.1	60%	0.601	38%	0.376	S	S	*	.	S	Bend	trans	56	7.7	-176.5	-52.3	0	0	0	0	114.7	C288	C288-S292 WeakPolarHBondContact O-CA 3.32Å; C288-S292 PolarHBondContact O-N 2.88Å
293	T	62.1	Low	63.1	Low	90 Å²	90	73.2 Å²	73.2	55%	0.552	38%	0.382	S	S	*	.	S	Bend	trans	-99.5	-40.4	-174.4	49.1	0	0	0	0	113.7	C291	C291-T293 WeakPolarHBondContact CB-OG1 3.39Å; C291-T293 WeakPolarHBondContact O-CG2 3.41Å; C291-T293 PolarHBondContact O-N 3.22Å; C291-T293 PolarHBondContact SG-OG1 3.22Å
294	D	59.4	Low	64.5	Low	92 Å²	92	68.5 Å²	68.5	49%	0.492	35%	0.351	S	S	.	.			trans	-130.9	153.2	-167.3	-64.4	-61.8	0	0	0	113.4	C288 H296	C288-D294 WeakPolarHBondContact CB-O 3.48Å; C288-D294 PolarHBondContact N-O 2.81Å; D294-H296 VanDerWaalsContact C-N 3.32Å; D294-H296 WeakPolarHBondContact CB-ND1 3.38Å; D294-H296 PolarHBondContact O-N 3.32Å
295	R	63.9	Low	66	Low	167 Å²	167	64.1 Å²	64.1	63%	0.63	33%	0.332	S	S	*	.			trans	-86.9	58.2	175.1	-62.6	-173.9	176.4	-122.8	-8.3	111.8	P283 H286 L287	P283-R295 PolarHBondContact O-NH2 3.49Å; H286-R295 HydrophobicContact CB-CG 4.36Å; H286-R295 VanDerWaalsContact CB-NH1 3.3Å; L287-R295 HydrophobicContact CD2-CG 4.29Å
296	H	68	Low	67.3	Low	62 Å²	62	70 Å²	70	29%	0.287	35%	0.353	S	S	.	.			trans	-101.7	152.4	169.9	58	-96.3	0	0	0	112.5	C288 C291 D294 F298 R301	C288-H296 VanDerWaalsContact CB-CE1 3.47Å; C288-H296 WeakPolarHBondContact CB-CE1 3.37Å; C288-H296 WeakPolarHBondContact CB-NE2 3.37Å; C288-H296 PolarHBondContact SG-NE2 2.92Å; C291-H296 PolarHBondContact SG-CE1 3.22Å; D294-H296 VanDerWaalsContact C-N 3.32Å; D294-H296 WeakPolarHBondContact CB-ND1 3.38Å; D294-H296 PolarHBondContact O-N 3.32Å; H296-F298 PolarHBondContact O-N 3.34Å; H296-R301 PolarHBondContact CE1-NE 2.78Å; H296-R301 VanDerWaalsContact NE2-CD 3.25Å; H296-R301 WeakPolarHBondContact NE2-CD 3.49Å; H296-R301 WeakPolarHBondContact NE2-CG 3.42Å; H296-R301 PolarHBondContact NE2-NE 3.06Å
297	H	65.4	Low	68.7	Low	68 Å²	68	66.3 Å²	66.3	32%	0.315	34%	0.337	S	S	.	.			trans	-65	119.3	178.5	-155.7	-81.9	0	0	0	110.4	A299 Q300 C325 Q327	H297-A299 WeakPolarHBondContact ND1-CB 3.41Å; H297-A299 PolarHBondContact O-N 2.89Å; H297-Q300 HydrophobicContact CB-CG 4.36Å; H297-Q300 PolarHBondContact O-N 3.11Å; H297-C325 PolarHBondContact CE1-O 2.62Å; H297-Q327 PolarHBondContact NE2-NE2 2.93Å
298	F	68.7	Low	69.8	Low	5 Å²	5	66.5 Å²	66.5	2%	0.022	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-48.9	-39	-178	178.8	-85.3	0	0	0	112.7	P289 I290 H296 Q300 R301 F304 T315 H319 V321 L326	P289-F298 HydrophobicContact CB-CD2 4.18Å; P289-F298 HydrophobicContact CB-CE2 4.23Å; P289-F298 HydrophobicContact CG-CD2 3.8Å; P289-F298 HydrophobicContact CG-CE2 4.26Å; I290-F298 HydrophobicContact CD1-CD2 4.15Å; I290-F298 HydrophobicContact CD1-CE2 3.62Å; I290-F298 HydrophobicContact CD1-CZ 4.25Å; I290-F298 HydrophobicContact CG1-CD2 4.3Å; I290-F298 HydrophobicContact CG1-CE2 3.81Å; H296-F298 PolarHBondContact O-N 3.34Å; F298-Q300 VanDerWaalsContact C-N 3.25Å; F298-Q300 PolarHBondContact O-N 2.77Å; F298-R301 PolarHBondContact O-N 2.69Å; F298-F304 HydrophobicContact CD1-CD2 4.42Å; F298-F304 HydrophobicContact CD1-CE1 4.39Å; F298-F304 HydrophobicContact CD1-CE2 4.3Å; F298-F304 HydrophobicContact CD1-CZ 4.28Å; F298-F304 HydrophobicContact CE1-CD1 4.36Å; F298-F304 AromaticContact CE1-CD2 3.67Å; F298-F304 HydrophobicContact CE1-CD2 3.67Å; F298-F304 HydrophobicContact CE1-CE1 4.05Å; F298-F304 AromaticContact CE1-CE2 3.3Å; F298-F304 HydrophobicContact CE1-CE2 3.3Å; F298-F304 HydrophobicContact CE1-CG 4.18Å; F298-F304 AromaticContact CE1-CZ 3.51Å; F298-F304 HydrophobicContact CE1-CZ 3.51Å; F298-F304 AromaticContact CZ-CD2 3.82Å; F298-F304 HydrophobicContact CZ-CD2 3.82Å; F298-F304 AromaticContact CZ-CE2 3.64Å; F298-F304 HydrophobicContact CZ-CE2 3.64Å; F298-F304 HydrophobicContact CZ-CZ 4.3Å; F298-T315 HydrophobicContact CE2-CG2 4.42Å; F298-T315 HydrophobicContact CZ-CG2 3.99Å; F298-H319 HydrophobicContact CE2-CB 4.41Å; F298-V321 HydrophobicContact CD2-CG1 4.36Å; F298-V321 HydrophobicContact CE1-CG2 4.09Å; F298-V321 HydrophobicContact CE2-CG1 4.33Å; F298-V321 HydrophobicContact CZ-CG2 4.07Å; F298-L326 VanDerWaalsContact CB-O 3.26Å; F298-L326 WeakPolarHBondContact CB-O 3.36Å; F298-L326 HydrophobicContact CD1-CB 3.63Å; F298-L326 HydrophobicContact CD1-CD1 4.15Å; F298-L326 HydrophobicContact CD1-CG 4.33Å; F298-L326 HydrophobicContact CE1-CB 4.18Å; F298-L326 HydrophobicContact CE1-CD1 4.36Å; F298-L326 HydrophobicContact CE1-CD2 4.3Å; F298-L326 HydrophobicContact CG-CB 4.46Å
299	A	65	Low	70.8	Confident	4 Å²	4	68 Å²	68	3%	0.033	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-68	-17.3	-179.3	0	0	0	0	0	115.3	H297 L326 H352	H297-A299 WeakPolarHBondContact ND1-CB 3.41Å; H297-A299 PolarHBondContact O-N 2.89Å; A299-L326 HydrophobicContact CB-CD1 3.89Å; A299-H352 VanDerWaalsContact CB-CE1 3.5Å; A299-H352 WeakPolarHBondContact CB-CE1 3.48Å
300	Q	69.5	Low	71.9	Confident	141 Å²	141	71.2 Å²	71.2	66%	0.659	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-104.1	-1.1	-177.9	-64.1	179.3	1.2	0	0	112.5	H297 F298	H297-Q300 HydrophobicContact CB-CG 4.36Å; H297-Q300 PolarHBondContact O-N 3.11Å; F298-Q300 VanDerWaalsContact C-N 3.25Å; F298-Q300 PolarHBondContact O-N 2.77Å
301	R	73.6	Confident	73.1	Confident	46 Å²	46	72 Å²	72	17%	0.174	36%	0.363	C	S	.	.			trans	-67.5	129.2	-174.7	-152.6	-175.9	-163	-122.6	-12.2	111.3	C291 H296 F298 L303 F304 L305	C291-R301 PolarHBondContact SG-NH2 3.25Å; H296-R301 PolarHBondContact CE1-NE 2.78Å; H296-R301 VanDerWaalsContact NE2-CD 3.25Å; H296-R301 WeakPolarHBondContact NE2-CD 3.49Å; H296-R301 WeakPolarHBondContact NE2-CG 3.42Å; H296-R301 PolarHBondContact NE2-NE 3.06Å; F298-R301 PolarHBondContact O-N 2.69Å; R301-L303 VanDerWaalsContact C-N 3.3Å; R301-L303 PolarHBondContact O-N 3.08Å; R301-F304 HydrophobicContact CB-CB 4.16Å; R301-F304 PolarHBondContact O-N 3.1Å; R301-L305 WeakPolarHBondContact O-CG 3.41Å; R301-L305 PolarHBondContact O-N 3.39Å
302	P	75.6	Confident	74.3	Confident	89 Å²	89	72.7 Å²	72.7	58%	0.578	36%	0.361	S	S	*	.	H	α-helix	trans	-54.7	-42.1	-177.3	-28.4	34.2	0	0	0	113.8	F304 L305 K306	P302-F304 PolarHBondContact O-N 3.06Å; P302-L305 PolarHBondContact O-N 3.22Å; P302-K306 WeakPolarHBondContact O-CG 3.2Å; P302-K306 PolarHBondContact O-N 2.76Å
303	L	73.3	Confident	75.6	Confident	101 Å²	101	70.9 Å²	70.9	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-64.5	-40.3	177.9	-68.8	178.6	0	0	0	112.3	R301 L305 K306 L307	R301-L303 VanDerWaalsContact C-N 3.3Å; R301-L303 PolarHBondContact O-N 3.08Å; L303-L305 VanDerWaalsContact C-N 3.35Å; L303-K306 PolarHBondContact O-N 3.25Å; L303-L307 WeakPolarHBondContact O-CG 3.34Å; L303-L307 PolarHBondContact O-N 3.41Å
304	F	78.6	Confident	76.7	Confident	1 Å²	1	73.4 Å²	73.4	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-68.5	-36.2	176.9	-174.9	-100.5	0	0	0	111.7	F298 R301 P302 K306 L307 R312 T315 L326 R354 L355	F298-F304 HydrophobicContact CD1-CD2 4.42Å; F298-F304 HydrophobicContact CD1-CE1 4.39Å; F298-F304 HydrophobicContact CD1-CE2 4.3Å; F298-F304 HydrophobicContact CD1-CZ 4.28Å; F298-F304 HydrophobicContact CE1-CD1 4.36Å; F298-F304 AromaticContact CE1-CD2 3.67Å; F298-F304 HydrophobicContact CE1-CD2 3.67Å; F298-F304 HydrophobicContact CE1-CE1 4.05Å; F298-F304 AromaticContact CE1-CE2 3.3Å; F298-F304 HydrophobicContact CE1-CE2 3.3Å; F298-F304 HydrophobicContact CE1-CG 4.18Å; F298-F304 AromaticContact CE1-CZ 3.51Å; F298-F304 HydrophobicContact CE1-CZ 3.51Å; F298-F304 AromaticContact CZ-CD2 3.82Å; F298-F304 HydrophobicContact CZ-CD2 3.82Å; F298-F304 AromaticContact CZ-CE2 3.64Å; F298-F304 HydrophobicContact CZ-CE2 3.64Å; F298-F304 HydrophobicContact CZ-CZ 4.3Å; R301-F304 HydrophobicContact CB-CB 4.16Å; R301-F304 PolarHBondContact O-N 3.1Å; P302-F304 PolarHBondContact O-N 3.06Å; F304-K306 VanDerWaalsContact C-N 3.33Å; F304-K306 PolarHBondContact O-N 3.4Å; F304-L307 HydrophobicContact CD2-CD1 4.04Å; F304-L307 WeakPolarHBondContact O-CB 3.45Å; F304-L307 PolarHBondContact O-N 3.12Å; F304-R312 HydrophobicContact CD1-CG 4.42Å; F304-R312 HydrophobicContact CD2-CG 4.37Å; F304-R312 HydrophobicContact CE1-CB 4.23Å; F304-R312 HydrophobicContact CE1-CG 3.97Å; F304-R312 HydrophobicContact CE2-CB 3.79Å; F304-R312 HydrophobicContact CE2-CG 3.92Å; F304-R312 HydrophobicContact CZ-CB 3.53Å; F304-R312 HydrophobicContact CZ-CG 3.7Å; F304-R312 PolarHBondContact O-NE 2.91Å; F304-T315 HydrophobicContact CD2-CG2 4.1Å; F304-T315 HydrophobicContact CE2-CG2 4.22Å; F304-L326 HydrophobicContact CE1-CD1 3.94Å; F304-L326 HydrophobicContact CZ-CD1 4.14Å; F304-R354 HydrophobicContact CE1-CB 4.31Å; F304-L355 HydrophobicContact CZ-CD2 4.38Å
305	L	80.1	Confident	77.8	Confident	52 Å²	52	69.9 Å²	69.9	27%	0.272	32%	0.323	S	S	.	.	H	α-helix	trans	-66	-34.9	176.1	-67.4	175.8	0	0	0	112.3	R301 P302 L303 L307 R312 R354	R301-L305 WeakPolarHBondContact O-CG 3.41Å; R301-L305 PolarHBondContact O-N 3.39Å; P302-L305 PolarHBondContact O-N 3.22Å; L303-L305 VanDerWaalsContact C-N 3.35Å; L305-L307 VanDerWaalsContact C-N 3.27Å; L305-L307 PolarHBondContact O-N 3.09Å; L305-R312 PolarHBondContact O-NH2 3.46Å; L305-R354 VanDerWaalsContact CD2-CZ 3.5Å
306	K	79.2	Confident	78.9	Confident	176 Å²	176	62 Å²	62	77%	0.765	29%	0.293	S	S	*	.	H	α-helix	trans	-69.9	-19.5	175	-73.2	178.6	179.7	-174.9	0	113.9	P302 L303 F304	P302-K306 WeakPolarHBondContact O-CG 3.2Å; P302-K306 PolarHBondContact O-N 2.76Å; L303-K306 PolarHBondContact O-N 3.25Å; F304-K306 VanDerWaalsContact C-N 3.33Å; F304-K306 PolarHBondContact O-N 3.4Å
307	L	82.5	Confident	79.7	Confident	44 Å²	44	65.4 Å²	65.4	23%	0.23	31%	0.307	C	S	.	.	S	Bend	trans	-68.9	142.9	176.5	-63.3	-180	0	0	0	111.1	L303 F304 L305 Q311 R312 T315	L303-L307 WeakPolarHBondContact O-CG 3.34Å; L303-L307 PolarHBondContact O-N 3.41Å; F304-L307 HydrophobicContact CD2-CD1 4.04Å; F304-L307 WeakPolarHBondContact O-CB 3.45Å; F304-L307 PolarHBondContact O-N 3.12Å; L305-L307 VanDerWaalsContact C-N 3.27Å; L305-L307 PolarHBondContact O-N 3.09Å; L307-Q311 HydrophobicContact CB-CB 3.78Å; L307-Q311 HydrophobicContact CD1-CB 4.28Å; L307-Q311 HydrophobicContact CD2-CB 4.06Å; L307-Q311 HydrophobicContact CG-CB 4.24Å; L307-R312 HydrophobicContact CB-CG 3.73Å; L307-R312 VanDerWaalsContact O-CZ 3.25Å; L307-R312 PolarHBondContact O-NE 2.82Å; L307-R312 PolarHBondContact O-NH2 2.7Å; L307-R312 VanDerWaalsContact O-NH2 3.13Å; L307-T315 HydrophobicContact CD1-CG2 4.39Å; L307-T315 WeakPolarHBondContact CD1-OG1 3.44Å
308	N	85.5	Confident	80.5	Confident	71 Å²	71	68.4 Å²	68.4	38%	0.38	32%	0.321	S	S	.	.			trans	-68.7	163.2	167.9	70.4	47.2	0	0	0	111	K310 Q311 R312	N308-K310 VanDerWaalsContact C-N 3.26Å; N308-K310 PolarHBondContact O-N 2.85Å; N308-K310 WeakPolarHBondContact OD1-CB 3.48Å; N308-K310 PolarHBondContact OD1-N 3.42Å; N308-K310 VanDerWaalsContact OD1-N 3.17Å; N308-Q311 VanDerWaalsContact CG-OE1 3.29Å; N308-Q311 PolarHBondContact ND2-OE1 3.3Å; N308-Q311 WeakPolarHBondContact O-CB 3.27Å; N308-Q311 PolarHBondContact O-N 3.26Å; N308-Q311 WeakPolarHBondContact OD1-CG 3.27Å; N308-Q311 PolarHBondContact OD1-N 2.9Å; N308-R312 WeakPolarHBondContact O-CG 3.16Å; N308-R312 PolarHBondContact O-N 3.39Å
309	V	85.8	Confident	81	Confident	34 Å²	34	69.9 Å²	69.9	21%	0.206	33%	0.328	C	S	.	.	H	α-helix	trans	-55.4	-40.3	-174.3	-179.3	0	0	0	0	112.3	R312 W313 Y356 Y357	V309-R312 PolarHBondContact O-N 3.26Å; V309-W313 VanDerWaalsContact O-CD1 3.29Å; V309-W313 PolarHBondContact O-N 3.49Å; V309-Y356 WeakPolarHBondContact CG1-O 3.33Å; V309-Y356 WeakPolarHBondContact CG2-O 3.35Å; V309-Y357 HydrophobicContact CB-CD1 4.28Å; V309-Y357 HydrophobicContact CB-CE1 4.29Å; V309-Y357 HydrophobicContact CG1-CD1 3.68Å; V309-Y357 HydrophobicContact CG1-CD2 4.31Å; V309-Y357 HydrophobicContact CG1-CE1 3.7Å; V309-Y357 HydrophobicContact CG1-CE2 4.33Å; V309-Y357 HydrophobicContact CG1-CG 4Å
310	K	85.4	Confident	81.8	Confident	83 Å²	83	79.9 Å²	79.9	36%	0.361	37%	0.365	S	S	.	.	H	α-helix	trans	-65.7	-41.5	178.6	-171.4	175.5	-177.3	175.2	0	111.9	N308 W313 R314	N308-K310 VanDerWaalsContact C-N 3.26Å; N308-K310 PolarHBondContact O-N 2.85Å; N308-K310 WeakPolarHBondContact OD1-CB 3.48Å; N308-K310 PolarHBondContact OD1-N 3.42Å; N308-K310 VanDerWaalsContact OD1-N 3.17Å; K310-W313 PolarHBondContact O-N 2.89Å; K310-R314 PolarHBondContact O-N 3.46Å; K310-R314 VanDerWaalsContact O-N 3.11Å
311	Q	86.2	Confident	82.6	Confident	71 Å²	71	73.5 Å²	73.5	33%	0.332	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-44	173.6	-73.9	169	-32.8	0	0	111	L307 N308 W313 R314 T315	L307-Q311 HydrophobicContact CB-CB 3.78Å; L307-Q311 HydrophobicContact CD1-CB 4.28Å; L307-Q311 HydrophobicContact CD2-CB 4.06Å; L307-Q311 HydrophobicContact CG-CB 4.24Å; N308-Q311 VanDerWaalsContact CG-OE1 3.29Å; N308-Q311 PolarHBondContact ND2-OE1 3.3Å; N308-Q311 WeakPolarHBondContact O-CB 3.27Å; N308-Q311 PolarHBondContact O-N 3.26Å; N308-Q311 WeakPolarHBondContact OD1-CG 3.27Å; N308-Q311 PolarHBondContact OD1-N 2.9Å; Q311-W313 VanDerWaalsContact C-N 3.33Å; Q311-W313 PolarHBondContact O-N 3.23Å; Q311-R314 WeakPolarHBondContact O-CB 3.42Å; Q311-R314 PolarHBondContact O-N 3.13Å; Q311-T315 PolarHBondContact O-N 2.82Å; Q311-T315 PolarHBondContact O-OG1 2.84Å
312	R	89.1	Confident	83.2	Confident	43 Å²	43	74.3 Å²	74.3	16%	0.162	34%	0.339	C	S	.	.	H	α-helix	trans	-57.3	-43.3	176	-68.4	-179.5	-165.4	154.6	6.9	112.5	F304 L305 L307 N308 V309 A316 R354 L355	F304-R312 HydrophobicContact CD1-CG 4.42Å; F304-R312 HydrophobicContact CD2-CG 4.37Å; F304-R312 HydrophobicContact CE1-CB 4.23Å; F304-R312 HydrophobicContact CE1-CG 3.97Å; F304-R312 HydrophobicContact CE2-CB 3.79Å; F304-R312 HydrophobicContact CE2-CG 3.92Å; F304-R312 HydrophobicContact CZ-CB 3.53Å; F304-R312 HydrophobicContact CZ-CG 3.7Å; F304-R312 PolarHBondContact O-NE 2.91Å; L305-R312 PolarHBondContact O-NH2 3.46Å; L307-R312 HydrophobicContact CB-CG 3.73Å; L307-R312 VanDerWaalsContact O-CZ 3.25Å; L307-R312 PolarHBondContact O-NE 2.82Å; L307-R312 PolarHBondContact O-NH2 2.7Å; L307-R312 VanDerWaalsContact O-NH2 3.13Å; N308-R312 WeakPolarHBondContact O-CG 3.16Å; N308-R312 PolarHBondContact O-N 3.39Å; V309-R312 PolarHBondContact O-N 3.26Å; R312-A316 VanDerWaalsContact O-CB 3.3Å; R312-A316 WeakPolarHBondContact O-CB 3.34Å; R312-A316 PolarHBondContact O-N 3.33Å; R312-R354 WeakPolarHBondContact CD-O 3.23Å; R312-R354 PolarHBondContact NH1-O 2.79Å; R312-L355 HydrophobicContact CB-CD2 3.83Å
313	W	90.4	Very high	83.9	Confident	49 Å²	49	73.3 Å²	73.3	19%	0.186	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-40.9	173.9	-88.4	102.4	0	0	0	112.9	V309 K310 Q311 A316 K317 F323 H351 L355 Y357	V309-W313 VanDerWaalsContact O-CD1 3.29Å; V309-W313 PolarHBondContact O-N 3.49Å; K310-W313 PolarHBondContact O-N 2.89Å; Q311-W313 VanDerWaalsContact C-N 3.33Å; Q311-W313 PolarHBondContact O-N 3.23Å; W313-A316 PolarHBondContact O-N 3.19Å; W313-K317 WeakPolarHBondContact O-CG 3.24Å; W313-K317 PolarHBondContact O-N 3.05Å; W313-K317 VanDerWaalsContact O-N 3.11Å; W313-F323 HydrophobicContact CE3-CD1 4.3Å; W313-F323 HydrophobicContact CE3-CE1 4.37Å; W313-F323 HydrophobicContact CH2-CB 4.46Å; W313-F323 HydrophobicContact CH2-CG 4.36Å; W313-F323 HydrophobicContact CZ3-CB 4.31Å; W313-F323 AromaticContact CZ3-CD1 3.92Å; W313-F323 HydrophobicContact CZ3-CD1 3.92Å; W313-F323 AromaticContact CZ3-CD2 3.86Å; W313-F323 HydrophobicContact CZ3-CD2 3.86Å; W313-F323 HydrophobicContact CZ3-CE1 4.23Å; W313-F323 HydrophobicContact CZ3-CE2 4.16Å; W313-F323 AromaticContact CZ3-CG 3.75Å; W313-F323 HydrophobicContact CZ3-CG 3.75Å; W313-F323 HydrophobicContact CZ3-CZ 4.36Å; W313-H351 HydrophobicContact CH2-CB 4.22Å; W313-H351 HydrophobicContact CZ2-CB 4.25Å; W313-L355 HydrophobicContact CD2-CB 4.44Å; W313-L355 HydrophobicContact CD2-CD1 4.21Å; W313-L355 HydrophobicContact CD2-CD2 4.25Å; W313-L355 HydrophobicContact CE3-CD1 4.21Å; W313-L355 HydrophobicContact CG-CD2 4.15Å; W313-L355 HydrophobicContact CH2-CD1 4.12Å; W313-L355 HydrophobicContact CZ2-CB 3.87Å; W313-L355 HydrophobicContact CZ2-CD1 4.09Å; W313-L355 HydrophobicContact CZ3-CD1 4.17Å; W313-L355 PolarHBondContact NE1-O 2.93Å; W313-Y357 AromaticContact CD1-CE2 3.76Å; W313-Y357 AromaticContact CD1-CZ 3.74Å; W313-Y357 AromaticContact NE1-CE2 3.4Å; W313-Y357 AromaticContact NE1-CZ 3.9Å
314	R	86.1	Confident	84.7	Confident	142 Å²	142	69.1 Å²	69.1	54%	0.536	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-50.8	177.2	-172	-174.3	-61.8	146.9	-2.8	110.8	K310 Q311 A316 K317 E318	K310-R314 PolarHBondContact O-N 3.46Å; K310-R314 VanDerWaalsContact O-N 3.11Å; Q311-R314 WeakPolarHBondContact O-CB 3.42Å; Q311-R314 PolarHBondContact O-N 3.13Å; R314-A316 VanDerWaalsContact C-N 3.27Å; R314-A316 PolarHBondContact O-N 2.93Å; R314-K317 WeakPolarHBondContact O-CB 3.42Å; R314-K317 PolarHBondContact O-N 2.86Å; R314-K317 VanDerWaalsContact O-N 3.1Å; R314-E318 VanDerWaalsContact O-CB 3.31Å; R314-E318 WeakPolarHBondContact O-CB 3.28Å; R314-E318 PolarHBondContact O-N 3.25Å
315	T	82.7	Confident	85.1	Confident	19 Å²	19	69.7 Å²	69.7	12%	0.117	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-41.2	176.6	-54	0	0	0	0	110.6	I290 F298 F304 L307 Q311 K317 H319	I290-T315 HydrophobicContact CD1-CG2 3.86Å; I290-T315 HydrophobicContact CG1-CG2 4.43Å; F298-T315 HydrophobicContact CE2-CG2 4.42Å; F298-T315 HydrophobicContact CZ-CG2 3.99Å; F304-T315 HydrophobicContact CD2-CG2 4.1Å; F304-T315 HydrophobicContact CE2-CG2 4.22Å; L307-T315 HydrophobicContact CD1-CG2 4.39Å; L307-T315 WeakPolarHBondContact CD1-OG1 3.44Å; Q311-T315 PolarHBondContact O-N 2.82Å; Q311-T315 PolarHBondContact O-OG1 2.84Å; T315-K317 VanDerWaalsContact C-N 3.35Å; T315-K317 PolarHBondContact O-N 3.46Å; T315-H319 VanDerWaalsContact CG2-CD2 3.44Å; T315-H319 WeakPolarHBondContact CG2-CD2 3.25Å; T315-H319 VanDerWaalsContact O-CB 3.31Å; T315-H319 WeakPolarHBondContact O-CB 3.1Å; T315-H319 PolarHBondContact O-CD2 2.97Å; T315-H319 PolarHBondContact O-N 2.67Å
316	A	86.6	Confident	85.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-41.1	176.6	0	0	0	0	0	113	R312 W313 R314 R320 V321 F323 L326	R312-A316 VanDerWaalsContact O-CB 3.3Å; R312-A316 WeakPolarHBondContact O-CB 3.34Å; R312-A316 PolarHBondContact O-N 3.33Å; W313-A316 PolarHBondContact O-N 3.19Å; R314-A316 VanDerWaalsContact C-N 3.27Å; R314-A316 PolarHBondContact O-N 2.93Å; A316-R320 PolarHBondContact O-N 3.16Å; A316-R320 VanDerWaalsContact O-N 3.11Å; A316-V321 VanDerWaalsContact CA-CG2 3.49Å; A316-V321 HydrophobicContact CB-CG2 3.71Å; A316-V321 VanDerWaalsContact O-CG2 3.3Å; A316-V321 WeakPolarHBondContact O-CG2 3.41Å; A316-V321 PolarHBondContact O-N 3Å; A316-F323 HydrophobicContact CB-CD1 3.98Å; A316-F323 HydrophobicContact CB-CE1 3.93Å; A316-L326 HydrophobicContact CB-CD2 4.14Å
317	K	84.8	Confident	85.5	Confident	134 Å²	134	62.8 Å²	62.8	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-69.7	-49.9	176.8	-75.4	174.7	179.6	-175.9	0	112.6	W313 R314 T315 H319 R320 F323	W313-K317 WeakPolarHBondContact O-CG 3.24Å; W313-K317 PolarHBondContact O-N 3.05Å; W313-K317 VanDerWaalsContact O-N 3.11Å; R314-K317 WeakPolarHBondContact O-CB 3.42Å; R314-K317 PolarHBondContact O-N 2.86Å; R314-K317 VanDerWaalsContact O-N 3.1Å; T315-K317 VanDerWaalsContact C-N 3.35Å; T315-K317 PolarHBondContact O-N 3.46Å; K317-H319 VanDerWaalsContact C-N 3.3Å; K317-H319 PolarHBondContact O-N 2.9Å; K317-R320 PolarHBondContact O-N 2.6Å; K317-F323 HydrophobicContact CG-CE1 3.93Å; K317-F323 HydrophobicContact CG-CZ 3.69Å
318	E	82.1	Confident	85.3	Confident	132 Å²	132	65.8 Å²	65.8	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-57.6	-46.6	179.5	178.9	173.5	-171	0	0	110.6	R314 R320	R314-E318 VanDerWaalsContact O-CB 3.31Å; R314-E318 WeakPolarHBondContact O-CB 3.28Å; R314-E318 PolarHBondContact O-N 3.25Å; E318-R320 PolarHBondContact O-N 2.93Å
319	H	79.5	Confident	84.7	Confident	35 Å²	35	64.3 Å²	64.3	16%	0.162	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	8.9	175.7	-64.7	-84.3	0	0	0	113.3	P289 F298 T315 K317 V321 R328	P289-H319 HydrophobicContact CB-CB 3.85Å; P289-H319 PolarHBondContact O-CE1 3.4Å; P289-H319 VanDerWaalsContact O-CE1 3.29Å; P289-H319 PolarHBondContact O-ND1 2.82Å; F298-H319 HydrophobicContact CE2-CB 4.41Å; T315-H319 VanDerWaalsContact CG2-CD2 3.44Å; T315-H319 WeakPolarHBondContact CG2-CD2 3.25Å; T315-H319 VanDerWaalsContact O-CB 3.31Å; T315-H319 WeakPolarHBondContact O-CB 3.1Å; T315-H319 PolarHBondContact O-CD2 2.97Å; T315-H319 PolarHBondContact O-N 2.67Å; K317-H319 VanDerWaalsContact C-N 3.3Å; K317-H319 PolarHBondContact O-N 2.9Å; H319-V321 PolarHBondContact O-N 2.95Å; H319-R328 VanDerWaalsContact C-NH2 3.34Å; H319-R328 VanDerWaalsContact CA-NH2 3.26Å; H319-R328 PolarHBondContact O-NE 2.92Å; H319-R328 PolarHBondContact O-NH2 3.48Å
320	R	80.9	Confident	84.4	Confident	215 Å²	215	65.3 Å²	65.3	81%	0.811	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	38.8	174	-56.4	-174.7	-179.4	-175.3	0.1	114.3	A316 K317 E318	A316-R320 PolarHBondContact O-N 3.16Å; A316-R320 VanDerWaalsContact O-N 3.11Å; K317-R320 PolarHBondContact O-N 2.6Å; E318-R320 PolarHBondContact O-N 2.93Å
321	V	86	Confident	84.1	Confident	7 Å²	7	64.2 Å²	64.2	4%	0.042	29%	0.292	C	S	.	.			trans	-86.4	153.6	173.7	-68.3	0	0	0	0	110.4	P289 F298 A316 H319 L326 Q327 R328	P289-V321 HydrophobicContact CG-CG1 3.82Å; F298-V321 HydrophobicContact CD2-CG1 4.36Å; F298-V321 HydrophobicContact CE1-CG2 4.09Å; F298-V321 HydrophobicContact CE2-CG1 4.33Å; F298-V321 HydrophobicContact CZ-CG2 4.07Å; A316-V321 VanDerWaalsContact CA-CG2 3.49Å; A316-V321 HydrophobicContact CB-CG2 3.71Å; A316-V321 VanDerWaalsContact O-CG2 3.3Å; A316-V321 WeakPolarHBondContact O-CG2 3.41Å; A316-V321 PolarHBondContact O-N 3Å; H319-V321 PolarHBondContact O-N 2.95Å; V321-L326 HydrophobicContact CG2-CD2 4.08Å; V321-Q327 WeakPolarHBondContact CA-O 3.5Å; V321-R328 HydrophobicContact CG1-CG 3.83Å
322	R	86.8	Confident	83.5	Confident	63 Å²	63	63.8 Å²	63.8	24%	0.238	30%	0.296	C	S	.	.			trans	-64.9	131.5	172.8	-66.2	-57.9	-52.3	154.7	3.6	110.5	T324 C325 L326 Q327 H330 S332	R322-T324 PolarHBondContact O-N 2.8Å; R322-C325 VanDerWaalsContact CB-SG 3.58Å; R322-L326 WeakPolarHBondContact O-CA 3.49Å; R322-L326 PolarHBondContact O-N 2.91Å; R322-Q327 PolarHBondContact N-O 3.18Å; R322-H330 WeakPolarHBondContact CD-O 3.46Å; R322-S332 VanDerWaalsContact CZ-CA 3.4Å; R322-S332 PolarHBondContact NH1-OG 3.49Å; R322-S332 VanDerWaalsContact NH2-CA 3.33Å; R322-S332 PolarHBondContact NH2-OG 3.38Å
323	F	91	Very high	82.9	Confident	68 Å²	68	65.4 Å²	65.4	30%	0.298	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.2	-176.2	-56.7	-43.3	0	0	0	114.3	W313 A316 K317 H351 H352 L355	W313-F323 HydrophobicContact CE3-CD1 4.3Å; W313-F323 HydrophobicContact CE3-CE1 4.37Å; W313-F323 HydrophobicContact CH2-CB 4.46Å; W313-F323 HydrophobicContact CH2-CG 4.36Å; W313-F323 HydrophobicContact CZ3-CB 4.31Å; W313-F323 AromaticContact CZ3-CD1 3.92Å; W313-F323 HydrophobicContact CZ3-CD1 3.92Å; W313-F323 AromaticContact CZ3-CD2 3.86Å; W313-F323 HydrophobicContact CZ3-CD2 3.86Å; W313-F323 HydrophobicContact CZ3-CE1 4.23Å; W313-F323 HydrophobicContact CZ3-CE2 4.16Å; W313-F323 AromaticContact CZ3-CG 3.75Å; W313-F323 HydrophobicContact CZ3-CG 3.75Å; W313-F323 HydrophobicContact CZ3-CZ 4.36Å; A316-F323 HydrophobicContact CB-CD1 3.98Å; A316-F323 HydrophobicContact CB-CE1 3.93Å; K317-F323 HydrophobicContact CG-CE1 3.93Å; K317-F323 HydrophobicContact CG-CZ 3.69Å; F323-H351 CarbonylContact O-C 3.55Å; F323-H351 WeakPolarHBondContact O-CA 3.35Å; F323-H352 WeakPolarHBondContact O-CB 3.3Å; F323-H352 PolarHBondContact O-N 3.02Å; F323-L355 HydrophobicContact CB-CD1 4.05Å; F323-L355 HydrophobicContact CD1-CD1 4.21Å; F323-L355 HydrophobicContact CG-CD1 4.47Å
324	T	89.9	Confident	82.5	Confident	12 Å²	12	72.8 Å²	72.8	7%	0.074	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-47	-179.9	48.5	0	0	0	0	112.9	R322 C335 A337 L350 H352	R322-T324 PolarHBondContact O-N 2.8Å; T324-C335 PolarHBondContact OG1-SG 3.21Å; T324-C335 VanDerWaalsContact OG1-SG 3.41Å; T324-A337 VanDerWaalsContact CB-O 3.22Å; T324-A337 WeakPolarHBondContact CB-O 3.39Å; T324-A337 PolarHBondContact OG1-O 2.84Å; T324-L350 HydrophobicContact CG2-CB 4.32Å; T324-H352 VanDerWaalsContact O-CB 3.31Å; T324-H352 WeakPolarHBondContact O-CB 3.28Å; T324-H352 PolarHBondContact O-CD2 3.18Å
325	C	87.4	Confident	82.4	Confident	14 Å²	14	66.1 Å²	66.1	10%	0.095	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-12	178.8	63.9	0	0	0	0	114.8	H297 R322 Q327 A337	H297-C325 PolarHBondContact CE1-O 2.62Å; R322-C325 VanDerWaalsContact CB-SG 3.58Å; C325-Q327 HydrophobicContact CB-CG 4.41Å; C325-Q327 PolarHBondContact O-N 3.22Å; C325-A337 HydrophobicContact CB-CB 4.03Å
326	L	86	Confident	82.5	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	36%	0.361	C	S	.	.			trans	58.1	29.7	-173.2	-59.5	176.5	0	0	0	114.7	F298 A299 F304 A316 V321 R322 H352 L355	F298-L326 VanDerWaalsContact CB-O 3.26Å; F298-L326 WeakPolarHBondContact CB-O 3.36Å; F298-L326 HydrophobicContact CD1-CB 3.63Å; F298-L326 HydrophobicContact CD1-CD1 4.15Å; F298-L326 HydrophobicContact CD1-CG 4.33Å; F298-L326 HydrophobicContact CE1-CB 4.18Å; F298-L326 HydrophobicContact CE1-CD1 4.36Å; F298-L326 HydrophobicContact CE1-CD2 4.3Å; F298-L326 HydrophobicContact CG-CB 4.46Å; A299-L326 HydrophobicContact CB-CD1 3.89Å; F304-L326 HydrophobicContact CE1-CD1 3.94Å; F304-L326 HydrophobicContact CZ-CD1 4.14Å; A316-L326 HydrophobicContact CB-CD2 4.14Å; V321-L326 HydrophobicContact CG2-CD2 4.08Å; R322-L326 WeakPolarHBondContact O-CA 3.49Å; R322-L326 PolarHBondContact O-N 2.91Å; L326-H352 HydrophobicContact CD1-CB 3.85Å; L326-H352 WeakPolarHBondContact CD1-ND1 3.41Å; L326-H352 HydrophobicContact CD2-CB 4.42Å; L326-H352 HydrophobicContact CG-CB 3.75Å; L326-L355 HydrophobicContact CD2-CD1 3.82Å; L326-L355 HydrophobicContact CD2-CG 4.19Å
327	Q	81.3	Confident	82.5	Confident	83 Å²	83	75.6 Å²	75.6	39%	0.388	37%	0.369	S	S	.	.			trans	-109.9	158.2	176.3	-62.7	175.6	-29.7	0	0	112.3	H297 V321 R322 C325	H297-Q327 PolarHBondContact NE2-NE2 2.93Å; V321-Q327 WeakPolarHBondContact CA-O 3.5Å; R322-Q327 PolarHBondContact N-O 3.18Å; C325-Q327 HydrophobicContact CB-CG 4.41Å; C325-Q327 PolarHBondContact O-N 3.22Å
328	R	77.8	Confident	82.3	Confident	106 Å²	106	73 Å²	73	40%	0.4	36%	0.358	S	S	.	.			trans	-93.8	175.3	171	-81.3	-173.3	173.3	171.3	-3.1	110.9	P289 H319 V321 H330	P289-R328 HydrophobicContact CG-CG 4.06Å; H319-R328 VanDerWaalsContact C-NH2 3.34Å; H319-R328 VanDerWaalsContact CA-NH2 3.26Å; H319-R328 PolarHBondContact O-NE 2.92Å; H319-R328 PolarHBondContact O-NH2 3.48Å; V321-R328 HydrophobicContact CG1-CG 3.83Å; R328-H330 PolarHBondContact O-ND1 2.83Å
329	G	72.3	Confident	82.5	Confident	40 Å²	40	72.7 Å²	72.7	41%	0.412	36%	0.361	S	S	.	.	S	Bend	trans	94.9	-4.9	162.8	0	0	0	0	0	115.9
330	H	79.4	Confident	82.8	Confident	56 Å²	56	75.7 Å²	75.7	26%	0.259	38%	0.375	S	S	.	.	S	Bend	trans	-144.4	156.5	179.1	62.2	-87.7	0	0	0	112.9	R322 R328 R334 C335	R322-H330 WeakPolarHBondContact CD-O 3.46Å; R328-H330 PolarHBondContact O-ND1 2.83Å; H330-R334 HydrophobicContact CB-CB 4.28Å; H330-C335 VanDerWaalsContact CD2-CA 3.44Å; H330-C335 WeakPolarHBondContact CD2-CA 3.42Å; H330-C335 WeakPolarHBondContact NE2-CB 3.43Å; H330-C335 PolarHBondContact NE2-SG 3.32Å
331	S	79.7	Confident	83.1	Confident	59 Å²	59	73.3 Å²	73.3	41%	0.413	37%	0.366	S	S	.	.			trans	-78.3	165.5	176.5	57.6	0	0	0	0	112.6	A333 R334 C335	S331-A333 PolarHBondContact O-N 2.97Å; S331-R334 PolarHBondContact O-N 3.16Å; S331-C335 PolarHBondContact O-N 3.46Å
332	S	74.2	Confident	83.2	Confident	62 Å²	62	73.4 Å²	73.4	43%	0.434	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-48	-46.3	172.1	-52.6	0	0	0	0	112.7	R322 R334 C335 Q338	R322-S332 VanDerWaalsContact CZ-CA 3.4Å; R322-S332 PolarHBondContact NH1-OG 3.49Å; R322-S332 VanDerWaalsContact NH2-CA 3.33Å; R322-S332 PolarHBondContact NH2-OG 3.38Å; S332-R334 PolarHBondContact O-N 3.2Å; S332-C335 WeakPolarHBondContact O-CB 3.43Å; S332-C335 PolarHBondContact O-N 3.13Å; S332-Q338 WeakPolarHBondContact O-CB 3.48Å; S332-Q338 PolarHBondContact O-OE1 3.29Å
333	A	77	Confident	83.3	Confident	77 Å²	77	79.3 Å²	79.3	64%	0.636	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-70	-14.3	-175.9	0	0	0	0	0	114.5	S331 Q338	S331-A333 PolarHBondContact O-N 2.97Å; A333-Q338 PolarHBondContact O-OE1 2.85Å
334	R	81.5	Confident	83	Confident	204 Å²	204	78.9 Å²	78.9	77%	0.77	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-112.1	11.4	179.8	-66.2	-174.3	-176.8	178.9	1.1	111.8	H330 S331 S332	H330-R334 HydrophobicContact CB-CB 4.28Å; S331-R334 PolarHBondContact O-N 3.16Å; S332-R334 PolarHBondContact O-N 3.2Å
335	C	83.7	Confident	82.7	Confident	2 Å²	2	85 Å²	85	1%	0.014	43%	0.427	C	S	.	.			trans	-86.6	120.3	179.2	-172.9	0	0	0	0	108.6	T324 H330 S331 S332 A337 Q338	T324-C335 PolarHBondContact OG1-SG 3.21Å; T324-C335 VanDerWaalsContact OG1-SG 3.41Å; H330-C335 VanDerWaalsContact CD2-CA 3.44Å; H330-C335 WeakPolarHBondContact CD2-CA 3.42Å; H330-C335 WeakPolarHBondContact NE2-CB 3.43Å; H330-C335 PolarHBondContact NE2-SG 3.32Å; S331-C335 PolarHBondContact O-N 3.46Å; S332-C335 WeakPolarHBondContact O-CB 3.43Å; S332-C335 PolarHBondContact O-N 3.13Å; C335-A337 PolarHBondContact O-N 3.47Å; C335-Q338 HydrophobicContact CB-CB 4.07Å; C335-Q338 WeakPolarHBondContact O-CB 3.45Å; C335-Q338 WeakPolarHBondContact O-CG 3.42Å; C335-Q338 PolarHBondContact O-N 3.31Å
336	E	85.2	Confident	82.3	Confident	199 Å²	199	87.9 Å²	87.9	93%	0.93	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-35.6	174.5	-66.9	174.2	-179	0	0	111.1	Q338	E336-Q338 VanDerWaalsContact C-N 3.26Å; E336-Q338 PolarHBondContact O-N 3.11Å
337	A	85.1	Confident	82.2	Confident	20 Å²	20	88.8 Å²	88.8	17%	0.165	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	18	174.9	0	0	0	0	0	114	T324 C325 C335 N339 E340	T324-A337 VanDerWaalsContact CB-O 3.22Å; T324-A337 WeakPolarHBondContact CB-O 3.39Å; T324-A337 PolarHBondContact OG1-O 2.84Å; C325-A337 HydrophobicContact CB-CB 4.03Å; C335-A337 PolarHBondContact O-N 3.47Å; A337-N339 PolarHBondContact O-N 2.96Å; A337-E340 HydrophobicContact CB-CB 4.1Å; A337-E340 HydrophobicContact CB-CG 3.84Å; A337-E340 WeakPolarHBondContact O-CB 3.4Å; A337-E340 PolarHBondContact O-N 3.26Å
338	Q	82.3	Confident	82.3	Confident	79 Å²	79	92.9 Å²	92.9	37%	0.369	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-33.9	-173.6	61.6	-174.8	-18.9	0	0	113.8	S332 A333 C335 E336	S332-Q338 WeakPolarHBondContact O-CB 3.48Å; S332-Q338 PolarHBondContact O-OE1 3.29Å; A333-Q338 PolarHBondContact O-OE1 2.85Å; C335-Q338 HydrophobicContact CB-CB 4.07Å; C335-Q338 WeakPolarHBondContact O-CB 3.45Å; C335-Q338 WeakPolarHBondContact O-CG 3.42Å; C335-Q338 PolarHBondContact O-N 3.31Å; E336-Q338 VanDerWaalsContact C-N 3.26Å; E336-Q338 PolarHBondContact O-N 3.11Å
339	N	84.8	Confident	82.7	Confident	126 Å²	126	93.9 Å²	93.9	67%	0.674	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	1	-178.5	-64.9	-32.5	0	0	0	112.8	A337 R341	A337-N339 PolarHBondContact O-N 2.96Å; N339-R341 PolarHBondContact O-N 3.17Å
340	E	86.5	Confident	83.4	Confident	98 Å²	98	96.3 Å²	96.3	46%	0.458	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-68.6	116.8	177.6	-70.4	-72.8	123.6	0	0	109.7	A337 R343 L350	A337-E340 HydrophobicContact CB-CB 4.1Å; A337-E340 HydrophobicContact CB-CG 3.84Å; A337-E340 WeakPolarHBondContact O-CB 3.4Å; A337-E340 PolarHBondContact O-N 3.26Å; E340-R343 IonicContact OE2-NH2 3.83Å; E340-L350 WeakPolarHBondContact O-CD2 3.32Å
341	R	87.1	Confident	84	Confident	164 Å²	164	94.5 Å²	94.5	62%	0.619	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-82.4	158	173.6	-66.9	-179.5	178.4	166.2	0.6	110.3	N339 R343 L350	N339-R341 PolarHBondContact O-N 3.17Å; R341-R343 PolarHBondContact O-N 3.44Å; R341-L350 HydrophobicContact CG-CD2 3.87Å
342	C	89.3	Confident	84.5	Confident	9 Å²	9	93.3 Å²	93.3	6%	0.061	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-54.2	127.1	174.5	-174.4	0	0	0	0	110.8	I344 C347 Q349 H351	C342-I344 PolarHBondContact O-N 2.79Å; C342-C347 HydrophobicContact CB-CB 3.8Å; C342-C347 VanDerWaalsContact CB-SG 3.55Å; C342-Q349 PolarHBondContact N-O 3.38Å; C342-H351 PolarHBondContact SG-CE1 3.3Å
343	R	87.2	Confident	85.2	Confident	188 Å²	188	94 Å²	94	71%	0.709	47%	0.47	S	S	*	.			trans	-73.1	-4.1	-178.3	-62.8	-176.9	-177.2	-178.7	-0.9	114.4	E340 R341	E340-R343 IonicContact OE2-NH2 3.83Å; R341-R343 PolarHBondContact O-N 3.44Å
344	I	85.2	Confident	85.7	Confident	58 Å²	58	95 Å²	95	30%	0.297	46%	0.457	S	S	.	.	S	Bend	trans	-82.9	126.2	-179.7	-66.8	171.3	0	0	0	109.7	C342 G346 C347 Q353 Y356	C342-I344 PolarHBondContact O-N 2.79Å; I344-G346 PolarHBondContact O-N 3.2Å; I344-C347 WeakPolarHBondContact O-CB 3.36Å; I344-C347 PolarHBondContact O-N 3.32Å; I344-Q353 HydrophobicContact CD1-CB 4.46Å; I344-Y356 HydrophobicContact CB-CD1 4.26Å; I344-Y356 HydrophobicContact CB-CD2 4.44Å; I344-Y356 HydrophobicContact CB-CE1 4.34Å; I344-Y356 HydrophobicContact CB-CG 4.28Å; I344-Y356 VanDerWaalsContact CD1-CB 3.48Å; I344-Y356 HydrophobicContact CD1-CD1 3.32Å; I344-Y356 HydrophobicContact CD1-CD2 4.43Å; I344-Y356 HydrophobicContact CD1-CE1 4.11Å; I344-Y356 HydrophobicContact CD1-CG 3.5Å; I344-Y356 HydrophobicContact CG1-CD1 4.35Å; I344-Y356 HydrophobicContact CG1-CG 4.46Å; I344-Y356 HydrophobicContact CG2-CD1 3.89Å; I344-Y356 HydrophobicContact CG2-CD2 4.49Å; I344-Y356 HydrophobicContact CG2-CE1 3.52Å; I344-Y356 HydrophobicContact CG2-CE2 4.23Å; I344-Y356 HydrophobicContact CG2-CG 4.34Å
345	T	84.1	Confident	86.1	Confident	140 Å²	140	85.2 Å²	85.2	86%	0.859	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	125.9	-178.6	-45.5	0	0	0	0	111.6
346	G	79.1	Confident	86.3	Confident	75 Å²	75	87.3 Å²	87.3	77%	0.773	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-7.8	-178.2	0	0	0	0	0	115.2	I344	I344-G346 PolarHBondContact O-N 3.2Å
347	C	84.3	Confident	86.2	Confident	20 Å²	20	84.3 Å²	84.3	14%	0.135	41%	0.409	C	S	.	.			trans	-94.2	121.1	171	-166.4	0	0	0	0	111.1	C342 I344 H351 Y356	C342-C347 HydrophobicContact CB-CB 3.8Å; C342-C347 VanDerWaalsContact CB-SG 3.55Å; I344-C347 WeakPolarHBondContact O-CB 3.36Å; I344-C347 PolarHBondContact O-N 3.32Å; C347-H351 PolarHBondContact SG-NE2 2.91Å; C347-Y356 HydrophobicContact CB-CD2 3.83Å; C347-Y356 HydrophobicContact CB-CE2 3.57Å
348	K	82.3	Confident	85.4	Confident	168 Å²	168	85.8 Å²	85.8	73%	0.73	43%	0.427	S	S	*	.			trans	-103.7	9.6	176	-59.4	-173.5	-178.7	-177.4	0	113.5
349	Q	86	Confident	83.9	Confident	128 Å²	128	90.3 Å²	90.3	60%	0.598	45%	0.445	S	S	*	.	S	Bend	trans	-87.1	152.1	-171.2	-61.5	-63.6	-34.5	0	0	112.3	C342 H351	C342-Q349 PolarHBondContact N-O 3.38Å; Q349-H351 VanDerWaalsContact CB-CD2 3.44Å; Q349-H351 WeakPolarHBondContact CB-CD2 3.37Å; Q349-H351 PolarHBondContact O-N 3.3Å
350	L	88.5	Confident	81.9	Confident	91 Å²	91	90.7 Å²	90.7	48%	0.476	45%	0.452	S	S	.	.	S	Bend	trans	-86.1	84.4	178	-66	173.1	0	0	0	110.7	T324 E340 R341	T324-L350 HydrophobicContact CG2-CB 4.32Å; E340-L350 WeakPolarHBondContact O-CD2 3.32Å; R341-L350 HydrophobicContact CG-CD2 3.87Å
351	H	90.3	Very high	79.3	Confident	17 Å²	17	92.5 Å²	92.5	8%	0.079	47%	0.465	C	S	.	.	S	Bend	trans	-156.7	159.2	171.6	64.4	83.7	0	0	0	110.9	W313 F323 C342 C347 Q349 L355	W313-H351 HydrophobicContact CH2-CB 4.22Å; W313-H351 HydrophobicContact CZ2-CB 4.25Å; F323-H351 CarbonylContact O-C 3.55Å; F323-H351 WeakPolarHBondContact O-CA 3.35Å; C342-H351 PolarHBondContact SG-CE1 3.3Å; C347-H351 PolarHBondContact SG-NE2 2.91Å; Q349-H351 VanDerWaalsContact CB-CD2 3.44Å; Q349-H351 WeakPolarHBondContact CB-CD2 3.37Å; Q349-H351 PolarHBondContact O-N 3.3Å; H351-L355 HydrophobicContact CB-CB 4.37Å; H351-L355 HydrophobicContact CB-CD1 4.44Å
352	H	90.1	Very high	76.5	Confident	34 Å²	34	94.6 Å²	94.6	16%	0.157	48%	0.478	C	S	.	.			trans	-61.6	141.4	173.9	-167.9	-94.4	0	0	0	110.1	A299 F323 T324 L326 R354 L355	A299-H352 VanDerWaalsContact CB-CE1 3.5Å; A299-H352 WeakPolarHBondContact CB-CE1 3.48Å; F323-H352 WeakPolarHBondContact O-CB 3.3Å; F323-H352 PolarHBondContact O-N 3.02Å; T324-H352 VanDerWaalsContact O-CB 3.31Å; T324-H352 WeakPolarHBondContact O-CB 3.28Å; T324-H352 PolarHBondContact O-CD2 3.18Å; L326-H352 HydrophobicContact CD1-CB 3.85Å; L326-H352 WeakPolarHBondContact CD1-ND1 3.41Å; L326-H352 HydrophobicContact CD2-CB 4.42Å; L326-H352 HydrophobicContact CG-CB 3.75Å; H352-R354 VanDerWaalsContact CE1-CG 3.47Å; H352-R354 WeakPolarHBondContact CE1-CG 3.44Å; H352-R354 WeakPolarHBondContact ND1-CG 3.44Å; H352-R354 PolarHBondContact ND1-N 2.8Å; H352-R354 PolarHBondContact O-N 3.4Å; H352-L355 WeakPolarHBondContact O-CB 3.42Å; H352-L355 PolarHBondContact O-N 2.92Å
353	Q	89.3	Confident	73.5	Confident	77 Å²	77	105 Å²	105	36%	0.36	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-53.6	-31.3	-178	60.7	-178.6	-5.9	0	0	114	I344 L355 Y356	I344-Q353 HydrophobicContact CD1-CB 4.46Å; Q353-L355 PolarHBondContact O-N 3.32Å; Q353-Y356 VanDerWaalsContact O-CB 3.28Å; Q353-Y356 WeakPolarHBondContact O-CB 3.45Å; Q353-Y356 PolarHBondContact O-N 3.11Å; Q353-Y356 VanDerWaalsContact O-N 3.13Å
354	R	87.9	Confident	70.6	Confident	97 Å²	97	101.3 Å²	101.3	37%	0.366	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-68.8	-14.1	178.2	-59.7	-67.9	-177.5	166.7	1.1	114	F304 L305 R312 H352	F304-R354 HydrophobicContact CE1-CB 4.31Å; L305-R354 VanDerWaalsContact CD2-CZ 3.5Å; R312-R354 WeakPolarHBondContact CD-O 3.23Å; R312-R354 PolarHBondContact NH1-O 2.79Å; H352-R354 VanDerWaalsContact CE1-CG 3.47Å; H352-R354 WeakPolarHBondContact CE1-CG 3.44Å; H352-R354 WeakPolarHBondContact ND1-CG 3.44Å; H352-R354 PolarHBondContact ND1-N 2.8Å; H352-R354 PolarHBondContact O-N 3.4Å
355	L	89.1	Confident	67.6	Low	0 Å²	0	109.5 Å²	109.5	0%	0	55%	0.548	C	S	.	.	G	3₁₀ helix	trans	-96.1	1.1	175.6	-64.7	-175.2	0	0	0	113.3	F304 R312 W313 F323 L326 H351 H352 Q353 Y357	F304-L355 HydrophobicContact CZ-CD2 4.38Å; R312-L355 HydrophobicContact CB-CD2 3.83Å; W313-L355 HydrophobicContact CD2-CB 4.44Å; W313-L355 HydrophobicContact CD2-CD1 4.21Å; W313-L355 HydrophobicContact CD2-CD2 4.25Å; W313-L355 HydrophobicContact CE3-CD1 4.21Å; W313-L355 HydrophobicContact CG-CD2 4.15Å; W313-L355 HydrophobicContact CH2-CD1 4.12Å; W313-L355 HydrophobicContact CZ2-CB 3.87Å; W313-L355 HydrophobicContact CZ2-CD1 4.09Å; W313-L355 HydrophobicContact CZ3-CD1 4.17Å; W313-L355 PolarHBondContact NE1-O 2.93Å; F323-L355 HydrophobicContact CB-CD1 4.05Å; F323-L355 HydrophobicContact CD1-CD1 4.21Å; F323-L355 HydrophobicContact CG-CD1 4.47Å; L326-L355 HydrophobicContact CD2-CD1 3.82Å; L326-L355 HydrophobicContact CD2-CG 4.19Å; H351-L355 HydrophobicContact CB-CB 4.37Å; H351-L355 HydrophobicContact CB-CD1 4.44Å; H352-L355 WeakPolarHBondContact O-CB 3.42Å; H352-L355 PolarHBondContact O-N 2.92Å; Q353-L355 PolarHBondContact O-N 3.32Å; L355-Y357 PolarHBondContact O-N 3.44Å
356	Y	89	Confident	64.8	Low	46 Å²	46	108.1 Å²	108.1	18%	0.18	54%	0.544	C	S	.	.			trans	-66.1	131.5	178.2	179.4	-111.4	0	0	0	112.1	V309 I344 C347 Q353 G358	V309-Y356 WeakPolarHBondContact CG1-O 3.33Å; V309-Y356 WeakPolarHBondContact CG2-O 3.35Å; I344-Y356 HydrophobicContact CB-CD1 4.26Å; I344-Y356 HydrophobicContact CB-CD2 4.44Å; I344-Y356 HydrophobicContact CB-CE1 4.34Å; I344-Y356 HydrophobicContact CB-CG 4.28Å; I344-Y356 VanDerWaalsContact CD1-CB 3.48Å; I344-Y356 HydrophobicContact CD1-CD1 3.32Å; I344-Y356 HydrophobicContact CD1-CD2 4.43Å; I344-Y356 HydrophobicContact CD1-CE1 4.11Å; I344-Y356 HydrophobicContact CD1-CG 3.5Å; I344-Y356 HydrophobicContact CG1-CD1 4.35Å; I344-Y356 HydrophobicContact CG1-CG 4.46Å; I344-Y356 HydrophobicContact CG2-CD1 3.89Å; I344-Y356 HydrophobicContact CG2-CD2 4.49Å; I344-Y356 HydrophobicContact CG2-CE1 3.52Å; I344-Y356 HydrophobicContact CG2-CE2 4.23Å; I344-Y356 HydrophobicContact CG2-CG 4.34Å; C347-Y356 HydrophobicContact CB-CD2 3.83Å; C347-Y356 HydrophobicContact CB-CE2 3.57Å; Q353-Y356 VanDerWaalsContact O-CB 3.28Å; Q353-Y356 WeakPolarHBondContact O-CB 3.45Å; Q353-Y356 PolarHBondContact O-N 3.11Å; Q353-Y356 VanDerWaalsContact O-N 3.13Å; Y356-G358 PolarHBondContact O-N 3.21Å
357	Y	82.5	Confident	62.1	Low	135 Å²	135	107.9 Å²	107.9	53%	0.529	54%	0.542	S	S	.	.			trans	-79.1	106.4	165.4	-70.8	-81.8	0	0	0	108.2	V309 W313 L355 K359	V309-Y357 HydrophobicContact CB-CD1 4.28Å; V309-Y357 HydrophobicContact CB-CE1 4.29Å; V309-Y357 HydrophobicContact CG1-CD1 3.68Å; V309-Y357 HydrophobicContact CG1-CD2 4.31Å; V309-Y357 HydrophobicContact CG1-CE1 3.7Å; V309-Y357 HydrophobicContact CG1-CE2 4.33Å; V309-Y357 HydrophobicContact CG1-CG 4Å; W313-Y357 AromaticContact CD1-CE2 3.76Å; W313-Y357 AromaticContact CD1-CZ 3.74Å; W313-Y357 AromaticContact NE1-CE2 3.4Å; W313-Y357 AromaticContact NE1-CZ 3.9Å; L355-Y357 PolarHBondContact O-N 3.44Å; Y357-K359 PolarHBondContact O-N 3.15Å
358	G	69.2	Low	59.3	Low	51 Å²	51	113.8 Å²	113.8	53%	0.526	58%	0.577	S	S	.	*			trans	-50.6	128.2	167.4	0	0	0	0	0	109.5	Y356 V360	Y356-G358 PolarHBondContact O-N 3.21Å; G358-V360 PolarHBondContact O-N 3.15Å
359	K	50.8	Low	56.6	Low	174 Å²	174	110.8 Å²	110.8	76%	0.757	58%	0.577	S	S	*	*			trans	-62	113.2	162.7	-79.3	-176.2	177.8	177.7	0	105.3	Y357 D361	Y357-K359 PolarHBondContact O-N 3.15Å; K359-D361 PolarHBondContact O-N 3.39Å
360	V	41.4	Very low	53.8	Low	134 Å²	134	110.4 Å²	110.4	81%	0.812	59%	0.585	S	S	*	*			trans	-52	112.6	171.8	178.7	0	0	0	0	106.8	G358 K362	G358-V360 PolarHBondContact O-N 3.15Å; V360-K362 PolarHBondContact O-N 2.85Å
361	D	33	Very low	50.8	Low	137 Å²	137	116 Å²	116	73%	0.733	61%	0.606	S	S	*	*			trans	-62.1	109.6	-178.8	-79	-49.4	0	0	0	109	K359 R363	K359-D361 PolarHBondContact O-N 3.39Å; D361-R363 PolarHBondContact O-N 3.25Å
362	K	27.7	Very low	47.6	Very low	207 Å²	207	121.3 Å²	121.3	90%	0.9	64%	0.64	S	S	*	*			trans	-74.3	33.9	174.1	-70.1	-173.3	173.1	-176	0	112.3	V360	V360-K362 PolarHBondContact O-N 2.85Å
363	R	26.5	Very low	44.7	Very low	228 Å²	228	128.5 Å²	128.5	86%	0.86	67%	0.673	S	S	*	*			trans	-128.1	65.2	-171.3	-71.3	-174.3	175.1	-179.1	-1.9	111.9	D361	D361-R363 PolarHBondContact O-N 3.25Å
364	S	25.5	Very low	41.5	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	69%	0.691	S	S	*	*			trans	-156.2	57.4	160.6	30.5	0	0	0	0	109.1
365	Y	22.4	Very low	38.6	Very low	231 Å²	231	131.3 Å²	131.3	91%	0.906	71%	0.71	S	S	*	*			trans	-126.6	74.1	162.7	-163.7	-90	0	0	0	108.3
366	S	25.3	Very low	35.5	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	74%	0.744	S	S	*	*			trans	-133.5	91.6	161.2	45.4	0	0	0	0	102.5
367	G	23.1	Very low	32.4	Very low	70 Å²	70	141.5 Å²	141.5	72%	0.722	78%	0.776	S	S	*	*				92.3	77.7	80.3	0	0	0	0	0	106.9
368	V	25.5	Very low	29.8	Very low	144 Å²	144	142.2 Å²	142.2	87%	0.873	79%	0.789	S	S	*	*			trans	-134.6	106.6	165.5	-175.5	0	0	0	0	106.8
369	S	25.2	Very low	28	Very low	104 Å²	104	147.6 Å²	147.6	73%	0.727	80%	0.801	S	S	*	*			trans	-63.3	150	173	-143.6	0	0	0	0	109.9	K371	S369-K371 PolarHBondContact O-N 2.62Å
370	P	26.8	Very low	26.9	Very low	120 Å²	120	146.5 Å²	146.5	78%	0.779	80%	0.803	S	S	*	*			trans	-75.8	116.7	-168.9	17.7	-8.2	0	0	0	110.5
371	K	26.9	Very low	26.4	Very low	209 Å²	209	151.9 Å²	151.9	91%	0.909	81%	0.808	S	S	*	*			trans	-99.1	110.7	160.6	-74.9	-171.2	176.8	-175.1	0	108.5	S369	S369-K371 PolarHBondContact O-N 2.62Å
372	T	21.9	Very low	26.3	Very low	129 Å²	129	151.7 Å²	151.7	79%	0.791	81%	0.812	S	S	*	*			trans	-45.5	124.7	157	-41.7	0	0	0	0	109.7
373	E	29	Very low	26.8	Very low	185 Å²	185	145.8 Å²	145.8	86%	0.864	80%	0.803	S	S	*	*			trans	-177.7	139.4	138	-100.2	161.1	-156.9	0	0	111
374	S	22.5	Very low	27.1	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	80%	0.8	S	S	*	*			trans	-56.4	150	177.6	44.8	0	0	0	0	114.2
375	V	27.4	Very low	27.7	Very low	127 Å²	127	142.3 Å²	142.3	77%	0.77	80%	0.801	S	S	*	*				157.7	123.1	129.2	163.9	0	0	0	0	109.8
376	S	24.4	Very low	28.1	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	79%	0.791	S	S	*	*			trans	25.6	132.5	147.9	-44.6	0	0	0	0	122.3
377	D	24.5	Very low	28.5	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	79%	0.787	S	S	*	*			trans	42.3	106.3	141.6	-74.4	-28.2	0	0	0	118.8
378	N	27.8	Very low	29.3	Very low	149 Å²	149	140.8 Å²	140.8	80%	0.797	78%	0.775	S	S	*	*				-168.6	159	105.9	-140.3	-18.6	0	0	0	111.5
379	Q	30.8	Very low	30.2	Very low	165 Å²	165	139.3 Å²	139.3	77%	0.771	76%	0.761	S	S	*	*			trans	-61.5	168.1	-170.6	-61.2	161.7	4.4	0	0	114.3
380	N	28.1	Very low	31.2	Very low	150 Å²	150	138.2 Å²	138.2	80%	0.802	77%	0.766	S	S	*	*			trans	84.3	46.3	171.5	-62.7	-19.4	0	0	0	117.7	T382	N380-T382 VanDerWaalsContact C-N 3.29Å; N380-T382 PolarHBondContact O-N 2.66Å; N380-T382 VanDerWaalsContact O-N 3.08Å
381	R	29.5	Very low	32.3	Very low	247 Å²	247	135.9 Å²	135.9	93%	0.932	75%	0.749	S	S	*	*			trans	-72.9	96.9	145.4	-71.9	-171.2	179.1	-168.6	0.6	107.6	A383	R381-A383 VanDerWaalsContact C-N 3.26Å; R381-A383 PolarHBondContact O-N 3.13Å
382	T	32.3	Very low	33	Very low	133 Å²	133	130.2 Å²	130.2	82%	0.816	74%	0.742	S	S	*	*			trans	-50.5	98.1	161.3	37	0	0	0	0	106.9	N380 D384	N380-T382 VanDerWaalsContact C-N 3.29Å; N380-T382 PolarHBondContact O-N 2.66Å; N380-T382 VanDerWaalsContact O-N 3.08Å; T382-D384 PolarHBondContact O-N 2.79Å
383	A	37.1	Very low	34.3	Very low	84 Å²	84	134.3 Å²	134.3	69%	0.694	75%	0.748	S	S	*	*			trans	-55.7	110.4	175.3	0	0	0	0	0	106.4	R381 S385	R381-A383 VanDerWaalsContact C-N 3.26Å; R381-A383 PolarHBondContact O-N 3.13Å; A383-S385 VanDerWaalsContact C-N 3.34Å; A383-S385 PolarHBondContact O-N 3.1Å; A383-S385 PolarHBondContact O-OG 3.16Å
384	D	34.1	Very low	35.2	Very low	152 Å²	152	128.1 Å²	128.1	81%	0.813	73%	0.725	S	S	*	*			trans	-45.2	104.4	172.8	-165.3	12.9	0	0	0	106.2	T382 E386	T382-D384 PolarHBondContact O-N 2.79Å; D384-E386 PolarHBondContact O-N 3.26Å
385	S	36.3	Very low	36.6	Very low	113 Å²	113	127.8 Å²	127.8	79%	0.79	72%	0.723	S	S	*	*			trans	-74.7	84	-172	-82.3	0	0	0	0	106.5	A383 L387	A383-S385 VanDerWaalsContact C-N 3.34Å; A383-S385 PolarHBondContact O-N 3.1Å; A383-S385 PolarHBondContact O-OG 3.16Å; S385-L387 VanDerWaalsContact C-N 3.32Å; S385-L387 PolarHBondContact O-N 3.36Å
386	E	32.5	Very low	37.9	Very low	147 Å²	147	125.6 Å²	125.6	69%	0.687	71%	0.707	S	S	*	*			trans	-53.3	105.8	161.9	-81.5	-163.9	145.2	0	0	106.7	D384 H388	D384-E386 PolarHBondContact O-N 3.26Å; E386-H388 VanDerWaalsContact C-N 3.27Å; E386-H388 PolarHBondContact O-N 3.38Å; E386-H388 PolarHBondContact O-ND1 3Å; E386-H388 IonicContact OE2-CE1 3.67Å; E386-H388 PolarHBondContact OE2-CE1 3.06Å
387	L	32.2	Very low	39.9	Very low	132 Å²	132	121.8 Å²	121.8	69%	0.691	68%	0.684	S	S	*	*			trans	-67	90.7	177.6	-172.7	82.5	0	0	0	107.3	S385 I389	S385-L387 VanDerWaalsContact C-N 3.32Å; S385-L387 PolarHBondContact O-N 3.36Å; L387-I389 VanDerWaalsContact C-N 3.34Å; L387-I389 HydrophobicContact CD2-CG1 4.17Å; L387-I389 HydrophobicContact CG-CG1 4.45Å; L387-I389 PolarHBondContact O-N 2.81Å
388	H	40.6	Very low	42.5	Very low	100 Å²	100	117.4 Å²	117.4	46%	0.463	66%	0.657	S	S	.	*			trans	-68.1	92.6	173.8	-65.2	-5.5	0	0	0	109	E386 G390 V391	E386-H388 VanDerWaalsContact C-N 3.27Å; E386-H388 PolarHBondContact O-N 3.38Å; E386-H388 PolarHBondContact O-ND1 3Å; E386-H388 IonicContact OE2-CE1 3.67Å; E386-H388 PolarHBondContact OE2-CE1 3.06Å; H388-G390 PolarHBondContact O-N 3.46Å; H388-V391 HydrophobicContact CB-CB 3.92Å; H388-V391 HydrophobicContact CB-CG2 4.2Å; H388-V391 PolarHBondContact O-N 3.04Å; H388-V391 VanDerWaalsContact O-N 3.17Å
389	I	43.5	Very low	45.2	Very low	113 Å²	113	114.7 Å²	114.7	58%	0.579	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	120.8	176.8	-60.3	174.8	0	0	0	108.2	L387	L387-I389 VanDerWaalsContact C-N 3.34Å; L387-I389 HydrophobicContact CD2-CG1 4.17Å; L387-I389 HydrophobicContact CG-CG1 4.45Å; L387-I389 PolarHBondContact O-N 2.81Å
390	G	47.6	Very low	48.1	Very low	81 Å²	81	107.1 Å²	107.1	84%	0.835	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	101	-15.3	-177.4	0	0	0	0	0	114.2	H388	H388-G390 PolarHBondContact O-N 3.46Å
391	V	49	Very low	51.1	Low	71 Å²	71	105.1 Å²	105.1	43%	0.43	60%	0.599	S	S	.	*			trans	-104.9	84.2	170.7	-174	0	0	0	0	108	H388 K393	H388-V391 HydrophobicContact CB-CB 3.92Å; H388-V391 HydrophobicContact CB-CG2 4.2Å; H388-V391 PolarHBondContact O-N 3.04Å; H388-V391 VanDerWaalsContact O-N 3.17Å; V391-K393 PolarHBondContact O-N 3.01Å
392	A	42.6	Very low	54.2	Low	91 Å²	91	95.2 Å²	95.2	75%	0.752	56%	0.564	S	S	*	*			trans	-73.7	113.8	163.9	0	0	0	0	0	107.1	S394	A392-S394 PolarHBondContact O-N 3.12Å
393	K	47.5	Very low	57.1	Low	214 Å²	214	89 Å²	89	93%	0.93	53%	0.526	S	S	*	.			trans	-62.3	88.1	163.8	-79.1	-176.6	178.1	176.4	0	107.2	V391	V391-K393 PolarHBondContact O-N 3.01Å
394	S	48.3	Very low	59.8	Low	55 Å²	55	85 Å²	85	39%	0.385	49%	0.493	S	S	.	.			trans	-93.4	144.4	168.5	-178.9	0	0	0	0	108.6	A392 D396	A392-S394 PolarHBondContact O-N 3.12Å; S394-D396 PolarHBondContact O-N 2.83Å; S394-D396 VanDerWaalsContact OG-CB 3.27Å; S394-D396 WeakPolarHBondContact OG-CB 3.43Å; S394-D396 PolarHBondContact OG-N 3.06Å; S394-D396 PolarHBondContact OG-OD2 3.32Å; S394-D396 VanDerWaalsContact OG-OD2 3.13Å
395	S	52.7	Low	62.5	Low	99 Å²	99	79.4 Å²	79.4	69%	0.692	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.1	164.1	48	0	0	0	0	112.9	G397	S395-G397 PolarHBondContact O-N 2.85Å; S395-G397 VanDerWaalsContact O-N 3.13Å
396	D	55.1	Low	65	Low	81 Å²	81	74.6 Å²	74.6	43%	0.433	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	12.1	-178.3	-69.6	-42	0	0	0	114.9	S394 R555	S394-D396 PolarHBondContact O-N 2.83Å; S394-D396 VanDerWaalsContact OG-CB 3.27Å; S394-D396 WeakPolarHBondContact OG-CB 3.43Å; S394-D396 PolarHBondContact OG-N 3.06Å; S394-D396 PolarHBondContact OG-OD2 3.32Å; S394-D396 VanDerWaalsContact OG-OD2 3.13Å; D396-R555 IonicContact OD1-NE 3.45Å; D396-R555 IonicContact OD1-NH2 2.7Å
397	G	66.6	Low	67.5	Low	21 Å²	21	73 Å²	73	22%	0.216	42%	0.419	C	S	.	.			trans	90	179.7	-178.3	0	0	0	0	0	113.2	S395 G554	S395-G397 PolarHBondContact O-N 2.85Å; S395-G397 VanDerWaalsContact O-N 3.13Å; G397-G554 WeakPolarHBondContact CA-O 3.5Å
398	K	79	Confident	69.9	Low	68 Å²	68	67.3 Å²	67.3	30%	0.296	39%	0.389	S	S	.	.			trans	-89	151.7	-175	-173.2	164.9	179.7	162.6	0	110.7	A486 K552 T553	K398-A486 PolarHBondContact NZ-O 3.11Å; K398-K552 CarbonylContact O-C 3.54Å; K398-K552 WeakPolarHBondContact O-CA 3.44Å; K398-T553 HydrophobicContact CB-CG2 4.26Å; K398-T553 PolarHBondContact N-OG1 3.19Å; K398-T553 WeakPolarHBondContact O-CG2 3.47Å; K398-T553 PolarHBondContact O-N 3.28Å; K398-T553 PolarHBondContact O-OG1 3.45Å; K398-T553 VanDerWaalsContact O-OG1 3.12Å
399	V	84.1	Confident	71.5	Confident	91 Å²	91	63 Å²	63	55%	0.552	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.9	167.9	-178.1	0	0	0	0	108.4	G551	V399-G551 CarbonylContact C-O 3.6Å; V399-G551 WeakPolarHBondContact CA-O 3.44Å
400	L	90.4	Very high	72.8	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.8	175.2	-60.4	179.3	0	0	0	109.9	P488 W494 F506 P538 L549 C550 G551 T553	L400-P488 HydrophobicContact CD2-CG 4.29Å; L400-W494 HydrophobicContact CD1-CH2 4.49Å; L400-F506 HydrophobicContact CD1-CE1 3.66Å; L400-F506 HydrophobicContact CD1-CZ 4.07Å; L400-F506 HydrophobicContact CD2-CE1 3.93Å; L400-F506 HydrophobicContact CG-CE1 4.42Å; L400-P538 HydrophobicContact CD1-CB 4.16Å; L400-L549 HydrophobicContact CD1-CB 4.01Å; L400-C550 WeakPolarHBondContact O-CA 3.47Å; L400-G551 PolarHBondContact N-O 3.22Å; L400-G551 PolarHBondContact O-N 2.82Å; L400-T553 HydrophobicContact CD1-CG2 3.89Å; L400-T553 HydrophobicContact CD2-CG2 3.92Å; L400-T553 HydrophobicContact CG-CG2 3.6Å
401	L	91.3	Very high	73.9	Confident	109 Å²	109	58.6 Å²	58.6	57%	0.571	33%	0.334	S	S	*	.			trans	-85.6	148.5	169.6	-59.9	-179.5	0	0	0	109.9	T403 L484	L401-T403 HydrophobicContact CB-CG2 4.31Å; L401-T403 PolarHBondContact O-N 3.17Å; L401-T403 PolarHBondContact O-OG1 2.83Å; L401-L484 HydrophobicContact CD1-CD2 4.21Å
402	Q	94.8	Very high	75	Confident	38 Å²	38	60.3 Å²	60.3	18%	0.178	34%	0.341	C	S	.	.			trans	-65.8	106	174.4	-71.8	-172.3	-3.3	0	0	109.8	P421 L422 Y522 I548 C550	Q402-P421 WeakPolarHBondContact O-CA 3.34Å; Q402-L422 HydrophobicContact CB-CB 4.27Å; Q402-L422 PolarHBondContact O-N 2.98Å; Q402-Y522 PolarHBondContact NE2-OH 3.24Å; Q402-Y522 VanDerWaalsContact OE1-CZ 3.29Å; Q402-Y522 PolarHBondContact OE1-OH 3.23Å; Q402-I548 HydrophobicContact CB-CG2 3.74Å; Q402-I548 HydrophobicContact CG-CG2 3.78Å; Q402-C550 HydrophobicContact CB-CB 4.49Å; Q402-C550 HydrophobicContact CG-CB 3.41Å; Q402-C550 VanDerWaalsContact CG-CB 3.41Å
403	T	94.2	Very high	76.5	Confident	4 Å²	4	57.8 Å²	57.8	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.4	-174.8	45.7	0	0	0	0	110.2	L401 C420 P421 L484 S503 D504	L401-T403 HydrophobicContact CB-CG2 4.31Å; L401-T403 PolarHBondContact O-N 3.17Å; L401-T403 PolarHBondContact O-OG1 2.83Å; T403-C420 CarbonylContact C-O 3.5Å; T403-C420 WeakPolarHBondContact CA-O 3.45Å; T403-P421 HydrophobicContact CG2-CB 4.2Å; T403-L484 HydrophobicContact CG2-CD1 3.72Å; T403-S503 PolarHBondContact O-OG 2.89Å; T403-D504 PolarHBondContact OG1-OD2 3.22Å
404	A	92.7	Very high	78	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.5	179.3	0	0	0	0	0	110.7	C420 L422 S503 F545	A404-C420 PolarHBondContact N-O 3.13Å; A404-C420 PolarHBondContact O-N 3.02Å; A404-L422 HydrophobicContact CB-CD1 4.08Å; A404-S503 CarbonylContact C-O 3.46Å; A404-S503 VanDerWaalsContact CA-O 3.3Å; A404-S503 WeakPolarHBondContact CA-O 3.45Å; A404-F545 HydrophobicContact CB-CB 3.96Å; A404-F545 HydrophobicContact CB-CD2 3.48Å; A404-F545 VanDerWaalsContact CB-CD2 3.48Å; A404-F545 HydrophobicContact CB-CE2 4.17Å; A404-F545 HydrophobicContact CB-CG 3.91Å
405	Q	91.9	Very high	79.5	Confident	34 Å²	34	52.5 Å²	52.5	16%	0.159	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.2	163.4	-71.9	-173	7.1	0	0	108.4	L417 V418 M419 S503 D504	Q405-L417 HydrophobicContact CB-CD1 4.36Å; Q405-V418 WeakPolarHBondContact CA-O 3.4Å; Q405-M419 HydrophobicContact CG-CE 4.32Å; Q405-M419 HydrophobicContact CG-SD 3.42Å; Q405-M419 WeakPolarHBondContact CG-SD 3.4Å; Q405-S503 PolarHBondContact N-O 3.22Å; Q405-D504 PolarHBondContact NE2-OD1 3.27Å
406	A	88.5	Confident	81	Confident	11 Å²	11	48.9 Å²	48.9	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	157	-179.8	0	0	0	0	0	110.6	L417 V418 F545	A406-L417 CarbonylContact O-C 3.17Å; A406-L417 WeakPolarHBondContact O-CA 3.42Å; A406-V418 HydrophobicContact CB-CG2 4.04Å; A406-V418 PolarHBondContact N-O 2.9Å; A406-V418 WeakPolarHBondContact O-CG2 3.26Å; A406-V418 PolarHBondContact O-N 3.37Å; A406-F545 HydrophobicContact CB-CD1 4Å; A406-F545 HydrophobicContact CB-CE1 3.47Å; A406-F545 VanDerWaalsContact CB-CE1 3.47Å; A406-F545 HydrophobicContact CB-CZ 3.8Å
407	K	84.3	Confident	82.6	Confident	113 Å²	113	50.2 Å²	50.2	49%	0.491	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	108	171.2	-166.3	171.1	-162.2	168.2	0	109.2	I409 K415 A416 Q465 G466	K407-I409 HydrophobicContact CG-CG1 4.44Å; K407-K415 HydrophobicContact CD-CB 4.48Å; K407-K415 HydrophobicContact CD-CD 4.27Å; K407-K415 VanDerWaalsContact CE-CD 3.44Å; K407-K415 HydrophobicContact CG-CB 4.3Å; K407-A416 CarbonylContact C-O 3.56Å; K407-A416 WeakPolarHBondContact CA-O 3.42Å; K407-Q465 VanDerWaalsContact O-O 3.14Å; K407-G466 WeakPolarHBondContact O-CA 3.3Å
408	L	83.2	Confident	83.8	Confident	13 Å²	13	49.2 Å²	49.2	7%	0.068	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.3	172.4	-155.8	65.3	0	0	0	109.6	K415 A416 V418 L435 L439 L441 A464 Q465 V515	L408-K415 CarbonylContact O-C 3.4Å; L408-K415 WeakPolarHBondContact O-CA 3.23Å; L408-A416 PolarHBondContact N-O 3.07Å; L408-A416 PolarHBondContact O-N 3.46Å; L408-V418 HydrophobicContact CB-CG1 3.73Å; L408-V418 HydrophobicContact CB-CG2 3.92Å; L408-V418 HydrophobicContact CD2-CG1 4.12Å; L408-L435 HydrophobicContact CD2-CD2 3.9Å; L408-L435 HydrophobicContact CD2-CG 4.24Å; L408-L439 HydrophobicContact CB-CD1 4.14Å; L408-L439 HydrophobicContact CD2-CD1 3.54Å; L408-L439 HydrophobicContact CG-CD1 3.91Å; L408-L441 HydrophobicContact CD2-CD1 4.37Å; L408-A464 HydrophobicContact CD1-CB 3.19Å; L408-A464 HydrophobicContact CD2-CB 4.15Å; L408-A464 HydrophobicContact CG-CB 3.71Å; L408-Q465 CarbonylContact C-O 3.37Å; L408-Q465 WeakPolarHBondContact CA-O 3.08Å; L408-V515 HydrophobicContact CD1-CG2 4.4Å; L408-V515 HydrophobicContact CD2-CG2 3.99Å
409	I	74.9	Confident	84.5	Confident	10 Å²	10	46 Å²	46	5%	0.051	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.2	-177.9	-52.3	170.9	0	0	0	108	K407 S414 K415 Q465	K407-I409 HydrophobicContact CG-CG1 4.44Å; I409-S414 CarbonylContact C-O 3.42Å; I409-S414 WeakPolarHBondContact CA-O 3.34Å; I409-K415 HydrophobicContact CB-CG 4.49Å; I409-K415 HydrophobicContact CD1-CD 4.48Å; I409-K415 HydrophobicContact CG1-CB 4.46Å; I409-K415 HydrophobicContact CG1-CD 4.24Å; I409-K415 HydrophobicContact CG1-CG 4.01Å; I409-K415 HydrophobicContact CG2-CG 4.23Å; I409-Q465 HydrophobicContact CB-CB 3.87Å; I409-Q465 WeakPolarHBondContact CB-O 3.5Å; I409-Q465 PolarHBondContact N-O 2.99Å; I409-Q465 WeakPolarHBondContact O-CB 3.41Å; I409-Q465 PolarHBondContact O-N 3.07Å; I409-Q465 VanDerWaalsContact O-N 3.12Å
410	G	71.1	Confident	84.9	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.021	23%	0.231	C	C	.	.			trans	-85.9	170.7	176.4	0	0	0	0	0	113.2	N412 G413 S414	G410-N412 VanDerWaalsContact C-N 3.26Å; G410-N412 PolarHBondContact O-N 2.78Å; G410-G413 PolarHBondContact O-N 3.31Å; G410-S414 PolarHBondContact N-O 3.13Å
411	P	68.9	Low	85.1	Confident	100 Å²	100	42.1 Å²	42.1	65%	0.649	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.9	-174.4	24.8	-33.2	0	0	0	113.3	G413 L441	P411-G413 PolarHBondContact O-N 3.24Å; P411-L441 VanDerWaalsContact CD-CD2 3.42Å
412	N	74	Confident	85.2	Confident	107 Å²	107	37.4 Å²	37.4	57%	0.572	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	10.2	174.9	64.3	-4.9	0	0	0	113.3	G410 S414	G410-N412 VanDerWaalsContact C-N 3.26Å; G410-N412 PolarHBondContact O-N 2.78Å; N412-S414 VanDerWaalsContact C-N 3.27Å; N412-S414 PolarHBondContact O-N 3.1Å; N412-S414 WeakPolarHBondContact OD1-CB 3.5Å; N412-S414 PolarHBondContact OD1-N 3.01Å; N412-S414 VanDerWaalsContact OD1-N 3.08Å; N412-S414 PolarHBondContact OD1-OG 2.8Å
413	G	72.9	Confident	85	Confident	38 Å²	38	38.7 Å²	38.7	39%	0.392	22%	0.217	S	C	.	.	S	Bend	trans	80	0.5	-177.2	0	0	0	0	0	115.1	G410 P411 K415	G410-G413 PolarHBondContact O-N 3.31Å; P411-G413 PolarHBondContact O-N 3.24Å; G413-K415 WeakPolarHBondContact O-CE 3.23Å; G413-K415 WeakPolarHBondContact O-CG 3.45Å
414	S	79.4	Confident	84.8	Confident	32 Å²	32	42.6 Å²	42.6	22%	0.224	24%	0.24	C	C	.	.			trans	-54.3	145.6	169.5	57.3	0	0	0	0	110.6	I409 G410 N412 L439	I409-S414 CarbonylContact C-O 3.42Å; I409-S414 WeakPolarHBondContact CA-O 3.34Å; G410-S414 PolarHBondContact N-O 3.13Å; N412-S414 VanDerWaalsContact C-N 3.27Å; N412-S414 PolarHBondContact O-N 3.1Å; N412-S414 WeakPolarHBondContact OD1-CB 3.5Å; N412-S414 PolarHBondContact OD1-N 3.01Å; N412-S414 VanDerWaalsContact OD1-N 3.08Å; N412-S414 PolarHBondContact OD1-OG 2.8Å; S414-L439 WeakPolarHBondContact OG-CD2 3.26Å
415	K	80.4	Confident	84.4	Confident	126 Å²	126	45.8 Å²	45.8	55%	0.548	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.4	-175.5	-45.2	-175.6	-174.8	157.2	0	111.1	K407 L408 I409 G413	K407-K415 HydrophobicContact CD-CB 4.48Å; K407-K415 HydrophobicContact CD-CD 4.27Å; K407-K415 VanDerWaalsContact CE-CD 3.44Å; K407-K415 HydrophobicContact CG-CB 4.3Å; L408-K415 CarbonylContact O-C 3.4Å; L408-K415 WeakPolarHBondContact O-CA 3.23Å; I409-K415 HydrophobicContact CB-CG 4.49Å; I409-K415 HydrophobicContact CD1-CD 4.48Å; I409-K415 HydrophobicContact CG1-CB 4.46Å; I409-K415 HydrophobicContact CG1-CD 4.24Å; I409-K415 HydrophobicContact CG1-CG 4.01Å; I409-K415 HydrophobicContact CG2-CG 4.23Å; G413-K415 WeakPolarHBondContact O-CE 3.23Å; G413-K415 WeakPolarHBondContact O-CG 3.45Å
416	A	84.2	Confident	84.1	Confident	22 Å²	22	45 Å²	45	18%	0.182	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.1	172.8	0	0	0	0	0	110.3	K407 L408 V418 L435 L439	K407-A416 CarbonylContact C-O 3.56Å; K407-A416 WeakPolarHBondContact CA-O 3.42Å; L408-A416 PolarHBondContact N-O 3.07Å; L408-A416 PolarHBondContact O-N 3.46Å; A416-V418 HydrophobicContact CB-CG1 4.12Å; A416-L435 HydrophobicContact CB-CD1 3.82Å; A416-L439 HydrophobicContact CB-CD1 4.12Å; A416-L439 HydrophobicContact CB-CD2 4.25Å
417	L	87.6	Confident	83.8	Confident	109 Å²	109	52.2 Å²	52.2	57%	0.571	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.5	166.9	-175.4	71.5	0	0	0	107.8	Q405 A406	Q405-L417 HydrophobicContact CB-CD1 4.36Å; A406-L417 CarbonylContact O-C 3.17Å; A406-L417 WeakPolarHBondContact O-CA 3.42Å
418	V	91.4	Very high	83.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.2	-170	-64.2	0	0	0	0	111.3	Q405 A406 L408 A416 C420 L435 D514 V515	Q405-V418 WeakPolarHBondContact CA-O 3.4Å; A406-V418 HydrophobicContact CB-CG2 4.04Å; A406-V418 PolarHBondContact N-O 2.9Å; A406-V418 WeakPolarHBondContact O-CG2 3.26Å; A406-V418 PolarHBondContact O-N 3.37Å; L408-V418 HydrophobicContact CB-CG1 3.73Å; L408-V418 HydrophobicContact CB-CG2 3.92Å; L408-V418 HydrophobicContact CD2-CG1 4.12Å; A416-V418 HydrophobicContact CB-CG1 4.12Å; V418-C420 VanDerWaalsContact CG2-SG 3.58Å; V418-L435 HydrophobicContact CG1-CD1 4.29Å; V418-L435 HydrophobicContact CG1-CD2 3.64Å; V418-D514 WeakPolarHBondContact CA-OD2 3.33Å; V418-D514 HydrophobicContact CB-CB 3.72Å; V418-D514 HydrophobicContact CG1-CB 4.01Å; V418-V515 HydrophobicContact CB-CG2 4.47Å; V418-V515 HydrophobicContact CG2-CG2 4.39Å
419	M	93.4	Very high	84.1	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	125.5	167.2	-73.5	-55.4	-51.6	0	0	111.2	Q405 L484 K511 E512 D514 V515	Q405-M419 HydrophobicContact CG-CE 4.32Å; Q405-M419 HydrophobicContact CG-SD 3.42Å; Q405-M419 WeakPolarHBondContact CG-SD 3.4Å; M419-L484 HydrophobicContact CE-CD1 4.46Å; M419-K511 HydrophobicContact CG-CB 4.23Å; M419-K511 HydrophobicContact CG-CD 3.33Å; M419-K511 HydrophobicContact CG-CG 3.62Å; M419-K511 HydrophobicContact SD-CD 3.73Å; M419-E512 WeakPolarHBondContact CB-O 3.42Å; M419-D514 PolarHBondContact N-OD2 2.99Å; M419-D514 PolarHBondContact O-N 3Å; M419-V515 PolarHBondContact O-N 2.79Å
420	C	92.9	Very high	84.8	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.027	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	98.6	-176.8	-58.7	0	0	0	0	111.7	T403 A404 V418 L422 V515 I517	T403-C420 CarbonylContact C-O 3.5Å; T403-C420 WeakPolarHBondContact CA-O 3.45Å; A404-C420 PolarHBondContact N-O 3.13Å; A404-C420 PolarHBondContact O-N 3.02Å; V418-C420 VanDerWaalsContact CG2-SG 3.58Å; C420-L422 WeakPolarHBondContact O-CD1 3.43Å; C420-V515 VanDerWaalsContact CA-O 3.24Å; C420-V515 WeakPolarHBondContact CA-O 3.47Å; C420-I517 HydrophobicContact CB-CD1 4.28Å
421	P	94.8	Very high	85.6	Confident	11 Å²	11	53.5 Å²	53.5	7%	0.071	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	135.9	157.2	26.7	-33.2	0	0	0	110.6	Q402 T403 V513 V515 L516 I517	Q402-P421 WeakPolarHBondContact O-CA 3.34Å; T403-P421 HydrophobicContact CG2-CB 4.2Å; P421-V513 HydrophobicContact CG-CB 4.38Å; P421-V513 HydrophobicContact CG-CG1 3.5Å; P421-V513 VanDerWaalsContact CG-CG1 3.5Å; P421-V513 HydrophobicContact CG-CG2 3.92Å; P421-V515 WeakPolarHBondContact CD-O 3.04Å; P421-L516 HydrophobicContact CG-CB 4.4Å; P421-L516 HydrophobicContact CG-CG 4.44Å; P421-I517 PolarHBondContact O-N 3.31Å
422	L	94.1	Very high	86.5	Confident	10 Å²	10	50 Å²	50	5%	0.052	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.8	171.4	-72.4	80.1	0	0	0	107.6	Q402 A404 C420 I517 Y522 F525 I526 I548	Q402-L422 HydrophobicContact CB-CB 4.27Å; Q402-L422 PolarHBondContact O-N 2.98Å; A404-L422 HydrophobicContact CB-CD1 4.08Å; C420-L422 WeakPolarHBondContact O-CD1 3.43Å; L422-I517 HydrophobicContact CG-CB 4.25Å; L422-I517 HydrophobicContact CG-CD1 4.31Å; L422-Y522 HydrophobicContact CB-CD2 3.85Å; L422-Y522 HydrophobicContact CB-CE2 3.76Å; L422-Y522 HydrophobicContact CD2-CD2 4.35Å; L422-Y522 HydrophobicContact CD2-CE2 4.36Å; L422-F525 HydrophobicContact CD2-CB 4.07Å; L422-I526 HydrophobicContact CD2-CD1 3.68Å; L422-I526 HydrophobicContact CD2-CG1 4.18Å; L422-I548 HydrophobicContact CD1-CD1 4.2Å; L422-I548 HydrophobicContact CD2-CD1 3.91Å
423	D	91.1	Very high	86.9	Confident	66 Å²	66	48.4 Å²	48.4	35%	0.353	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	99.3	-169.7	-176.4	10.7	0	0	0	111.5	G425 S426 L516 I517 G518	D423-G425 PolarHBondContact O-N 3.22Å; D423-G425 VanDerWaalsContact OD1-CA 3.26Å; D423-G425 WeakPolarHBondContact OD1-CA 3.33Å; D423-G425 PolarHBondContact OD1-N 2.85Å; D423-S426 PolarHBondContact O-N 3.04Å; D423-L516 HydrophobicContact CB-CD1 4.26Å; D423-L516 HydrophobicContact CB-CD2 4.3Å; D423-L516 HydrophobicContact CB-CG 4.3Å; D423-I517 PolarHBondContact N-O 3.15Å; D423-G518 WeakPolarHBondContact O-CA 3.38Å
424	V	89.3	Confident	87.6	Confident	86 Å²	86	50 Å²	50	52%	0.521	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.3	172.5	-64.6	0	0	0	0	113.1	Y522	V424-Y522 HydrophobicContact CG1-CD1 3.52Å; V424-Y522 HydrophobicContact CG1-CD2 3.47Å; V424-Y522 VanDerWaalsContact CG1-CD2 3.47Å; V424-Y522 HydrophobicContact CG1-CE1 3.64Å; V424-Y522 HydrophobicContact CG1-CE2 3.6Å; V424-Y522 HydrophobicContact CG1-CG 3.44Å; V424-Y522 VanDerWaalsContact CG1-CG 3.44Å
425	G	83.1	Confident	87.9	Confident	66 Å²	66	49.1 Å²	49.1	68%	0.68	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.8	172.3	0	0	0	0	0	113.5	D423	D423-G425 PolarHBondContact O-N 3.22Å; D423-G425 VanDerWaalsContact OD1-CA 3.26Å; D423-G425 WeakPolarHBondContact OD1-CA 3.33Å; D423-G425 PolarHBondContact OD1-N 2.85Å
426	S	86.7	Confident	88.2	Confident	19 Å²	19	43.1 Å²	43.1	13%	0.133	23%	0.232	C	C	.	.			trans	-99.1	121.9	173.5	-172.7	0	0	0	0	111	D423 R428 F430 L516 G518 A519	D423-S426 PolarHBondContact O-N 3.04Å; S426-R428 PolarHBondContact O-N 2.76Å; S426-R428 PolarHBondContact OG-O 2.82Å; S426-F430 WeakPolarHBondContact OG-CE2 3.07Å; S426-L516 VanDerWaalsContact CB-CD2 3.47Å; S426-G518 CarbonylContact O-C 3.53Å; S426-G518 VanDerWaalsContact O-CA 3.23Å; S426-G518 WeakPolarHBondContact O-CA 3.46Å; S426-A519 WeakPolarHBondContact O-CB 3.34Å; S426-A519 PolarHBondContact O-N 3.03Å
427	Q	81.6	Confident	88.2	Confident	162 Å²	162	45.5 Å²	45.5	76%	0.757	24%	0.242	S	C	*	.	S	Bend	trans	-69.9	-10.3	176.9	-65.7	-176.9	-32.9	0	0	114.2
428	R	85.7	Confident	88	Confident	141 Å²	141	46.1 Å²	46.1	53%	0.532	25%	0.245	S	C	.	.	S	Bend	trans	-139.1	151.5	-175.3	-70.9	-68	-171.1	-94.6	1.6	110.9	S426 F430 L475 D520	S426-R428 PolarHBondContact O-N 2.76Å; S426-R428 PolarHBondContact OG-O 2.82Å; R428-F430 HydrophobicContact CB-CE2 3.91Å; R428-F430 HydrophobicContact CB-CZ 4.13Å; R428-F430 VanDerWaalsContact O-CD2 3.26Å; R428-F430 WeakPolarHBondContact O-CD2 3.31Å; R428-F430 VanDerWaalsContact O-CE2 3.23Å; R428-F430 WeakPolarHBondContact O-CE2 3.38Å; R428-L475 HydrophobicContact CB-CD1 3.85Å; R428-L475 HydrophobicContact CG-CD1 3.92Å; R428-D520 WeakPolarHBondContact CA-OD2 3.18Å
429	S	88.4	Confident	87.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.			trans	-85.3	148.8	169.6	-64.6	0	0	0	0	111.6	A474 L475 L516 G518 D520 Y521	S429-A474 CarbonylContact O-C 3.37Å; S429-A474 WeakPolarHBondContact O-CA 3.5Å; S429-L475 PolarHBondContact O-N 2.88Å; S429-L516 CarbonylContact C-O 3.48Å; S429-L516 WeakPolarHBondContact CA-O 3.42Å; S429-L516 WeakPolarHBondContact CB-O 3.18Å; S429-G518 PolarHBondContact OG-N 3.26Å; S429-D520 PolarHBondContact N-OD1 3.42Å; S429-D520 VanDerWaalsContact N-OD1 3.1Å; S429-D520 PolarHBondContact N-OD2 2.91Å; S429-D520 PolarHBondContact OG-OD1 3.31Å; S429-Y521 WeakPolarHBondContact OG-CD2 3.38Å
430	F	89.6	Confident	86.9	Confident	21 Å²	21	50 Å²	50	9%	0.092	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155.6	-176.8	-64.1	-95	0	0	0	112.4	S426 R428 I450 L475 V477 I480 V515 L516	S426-F430 WeakPolarHBondContact OG-CE2 3.07Å; R428-F430 HydrophobicContact CB-CE2 3.91Å; R428-F430 HydrophobicContact CB-CZ 4.13Å; R428-F430 VanDerWaalsContact O-CD2 3.26Å; R428-F430 WeakPolarHBondContact O-CD2 3.31Å; R428-F430 VanDerWaalsContact O-CE2 3.23Å; R428-F430 WeakPolarHBondContact O-CE2 3.38Å; F430-I450 HydrophobicContact CD1-CD1 4.4Å; F430-I450 HydrophobicContact CE1-CD1 3.71Å; F430-I450 HydrophobicContact CE1-CG1 4.01Å; F430-I450 HydrophobicContact CZ-CD1 4.39Å; F430-I450 HydrophobicContact CZ-CG1 4.29Å; F430-L475 CarbonylContact C-O 3.46Å; F430-L475 WeakPolarHBondContact CA-O 3.28Å; F430-L475 WeakPolarHBondContact CB-O 3.46Å; F430-L475 HydrophobicContact CD1-CB 3.59Å; F430-L475 WeakPolarHBondContact CD1-O 3.47Å; F430-L475 HydrophobicContact CE1-CB 3.74Å; F430-L475 HydrophobicContact CE1-CD1 3.86Å; F430-L475 HydrophobicContact CE1-CG 4.45Å; F430-L475 HydrophobicContact CG-CB 4.36Å; F430-L475 HydrophobicContact CZ-CD1 4.09Å; F430-V477 HydrophobicContact CB-CG2 4.39Å; F430-V477 HydrophobicContact CD1-CG1 3.74Å; F430-V477 HydrophobicContact CD1-CG2 4.22Å; F430-V477 HydrophobicContact CE1-CG1 4.16Å; F430-I480 HydrophobicContact CB-CD1 4.08Å; F430-I480 HydrophobicContact CB-CG1 4.01Å; F430-V515 CarbonylContact O-C 3.52Å; F430-V515 VanDerWaalsContact O-CA 3.28Å; F430-V515 WeakPolarHBondContact O-CA 3.46Å; F430-V515 WeakPolarHBondContact O-CG1 3.35Å; F430-L516 HydrophobicContact CB-CB 4.33Å; F430-L516 HydrophobicContact CD2-CD2 4.1Å; F430-L516 PolarHBondContact N-O 3.42Å; F430-L516 PolarHBondContact O-N 3.31Å
431	V	88.2	Confident	86.2	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	143.4	174.6	61.8	0	0	0	0	110.7	L435 A436 V462 A474 L475 C476 V477 V515	V431-L435 HydrophobicContact CG2-CD2 4.18Å; V431-A436 HydrophobicContact CG1-CB 4.26Å; V431-A436 HydrophobicContact CG2-CB 4.38Å; V431-V462 HydrophobicContact CG1-CB 3.66Å; V431-V462 HydrophobicContact CG1-CG1 3.7Å; V431-V462 HydrophobicContact CG1-CG2 4.04Å; V431-A474 HydrophobicContact CB-CB 4.16Å; V431-A474 HydrophobicContact CG1-CB 4.11Å; V431-L475 PolarHBondContact N-O 3.3Å; V431-C476 HydrophobicContact CG1-CB 3.76Å; V431-C476 CarbonylContact O-C 3.51Å; V431-C476 VanDerWaalsContact O-CA 3.25Å; V431-C476 WeakPolarHBondContact O-CA 3.49Å; V431-V477 PolarHBondContact O-N 3.23Å; V431-V515 HydrophobicContact CB-CG2 4.44Å; V431-V515 HydrophobicContact CG2-CG2 4.02Å
432	R	87.3	Confident	85.2	Confident	28 Å²	28	57.8 Å²	57.8	11%	0.106	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	136.7	176.5	-153.3	175.8	56.2	-126.3	-19	110.8	D434 L435 A436 V477 P478 E512 D514	R432-D434 WeakPolarHBondContact CB-OD1 3.44Å; R432-D434 WeakPolarHBondContact CD-OD1 3.29Å; R432-D434 WeakPolarHBondContact CG-OD1 3.49Å; R432-D434 IonicContact CZ-OD1 3.97Å; R432-D434 IonicContact CZ-OD2 3.6Å; R432-D434 VanDerWaalsContact NE-CG 3.32Å; R432-D434 IonicContact NE-OD1 3.45Å; R432-D434 PolarHBondContact NE-OD1 2.84Å; R432-D434 IonicContact NE-OD2 2.62Å; R432-D434 PolarHBondContact NE-OD2 3.35Å; R432-D434 VanDerWaalsContact NE-OD2 3.11Å; R432-D434 IonicContact NH2-OD1 2.64Å; R432-D434 IonicContact NH2-OD2 3.11Å; R432-D434 PolarHBondContact O-N 2.95Å; R432-L435 HydrophobicContact CB-CB 4.4Å; R432-L435 PolarHBondContact O-N 3.08Å; R432-A436 PolarHBondContact O-N 3.1Å; R432-V477 CarbonylContact C-O 3.06Å; R432-V477 WeakPolarHBondContact CA-O 3.35Å; R432-P478 VanDerWaalsContact CG-O 3.31Å; R432-P478 WeakPolarHBondContact CG-O 3.43Å; R432-E512 IonicContact CZ-OE2 3.18Å; R432-E512 IonicContact NE-OE2 3.46Å; R432-E512 IonicContact NH1-OE2 2.83Å; R432-E512 PolarHBondContact NH1-OE2 2.97Å; R432-D514 IonicContact CZ-OD1 3.76Å; R432-D514 PolarHBondContact N-O 2.86Å; R432-D514 IonicContact NH1-OD1 3.4Å; R432-D514 PolarHBondContact NH1-OD1 3.31Å; R432-D514 IonicContact NH2-OD1 2.78Å; R432-D514 PolarHBondContact NH2-OD1 3.13Å
433	K	83.1	Confident	83.8	Confident	73 Å²	73	59.1 Å²	59.1	32%	0.317	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-40.8	-169.6	-178.8	174.9	-180	-177.9	0	113.5	A436 N437 C476 V477 P478	K433-A436 PolarHBondContact O-N 3.11Å; K433-N437 WeakPolarHBondContact O-CB 3.26Å; K433-N437 PolarHBondContact O-N 3.06Å; K433-N437 PolarHBondContact O-ND2 3.44Å; K433-C476 VanDerWaalsContact CA-SG 3.55Å; K433-V477 WeakPolarHBondContact CB-O 3.31Å; K433-V477 PolarHBondContact N-O 3.34Å; K433-P478 HydrophobicContact CD-CG 4.45Å
434	D	86.3	Confident	82.3	Confident	70 Å²	70	59.3 Å²	59.3	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-47.9	174.8	63.9	-30.5	0	0	0	111	R432 A436 N437 N438	R432-D434 WeakPolarHBondContact CB-OD1 3.44Å; R432-D434 WeakPolarHBondContact CD-OD1 3.29Å; R432-D434 WeakPolarHBondContact CG-OD1 3.49Å; R432-D434 IonicContact CZ-OD1 3.97Å; R432-D434 IonicContact CZ-OD2 3.6Å; R432-D434 VanDerWaalsContact NE-CG 3.32Å; R432-D434 IonicContact NE-OD1 3.45Å; R432-D434 PolarHBondContact NE-OD1 2.84Å; R432-D434 IonicContact NE-OD2 2.62Å; R432-D434 PolarHBondContact NE-OD2 3.35Å; R432-D434 VanDerWaalsContact NE-OD2 3.11Å; R432-D434 IonicContact NH2-OD1 2.64Å; R432-D434 IonicContact NH2-OD2 3.11Å; R432-D434 PolarHBondContact O-N 2.95Å; D434-A436 PolarHBondContact O-N 3.4Å; D434-N437 PolarHBondContact O-N 3.11Å; D434-N438 WeakPolarHBondContact O-CB 3.35Å; D434-N438 PolarHBondContact O-N 3.5Å; D434-N438 PolarHBondContact O-ND2 2.94Å; D434-N438 PolarHBondContact O-OD1 3.44Å
435	L	86.7	Confident	80.2	Confident	14 Å²	14	61 Å²	61	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-61.9	-44.9	177.4	176.7	65.8	0	0	0	111.5	L408 A416 V418 V431 R432 N437 N438 L439 D514 V515	L408-L435 HydrophobicContact CD2-CD2 3.9Å; L408-L435 HydrophobicContact CD2-CG 4.24Å; A416-L435 HydrophobicContact CB-CD1 3.82Å; V418-L435 HydrophobicContact CG1-CD1 4.29Å; V418-L435 HydrophobicContact CG1-CD2 3.64Å; V431-L435 HydrophobicContact CG2-CD2 4.18Å; R432-L435 HydrophobicContact CB-CB 4.4Å; R432-L435 PolarHBondContact O-N 3.08Å; L435-N437 VanDerWaalsContact C-N 3.33Å; L435-N437 PolarHBondContact O-N 3.35Å; L435-N438 PolarHBondContact O-N 3.03Å; L435-L439 HydrophobicContact CD1-CD1 3.89Å; L435-L439 HydrophobicContact CD1-CG 4.28Å; L435-L439 HydrophobicContact CG-CD1 4.25Å; L435-L439 PolarHBondContact O-N 3Å; L435-D514 HydrophobicContact CD2-CB 3.8Å; L435-V515 HydrophobicContact CD2-CG2 4.25Å
436	A	85.8	Confident	78.1	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-43.7	175	0	0	0	0	0	112.5	V431 R432 K433 D434 V440 L441 V462 C476	V431-A436 HydrophobicContact CG1-CB 4.26Å; V431-A436 HydrophobicContact CG2-CB 4.38Å; R432-A436 PolarHBondContact O-N 3.1Å; K433-A436 PolarHBondContact O-N 3.11Å; D434-A436 PolarHBondContact O-N 3.4Å; A436-V440 PolarHBondContact O-N 2.84Å; A436-L441 HydrophobicContact CB-CB 4.41Å; A436-L441 WeakPolarHBondContact O-CB 3.31Å; A436-L441 PolarHBondContact O-N 3.33Å; A436-V462 HydrophobicContact CB-CG1 4.36Å; A436-V462 HydrophobicContact CB-CG2 3.64Å; A436-C476 HydrophobicContact CB-CB 4.49Å
437	N	84.9	Confident	76	Confident	72 Å²	72	71.8 Å²	71.8	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-44	176.9	-67.1	-25	0	0	0	111.3	K433 D434 L435 L439 V440 R460	K433-N437 WeakPolarHBondContact O-CB 3.26Å; K433-N437 PolarHBondContact O-N 3.06Å; K433-N437 PolarHBondContact O-ND2 3.44Å; D434-N437 PolarHBondContact O-N 3.11Å; L435-N437 VanDerWaalsContact C-N 3.33Å; L435-N437 PolarHBondContact O-N 3.35Å; N437-L439 VanDerWaalsContact C-N 3.28Å; N437-L439 PolarHBondContact O-N 2.81Å; N437-V440 WeakPolarHBondContact O-CA 3.42Å; N437-V440 PolarHBondContact O-N 3.46Å; N437-R460 PolarHBondContact OD1-NH1 3.2Å
438	N	82.9	Confident	74	Confident	122 Å²	122	66 Å²	66	65%	0.652	33%	0.325	S	S	*	.	H	α-helix	trans	-62.6	-34.8	-179.1	-68.7	-13.2	0	0	0	112.4	D434 L435 V440	D434-N438 WeakPolarHBondContact O-CB 3.35Å; D434-N438 PolarHBondContact O-N 3.5Å; D434-N438 PolarHBondContact O-ND2 2.94Å; D434-N438 PolarHBondContact O-OD1 3.44Å; L435-N438 PolarHBondContact O-N 3.03Å; N438-V440 VanDerWaalsContact C-N 3.3Å
439	L	81.1	Confident	71.8	Confident	8 Å²	8	62.5 Å²	62.5	4%	0.042	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	6.5	175.4	-64.4	176.7	0	0	0	113.3	L408 S414 A416 L435 N437 L441	L408-L439 HydrophobicContact CB-CD1 4.14Å; L408-L439 HydrophobicContact CD2-CD1 3.54Å; L408-L439 HydrophobicContact CG-CD1 3.91Å; S414-L439 WeakPolarHBondContact OG-CD2 3.26Å; A416-L439 HydrophobicContact CB-CD1 4.12Å; A416-L439 HydrophobicContact CB-CD2 4.25Å; L435-L439 HydrophobicContact CD1-CD1 3.89Å; L435-L439 HydrophobicContact CD1-CG 4.28Å; L435-L439 HydrophobicContact CG-CD1 4.25Å; L435-L439 PolarHBondContact O-N 3Å; N437-L439 VanDerWaalsContact C-N 3.28Å; N437-L439 PolarHBondContact O-N 2.81Å; L439-L441 HydrophobicContact CB-CD1 3.94Å; L439-L441 HydrophobicContact CB-CD2 3.93Å; L439-L441 HydrophobicContact CB-CG 3.69Å; L439-L441 HydrophobicContact CD1-CD1 4.2Å; L439-L441 WeakPolarHBondContact O-CD2 3.27Å; L439-L441 PolarHBondContact O-N 2.88Å
440	V	80.7	Confident	69.7	Low	73 Å²	73	64 Å²	64	44%	0.442	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	39.5	179.5	-160.8	0	0	0	0	111.9	A436 N437 N438	A436-V440 PolarHBondContact O-N 2.84Å; N437-V440 WeakPolarHBondContact O-CA 3.42Å; N437-V440 PolarHBondContact O-N 3.46Å; N438-V440 VanDerWaalsContact C-N 3.3Å
441	L	79	Confident	67.5	Low	11 Å²	11	69.4 Å²	69.4	6%	0.058	36%	0.358	C	S	.	.			trans	-79	130.8	-179.7	-51.6	-179.3	0	0	0	109.7	L408 P411 A436 L439 V462 V463 A464	L408-L441 HydrophobicContact CD2-CD1 4.37Å; P411-L441 VanDerWaalsContact CD-CD2 3.42Å; A436-L441 HydrophobicContact CB-CB 4.41Å; A436-L441 WeakPolarHBondContact O-CB 3.31Å; A436-L441 PolarHBondContact O-N 3.33Å; L439-L441 HydrophobicContact CB-CD1 3.94Å; L439-L441 HydrophobicContact CB-CD2 3.93Å; L439-L441 HydrophobicContact CB-CG 3.69Å; L439-L441 HydrophobicContact CD1-CD1 4.2Å; L439-L441 WeakPolarHBondContact O-CD2 3.27Å; L439-L441 PolarHBondContact O-N 2.88Å; L441-V462 HydrophobicContact CB-CB 4Å; L441-V462 HydrophobicContact CB-CG1 3.28Å; L441-V462 HydrophobicContact CB-CG2 3.77Å; L441-V462 HydrophobicContact CD1-CG1 3.17Å; L441-V462 HydrophobicContact CG-CG1 3.75Å; L441-V463 WeakPolarHBondContact CD2-O 3.39Å; L441-A464 HydrophobicContact CD1-CB 4.19Å
442	K	74.4	Confident	65.7	Low	169 Å²	169	73.8 Å²	73.8	74%	0.735	39%	0.385	S	S	*	.			trans	-119.8	151.2	-176	-63.2	-175.3	-178.9	179.5	0	111	Q461	K442-Q461 CarbonylContact C-O 3.46Å
443	G	64.7	Low	63.7	Low	37 Å²	37	81.2 Å²	81.2	38%	0.381	42%	0.419	S	S	.	.			trans	-176.7	172.6	170.3	0	0	0	0	0	110.9	Q461	G443-Q461 WeakPolarHBondContact CA-O 3.48Å; G443-Q461 PolarHBondContact N-O 3.31Å; G443-Q461 VanDerWaalsContact N-O 3.11Å
444	P	58.2	Low	61.5	Low	70 Å²	70	80.2 Å²	80.2	46%	0.455	43%	0.429	S	S	.	.			trans	-61.5	154.1	-179.3	26	-34.8	0	0	0	112	Q461	P444-Q461 HydrophobicContact CG-CB 4.35Å; P444-Q461 PolarHBondContact O-N 2.87Å; P444-Q461 VanDerWaalsContact O-N 3.14Å
445	N	45.6	Very low	59.1	Low	122 Å²	122	82.5 Å²	82.5	65%	0.652	44%	0.441	S	S	*	.			trans	-82.9	120.2	167.5	-76.3	-25.2	0	0	0	108.3	R460	N445-R460 VanDerWaalsContact OD1-CG 3.28Å; N445-R460 WeakPolarHBondContact OD1-CG 3.44Å
446	E	39.7	Very low	56.8	Low	89 Å²	89	89.7 Å²	89.7	42%	0.416	47%	0.467	S	S	.	.			trans	-122.8	141.4	172.7	-67.3	-179.2	-170.1	0	0	109.3
447	Y	41.4	Very low	54.6	Low	223 Å²	223	97.2 Å²	97.2	88%	0.875	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.1	171.3	-69.9	-84.4	0	0	0	109.3
448	I	41.3	Very low	52.5	Low	41 Å²	41	94.2 Å²	94.2	21%	0.21	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.2	-175.5	17	155.8	0	0	0	109.9	G458 L475	I448-G458 WeakPolarHBondContact CG1-O 3.48Å; I448-L475 HydrophobicContact CD1-CB 3.8Å; I448-L475 HydrophobicContact CD1-CD1 3.59Å; I448-L475 HydrophobicContact CD1-CD2 3.75Å; I448-L475 HydrophobicContact CD1-CG 3.88Å; I448-L475 HydrophobicContact CG2-CD1 4.2Å
449	S	37.5	Very low	50.3	Low	66 Å²	66	90.6 Å²	90.6	46%	0.462	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	115.5	171.1	-175.3	0	0	0	0	108.9
450	I	45.6	Very low	48.4	Very low	31 Å²	31	94.7 Å²	94.7	16%	0.159	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	107.7	178.5	-57.2	172.1	0	0	0	107.5	F430 T452 R456 V477	F430-I450 HydrophobicContact CD1-CD1 4.4Å; F430-I450 HydrophobicContact CE1-CD1 3.71Å; F430-I450 HydrophobicContact CE1-CG1 4.01Å; F430-I450 HydrophobicContact CZ-CD1 4.39Å; F430-I450 HydrophobicContact CZ-CG1 4.29Å; I450-T452 HydrophobicContact CG2-CG2 3.91Å; I450-T452 PolarHBondContact O-N 3.17Å; I450-R456 WeakPolarHBondContact CB-O 3.38Å; I450-R456 PolarHBondContact N-O 3.04Å; I450-R456 PolarHBondContact O-N 3.17Å; I450-V477 HydrophobicContact CD1-CG1 3.69Å
451	L	43.1	Very low	46.3	Very low	135 Å²	135	93 Å²	93	71%	0.707	47%	0.474	S	S	*	.			trans	-93.8	63.8	-177.7	-64.2	172.4	0	0	0	111	F453	L451-F453 PolarHBondContact O-N 3.35Å
452	T	50.7	Low	44.8	Very low	94 Å²	94	92.7 Å²	92.7	58%	0.577	47%	0.473	S	S	*	.	S	Bend	trans	-96.1	84.2	170	52.8	0	0	0	0	108.6	I450 G454	I450-T452 HydrophobicContact CG2-CG2 3.91Å; I450-T452 PolarHBondContact O-N 3.17Å; T452-G454 PolarHBondContact O-N 3.26Å
453	F	45.9	Very low	43	Very low	185 Å²	185	87.2 Å²	87.2	81%	0.811	45%	0.453	S	S	*	.	S	Bend	trans	55.7	18.3	-178.6	-62.1	-71	0	0	0	117.9	L451	L451-F453 PolarHBondContact O-N 3.35Å
454	G	35.8	Very low	41.9	Very low	51 Å²	51	85.8 Å²	85.8	53%	0.526	44%	0.438	S	S	.	.	S	Bend	trans	140.9	105.7	172.9	0	0	0	0	0	112.9	T452	T452-G454 PolarHBondContact O-N 3.26Å
455	N	35.8	Very low	40.5	Very low	118 Å²	118	83.9 Å²	83.9	63%	0.631	42%	0.423	S	S	*	.			trans	25.8	99	163	-67.3	-6	0	0	0	118.6
456	R	39.4	Very low	39.9	Very low	166 Å²	166	78.7 Å²	78.7	63%	0.626	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.3	149.8	-68.7	-171.6	179.3	-166.8	0.2	110.4	I450	I450-R456 WeakPolarHBondContact CB-O 3.38Å; I450-R456 PolarHBondContact N-O 3.04Å; I450-R456 PolarHBondContact O-N 3.17Å
457	H	38	Very low	39.8	Very low	158 Å²	158	82.6 Å²	82.6	73%	0.731	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.9	175.5	-59.7	-74.2	0	0	0	109.5
458	G	41.5	Very low	40.2	Very low	9 Å²	9	75.9 Å²	75.9	9%	0.093	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	162.8	177.4	0	0	0	0	0	111.4	I448	I448-G458 WeakPolarHBondContact CG1-O 3.48Å
459	S	37.4	Very low	41.2	Very low	46 Å²	46	80.1 Å²	80.1	32%	0.322	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	143.8	-177.7	76.6	0	0	0	0	115.5	C476	S459-C476 CarbonylContact C-O 3.49Å; S459-C476 PolarHBondContact N-O 3.32Å; S459-C476 CarbonylContact O-C 3.58Å
460	R	40.5	Very low	42.7	Very low	94 Å²	94	80.9 Å²	80.9	36%	0.355	41%	0.405	S	S	.	.			trans	104.5	151.7	175.8	-70.7	173.8	169.6	-164.5	-4.1	113.9	N437 N445 L475 C476	N437-R460 PolarHBondContact OD1-NH1 3.2Å; N445-R460 VanDerWaalsContact OD1-CG 3.28Å; N445-R460 WeakPolarHBondContact OD1-CG 3.44Å; R460-L475 CarbonylContact O-C 3.56Å; R460-L475 WeakPolarHBondContact O-CA 3.27Å; R460-C476 HydrophobicContact CB-CB 3.56Å; R460-C476 WeakPolarHBondContact O-CA 3.31Å; R460-C476 PolarHBondContact O-N 2.85Å
461	Q	37.5	Very low	44	Very low	39 Å²	39	86.6 Å²	86.6	18%	0.182	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	148.3	167.3	-170.3	-179.1	43.5	0	0	109.7	K442 G443 P444 A474	K442-Q461 CarbonylContact C-O 3.46Å; G443-Q461 WeakPolarHBondContact CA-O 3.48Å; G443-Q461 PolarHBondContact N-O 3.31Å; G443-Q461 VanDerWaalsContact N-O 3.11Å; P444-Q461 HydrophobicContact CG-CB 4.35Å; P444-Q461 PolarHBondContact O-N 2.87Å; P444-Q461 VanDerWaalsContact O-N 3.14Å; Q461-A474 CarbonylContact C-O 3.45Å; Q461-A474 VanDerWaalsContact CA-O 3.29Å; Q461-A474 WeakPolarHBondContact CA-O 3.49Å
462	V	46	Very low	45.6	Very low	3 Å²	3	80.7 Å²	80.7	2%	0.018	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.9	-172.8	154.8	0	0	0	0	109.6	V431 A436 L441 A474 C476	V431-V462 HydrophobicContact CG1-CB 3.66Å; V431-V462 HydrophobicContact CG1-CG1 3.7Å; V431-V462 HydrophobicContact CG1-CG2 4.04Å; A436-V462 HydrophobicContact CB-CG1 4.36Å; A436-V462 HydrophobicContact CB-CG2 3.64Å; L441-V462 HydrophobicContact CB-CB 4Å; L441-V462 HydrophobicContact CB-CG1 3.28Å; L441-V462 HydrophobicContact CB-CG2 3.77Å; L441-V462 HydrophobicContact CD1-CG1 3.17Å; L441-V462 HydrophobicContact CG-CG1 3.75Å; V462-A474 PolarHBondContact N-O 3.2Å; V462-A474 PolarHBondContact O-N 3.02Å; V462-C476 HydrophobicContact CB-CB 4.5Å; V462-C476 HydrophobicContact CG2-CB 3.77Å
463	V	37.5	Very low	47.1	Very low	54 Å²	54	81.8 Å²	81.8	33%	0.327	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.5	178	-177.6	0	0	0	0	109.8	L441 W471 I472 K473	L441-V463 WeakPolarHBondContact CD2-O 3.39Å; V463-W471 HydrophobicContact CG1-CE3 3.38Å; V463-W471 HydrophobicContact CG1-CZ3 3.55Å; V463-I472 WeakPolarHBondContact CA-O 3.32Å; V463-K473 HydrophobicContact CG2-CG 4.37Å
464	A	41	Very low	48.9	Very low	7 Å²	7	73.2 Å²	73.2	6%	0.058	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	158	-177.8	0	0	0	0	0	114	L408 L441 I472	L408-A464 HydrophobicContact CD1-CB 3.19Å; L408-A464 HydrophobicContact CD2-CB 4.15Å; L408-A464 HydrophobicContact CG-CB 3.71Å; L441-A464 HydrophobicContact CD1-CB 4.19Å; A464-I472 PolarHBondContact N-O 3.08Å; A464-I472 PolarHBondContact O-N 2.83Å
465	Q	30.1	Very low	51.2	Low	31 Å²	31	71.3 Å²	71.3	15%	0.145	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.1	-171.4	-70.1	172.5	-9.6	0	0	112.6	K407 L408 I409 W471	K407-Q465 VanDerWaalsContact O-O 3.14Å; L408-Q465 CarbonylContact C-O 3.37Å; L408-Q465 WeakPolarHBondContact CA-O 3.08Å; I409-Q465 HydrophobicContact CB-CB 3.87Å; I409-Q465 WeakPolarHBondContact CB-O 3.5Å; I409-Q465 PolarHBondContact N-O 2.99Å; I409-Q465 WeakPolarHBondContact O-CB 3.41Å; I409-Q465 PolarHBondContact O-N 3.07Å; I409-Q465 VanDerWaalsContact O-N 3.12Å; Q465-W471 HydrophobicContact CG-CD2 4.01Å; Q465-W471 HydrophobicContact CG-CE3 3.77Å; Q465-W471 HydrophobicContact CG-CH2 3.81Å; Q465-W471 HydrophobicContact CG-CZ2 3.95Å; Q465-W471 HydrophobicContact CG-CZ3 3.67Å
466	G	32.1	Very low	53.4	Low	12 Å²	12	65.7 Å²	65.7	12%	0.124	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	139.6	169.4	0	0	0	0	0	114.2	K407 P468 R469	K407-G466 WeakPolarHBondContact O-CA 3.3Å; G466-P468 CarbonylContact O-C 3.48Å; G466-R469 WeakPolarHBondContact O-CA 3.16Å; G466-R469 PolarHBondContact O-N 2.95Å
467	K	37.2	Very low	55.5	Low	171 Å²	171	58 Å²	58	74%	0.743	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	141.2	-172.3	-77.8	-175.5	173.4	-172.6	0	114.1	R469	K467-R469 HydrophobicContact CG-CG 4.23Å
468	P	50.8	Low	57.6	Low	82 Å²	82	54.5 Å²	54.5	53%	0.532	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	cis	-60.2	132.7	-18	11.3	-7.4	0	0	0	109.9	G466 K470 I544	G466-P468 CarbonylContact O-C 3.48Å; P468-K470 PolarHBondContact O-N 3.45Å; P468-I544 HydrophobicContact CG-CB 4.03Å
469	R	62.3	Low	59.4	Low	131 Å²	131	58.7 Å²	58.7	49%	0.494	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	110	-156.9	-74.7	177.5	128.3	158	-3.6	113.8	G466 K467	G466-R469 WeakPolarHBondContact O-CA 3.16Å; G466-R469 PolarHBondContact O-N 2.95Å; K467-R469 HydrophobicContact CG-CG 4.23Å
470	K	69.5	Low	61.7	Low	81 Å²	81	58.1 Å²	58.1	35%	0.352	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.2	161.4	-63.8	-67.2	-175.6	157.8	0	110.1	P468 D524 F525 I544	P468-K470 PolarHBondContact O-N 3.45Å; K470-D524 HydrophobicContact CD-CB 4.29Å; K470-D524 WeakPolarHBondContact CE-O 2.91Å; K470-F525 HydrophobicContact CB-CE1 3.87Å; K470-F525 HydrophobicContact CB-CE2 4.43Å; K470-F525 HydrophobicContact CB-CZ 3.68Å; K470-F525 HydrophobicContact CG-CE1 4.17Å; K470-F525 HydrophobicContact CG-CZ 4.3Å; K470-I544 HydrophobicContact CG-CD1 4.03Å
471	W	72	Confident	63.6	Low	152 Å²	152	56.3 Å²	56.3	58%	0.576	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.4	173.5	-71.7	93.5	0	0	0	108.2	V463 Q465	V463-W471 HydrophobicContact CG1-CE3 3.38Å; V463-W471 HydrophobicContact CG1-CZ3 3.55Å; Q465-W471 HydrophobicContact CG-CD2 4.01Å; Q465-W471 HydrophobicContact CG-CE3 3.77Å; Q465-W471 HydrophobicContact CG-CH2 3.81Å; Q465-W471 HydrophobicContact CG-CZ2 3.95Å; Q465-W471 HydrophobicContact CG-CZ3 3.67Å
472	I	77.2	Confident	65.7	Low	11 Å²	11	56.4 Å²	56.4	6%	0.056	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.3	174.4	67.1	172.7	0	0	0	110.2	V463 A464 V515 Y521 F525	V463-I472 WeakPolarHBondContact CA-O 3.32Å; A464-I472 PolarHBondContact N-O 3.08Å; A464-I472 PolarHBondContact O-N 2.83Å; I472-V515 HydrophobicContact CD1-CG1 4.02Å; I472-Y521 HydrophobicContact CB-CD1 4.27Å; I472-Y521 HydrophobicContact CB-CD2 3.99Å; I472-Y521 HydrophobicContact CB-CE1 4.31Å; I472-Y521 HydrophobicContact CB-CE2 4.03Å; I472-Y521 HydrophobicContact CB-CG 4.11Å; I472-Y521 HydrophobicContact CG2-CD1 3.72Å; I472-Y521 HydrophobicContact CG2-CD2 4.06Å; I472-Y521 HydrophobicContact CG2-CE1 4.16Å; I472-Y521 HydrophobicContact CG2-CE2 4.47Å; I472-Y521 HydrophobicContact CG2-CG 3.67Å; I472-F525 HydrophobicContact CG2-CE2 3.75Å; I472-F525 HydrophobicContact CG2-CZ 3.71Å
473	K	81.3	Confident	67.6	Low	117 Å²	117	59.9 Å²	59.9	51%	0.509	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	112.4	165.6	-66.7	-177.3	-179.3	178.9	0	107.8	V463 Y521	V463-K473 HydrophobicContact CG2-CG 4.37Å; K473-Y521 PolarHBondContact N-OH 3.31Å; K473-Y521 VanDerWaalsContact N-OH 3.12Å
474	A	84.3	Confident	69.9	Low	4 Å²	4	58.2 Å²	58.2	3%	0.033	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.7	-177.8	0	0	0	0	0	111.3	S429 V431 Q461 V462 C476	S429-A474 CarbonylContact O-C 3.37Å; S429-A474 WeakPolarHBondContact O-CA 3.5Å; V431-A474 HydrophobicContact CB-CB 4.16Å; V431-A474 HydrophobicContact CG1-CB 4.11Å; Q461-A474 CarbonylContact C-O 3.45Å; Q461-A474 VanDerWaalsContact CA-O 3.29Å; Q461-A474 WeakPolarHBondContact CA-O 3.49Å; V462-A474 PolarHBondContact N-O 3.2Å; V462-A474 PolarHBondContact O-N 3.02Å; A474-C476 PolarHBondContact O-N 2.84Å
475	L	83.9	Confident	72	Confident	12 Å²	12	60.9 Å²	60.9	6%	0.063	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	115.2	171.6	-65	169.4	0	0	0	109.3	R428 S429 F430 V431 I448 R460	R428-L475 HydrophobicContact CB-CD1 3.85Å; R428-L475 HydrophobicContact CG-CD1 3.92Å; S429-L475 PolarHBondContact O-N 2.88Å; F430-L475 CarbonylContact C-O 3.46Å; F430-L475 WeakPolarHBondContact CA-O 3.28Å; F430-L475 WeakPolarHBondContact CB-O 3.46Å; F430-L475 HydrophobicContact CD1-CB 3.59Å; F430-L475 WeakPolarHBondContact CD1-O 3.47Å; F430-L475 HydrophobicContact CE1-CB 3.74Å; F430-L475 HydrophobicContact CE1-CD1 3.86Å; F430-L475 HydrophobicContact CE1-CG 4.45Å; F430-L475 HydrophobicContact CG-CB 4.36Å; F430-L475 HydrophobicContact CZ-CD1 4.09Å; V431-L475 PolarHBondContact N-O 3.3Å; I448-L475 HydrophobicContact CD1-CB 3.8Å; I448-L475 HydrophobicContact CD1-CD1 3.59Å; I448-L475 HydrophobicContact CD1-CD2 3.75Å; I448-L475 HydrophobicContact CD1-CG 3.88Å; I448-L475 HydrophobicContact CG2-CD1 4.2Å; R460-L475 CarbonylContact O-C 3.56Å; R460-L475 WeakPolarHBondContact O-CA 3.27Å
476	C	82.9	Confident	74.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.2	173.8	159.6	0	0	0	0	110.5	V431 K433 A436 S459 R460 V462 A474	V431-C476 HydrophobicContact CG1-CB 3.76Å; V431-C476 CarbonylContact O-C 3.51Å; V431-C476 VanDerWaalsContact O-CA 3.25Å; V431-C476 WeakPolarHBondContact O-CA 3.49Å; K433-C476 VanDerWaalsContact CA-SG 3.55Å; A436-C476 HydrophobicContact CB-CB 4.49Å; S459-C476 CarbonylContact C-O 3.49Å; S459-C476 PolarHBondContact N-O 3.32Å; S459-C476 CarbonylContact O-C 3.58Å; R460-C476 HydrophobicContact CB-CB 3.56Å; R460-C476 WeakPolarHBondContact O-CA 3.31Å; R460-C476 PolarHBondContact O-N 2.85Å; V462-C476 HydrophobicContact CB-CB 4.5Å; V462-C476 HydrophobicContact CG2-CB 3.77Å; A474-C476 PolarHBondContact O-N 2.84Å
477	V	82.5	Confident	77.4	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	148.2	179.9	-64.5	0	0	0	0	109.5	F430 V431 R432 K433 I450 Q479 I480	F430-V477 HydrophobicContact CB-CG2 4.39Å; F430-V477 HydrophobicContact CD1-CG1 3.74Å; F430-V477 HydrophobicContact CD1-CG2 4.22Å; F430-V477 HydrophobicContact CE1-CG1 4.16Å; V431-V477 PolarHBondContact O-N 3.23Å; R432-V477 CarbonylContact C-O 3.06Å; R432-V477 WeakPolarHBondContact CA-O 3.35Å; K433-V477 WeakPolarHBondContact CB-O 3.31Å; K433-V477 PolarHBondContact N-O 3.34Å; I450-V477 HydrophobicContact CD1-CG1 3.69Å; V477-Q479 WeakPolarHBondContact CG2-O 3.5Å; V477-Q479 PolarHBondContact O-N 3.26Å; V477-I480 HydrophobicContact CG2-CB 4.44Å; V477-I480 HydrophobicContact CG2-CG1 3.63Å
478	P	81.4	Confident	79.9	Confident	85 Å²	85	54.9 Å²	54.9	55%	0.552	29%	0.294	S	S	*	.	S	Bend	trans	-54.8	-39.3	179.9	-26.1	34.9	0	0	0	113.2	R432 K433	R432-P478 VanDerWaalsContact CG-O 3.31Å; R432-P478 WeakPolarHBondContact CG-O 3.43Å; K433-P478 HydrophobicContact CD-CG 4.45Å
479	Q	81.2	Confident	81.7	Confident	97 Å²	97	55.4 Å²	55.4	45%	0.453	30%	0.298	S	S	.	.			trans	-148.9	137.4	177.4	-175.1	-178.3	16.8	0	0	108.2	V477 C481	V477-Q479 WeakPolarHBondContact CG2-O 3.5Å; V477-Q479 PolarHBondContact O-N 3.26Å; Q479-C481 WeakPolarHBondContact CG-O 3.44Å; Q479-C481 PolarHBondContact NE2-O 2.9Å; Q479-C481 VanDerWaalsContact NE2-O 3.11Å
480	I	84.7	Confident	83	Confident	34 Å²	34	50.8 Å²	50.8	17%	0.174	28%	0.281	C	S	.	.	S	Bend	trans	-83.3	-58.3	178.3	-62.7	169.7	0	0	0	109.5	F430 V477 V513 L516	F430-I480 HydrophobicContact CB-CD1 4.08Å; F430-I480 HydrophobicContact CB-CG1 4.01Å; V477-I480 HydrophobicContact CG2-CB 4.44Å; V477-I480 HydrophobicContact CG2-CG1 3.63Å; I480-V513 HydrophobicContact CB-CG1 4.13Å; I480-V513 HydrophobicContact CD1-CG1 3.88Å; I480-V513 HydrophobicContact CG2-CG1 4.04Å; I480-L516 HydrophobicContact CD1-CB 4.32Å; I480-L516 HydrophobicContact CG2-CB 3.84Å; I480-L516 HydrophobicContact CG2-CD1 3.88Å
481	C	81.4	Confident	83.9	Confident	57 Å²	57	48.6 Å²	48.6	39%	0.385	28%	0.276	S	S	.	.	S	Bend	trans	-152.5	-178.8	175.8	57.6	0	0	0	0	110.6	Q479 V513	Q479-C481 WeakPolarHBondContact CG-O 3.44Å; Q479-C481 PolarHBondContact NE2-O 2.9Å; Q479-C481 VanDerWaalsContact NE2-O 3.11Å; C481-V513 WeakPolarHBondContact SG-CG2 3.3Å
482	G	80.5	Confident	84.5	Confident	41 Å²	41	49.7 Å²	49.7	42%	0.423	29%	0.285	S	S	.	.	S	Bend	trans	-63.4	166.5	168.9	0	0	0	0	0	111.8
483	P	85.6	Confident	84.9	Confident	75 Å²	75	55.6 Å²	55.6	49%	0.487	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-63.9	147.2	-178.6	29.2	-35.4	0	0	0	111.7	I510 E512	P483-I510 HydrophobicContact CB-CG2 3.61Å; P483-I510 HydrophobicContact CG-CG2 4Å; P483-E512 HydrophobicContact CB-CG 4.49Å
484	L	86.4	Confident	85.3	Confident	19 Å²	19	50.4 Å²	50.4	10%	0.099	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-74	134.5	175.1	-62.3	170.7	0	0	0	110	L401 T403 M419 I510 K511 V513	L401-L484 HydrophobicContact CD1-CD2 4.21Å; T403-L484 HydrophobicContact CG2-CD1 3.72Å; M419-L484 HydrophobicContact CE-CD1 4.46Å; L484-I510 VanDerWaalsContact O-CA 3.3Å; L484-I510 WeakPolarHBondContact O-CA 3.45Å; L484-K511 PolarHBondContact N-O 3.21Å; L484-K511 PolarHBondContact O-N 3.32Å; L484-K511 VanDerWaalsContact O-N 3.13Å; L484-V513 HydrophobicContact CD1-CG2 3.79Å; L484-V513 HydrophobicContact CD2-CG2 3.92Å; L484-V513 HydrophobicContact CG-CG2 3.56Å
485	D	84	Confident	85.4	Confident	63 Å²	63	58.7 Å²	58.7	34%	0.337	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-60.4	152.6	175.5	-67.8	-33.5	0	0	0	112.6	R508	D485-R508 PolarHBondContact O-NH2 3.33Å
486	A	87.3	Confident	85.7	Confident	41 Å²	41	59.8 Å²	59.8	34%	0.339	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-56.3	135.4	179.6	0	0	0	0	0	114.5	K398 R508 I510	K398-A486 PolarHBondContact NZ-O 3.11Å; A486-R508 CarbonylContact C-O 3.56Å; A486-R508 VanDerWaalsContact C-O 3.32Å; A486-R508 WeakPolarHBondContact CA-O 3.42Å; A486-R508 WeakPolarHBondContact CB-O 3.3Å; A486-I510 HydrophobicContact CB-CG1 4.43Å
487	N	89.7	Confident	86.1	Confident	11 Å²	11	60.1 Å²	60.1	6%	0.059	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-74.7	138.4	170.4	-68.9	-15.7	0	0	0	109.9	D504 Q505 F506 P507 R508	N487-D504 PolarHBondContact ND2-OD2 2.9Å; N487-Q505 WeakPolarHBondContact CB-O 3.5Å; N487-Q505 PolarHBondContact ND2-O 3.04Å; N487-F506 HydrophobicContact CB-CD1 3.75Å; N487-F506 HydrophobicContact CB-CE1 3.7Å; N487-F506 HydrophobicContact CB-CG 4.31Å; N487-F506 HydrophobicContact CB-CZ 4.24Å; N487-P507 WeakPolarHBondContact O-CA 3.43Å; N487-R508 HydrophobicContact CB-CB 3.86Å; N487-R508 PolarHBondContact N-O 2.66Å; N487-R508 PolarHBondContact O-N 3.05Å; N487-R508 PolarHBondContact OD1-NH2 2.88Å
488	P	88.7	Confident	86.4	Confident	36 Å²	36	61 Å²	61	23%	0.234	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-68.1	165.1	174.9	31.8	-35.5	0	0	0	111.2	L400 W494 F506 T553	L400-P488 HydrophobicContact CD2-CG 4.29Å; P488-W494 HydrophobicContact CG-CH2 4.28Å; P488-F506 WeakPolarHBondContact O-CD1 3.44Å; P488-T553 HydrophobicContact CG-CG2 4.3Å
489	P	89.3	Confident	86.5	Confident	94 Å²	94	63.2 Å²	63.2	61%	0.61	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-57.6	145.8	167.6	-21.5	33.1	0	0	0	111.3	S491 P507	P489-S491 PolarHBondContact O-N 3.04Å; P489-S491 VanDerWaalsContact O-N 3.15Å; P489-P507 HydrophobicContact CG-CB 4.37Å
490	F	89.5	Confident	86.7	Confident	34 Å²	34	66.9 Å²	66.9	15%	0.149	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-61.5	118.8	176.2	-169.1	-74.4	0	0	0	110.7	W494 L497 K499 L502 F506 L549	F490-W494 HydrophobicContact CB-CZ3 4.46Å; F490-W494 HydrophobicContact CD1-CE3 4.09Å; F490-W494 AromaticContact CD2-CE3 3.88Å; F490-W494 HydrophobicContact CD2-CE3 3.88Å; F490-W494 HydrophobicContact CD2-CZ3 4.02Å; F490-W494 HydrophobicContact CE1-CB 4.14Å; F490-W494 HydrophobicContact CE1-CE3 4.11Å; F490-W494 AromaticContact CE2-CE3 3.94Å; F490-W494 HydrophobicContact CE2-CE3 3.94Å; F490-W494 HydrophobicContact CE2-CZ3 4.46Å; F490-W494 AromaticContact CG-CE3 3.98Å; F490-W494 HydrophobicContact CG-CE3 3.98Å; F490-W494 HydrophobicContact CG-CZ3 4.15Å; F490-W494 HydrophobicContact CZ-CB 4.23Å; F490-W494 HydrophobicContact CZ-CE3 4.06Å; F490-L497 HydrophobicContact CE2-CB 4.35Å; F490-L497 HydrophobicContact CZ-CB 3.88Å; F490-L497 WeakPolarHBondContact CZ-O 3.39Å; F490-K499 HydrophobicContact CD1-CD 4.06Å; F490-K499 HydrophobicContact CD1-CG 3.62Å; F490-K499 HydrophobicContact CE1-CD 4.15Å; F490-K499 HydrophobicContact CE1-CG 3.4Å; F490-K499 HydrophobicContact CE2-CG 4.37Å; F490-K499 HydrophobicContact CG-CG 4.22Å; F490-K499 HydrophobicContact CZ-CG 3.79Å; F490-L502 HydrophobicContact CD2-CD1 3.67Å; F490-L502 HydrophobicContact CE2-CD1 3.98Å; F490-L502 HydrophobicContact CE2-CD2 4.27Å; F490-F506 HydrophobicContact CB-CB 4.07Å; F490-L549 HydrophobicContact CD2-CD1 4.05Å; F490-L549 HydrophobicContact CE2-CD1 3.87Å
491	S	88	Confident	86.9	Confident	35 Å²	35	70.9 Å²	70.9	25%	0.245	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-74.2	138.8	-176.8	-176.9	0	0	0	0	112.2	P489 M493 W494	P489-S491 PolarHBondContact O-N 3.04Å; P489-S491 VanDerWaalsContact O-N 3.15Å; S491-M493 PolarHBondContact O-N 3.42Å; S491-M493 WeakPolarHBondContact OG-CB 3.46Å; S491-M493 PolarHBondContact OG-N 3.41Å; S491-M493 VanDerWaalsContact OG-N 3.15Å; S491-W494 VanDerWaalsContact CB-CE2 3.45Å; S491-W494 PolarHBondContact O-N 3.29Å
492	K	85	Confident	87.5	Confident	175 Å²	175	69.9 Å²	69.9	76%	0.761	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-16	170.5	-65.1	-176	-178.1	179.7	0	112.7
493	M	85	Confident	88	Confident	134 Å²	134	68.1 Å²	68.1	66%	0.66	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-24.2	178.9	-63.8	178.2	62.9	0	0	113	S491 K495	S491-M493 PolarHBondContact O-N 3.42Å; S491-M493 WeakPolarHBondContact OG-CB 3.46Å; S491-M493 PolarHBondContact OG-N 3.41Å; S491-M493 VanDerWaalsContact OG-N 3.15Å; M493-K495 PolarHBondContact O-N 3.17Å
494	W	89.2	Confident	88.4	Confident	9 Å²	9	65 Å²	65	3%	0.034	32%	0.323	C	S	.	.			trans	-77.3	54.1	-177.6	-55.1	-19.4	0	0	0	112.3	L400 P488 F490 S491 H496 L497 F506 P538 L549 T553	L400-W494 HydrophobicContact CD1-CH2 4.49Å; P488-W494 HydrophobicContact CG-CH2 4.28Å; F490-W494 HydrophobicContact CB-CZ3 4.46Å; F490-W494 HydrophobicContact CD1-CE3 4.09Å; F490-W494 AromaticContact CD2-CE3 3.88Å; F490-W494 HydrophobicContact CD2-CE3 3.88Å; F490-W494 HydrophobicContact CD2-CZ3 4.02Å; F490-W494 HydrophobicContact CE1-CB 4.14Å; F490-W494 HydrophobicContact CE1-CE3 4.11Å; F490-W494 AromaticContact CE2-CE3 3.94Å; F490-W494 HydrophobicContact CE2-CE3 3.94Å; F490-W494 HydrophobicContact CE2-CZ3 4.46Å; F490-W494 AromaticContact CG-CE3 3.98Å; F490-W494 HydrophobicContact CG-CE3 3.98Å; F490-W494 HydrophobicContact CG-CZ3 4.15Å; F490-W494 HydrophobicContact CZ-CB 4.23Å; F490-W494 HydrophobicContact CZ-CE3 4.06Å; S491-W494 VanDerWaalsContact CB-CE2 3.45Å; S491-W494 PolarHBondContact O-N 3.29Å; W494-H496 PolarHBondContact O-N 2.89Å; W494-H496 VanDerWaalsContact O-N 3.16Å; W494-L497 HydrophobicContact CB-CB 4.37Å; W494-L497 HydrophobicContact CB-CD1 4.08Å; W494-L497 HydrophobicContact CG-CD1 4.49Å; W494-L497 PolarHBondContact O-N 3.23Å; W494-F506 HydrophobicContact CZ3-CD1 4.39Å; W494-P538 VanDerWaalsContact CD1-CD 3.48Å; W494-P538 HydrophobicContact CD2-CG 3.53Å; W494-P538 VanDerWaalsContact CE2-CG 3.45Å; W494-P538 HydrophobicContact CE3-CG 4.06Å; W494-P538 HydrophobicContact CG-CG 3.82Å; W494-P538 HydrophobicContact CH2-CG 4.42Å; W494-P538 HydrophobicContact CZ2-CG 3.95Å; W494-P538 HydrophobicContact CZ3-CG 4.46Å; W494-P538 VanDerWaalsContact NE1-CD 3.33Å; W494-L549 HydrophobicContact CE3-CD1 4.37Å; W494-L549 HydrophobicContact CZ3-CD1 4.14Å; W494-T553 HydrophobicContact CH2-CG2 4.44Å; W494-T553 HydrophobicContact CZ2-CG2 4.02Å; W494-T553 PolarHBondContact NE1-O 2.86Å
495	K	86.6	Confident	88.7	Confident	178 Å²	178	69 Å²	69	77%	0.774	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-23.2	-170.9	-64.3	-174.6	-179	-178	0	113.8	M493 L497	M493-K495 PolarHBondContact O-N 3.17Å; K495-L497 VanDerWaalsContact C-N 3.26Å
496	H	90.9	Very high	89	Confident	35 Å²	35	67.2 Å²	67.2	16%	0.162	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-12	175.5	61.1	-60.7	0	0	0	113.2	W494 K533 E537 P538	W494-H496 PolarHBondContact O-N 2.89Å; W494-H496 VanDerWaalsContact O-N 3.16Å; H496-K533 HydrophobicContact CB-CB 4.13Å; H496-K533 HydrophobicContact CB-CD 4.39Å; H496-E537 IonicContact CE1-OE2 3.51Å; H496-E537 PolarHBondContact CE1-OE2 3.41Å; H496-E537 IonicContact ND1-OE2 3.02Å; H496-E537 PolarHBondContact ND1-OE2 2.87Å; H496-P538 PolarHBondContact NE2-O 3.46Å
497	L	91.9	Very high	89.2	Confident	7 Å²	7	69.4 Å²	69.4	4%	0.037	34%	0.341	C	S	.	.	S	Bend	trans	-106.4	126	-178.6	-60.4	173.6	0	0	0	110.2	F490 W494 K495 R531 P538 L547 L549	F490-L497 HydrophobicContact CE2-CB 4.35Å; F490-L497 HydrophobicContact CZ-CB 3.88Å; F490-L497 WeakPolarHBondContact CZ-O 3.39Å; W494-L497 HydrophobicContact CB-CB 4.37Å; W494-L497 HydrophobicContact CB-CD1 4.08Å; W494-L497 HydrophobicContact CG-CD1 4.49Å; W494-L497 PolarHBondContact O-N 3.23Å; K495-L497 VanDerWaalsContact C-N 3.26Å; L497-R531 HydrophobicContact CD2-CB 4Å; L497-P538 HydrophobicContact CD1-CB 4.23Å; L497-P538 HydrophobicContact CD1-CG 3.79Å; L497-L547 HydrophobicContact CD2-CD2 4.07Å; L497-L549 HydrophobicContact CB-CD2 4.49Å; L497-L549 HydrophobicContact CD1-CD2 3.67Å; L497-L549 HydrophobicContact CD2-CD2 4.08Å; L497-L549 HydrophobicContact CG-CD2 4.29Å
498	P	87.9	Confident	89.3	Confident	22 Å²	22	69.5 Å²	69.5	14%	0.143	34%	0.341	C	S	.	.			trans	-65.9	144.6	172.2	28.4	-33.6	0	0	0	110.1	Y500 L502 L547	P498-Y500 VanDerWaalsContact C-N 3.28Å; P498-Y500 HydrophobicContact CB-CD1 3.93Å; P498-Y500 HydrophobicContact CB-CD2 4.48Å; P498-Y500 HydrophobicContact CB-CE1 3.56Å; P498-Y500 HydrophobicContact CB-CE2 4.18Å; P498-Y500 HydrophobicContact CB-CG 4.37Å; P498-L502 WeakPolarHBondContact O-CD2 3.46Å; P498-L547 VanDerWaalsContact CD-CD2 3.49Å; P498-L547 HydrophobicContact CG-CD2 3.68Å
499	K	84.4	Confident	89.3	Confident	131 Å²	131	70.1 Å²	70.1	57%	0.57	35%	0.353	S	S	*	.	S	Bend	trans	-81.7	-6.9	176.6	-69.9	-174.8	-179.9	-176.2	0	113.9	F490	F490-K499 HydrophobicContact CD1-CD 4.06Å; F490-K499 HydrophobicContact CD1-CG 3.62Å; F490-K499 HydrophobicContact CE1-CD 4.15Å; F490-K499 HydrophobicContact CE1-CG 3.4Å; F490-K499 HydrophobicContact CE2-CG 4.37Å; F490-K499 HydrophobicContact CG-CG 4.22Å; F490-K499 HydrophobicContact CZ-CG 3.79Å
500	Y	85.5	Confident	89.3	Confident	174 Å²	174	71.3 Å²	71.3	68%	0.682	35%	0.353	S	S	*	.	S	Bend	trans	-109.3	159.4	-177.4	57.4	-92.3	0	0	0	110.6	P498 L502	P498-Y500 VanDerWaalsContact C-N 3.28Å; P498-Y500 HydrophobicContact CB-CD1 3.93Å; P498-Y500 HydrophobicContact CB-CD2 4.48Å; P498-Y500 HydrophobicContact CB-CE1 3.56Å; P498-Y500 HydrophobicContact CB-CE2 4.18Å; P498-Y500 HydrophobicContact CB-CG 4.37Å; Y500-L502 VanDerWaalsContact C-N 3.26Å; Y500-L502 PolarHBondContact O-N 2.72Å
501	N	88.1	Confident	89.3	Confident	118 Å²	118	72.7 Å²	72.7	63%	0.631	36%	0.36	S	S	*	.	S	Bend	trans	54.2	39.3	179.6	-165.8	38.4	0	0	0	113.5	G546 L547	N501-G546 CarbonylContact O-C 2.98Å; N501-G546 VanDerWaalsContact O-CA 3.28Å; N501-G546 WeakPolarHBondContact O-CA 3.38Å; N501-L547 PolarHBondContact O-N 3.21Å
502	L	93.4	Very high	89.4	Confident	36 Å²	36	76.1 Å²	76.1	19%	0.188	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-74.9	141.4	171.8	-60.6	179.4	0	0	0	109.6	F490 P498 Y500 D504 F506 L547 L549	F490-L502 HydrophobicContact CD2-CD1 3.67Å; F490-L502 HydrophobicContact CE2-CD1 3.98Å; F490-L502 HydrophobicContact CE2-CD2 4.27Å; P498-L502 WeakPolarHBondContact O-CD2 3.46Å; Y500-L502 VanDerWaalsContact C-N 3.26Å; Y500-L502 PolarHBondContact O-N 2.72Å; L502-D504 WeakPolarHBondContact CB-O 3.44Å; L502-D504 PolarHBondContact O-N 2.74Å; L502-F506 HydrophobicContact CD1-CB 4.47Å; L502-F506 HydrophobicContact CD1-CD2 3.99Å; L502-L547 HydrophobicContact CD2-CB 4.3Å; L502-L547 HydrophobicContact CD2-CD2 4.34Å; L502-L549 HydrophobicContact CD1-CD1 4.37Å; L502-L549 HydrophobicContact CD2-CD1 4.09Å; L502-L549 HydrophobicContact CD2-CD2 4.17Å; L502-L549 HydrophobicContact CD2-CG 4.11Å
503	S	92	Very high	89.7	Confident	4 Å²	4	68 Å²	68	3%	0.028	34%	0.336	C	S	.	.	S	Bend	trans	-69.9	-19	178.2	64.7	0	0	0	0	113.2	T403 A404 Q405 F545 L547 I548	T403-S503 PolarHBondContact O-OG 2.89Å; A404-S503 CarbonylContact C-O 3.46Å; A404-S503 VanDerWaalsContact CA-O 3.3Å; A404-S503 WeakPolarHBondContact CA-O 3.45Å; Q405-S503 PolarHBondContact N-O 3.22Å; S503-F545 WeakPolarHBondContact CA-O 3.31Å; S503-L547 PolarHBondContact N-O 3.3Å; S503-L547 PolarHBondContact OG-O 2.87Å; S503-I548 VanDerWaalsContact OG-CA 3.27Å; S503-I548 WeakPolarHBondContact OG-CA 3.5Å; S503-I548 VanDerWaalsContact OG-CG1 3.23Å; S503-I548 WeakPolarHBondContact OG-CG1 3.34Å
504	D	93.7	Very high	90	Very high	8 Å²	8	62.3 Å²	62.3	4%	0.043	31%	0.309	C	S	.	.	S	Bend	trans	-140.7	167.5	179.1	-166.5	12.2	0	0	0	110.5	T403 Q405 N487 L502 F506 R508	T403-D504 PolarHBondContact OG1-OD2 3.22Å; Q405-D504 PolarHBondContact NE2-OD1 3.27Å; N487-D504 PolarHBondContact ND2-OD2 2.9Å; L502-D504 WeakPolarHBondContact CB-O 3.44Å; L502-D504 PolarHBondContact O-N 2.74Å; D504-F506 HydrophobicContact CB-CE2 4.21Å; D504-F506 WeakPolarHBondContact O-CD2 3.39Å; D504-R508 WeakPolarHBondContact OD1-CD 3.4Å; D504-R508 IonicContact OD2-CZ 2.83Å; D504-R508 IonicContact OD2-NE 3.44Å; D504-R508 IonicContact OD2-NH1 3.79Å; D504-R508 PolarHBondContact OD2-NH1 3.13Å
505	Q	91.5	Very high	90.2	Very high	104 Å²	104	62.1 Å²	62.1	49%	0.486	31%	0.309	S	S	.	.			trans	-82.3	139.7	-177.8	-63.2	175.6	1	0	0	111.5	N487 P507 R508	N487-Q505 WeakPolarHBondContact CB-O 3.5Å; N487-Q505 PolarHBondContact ND2-O 3.04Å; Q505-P507 CarbonylContact C-O 3.58Å; Q505-P507 WeakPolarHBondContact CB-O 3.22Å; Q505-P507 CarbonylContact O-C 3.49Å; Q505-R508 HydrophobicContact CB-CB 4.07Å; Q505-R508 WeakPolarHBondContact O-CB 3.31Å
506	F	92.1	Very high	90.5	Very high	26 Å²	26	54.4 Å²	54.4	11%	0.114	28%	0.276	C	S	.	.	S	Bend	trans	-136.9	94	176.3	-74.1	-94.9	0	0	0	108.9	L400 N487 P488 F490 W494 L502 D504 L549	L400-F506 HydrophobicContact CD1-CE1 3.66Å; L400-F506 HydrophobicContact CD1-CZ 4.07Å; L400-F506 HydrophobicContact CD2-CE1 3.93Å; L400-F506 HydrophobicContact CG-CE1 4.42Å; N487-F506 HydrophobicContact CB-CD1 3.75Å; N487-F506 HydrophobicContact CB-CE1 3.7Å; N487-F506 HydrophobicContact CB-CG 4.31Å; N487-F506 HydrophobicContact CB-CZ 4.24Å; P488-F506 WeakPolarHBondContact O-CD1 3.44Å; F490-F506 HydrophobicContact CB-CB 4.07Å; W494-F506 HydrophobicContact CZ3-CD1 4.39Å; L502-F506 HydrophobicContact CD1-CB 4.47Å; L502-F506 HydrophobicContact CD1-CD2 3.99Å; D504-F506 HydrophobicContact CB-CE2 4.21Å; D504-F506 WeakPolarHBondContact O-CD2 3.39Å; F506-L549 HydrophobicContact CD1-CD1 4.45Å; F506-L549 HydrophobicContact CD2-CD1 4.12Å; F506-L549 HydrophobicContact CE1-CD1 4.28Å; F506-L549 HydrophobicContact CE2-CB 4.18Å; F506-L549 HydrophobicContact CE2-CD1 3.93Å; F506-L549 HydrophobicContact CE2-CG 4.19Å; F506-L549 HydrophobicContact CG-CD1 4.4Å; F506-L549 HydrophobicContact CZ-CB 3.84Å; F506-L549 HydrophobicContact CZ-CD1 4.03Å; F506-L549 HydrophobicContact CZ-CG 4.3Å
507	P	91.1	Very high	90.5	Very high	86 Å²	86	52.9 Å²	52.9	56%	0.558	27%	0.269	S	S	*	.	S	Bend	cis	-83.3	158.9	13	33.9	-35.3	0	0	0	114.5	N487 P489 Q505	N487-P507 WeakPolarHBondContact O-CA 3.43Å; P489-P507 HydrophobicContact CG-CB 4.37Å; Q505-P507 CarbonylContact C-O 3.58Å; Q505-P507 WeakPolarHBondContact CB-O 3.22Å; Q505-P507 CarbonylContact O-C 3.49Å
508	R	91.4	Very high	90.5	Very high	14 Å²	14	52.5 Å²	52.5	5%	0.053	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-132.5	140.6	169.8	-175	-159.8	69.8	-152.5	-3.5	108.3	D485 A486 N487 D504 Q505	D485-R508 PolarHBondContact O-NH2 3.33Å; A486-R508 CarbonylContact C-O 3.56Å; A486-R508 VanDerWaalsContact C-O 3.32Å; A486-R508 WeakPolarHBondContact CA-O 3.42Å; A486-R508 WeakPolarHBondContact CB-O 3.3Å; N487-R508 HydrophobicContact CB-CB 3.86Å; N487-R508 PolarHBondContact N-O 2.66Å; N487-R508 PolarHBondContact O-N 3.05Å; N487-R508 PolarHBondContact OD1-NH2 2.88Å; D504-R508 WeakPolarHBondContact OD1-CD 3.4Å; D504-R508 IonicContact OD2-CZ 2.83Å; D504-R508 IonicContact OD2-NE 3.44Å; D504-R508 IonicContact OD2-NH1 3.79Å; D504-R508 PolarHBondContact OD2-NH1 3.13Å; Q505-R508 HydrophobicContact CB-CB 4.07Å; Q505-R508 WeakPolarHBondContact O-CB 3.31Å
509	G	89.1	Confident	90.6	Very high	48 Å²	48	53.5 Å²	53.5	50%	0.495	28%	0.277	S	S	.	.			trans	-67.3	179.7	169.8	0	0	0	0	0	113.9
510	I	89.2	Confident	91	Very high	119 Å²	119	49.9 Å²	49.9	61%	0.61	26%	0.264	S	S	*	.			trans	-63	133.4	167.6	-63.8	174.8	0	0	0	108.1	P483 L484 A486	P483-I510 HydrophobicContact CB-CG2 3.61Å; P483-I510 HydrophobicContact CG-CG2 4Å; L484-I510 VanDerWaalsContact O-CA 3.3Å; L484-I510 WeakPolarHBondContact O-CA 3.45Å; A486-I510 HydrophobicContact CB-CG1 4.43Å
511	K	88.6	Confident	91.2	Very high	64 Å²	64	43.8 Å²	43.8	28%	0.278	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-146.7	139.2	-175.7	-159.3	163	172.5	-164.9	0	112	M419 L484	M419-K511 HydrophobicContact CG-CB 4.23Å; M419-K511 HydrophobicContact CG-CD 3.33Å; M419-K511 HydrophobicContact CG-CG 3.62Å; M419-K511 HydrophobicContact SD-CD 3.73Å; L484-K511 PolarHBondContact N-O 3.21Å; L484-K511 PolarHBondContact O-N 3.32Å; L484-K511 VanDerWaalsContact O-N 3.13Å
512	E	91.1	Very high	91.5	Very high	106 Å²	106	38.9 Å²	38.9	50%	0.495	21%	0.213	S	C	.	.			trans	-67.3	155.1	176.6	-67.4	-162.8	161.9	0	0	112.7	M419 R432 P483	M419-E512 WeakPolarHBondContact CB-O 3.42Å; R432-E512 IonicContact CZ-OE2 3.18Å; R432-E512 IonicContact NE-OE2 3.46Å; R432-E512 IonicContact NH1-OE2 2.83Å; R432-E512 PolarHBondContact NH1-OE2 2.97Å; P483-E512 HydrophobicContact CB-CG 4.49Å
513	V	90.6	Very high	91.4	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.024	24%	0.237	C	C	.	.			trans	-87.5	118.5	173.9	175.6	0	0	0	0	109.9	P421 I480 C481 L484	P421-V513 HydrophobicContact CG-CB 4.38Å; P421-V513 HydrophobicContact CG-CG1 3.5Å; P421-V513 VanDerWaalsContact CG-CG1 3.5Å; P421-V513 HydrophobicContact CG-CG2 3.92Å; I480-V513 HydrophobicContact CB-CG1 4.13Å; I480-V513 HydrophobicContact CD1-CG1 3.88Å; I480-V513 HydrophobicContact CG2-CG1 4.04Å; C481-V513 WeakPolarHBondContact SG-CG2 3.3Å; L484-V513 HydrophobicContact CD1-CG2 3.79Å; L484-V513 HydrophobicContact CD2-CG2 3.92Å; L484-V513 HydrophobicContact CG-CG2 3.56Å
514	D	92.4	Very high	91.3	Very high	16 Å²	16	49 Å²	49	9%	0.086	25%	0.253	C	S	.	.			trans	-91.5	-44.3	-177.8	-64.9	-51.8	0	0	0	111.7	V418 M419 R432 L435	V418-D514 WeakPolarHBondContact CA-OD2 3.33Å; V418-D514 HydrophobicContact CB-CB 3.72Å; V418-D514 HydrophobicContact CG1-CB 4.01Å; M419-D514 PolarHBondContact N-OD2 2.99Å; M419-D514 PolarHBondContact O-N 3Å; R432-D514 IonicContact CZ-OD1 3.76Å; R432-D514 PolarHBondContact N-O 2.86Å; R432-D514 IonicContact NH1-OD1 3.4Å; R432-D514 PolarHBondContact NH1-OD1 3.31Å; R432-D514 IonicContact NH2-OD1 2.78Å; R432-D514 PolarHBondContact NH2-OD1 3.13Å; L435-D514 HydrophobicContact CD2-CB 3.8Å
515	V	92.3	Very high	91	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.024	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	128.6	-179.6	177.4	0	0	0	0	108.7	L408 V418 M419 C420 P421 F430 V431 L435 I472 I517	L408-V515 HydrophobicContact CD1-CG2 4.4Å; L408-V515 HydrophobicContact CD2-CG2 3.99Å; V418-V515 HydrophobicContact CB-CG2 4.47Å; V418-V515 HydrophobicContact CG2-CG2 4.39Å; M419-V515 PolarHBondContact O-N 2.79Å; C420-V515 VanDerWaalsContact CA-O 3.24Å; C420-V515 WeakPolarHBondContact CA-O 3.47Å; P421-V515 WeakPolarHBondContact CD-O 3.04Å; F430-V515 CarbonylContact O-C 3.52Å; F430-V515 VanDerWaalsContact O-CA 3.28Å; F430-V515 WeakPolarHBondContact O-CA 3.46Å; F430-V515 WeakPolarHBondContact O-CG1 3.35Å; V431-V515 HydrophobicContact CB-CG2 4.44Å; V431-V515 HydrophobicContact CG2-CG2 4.02Å; L435-V515 HydrophobicContact CD2-CG2 4.25Å; I472-V515 HydrophobicContact CD1-CG1 4.02Å; V515-I517 HydrophobicContact CG1-CG1 4.47Å
516	L	93.3	Very high	91	Very high	16 Å²	16	45.2 Å²	45.2	8%	0.084	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.6	170.5	-178.9	152.1	0	0	0	109	P421 D423 S426 S429 F430 I480	P421-L516 HydrophobicContact CG-CB 4.4Å; P421-L516 HydrophobicContact CG-CG 4.44Å; D423-L516 HydrophobicContact CB-CD1 4.26Å; D423-L516 HydrophobicContact CB-CD2 4.3Å; D423-L516 HydrophobicContact CB-CG 4.3Å; S426-L516 VanDerWaalsContact CB-CD2 3.47Å; S429-L516 CarbonylContact C-O 3.48Å; S429-L516 WeakPolarHBondContact CA-O 3.42Å; S429-L516 WeakPolarHBondContact CB-O 3.18Å; F430-L516 HydrophobicContact CB-CB 4.33Å; F430-L516 HydrophobicContact CD2-CD2 4.1Å; F430-L516 PolarHBondContact N-O 3.42Å; F430-L516 PolarHBondContact O-N 3.31Å; I480-L516 HydrophobicContact CD1-CB 4.32Å; I480-L516 HydrophobicContact CG2-CB 3.84Å; I480-L516 HydrophobicContact CG2-CD1 3.88Å
517	I	91.4	Very high	90.8	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.015	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.7	174.8	-60.2	175.8	0	0	0	107.6	C420 P421 L422 D423 V515 F525 F545	C420-I517 HydrophobicContact CB-CD1 4.28Å; P421-I517 PolarHBondContact O-N 3.31Å; L422-I517 HydrophobicContact CG-CB 4.25Å; L422-I517 HydrophobicContact CG-CD1 4.31Å; D423-I517 PolarHBondContact N-O 3.15Å; V515-I517 HydrophobicContact CG1-CG1 4.47Å; I517-F525 HydrophobicContact CD1-CD1 4.27Å; I517-F525 HydrophobicContact CD1-CD2 4Å; I517-F525 HydrophobicContact CD1-CE1 4.21Å; I517-F525 HydrophobicContact CD1-CE2 3.91Å; I517-F525 HydrophobicContact CD1-CG 4.21Å; I517-F525 HydrophobicContact CD1-CZ 4.02Å; I517-F525 HydrophobicContact CG2-CD2 3.87Å; I517-F525 HydrophobicContact CG2-CE2 4.01Å; I517-F545 HydrophobicContact CD1-CE2 4.17Å; I517-F545 HydrophobicContact CD1-CZ 4.4Å
518	G	91.3	Very high	90.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	177.2	178.4	0	0	0	0	0	112.9	D423 S426 S429 D520 Y521 Y522	D423-G518 WeakPolarHBondContact O-CA 3.38Å; S426-G518 CarbonylContact O-C 3.53Å; S426-G518 VanDerWaalsContact O-CA 3.23Å; S426-G518 WeakPolarHBondContact O-CA 3.46Å; S429-G518 PolarHBondContact OG-N 3.26Å; G518-D520 VanDerWaalsContact C-OD1 3.28Å; G518-D520 WeakPolarHBondContact CA-OD1 3.44Å; G518-D520 PolarHBondContact O-N 3.48Å; G518-D520 VanDerWaalsContact O-N 3.07Å; G518-Y521 PolarHBondContact O-N 3.24Å; G518-Y521 VanDerWaalsContact O-N 3.08Å; G518-Y522 WeakPolarHBondContact O-CB 3.28Å; G518-Y522 PolarHBondContact O-N 3.22Å
519	A	91	Very high	90.7	Very high	42 Å²	42	52 Å²	52	35%	0.347	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.9	173.6	0	0	0	0	0	114	S426 Y521	S426-A519 WeakPolarHBondContact O-CB 3.34Å; S426-A519 PolarHBondContact O-N 3.03Å; A519-Y521 VanDerWaalsContact C-N 3.26Å; A519-Y521 PolarHBondContact O-N 3.36Å
520	D	92.2	Very high	90.9	Very high	56 Å²	56	53.6 Å²	53.6	30%	0.299	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.8	176.3	56.9	-17.6	0	0	0	113.5	R428 S429 G518	R428-D520 WeakPolarHBondContact CA-OD2 3.18Å; S429-D520 PolarHBondContact N-OD1 3.42Å; S429-D520 VanDerWaalsContact N-OD1 3.1Å; S429-D520 PolarHBondContact N-OD2 2.91Å; S429-D520 PolarHBondContact OG-OD1 3.31Å; G518-D520 VanDerWaalsContact C-OD1 3.28Å; G518-D520 WeakPolarHBondContact CA-OD1 3.44Å; G518-D520 PolarHBondContact O-N 3.48Å; G518-D520 VanDerWaalsContact O-N 3.07Å
521	Y	89.6	Confident	91	Very high	45 Å²	45	52.2 Å²	52.2	18%	0.176	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-6.4	177.7	-69.1	-77.4	0	0	0	113.8	S429 I472 K473 G518 A519 W523 D524 F525	S429-Y521 WeakPolarHBondContact OG-CD2 3.38Å; I472-Y521 HydrophobicContact CB-CD1 4.27Å; I472-Y521 HydrophobicContact CB-CD2 3.99Å; I472-Y521 HydrophobicContact CB-CE1 4.31Å; I472-Y521 HydrophobicContact CB-CE2 4.03Å; I472-Y521 HydrophobicContact CB-CG 4.11Å; I472-Y521 HydrophobicContact CG2-CD1 3.72Å; I472-Y521 HydrophobicContact CG2-CD2 4.06Å; I472-Y521 HydrophobicContact CG2-CE1 4.16Å; I472-Y521 HydrophobicContact CG2-CE2 4.47Å; I472-Y521 HydrophobicContact CG2-CG 3.67Å; K473-Y521 PolarHBondContact N-OH 3.31Å; K473-Y521 VanDerWaalsContact N-OH 3.12Å; G518-Y521 PolarHBondContact O-N 3.24Å; G518-Y521 VanDerWaalsContact O-N 3.08Å; A519-Y521 VanDerWaalsContact C-N 3.26Å; A519-Y521 PolarHBondContact O-N 3.36Å; Y521-W523 VanDerWaalsContact C-N 3.3Å; Y521-W523 PolarHBondContact O-N 3.41Å; Y521-W523 VanDerWaalsContact O-N 3.17Å; Y521-D524 WeakPolarHBondContact CD1-OD2 3.44Å; Y521-D524 VanDerWaalsContact O-CB 3.28Å; Y521-D524 WeakPolarHBondContact O-CB 3.43Å; Y521-D524 PolarHBondContact O-N 2.88Å; Y521-F525 VanDerWaalsContact O-CD2 3.25Å; Y521-F525 WeakPolarHBondContact O-CD2 3.48Å
522	Y	94	Very high	91.1	Very high	16 Å²	16	59.1 Å²	59.1	6%	0.063	28%	0.284	C	S	.	.	H	α-helix	trans	-46.4	-50.7	-175.3	-179.8	-93.1	0	0	0	113.5	Q402 L422 V424 G518 D524 F525 I526	Q402-Y522 PolarHBondContact NE2-OH 3.24Å; Q402-Y522 VanDerWaalsContact OE1-CZ 3.29Å; Q402-Y522 PolarHBondContact OE1-OH 3.23Å; L422-Y522 HydrophobicContact CB-CD2 3.85Å; L422-Y522 HydrophobicContact CB-CE2 3.76Å; L422-Y522 HydrophobicContact CD2-CD2 4.35Å; L422-Y522 HydrophobicContact CD2-CE2 4.36Å; V424-Y522 HydrophobicContact CG1-CD1 3.52Å; V424-Y522 HydrophobicContact CG1-CD2 3.47Å; V424-Y522 VanDerWaalsContact CG1-CD2 3.47Å; V424-Y522 HydrophobicContact CG1-CE1 3.64Å; V424-Y522 HydrophobicContact CG1-CE2 3.6Å; V424-Y522 HydrophobicContact CG1-CG 3.44Å; V424-Y522 VanDerWaalsContact CG1-CG 3.44Å; G518-Y522 WeakPolarHBondContact O-CB 3.28Å; G518-Y522 PolarHBondContact O-N 3.22Å; Y522-D524 PolarHBondContact O-N 3.38Å; Y522-F525 PolarHBondContact O-N 3.4Å; Y522-F525 VanDerWaalsContact O-N 3.14Å; Y522-I526 HydrophobicContact CD1-CG1 3.98Å; Y522-I526 HydrophobicContact CD2-CG1 4.41Å; Y522-I526 HydrophobicContact CE1-CB 4.27Å; Y522-I526 HydrophobicContact CE1-CG1 3.53Å; Y522-I526 HydrophobicContact CE2-CD1 4.38Å; Y522-I526 HydrophobicContact CE2-CG1 4Å; Y522-I526 HydrophobicContact CG-CG1 4.39Å; Y522-I526 PolarHBondContact O-N 3.04Å
523	W	92.3	Very high	90.7	Very high	183 Å²	183	61 Å²	61	69%	0.693	29%	0.29	S	S	*	.	H	α-helix	trans	-72.3	-8.4	-178	-60.8	112.8	0	0	0	114.2	Y521 F525 I526	Y521-W523 VanDerWaalsContact C-N 3.3Å; Y521-W523 PolarHBondContact O-N 3.41Å; Y521-W523 VanDerWaalsContact O-N 3.17Å; W523-F525 VanDerWaalsContact C-N 3.32Å; W523-I526 HydrophobicContact CE3-CB 4.33Å; W523-I526 HydrophobicContact CE3-CG2 4.32Å; W523-I526 HydrophobicContact CZ3-CG2 4.15Å
524	D	88.4	Confident	90	Very high	70 Å²	70	63.4 Å²	63.4	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-79.2	-19.1	171.7	-67.6	-20.5	0	0	0	112.7	K470 Y521 Y522	K470-D524 HydrophobicContact CD-CB 4.29Å; K470-D524 WeakPolarHBondContact CE-O 2.91Å; Y521-D524 WeakPolarHBondContact CD1-OD2 3.44Å; Y521-D524 VanDerWaalsContact O-CB 3.28Å; Y521-D524 WeakPolarHBondContact O-CB 3.43Å; Y521-D524 PolarHBondContact O-N 2.88Å; Y522-D524 PolarHBondContact O-N 3.38Å
525	F	87.3	Confident	89	Confident	12 Å²	12	67 Å²	67	5%	0.053	34%	0.343	C	S	.	.	H	α-helix	trans	-105.6	-31.1	-176.9	-67.3	-88.3	0	0	0	113	L422 K470 I472 I517 Y521 Y522 W523 S543 I544 F545	L422-F525 HydrophobicContact CD2-CB 4.07Å; K470-F525 HydrophobicContact CB-CE1 3.87Å; K470-F525 HydrophobicContact CB-CE2 4.43Å; K470-F525 HydrophobicContact CB-CZ 3.68Å; K470-F525 HydrophobicContact CG-CE1 4.17Å; K470-F525 HydrophobicContact CG-CZ 4.3Å; I472-F525 HydrophobicContact CG2-CE2 3.75Å; I472-F525 HydrophobicContact CG2-CZ 3.71Å; I517-F525 HydrophobicContact CD1-CD1 4.27Å; I517-F525 HydrophobicContact CD1-CD2 4Å; I517-F525 HydrophobicContact CD1-CE1 4.21Å; I517-F525 HydrophobicContact CD1-CE2 3.91Å; I517-F525 HydrophobicContact CD1-CG 4.21Å; I517-F525 HydrophobicContact CD1-CZ 4.02Å; I517-F525 HydrophobicContact CG2-CD2 3.87Å; I517-F525 HydrophobicContact CG2-CE2 4.01Å; Y521-F525 VanDerWaalsContact O-CD2 3.25Å; Y521-F525 WeakPolarHBondContact O-CD2 3.48Å; Y522-F525 PolarHBondContact O-N 3.4Å; Y522-F525 VanDerWaalsContact O-N 3.14Å; W523-F525 VanDerWaalsContact C-N 3.32Å; F525-S543 CarbonylContact O-C 3.53Å; F525-S543 WeakPolarHBondContact O-CA 3.12Å; F525-S543 VanDerWaalsContact O-CB 3.27Å; F525-S543 WeakPolarHBondContact O-CB 3.17Å; F525-I544 HydrophobicContact CB-CG1 4.37Å; F525-I544 HydrophobicContact CD1-CD1 3.27Å; F525-I544 HydrophobicContact CD1-CG1 3.64Å; F525-I544 HydrophobicContact CE1-CD1 3.63Å; F525-I544 HydrophobicContact CE1-CG1 4.44Å; F525-I544 HydrophobicContact CG-CD1 4.3Å; F525-I544 HydrophobicContact CG-CG1 4.45Å; F525-I544 PolarHBondContact O-N 3.24Å; F525-F545 HydrophobicContact CB-CE2 4.31Å; F525-F545 HydrophobicContact CD1-CD2 4.35Å; F525-F545 HydrophobicContact CD1-CE1 4.17Å; F525-F545 AromaticContact CD1-CE2 3.34Å; F525-F545 HydrophobicContact CD1-CE2 3.34Å; F525-F545 AromaticContact CD1-CZ 3.23Å; F525-F545 HydrophobicContact CD1-CZ 3.23Å; F525-F545 HydrophobicContact CE1-CE1 4.23Å; F525-F545 AromaticContact CE1-CE2 3.95Å; F525-F545 HydrophobicContact CE1-CE2 3.95Å; F525-F545 AromaticContact CE1-CZ 3.37Å; F525-F545 HydrophobicContact CE1-CZ 3.37Å; F525-F545 HydrophobicContact CG-CE2 4.06Å; F525-F545 HydrophobicContact CG-CZ 4.33Å
526	I	92.5	Very high	88.4	Confident	19 Å²	19	70.4 Å²	70.4	10%	0.097	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134.6	-179.6	-63.3	-56.5	0	0	0	110.7	L422 Y522 W523 V541 I548	L422-I526 HydrophobicContact CD2-CD1 3.68Å; L422-I526 HydrophobicContact CD2-CG1 4.18Å; Y522-I526 HydrophobicContact CD1-CG1 3.98Å; Y522-I526 HydrophobicContact CD2-CG1 4.41Å; Y522-I526 HydrophobicContact CE1-CB 4.27Å; Y522-I526 HydrophobicContact CE1-CG1 3.53Å; Y522-I526 HydrophobicContact CE2-CD1 4.38Å; Y522-I526 HydrophobicContact CE2-CG1 4Å; Y522-I526 HydrophobicContact CG-CG1 4.39Å; Y522-I526 PolarHBondContact O-N 3.04Å; W523-I526 HydrophobicContact CE3-CB 4.33Å; W523-I526 HydrophobicContact CE3-CG2 4.32Å; W523-I526 HydrophobicContact CZ3-CG2 4.15Å; I526-V541 HydrophobicContact CD1-CG1 4.05Å; I526-V541 HydrophobicContact CG2-CG1 3.73Å; I526-I548 HydrophobicContact CD1-CD1 3.61Å
527	G	88.5	Confident	88.1	Confident	24 Å²	24	71.3 Å²	71.3	25%	0.247	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-175.6	173.6	0	0	0	0	0	112.7	Q542	G527-Q542 PolarHBondContact N-O 3.49Å
528	N	87.9	Confident	88.1	Confident	168 Å²	168	71.2 Å²	71.2	90%	0.898	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	-10.1	-173.2	-63.6	-22.3	0	0	0	113.8
529	E	90.8	Very high	88.2	Confident	77 Å²	77	73.2 Å²	73.2	36%	0.36	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128	-177.1	-168.8	-172.2	159.7	0	0	111.9	R531 Q542	E529-R531 IonicContact OE1-CZ 3.91Å; E529-R531 IonicContact OE1-NE 3.69Å; E529-R531 PolarHBondContact OE1-NE 3.38Å; E529-R531 IonicContact OE1-NH2 3.11Å; E529-R531 PolarHBondContact OE1-NH2 3.28Å; E529-Q542 HydrophobicContact CB-CB 3.87Å; E529-Q542 WeakPolarHBondContact O-CB 3.38Å; E529-Q542 PolarHBondContact O-N 2.95Å
530	V	93.8	Very high	88.4	Confident	82 Å²	82	71.2 Å²	71.2	50%	0.497	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.7	174	-179.8	0	0	0	0	109.5	V539 G540	V530-V539 HydrophobicContact CG1-CG1 3.45Å; V530-V539 VanDerWaalsContact CG1-CG1 3.45Å; V530-G540 CarbonylContact C-O 3.48Å; V530-G540 WeakPolarHBondContact CA-O 3.39Å
531	R	92.1	Very high	88.5	Confident	89 Å²	89	69 Å²	69	34%	0.336	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	111.1	176.8	-62.2	-172.8	-178.9	-158.5	0.2	110.1	L497 E529 V539 G540	L497-R531 HydrophobicContact CD2-CB 4Å; E529-R531 IonicContact OE1-CZ 3.91Å; E529-R531 IonicContact OE1-NE 3.69Å; E529-R531 PolarHBondContact OE1-NE 3.38Å; E529-R531 IonicContact OE1-NH2 3.11Å; E529-R531 PolarHBondContact OE1-NH2 3.28Å; R531-V539 WeakPolarHBondContact O-CA 3.26Å; R531-G540 PolarHBondContact N-O 3.03Å; R531-G540 PolarHBondContact O-N 3.28Å
532	R	90.2	Very high	88.7	Confident	210 Å²	210	70.9 Å²	70.9	79%	0.792	36%	0.359	S	S	*	.			trans	-133	145.9	177.5	61.8	-177.2	-178.2	178.5	0.3	109.5	V539	R532-V539 HydrophobicContact CB-CG1 4.49Å; R532-V539 HydrophobicContact CB-CG2 4.27Å
533	K	83.3	Confident	88.6	Confident	145 Å²	145	70.7 Å²	70.7	63%	0.63	36%	0.36	S	S	*	.			trans	-129.4	-79.1	177.4	-170.7	-176	179	-172	0	111.3	H496	H496-K533 HydrophobicContact CB-CB 4.13Å; H496-K533 HydrophobicContact CB-CD 4.39Å
534	A	75	Confident	88.4	Confident	54 Å²	54	64.5 Å²	64.5	45%	0.446	34%	0.339	S	S	.	.	S	Bend	trans	-103.4	160.1	178.3	0	0	0	0	0	112.1	D536 E537	A534-D536 PolarHBondContact O-N 3.49Å; A534-E537 HydrophobicContact CB-CB 4.49Å; A534-E537 HydrophobicContact CB-CG 4.23Å; A534-E537 PolarHBondContact O-N 3Å
535	A	72.2	Confident	88.4	Confident	92 Å²	92	62.7 Å²	62.7	76%	0.76	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.8	-178.8	0	0	0	0	0	114.1
536	D	80.3	Confident	88.6	Confident	76 Å²	76	62.3 Å²	62.3	41%	0.406	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	25.5	-179.7	-63.9	-38.6	0	0	0	112.5	A534 K552 G554	A534-D536 PolarHBondContact O-N 3.49Å; D536-K552 WeakPolarHBondContact OD1-CD 3.25Å; D536-K552 IonicContact OD1-NZ 3.52Å; D536-K552 PolarHBondContact OD1-NZ 3.05Å; D536-G554 WeakPolarHBondContact O-CA 3.31Å; D536-G554 PolarHBondContact O-N 3.37Å
537	E	86.2	Confident	88.7	Confident	35 Å²	35	62.1 Å²	62.1	16%	0.164	33%	0.327	C	S	.	.	S	Bend	trans	-121.9	154.2	171.7	-72.8	-178	172.3	0	0	110.3	H496 A534 K552	H496-E537 IonicContact CE1-OE2 3.51Å; H496-E537 PolarHBondContact CE1-OE2 3.41Å; H496-E537 IonicContact ND1-OE2 3.02Å; H496-E537 PolarHBondContact ND1-OE2 2.87Å; A534-E537 HydrophobicContact CB-CB 4.49Å; A534-E537 HydrophobicContact CB-CG 4.23Å; A534-E537 PolarHBondContact O-N 3Å; E537-K552 CarbonylContact C-O 3.32Å
538	P	91.3	Very high	89	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-69.1	149.8	-177.8	23	-27.8	0	0	0	110.8	L400 W494 H496 L497 C550 K552	L400-P538 HydrophobicContact CD1-CB 4.16Å; W494-P538 VanDerWaalsContact CD1-CD 3.48Å; W494-P538 HydrophobicContact CD2-CG 3.53Å; W494-P538 VanDerWaalsContact CE2-CG 3.45Å; W494-P538 HydrophobicContact CE3-CG 4.06Å; W494-P538 HydrophobicContact CG-CG 3.82Å; W494-P538 HydrophobicContact CH2-CG 4.42Å; W494-P538 HydrophobicContact CZ2-CG 3.95Å; W494-P538 HydrophobicContact CZ3-CG 4.46Å; W494-P538 VanDerWaalsContact NE1-CD 3.33Å; H496-P538 PolarHBondContact NE2-O 3.46Å; L497-P538 HydrophobicContact CD1-CB 4.23Å; L497-P538 HydrophobicContact CD1-CG 3.79Å; P538-C550 WeakPolarHBondContact CA-O 3.5Å; P538-K552 VanDerWaalsContact CA-O 3.27Å; P538-K552 WeakPolarHBondContact CA-O 3.47Å; P538-K552 VanDerWaalsContact CD-O 3.31Å; P538-K552 WeakPolarHBondContact CD-O 3.48Å
539	V	93.9	Very high	89.3	Confident	42 Å²	42	53 Å²	53	26%	0.255	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.2	173.6	-179.8	0	0	0	0	108.4	V530 R531 R532 V541 L549 C550	V530-V539 HydrophobicContact CG1-CG1 3.45Å; V530-V539 VanDerWaalsContact CG1-CG1 3.45Å; R531-V539 WeakPolarHBondContact O-CA 3.26Å; R532-V539 HydrophobicContact CB-CG1 4.49Å; R532-V539 HydrophobicContact CB-CG2 4.27Å; V539-V541 HydrophobicContact CG1-CG2 4.08Å; V539-L549 WeakPolarHBondContact O-CA 3.18Å; V539-C550 PolarHBondContact N-O 3.2Å; V539-C550 PolarHBondContact O-N 3.21Å
540	G	94.6	Very high	89.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.1	169.1	0	0	0	0	0	109.9	V530 R531 I548	V530-G540 CarbonylContact C-O 3.48Å; V530-G540 WeakPolarHBondContact CA-O 3.39Å; R531-G540 PolarHBondContact N-O 3.03Å; R531-G540 PolarHBondContact O-N 3.28Å; G540-I548 CarbonylContact C-O 3.47Å; G540-I548 WeakPolarHBondContact CA-O 3.47Å
541	V	95.1	Very high	89.2	Confident	11 Å²	11	47.5 Å²	47.5	7%	0.067	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	121.7	176.1	-177.6	0	0	0	0	108.1	I526 V539 I548	I526-V541 HydrophobicContact CD1-CG1 4.05Å; I526-V541 HydrophobicContact CG2-CG1 3.73Å; V539-V541 HydrophobicContact CG1-CG2 4.08Å; V541-I548 HydrophobicContact CB-CB 4.47Å; V541-I548 PolarHBondContact N-O 3.31Å; V541-I548 PolarHBondContact O-N 2.94Å
542	Q	93.9	Very high	88.9	Confident	84 Å²	84	48 Å²	48	39%	0.393	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	138.9	176.6	-173.7	-174.4	34.2	0	0	109.7	G527 E529	G527-Q542 PolarHBondContact N-O 3.49Å; E529-Q542 HydrophobicContact CB-CB 3.87Å; E529-Q542 WeakPolarHBondContact O-CB 3.38Å; E529-Q542 PolarHBondContact O-N 2.95Å
543	S	91.6	Very high	88.6	Confident	12 Å²	12	39.1 Å²	39.1	8%	0.084	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	170.8	174.1	78.6	0	0	0	0	110.3	F525 F545 G546	F525-S543 CarbonylContact O-C 3.53Å; F525-S543 WeakPolarHBondContact O-CA 3.12Å; F525-S543 VanDerWaalsContact O-CB 3.27Å; F525-S543 WeakPolarHBondContact O-CB 3.17Å; S543-F545 PolarHBondContact O-N 3.24Å; S543-F545 PolarHBondContact OG-N 3.39Å; S543-F545 VanDerWaalsContact OG-N 3.11Å; S543-G546 WeakPolarHBondContact CB-O 3.47Å; S543-G546 PolarHBondContact N-O 2.92Å; S543-G546 PolarHBondContact O-N 3.03Å; S543-G546 VanDerWaalsContact O-N 3.09Å; S543-G546 PolarHBondContact OG-O 3.26Å
544	I	87.3	Confident	88.1	Confident	52 Å²	52	32.9 Å²	32.9	27%	0.267	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-19	172.7	69.8	163.7	0	0	0	113.5	P468 K470 F525	P468-I544 HydrophobicContact CG-CB 4.03Å; K470-I544 HydrophobicContact CG-CD1 4.03Å; F525-I544 HydrophobicContact CB-CG1 4.37Å; F525-I544 HydrophobicContact CD1-CD1 3.27Å; F525-I544 HydrophobicContact CD1-CG1 3.64Å; F525-I544 HydrophobicContact CE1-CD1 3.63Å; F525-I544 HydrophobicContact CE1-CG1 4.44Å; F525-I544 HydrophobicContact CG-CD1 4.3Å; F525-I544 HydrophobicContact CG-CG1 4.45Å; F525-I544 PolarHBondContact O-N 3.24Å
545	F	88.3	Confident	87.6	Confident	33 Å²	33	38.9 Å²	38.9	15%	0.145	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-1.3	178.4	-54.1	-56.9	0	0	0	113	A404 A406 S503 I517 F525 S543	A404-F545 HydrophobicContact CB-CB 3.96Å; A404-F545 HydrophobicContact CB-CD2 3.48Å; A404-F545 VanDerWaalsContact CB-CD2 3.48Å; A404-F545 HydrophobicContact CB-CE2 4.17Å; A404-F545 HydrophobicContact CB-CG 3.91Å; A406-F545 HydrophobicContact CB-CD1 4Å; A406-F545 HydrophobicContact CB-CE1 3.47Å; A406-F545 VanDerWaalsContact CB-CE1 3.47Å; A406-F545 HydrophobicContact CB-CZ 3.8Å; S503-F545 WeakPolarHBondContact CA-O 3.31Å; I517-F545 HydrophobicContact CD1-CE2 4.17Å; I517-F545 HydrophobicContact CD1-CZ 4.4Å; F525-F545 HydrophobicContact CB-CE2 4.31Å; F525-F545 HydrophobicContact CD1-CD2 4.35Å; F525-F545 HydrophobicContact CD1-CE1 4.17Å; F525-F545 AromaticContact CD1-CE2 3.34Å; F525-F545 HydrophobicContact CD1-CE2 3.34Å; F525-F545 AromaticContact CD1-CZ 3.23Å; F525-F545 HydrophobicContact CD1-CZ 3.23Å; F525-F545 HydrophobicContact CE1-CE1 4.23Å; F525-F545 AromaticContact CE1-CE2 3.95Å; F525-F545 HydrophobicContact CE1-CE2 3.95Å; F525-F545 AromaticContact CE1-CZ 3.37Å; F525-F545 HydrophobicContact CE1-CZ 3.37Å; F525-F545 HydrophobicContact CG-CE2 4.06Å; F525-F545 HydrophobicContact CG-CZ 4.33Å; S543-F545 PolarHBondContact O-N 3.24Å; S543-F545 PolarHBondContact OG-N 3.39Å; S543-F545 VanDerWaalsContact OG-N 3.11Å
546	G	90.9	Very high	86.7	Confident	4 Å²	4	39.7 Å²	39.7	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.3	-165.2	-167.5	0	0	0	0	0	112	N501 S543 I548	N501-G546 CarbonylContact O-C 2.98Å; N501-G546 VanDerWaalsContact O-CA 3.28Å; N501-G546 WeakPolarHBondContact O-CA 3.38Å; S543-G546 WeakPolarHBondContact CB-O 3.47Å; S543-G546 PolarHBondContact N-O 2.92Å; S543-G546 PolarHBondContact O-N 3.03Å; S543-G546 VanDerWaalsContact O-N 3.09Å; S543-G546 PolarHBondContact OG-O 3.26Å; G546-I548 PolarHBondContact O-N 3.17Å
547	L	94.7	Very high	84.8	Confident	15 Å²	15	44.5 Å²	44.5	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	115.8	-178	-169.2	73.7	0	0	0	110.8	L497 P498 N501 L502 S503 L549	L497-L547 HydrophobicContact CD2-CD2 4.07Å; P498-L547 VanDerWaalsContact CD-CD2 3.49Å; P498-L547 HydrophobicContact CG-CD2 3.68Å; N501-L547 PolarHBondContact O-N 3.21Å; L502-L547 HydrophobicContact CD2-CB 4.3Å; L502-L547 HydrophobicContact CD2-CD2 4.34Å; S503-L547 PolarHBondContact N-O 3.3Å; S503-L547 PolarHBondContact OG-O 2.87Å; L547-L549 HydrophobicContact CD2-CD2 4.04Å; L547-L549 HydrophobicContact CG-CD2 4.23Å
548	I	94.9	Very high	82.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	124.5	174.6	-62.4	169.4	0	0	0	109.2	Q402 L422 S503 I526 G540 V541 G546	Q402-I548 HydrophobicContact CB-CG2 3.74Å; Q402-I548 HydrophobicContact CG-CG2 3.78Å; L422-I548 HydrophobicContact CD1-CD1 4.2Å; L422-I548 HydrophobicContact CD2-CD1 3.91Å; S503-I548 VanDerWaalsContact OG-CA 3.27Å; S503-I548 WeakPolarHBondContact OG-CA 3.5Å; S503-I548 VanDerWaalsContact OG-CG1 3.23Å; S503-I548 WeakPolarHBondContact OG-CG1 3.34Å; I526-I548 HydrophobicContact CD1-CD1 3.61Å; G540-I548 CarbonylContact C-O 3.47Å; G540-I548 WeakPolarHBondContact CA-O 3.47Å; V541-I548 HydrophobicContact CB-CB 4.47Å; V541-I548 PolarHBondContact N-O 3.31Å; V541-I548 PolarHBondContact O-N 2.94Å; G546-I548 PolarHBondContact O-N 3.17Å
549	L	94	Very high	79.7	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.4	173.1	-54.9	-171.7	0	0	0	110.4	L400 F490 W494 L497 L502 F506 V539 L547	L400-L549 HydrophobicContact CD1-CB 4.01Å; F490-L549 HydrophobicContact CD2-CD1 4.05Å; F490-L549 HydrophobicContact CE2-CD1 3.87Å; W494-L549 HydrophobicContact CE3-CD1 4.37Å; W494-L549 HydrophobicContact CZ3-CD1 4.14Å; L497-L549 HydrophobicContact CB-CD2 4.49Å; L497-L549 HydrophobicContact CD1-CD2 3.67Å; L497-L549 HydrophobicContact CD2-CD2 4.08Å; L497-L549 HydrophobicContact CG-CD2 4.29Å; L502-L549 HydrophobicContact CD1-CD1 4.37Å; L502-L549 HydrophobicContact CD2-CD1 4.09Å; L502-L549 HydrophobicContact CD2-CD2 4.17Å; L502-L549 HydrophobicContact CD2-CG 4.11Å; F506-L549 HydrophobicContact CD1-CD1 4.45Å; F506-L549 HydrophobicContact CD2-CD1 4.12Å; F506-L549 HydrophobicContact CE1-CD1 4.28Å; F506-L549 HydrophobicContact CE2-CB 4.18Å; F506-L549 HydrophobicContact CE2-CD1 3.93Å; F506-L549 HydrophobicContact CE2-CG 4.19Å; F506-L549 HydrophobicContact CG-CD1 4.4Å; F506-L549 HydrophobicContact CZ-CB 3.84Å; F506-L549 HydrophobicContact CZ-CD1 4.03Å; F506-L549 HydrophobicContact CZ-CG 4.3Å; V539-L549 WeakPolarHBondContact O-CA 3.18Å; L547-L549 HydrophobicContact CD2-CD2 4.04Å; L547-L549 HydrophobicContact CG-CD2 4.23Å
550	C	92.8	Very high	79	Confident	16 Å²	16	66.8 Å²	66.8	11%	0.108	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	164.1	179.1	61.3	0	0	0	0	113.1	L400 Q402 P538 V539	L400-C550 WeakPolarHBondContact O-CA 3.47Å; Q402-C550 HydrophobicContact CB-CB 4.49Å; Q402-C550 HydrophobicContact CG-CB 3.41Å; Q402-C550 VanDerWaalsContact CG-CB 3.41Å; P538-C550 WeakPolarHBondContact CA-O 3.5Å; V539-C550 PolarHBondContact N-O 3.2Å; V539-C550 PolarHBondContact O-N 3.21Å
551	G	89.8	Confident	78.2	Confident	26 Å²	26	70.3 Å²	70.3	27%	0.268	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	89.8	-166.2	-179.9	0	0	0	0	0	113.1	V399 L400	V399-G551 CarbonylContact C-O 3.6Å; V399-G551 WeakPolarHBondContact CA-O 3.44Å; L400-G551 PolarHBondContact N-O 3.22Å; L400-G551 PolarHBondContact O-N 2.82Å
552	K	87.6	Confident	77.2	Confident	100 Å²	100	73.6 Å²	73.6	44%	0.435	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	143.2	-173.9	-61.2	-177.9	-174.3	-180	0	111.6	K398 D536 E537 P538	K398-K552 CarbonylContact O-C 3.54Å; K398-K552 WeakPolarHBondContact O-CA 3.44Å; D536-K552 WeakPolarHBondContact OD1-CD 3.25Å; D536-K552 IonicContact OD1-NZ 3.52Å; D536-K552 PolarHBondContact OD1-NZ 3.05Å; E537-K552 CarbonylContact C-O 3.32Å; P538-K552 VanDerWaalsContact CA-O 3.27Å; P538-K552 WeakPolarHBondContact CA-O 3.47Å; P538-K552 VanDerWaalsContact CD-O 3.31Å; P538-K552 WeakPolarHBondContact CD-O 3.48Å
553	T	82.8	Confident	76.3	Confident	24 Å²	24	73 Å²	73	15%	0.147	35%	0.354	C	S	.	.			trans	-89.9	-7.4	175	59	0	0	0	0	114.2	K398 L400 P488 W494	K398-T553 HydrophobicContact CB-CG2 4.26Å; K398-T553 PolarHBondContact N-OG1 3.19Å; K398-T553 WeakPolarHBondContact O-CG2 3.47Å; K398-T553 PolarHBondContact O-N 3.28Å; K398-T553 PolarHBondContact O-OG1 3.45Å; K398-T553 VanDerWaalsContact O-OG1 3.12Å; L400-T553 HydrophobicContact CD1-CG2 3.89Å; L400-T553 HydrophobicContact CD2-CG2 3.92Å; L400-T553 HydrophobicContact CG-CG2 3.6Å; P488-T553 HydrophobicContact CG-CG2 4.3Å; W494-T553 HydrophobicContact CH2-CG2 4.44Å; W494-T553 HydrophobicContact CZ2-CG2 4.02Å; W494-T553 PolarHBondContact NE1-O 2.86Å
554	G	73.9	Confident	75.3	Confident	13 Å²	13	76.8 Å²	76.8	13%	0.134	37%	0.371	C	S	.	.			trans	87	164.8	-172.2	0	0	0	0	0	113.1	G397 D536 T556	G397-G554 WeakPolarHBondContact CA-O 3.5Å; D536-G554 WeakPolarHBondContact O-CA 3.31Å; D536-G554 PolarHBondContact O-N 3.37Å; G554-T556 PolarHBondContact O-N 3.39Å
555	R	63.1	Low	74.5	Confident	181 Å²	181	78.5 Å²	78.5	68%	0.683	38%	0.377	S	S	*	.			trans	-64	126.1	-178.9	-71.4	-178.9	175.2	163.9	2.4	110.2	D396 M557	D396-R555 IonicContact OD1-NE 3.45Å; D396-R555 IonicContact OD1-NH2 2.7Å; R555-M557 PolarHBondContact O-N 2.98Å
556	T	52.8	Low	73.5	Confident	108 Å²	108	81.7 Å²	81.7	66%	0.663	39%	0.394	S	S	*	.			trans	-63.1	107.4	158.7	40.9	0	0	0	0	106.9	G554 K558	G554-T556 PolarHBondContact O-N 3.39Å; T556-K558 PolarHBondContact O-N 2.9Å
557	M	42.2	Very low	72.2	Confident	177 Å²	177	87.7 Å²	87.7	87%	0.872	42%	0.421	S	S	*	.			trans	-52.6	116.3	166.2	-71.9	-87.6	-90	0	0	106.4	R555 K559	R555-M557 PolarHBondContact O-N 2.98Å; M557-K559 PolarHBondContact O-N 3.36Å; M557-K559 VanDerWaalsContact O-N 3.1Å
558	K	36.6	Very low	70.3	Confident	202 Å²	202	93.8 Å²	93.8	88%	0.878	45%	0.45	S	S	*	.			trans	-53.6	118.4	161.8	-78.5	-179.8	172.9	-178.6	0	105.4	T556	T556-K558 PolarHBondContact O-N 2.9Å
559	K	33.2	Very low	68.1	Low	277 Å²	277	102.3 Å²	102.3	100%	1.204	49%	0.491	S	S	*	.			trans	-67.3	0	154.1	-94.3	-172.3	172.2	-173.3	0	108.1	M557	M557-K559 PolarHBondContact O-N 3.36Å; M557-K559 VanDerWaalsContact O-N 3.1Å

Retrieved 559 of 559 residues in 2963.1 ms (Link to these results)

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