A0A060D4M4_MAIZE Loading...

GRAS transcription factor

AlphaFold DB , UniProt , Accession A0A060D4M4, Species MAIZE (Zea mays, Maize), Gene GRAS65, Length 551 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	34.2	Very low	39.3	Very low	203 Å²	203	82.4 Å²	82.4	100%	1	47%	0.472	S	S	*	.				0	-52.4	0	-73.2	-175.3	-167.3	0	0	112.7	Y3 M4	M1-Y3 PolarHBondContact O-N 3.42Å; M1-M4 PolarHBondContact O-N 3.23Å; M1-M4 VanDerWaalsContact O-N 3.09Å
2	A	32.2	Very low	39.9	Very low	87 Å²	87	82.6 Å²	82.6	72%	0.719	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.5	174.7	0	0	0	0	0	114.7	M4	A2-M4 VanDerWaalsContact C-N 3.31Å; A2-M4 PolarHBondContact O-N 3.36Å
3	Y	35	Very low	41	Very low	165 Å²	165	79.6 Å²	79.6	65%	0.647	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-14.7	178.1	-71.7	-81.3	0	0	0	115.4	M1 L254	M1-Y3 PolarHBondContact O-N 3.42Å; Y3-L254 HydrophobicContact CE1-CD2 4.06Å
4	M	34.5	Very low	42	Very low	128 Å²	128	75.6 Å²	75.6	63%	0.631	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-28.9	-179.8	-66.6	-161.8	-175.3	0	0	113.2	M1 A2	M1-M4 PolarHBondContact O-N 3.23Å; M1-M4 VanDerWaalsContact O-N 3.09Å; A2-M4 VanDerWaalsContact C-N 3.31Å; A2-M4 PolarHBondContact O-N 3.36Å
5	C	34.1	Very low	42.8	Very low	62 Å²	62	73.1 Å²	73.1	42%	0.419	43%	0.427	S	S	.	.	H	α-helix	trans	-78.9	-18.5	-177.4	-59.7	0	0	0	0	114.2	S8	C5-S8 PolarHBondContact O-OG 3.13Å
6	A	38.4	Very low	44.1	Very low	55 Å²	55	75.2 Å²	75.2	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-78.9	-24.6	178.7	0	0	0	0	0	112.9
7	D	45.5	Very low	45.3	Very low	43 Å²	43	72.5 Å²	72.5	23%	0.23	41%	0.414	C	S	.	.	H	α-helix	trans	-73.6	-27.7	177.9	-86.2	11.2	0	0	0	112.1	L11 K257 R342	D7-L11 WeakPolarHBondContact O-CD1 3.33Å; D7-L11 VanDerWaalsContact O-CG 3.32Å; D7-L11 WeakPolarHBondContact O-CG 3.46Å; D7-L11 PolarHBondContact O-N 3.32Å; D7-K257 IonicContact OD1-NZ 3.31Å; D7-K257 PolarHBondContact OD1-NZ 3.29Å; D7-R342 IonicContact OD2-NH1 2.83Å; D7-R342 PolarHBondContact OD2-NH1 3.2Å
8	S	37.3	Very low	46.3	Very low	20 Å²	20	69.3 Å²	69.3	14%	0.14	40%	0.397	C	S	.	.	H	α-helix	trans	-70.4	-38.1	179.8	57	0	0	0	0	112.6	C5 N10 L11 M12	C5-S8 PolarHBondContact O-OG 3.13Å; S8-N10 PolarHBondContact O-N 3.39Å; S8-L11 PolarHBondContact O-N 3Å; S8-M12 WeakPolarHBondContact O-CB 3.36Å; S8-M12 PolarHBondContact O-N 3.04Å
9	G	41.3	Very low	47.5	Very low	39 Å²	39	69.8 Å²	69.8	40%	0.402	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-40.1	178.7	0	0	0	0	0	113.4	A13	G9-A13 PolarHBondContact O-N 3.33Å; G9-A13 VanDerWaalsContact O-N 3.12Å
10	N	50.8	Low	48.6	Very low	32 Å²	32	72 Å²	72	17%	0.171	40%	0.404	C	S	.	.	H	α-helix	trans	-73	-37.8	178.5	-129	-4.8	0	0	0	111.6	S8 A13 I14 D261 K267	S8-N10 PolarHBondContact O-N 3.39Å; N10-A13 PolarHBondContact O-N 2.92Å; N10-I14 WeakPolarHBondContact O-CG1 3.39Å; N10-I14 PolarHBondContact O-N 2.95Å; N10-I14 VanDerWaalsContact O-N 3.09Å; N10-D261 PolarHBondContact ND2-OD1 3.05Å; N10-K267 WeakPolarHBondContact OD1-CE 3.32Å; N10-K267 PolarHBondContact OD1-NZ 3.09Å
11	L	49	Very low	49.3	Very low	72 Å²	72	69.7 Å²	69.7	38%	0.377	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-40.5	173.7	-75.8	168.5	0	0	0	111.9	D7 S8 I14 A15 I298 A301	D7-L11 WeakPolarHBondContact O-CD1 3.33Å; D7-L11 VanDerWaalsContact O-CG 3.32Å; D7-L11 WeakPolarHBondContact O-CG 3.46Å; D7-L11 PolarHBondContact O-N 3.32Å; S8-L11 PolarHBondContact O-N 3Å; L11-I14 PolarHBondContact O-N 3.31Å; L11-A15 WeakPolarHBondContact O-CB 3.47Å; L11-A15 PolarHBondContact O-N 3.02Å; L11-I298 HydrophobicContact CD2-CD1 4.14Å; L11-I298 HydrophobicContact CD2-CG1 3.89Å; L11-A301 HydrophobicContact CD2-CB 4.36Å
12	M	47.1	Very low	50.8	Low	85 Å²	85	62 Å²	62	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-63.7	-44.1	176.3	-173.1	-173.1	67.7	0	0	111.4	S8 I14 A15 Q16	S8-M12 WeakPolarHBondContact O-CB 3.36Å; S8-M12 PolarHBondContact O-N 3.04Å; M12-I14 VanDerWaalsContact C-N 3.34Å; M12-I14 PolarHBondContact O-N 3.36Å; M12-A15 PolarHBondContact O-N 3.44Å; M12-Q16 HydrophobicContact CG-CG 4.34Å; M12-Q16 WeakPolarHBondContact O-CB 3.39Å; M12-Q16 VanDerWaalsContact O-CG 3.29Å; M12-Q16 WeakPolarHBondContact O-CG 3.49Å; M12-Q16 PolarHBondContact O-N 3.4Å
13	A	53.7	Low	52.7	Low	44 Å²	44	63.1 Å²	63.1	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-61	-43.1	176.9	0	0	0	0	0	111.8	G9 N10 Q17	G9-A13 PolarHBondContact O-N 3.33Å; G9-A13 VanDerWaalsContact O-N 3.12Å; N10-A13 PolarHBondContact O-N 2.92Å; A13-Q17 VanDerWaalsContact O-CB 3.25Å; A13-Q17 WeakPolarHBondContact O-CB 3.14Å; A13-Q17 PolarHBondContact O-N 3.14Å
14	I	55.1	Low	54.5	Low	24 Å²	24	59.6 Å²	59.6	12%	0.123	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-45.8	176	-66.7	167.2	0	0	0	110.7	N10 L11 M12 Q16 Q17 V18 I298 A302	N10-I14 WeakPolarHBondContact O-CG1 3.39Å; N10-I14 PolarHBondContact O-N 2.95Å; N10-I14 VanDerWaalsContact O-N 3.09Å; L11-I14 PolarHBondContact O-N 3.31Å; M12-I14 VanDerWaalsContact C-N 3.34Å; M12-I14 PolarHBondContact O-N 3.36Å; I14-Q16 PolarHBondContact O-N 3.01Å; I14-Q17 PolarHBondContact O-N 3.48Å; I14-V18 HydrophobicContact CG2-CG2 4.38Å; I14-V18 VanDerWaalsContact O-CG2 3.27Å; I14-V18 WeakPolarHBondContact O-CG2 3.41Å; I14-V18 PolarHBondContact O-N 3.35Å; I14-I298 HydrophobicContact CD1-CD1 3.79Å; I14-I298 HydrophobicContact CD1-CG1 4.03Å; I14-A302 HydrophobicContact CG2-CB 4.11Å
15	A	54.2	Low	56	Low	38 Å²	38	56.1 Å²	56.1	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-45.3	178.6	0	0	0	0	0	111.7	L11 M12 Q17 V18 I19	L11-A15 WeakPolarHBondContact O-CB 3.47Å; L11-A15 PolarHBondContact O-N 3.02Å; M12-A15 PolarHBondContact O-N 3.44Å; A15-Q17 VanDerWaalsContact C-N 3.33Å; A15-Q17 PolarHBondContact O-N 2.89Å; A15-V18 PolarHBondContact O-N 2.93Å; A15-I19 WeakPolarHBondContact O-CD1 3.43Å; A15-I19 VanDerWaalsContact O-CG1 3.23Å; A15-I19 WeakPolarHBondContact O-CG1 3.48Å; A15-I19 PolarHBondContact O-N 2.88Å
16	Q	63.3	Low	57.8	Low	106 Å²	106	59 Å²	59	50%	0.495	32%	0.32	S	S	.	.	H	α-helix	trans	-61.1	-41.6	175.8	-76.5	176.2	-14.4	0	0	111.8	M12 I14 I19 Q20	M12-Q16 HydrophobicContact CG-CG 4.34Å; M12-Q16 WeakPolarHBondContact O-CB 3.39Å; M12-Q16 VanDerWaalsContact O-CG 3.29Å; M12-Q16 WeakPolarHBondContact O-CG 3.49Å; M12-Q16 PolarHBondContact O-N 3.4Å; I14-Q16 PolarHBondContact O-N 3.01Å; Q16-I19 PolarHBondContact O-N 3.21Å; Q16-Q20 PolarHBondContact O-N 3.25Å
17	Q	64.2	Low	59.3	Low	29 Å²	29	62.1 Å²	62.1	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-66.7	-40.8	178.2	-167.8	167.3	4.1	0	0	111.7	A13 I14 A15 Q20 Q21 L514	A13-Q17 VanDerWaalsContact O-CB 3.25Å; A13-Q17 WeakPolarHBondContact O-CB 3.14Å; A13-Q17 PolarHBondContact O-N 3.14Å; I14-Q17 PolarHBondContact O-N 3.48Å; A15-Q17 VanDerWaalsContact C-N 3.33Å; A15-Q17 PolarHBondContact O-N 2.89Å; Q17-Q20 PolarHBondContact O-N 3.04Å; Q17-Q21 WeakPolarHBondContact O-CB 3.29Å; Q17-Q21 PolarHBondContact O-N 3.44Å; Q17-L514 HydrophobicContact CG-CD2 4.05Å; Q17-L514 HydrophobicContact CG-CG 4.41Å; Q17-L514 PolarHBondContact NE2-O 3.38Å
18	V	64.4	Low	60.4	Low	16 Å²	16	65.9 Å²	65.9	10%	0.097	34%	0.341	C	S	.	.	H	α-helix	trans	-63.3	-41.2	173.6	172.6	0	0	0	0	111.1	I14 A15 Q21 Q22 Q305	I14-V18 HydrophobicContact CG2-CG2 4.38Å; I14-V18 VanDerWaalsContact O-CG2 3.27Å; I14-V18 WeakPolarHBondContact O-CG2 3.41Å; I14-V18 PolarHBondContact O-N 3.35Å; A15-V18 PolarHBondContact O-N 2.93Å; V18-Q21 WeakPolarHBondContact O-CB 3.33Å; V18-Q21 PolarHBondContact O-N 3.29Å; V18-Q22 PolarHBondContact O-N 3.46Å; V18-Q305 HydrophobicContact CG1-CG 4.02Å
19	I	68.4	Low	61.6	Low	78 Å²	78	69.5 Å²	69.5	40%	0.4	36%	0.356	S	S	.	.	H	α-helix	trans	-63.8	-48.4	176.1	-69.3	164	0	0	0	111	A15 Q16 Q21 Q22 Q23	A15-I19 WeakPolarHBondContact O-CD1 3.43Å; A15-I19 VanDerWaalsContact O-CG1 3.23Å; A15-I19 WeakPolarHBondContact O-CG1 3.48Å; A15-I19 PolarHBondContact O-N 2.88Å; Q16-I19 PolarHBondContact O-N 3.21Å; I19-Q21 PolarHBondContact O-N 3.09Å; I19-Q22 PolarHBondContact O-N 3.19Å; I19-Q23 WeakPolarHBondContact O-CG 3.23Å; I19-Q23 PolarHBondContact O-N 3.17Å; I19-Q23 VanDerWaalsContact O-N 3.09Å
20	Q	69.5	Low	62.4	Low	114 Å²	114	76.8 Å²	76.8	53%	0.533	37%	0.372	S	S	.	.	H	α-helix	trans	-57.3	-41.3	175.6	-96.1	-178.7	-7.7	0	0	111.5	Q16 Q17 Q22 Q23 Q24	Q16-Q20 PolarHBondContact O-N 3.25Å; Q17-Q20 PolarHBondContact O-N 3.04Å; Q20-Q22 VanDerWaalsContact C-N 3.34Å; Q20-Q22 PolarHBondContact O-N 3.05Å; Q20-Q23 PolarHBondContact O-N 3.34Å; Q20-Q24 WeakPolarHBondContact O-CG 3.17Å; Q20-Q24 PolarHBondContact O-N 3.35Å
21	Q	63.4	Low	62.8	Low	23 Å²	23	82.4 Å²	82.4	11%	0.107	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-41.3	179	-163.2	-169	6.7	0	0	111.9	Q17 V18 I19 Q24 Q25 L514	Q17-Q21 WeakPolarHBondContact O-CB 3.29Å; Q17-Q21 PolarHBondContact O-N 3.44Å; V18-Q21 WeakPolarHBondContact O-CB 3.33Å; V18-Q21 PolarHBondContact O-N 3.29Å; I19-Q21 PolarHBondContact O-N 3.09Å; Q21-Q24 PolarHBondContact O-N 2.94Å; Q21-Q25 WeakPolarHBondContact O-CG 3.49Å; Q21-Q25 PolarHBondContact O-N 2.87Å; Q21-L514 HydrophobicContact CB-CD2 4.44Å; Q21-L514 HydrophobicContact CG-CD2 4.47Å
22	Q	66	Low	63	Low	41 Å²	41	85.6 Å²	85.6	19%	0.192	41%	0.409	C	S	.	.	H	α-helix	trans	-65	-39.7	176.5	-78.1	175.8	14.8	0	0	112.6	V18 I19 Q20 Q24 Q25 Q26 T309	V18-Q22 PolarHBondContact O-N 3.46Å; I19-Q22 PolarHBondContact O-N 3.19Å; Q20-Q22 VanDerWaalsContact C-N 3.34Å; Q20-Q22 PolarHBondContact O-N 3.05Å; Q22-Q24 VanDerWaalsContact C-N 3.29Å; Q22-Q24 PolarHBondContact O-N 3.43Å; Q22-Q25 PolarHBondContact O-N 3.32Å; Q22-Q26 WeakPolarHBondContact O-CG 3.38Å; Q22-Q26 PolarHBondContact O-N 2.91Å; Q22-T309 PolarHBondContact NE2-OG1 3.43Å
23	Q	71.5	Confident	63.3	Low	112 Å²	112	89.3 Å²	89.3	52%	0.523	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-41.5	174.8	-68.5	177.3	-2.1	0	0	110.9	I19 Q20 Q26 Q27	I19-Q23 WeakPolarHBondContact O-CG 3.23Å; I19-Q23 PolarHBondContact O-N 3.17Å; I19-Q23 VanDerWaalsContact O-N 3.09Å; Q20-Q23 PolarHBondContact O-N 3.34Å; Q23-Q26 PolarHBondContact O-N 2.67Å; Q23-Q27 WeakPolarHBondContact O-CG 3.28Å; Q23-Q27 PolarHBondContact O-N 3.03Å
24	Q	73.6	Confident	63	Low	90 Å²	90	95 Å²	95	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-66.1	-37.6	174.4	-70.5	179.8	1.1	0	0	112.8	Q20 Q21 Q22 Q27 H28	Q20-Q24 WeakPolarHBondContact O-CG 3.17Å; Q20-Q24 PolarHBondContact O-N 3.35Å; Q21-Q24 PolarHBondContact O-N 2.94Å; Q22-Q24 VanDerWaalsContact C-N 3.29Å; Q22-Q24 PolarHBondContact O-N 3.43Å; Q24-Q27 PolarHBondContact O-N 3.36Å; Q24-H28 PolarHBondContact O-N 3.37Å; Q24-H28 PolarHBondContact O-ND1 3.3Å
25	Q	65.5	Low	62	Low	55 Å²	55	100 Å²	100	26%	0.257	47%	0.471	S	S	.	.	H	α-helix	trans	-63.5	-44.1	174.2	-76.5	-179.4	3	0	0	111.7	Q21 Q22 Q27 H28 Q29	Q21-Q25 WeakPolarHBondContact O-CG 3.49Å; Q21-Q25 PolarHBondContact O-N 2.87Å; Q22-Q25 PolarHBondContact O-N 3.32Å; Q25-Q27 VanDerWaalsContact C-N 3.3Å; Q25-Q27 PolarHBondContact O-N 2.64Å; Q25-H28 PolarHBondContact O-N 3.32Å; Q25-Q29 WeakPolarHBondContact O-CB 3.33Å; Q25-Q29 WeakPolarHBondContact O-CG 3.37Å; Q25-Q29 PolarHBondContact O-N 3.49Å
26	Q	71.2	Confident	61.3	Low	122 Å²	122	103.1 Å²	103.1	57%	0.57	49%	0.487	S	S	*	.	H	α-helix	trans	-63.8	-36.6	176.6	-70.9	-179.7	17.2	0	0	111.7	Q22 Q23 R30	Q22-Q26 WeakPolarHBondContact O-CG 3.38Å; Q22-Q26 PolarHBondContact O-N 2.91Å; Q23-Q26 PolarHBondContact O-N 2.67Å; Q26-R30 WeakPolarHBondContact O-CB 3.5Å; Q26-R30 WeakPolarHBondContact O-CG 3.25Å; Q26-R30 PolarHBondContact O-N 2.83Å
27	Q	71.2	Confident	60.3	Low	122 Å²	122	104 Å²	104	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-66.8	-44.4	173.9	-74.7	178.4	-8.5	0	0	112.5	Q23 Q24 Q25 R30 H31	Q23-Q27 WeakPolarHBondContact O-CG 3.28Å; Q23-Q27 PolarHBondContact O-N 3.03Å; Q24-Q27 PolarHBondContact O-N 3.36Å; Q25-Q27 VanDerWaalsContact C-N 3.3Å; Q25-Q27 PolarHBondContact O-N 2.64Å; Q27-R30 PolarHBondContact O-N 3.45Å; Q27-H31 PolarHBondContact O-N 2.78Å
28	H	68.3	Low	59.3	Low	121 Å²	121	110.3 Å²	110.3	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-39.6	178.3	-80.5	80.1	0	0	0	112.5	Q24 Q25 H31 H32	Q24-H28 PolarHBondContact O-N 3.37Å; Q24-H28 PolarHBondContact O-ND1 3.3Å; Q25-H28 PolarHBondContact O-N 3.32Å; H28-H31 PolarHBondContact O-N 2.78Å; H28-H32 PolarHBondContact O-N 3.28Å
29	Q	61.8	Low	58.5	Low	97 Å²	97	115.1 Å²	115.1	45%	0.453	57%	0.568	S	S	.	*	H	α-helix	trans	-66	-37.7	174.7	-72.9	179.8	4.5	0	0	111.9	Q25 H32 H33	Q25-Q29 WeakPolarHBondContact O-CB 3.33Å; Q25-Q29 WeakPolarHBondContact O-CG 3.37Å; Q25-Q29 PolarHBondContact O-N 3.49Å; Q29-H32 PolarHBondContact O-N 3.17Å; Q29-H33 PolarHBondContact O-N 3.33Å; Q29-H33 VanDerWaalsContact O-N 3.13Å
30	R	59.5	Low	57.5	Low	191 Å²	191	119 Å²	119	72%	0.721	59%	0.589	S	S	*	*	H	α-helix	trans	-64.9	-36.8	173.5	-81.5	-176.5	159.8	179.6	-3.5	112.9	Q26 Q27 H34	Q26-R30 WeakPolarHBondContact O-CB 3.5Å; Q26-R30 WeakPolarHBondContact O-CG 3.25Å; Q26-R30 PolarHBondContact O-N 2.83Å; Q27-R30 PolarHBondContact O-N 3.45Å; R30-H34 PolarHBondContact O-CD2 3.07Å
31	H	57.3	Low	56.6	Low	151 Å²	151	119.3 Å²	119.3	70%	0.699	60%	0.6	S	S	*	*	H	α-helix	trans	-72.4	-31.4	176	-83.4	-50.8	0	0	0	113.6	Q27 H28	Q27-H31 PolarHBondContact O-N 2.78Å; H28-H31 PolarHBondContact O-N 2.78Å
32	H	54.7	Low	55.7	Low	138 Å²	138	126 Å²	126	64%	0.639	64%	0.636	S	S	*	*	H	α-helix	trans	-79.7	-21	176.4	-83.9	-58.7	0	0	0	114.6	H28 Q29	H28-H32 PolarHBondContact O-N 3.28Å; Q29-H32 PolarHBondContact O-N 3.17Å
33	H	53.2	Low	55	Low	164 Å²	164	129.1 Å²	129.1	76%	0.759	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-0.5	175.7	-77.8	-31.1	0	0	0	115.4	Q29	Q29-H33 PolarHBondContact O-N 3.33Å; Q29-H33 VanDerWaalsContact O-N 3.13Å
34	H	46.6	Very low	53.7	Low	163 Å²	163	130.2 Å²	130.2	76%	0.755	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	13.7	176.5	-78.4	-51.4	0	0	0	115.4	R30 P36	R30-H34 PolarHBondContact O-CD2 3.07Å; H34-P36 WeakPolarHBondContact O-CD 3.27Å
35	L	35.3	Very low	52.3	Low	130 Å²	130	137.6 Å²	137.6	68%	0.681	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-81.5	118	166.2	-90.3	144.9	0	0	0	109.8
36	P	37.8	Very low	51.2	Low	103 Å²	103	144.4 Å²	144.4	67%	0.669	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-64.2	148.2	173.3	28.2	-31.3	0	0	0	109.1	H34 L38	H34-P36 WeakPolarHBondContact O-CD 3.27Å; P36-L38 PolarHBondContact O-N 3.04Å
37	P	42.1	Very low	49.9	Very low	124 Å²	124	143.3 Å²	143.3	81%	0.805	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-61.4	125.9	179.2	24.6	-30.3	0	0	0	109.5
38	L	44.5	Very low	49.2	Very low	161 Å²	161	143 Å²	143	84%	0.843	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-54.2	136.3	168.3	-90.9	147.7	0	0	0	109.3	P36 L40	P36-L38 PolarHBondContact O-N 3.04Å; L38-L40 PolarHBondContact O-N 3.49Å
39	P	47.6	Very low	48.4	Very low	118 Å²	118	143.5 Å²	143.5	77%	0.766	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-64.2	126.8	179	-13.4	26.6	0	0	0	110.2
40	L	47.4	Very low	47.9	Very low	160 Å²	160	147.4 Å²	147.4	84%	0.838	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-57.7	134	170	-78.5	159.6	0	0	0	110	L38 L42	L38-L40 PolarHBondContact O-N 3.49Å; L40-L42 PolarHBondContact O-N 3.26Å
41	P	49.2	Very low	47.6	Very low	119 Å²	119	143.3 Å²	143.3	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.4	124.4	176.3	24.9	-26.3	0	0	0	110.3
42	L	45	Very low	47.4	Very low	164 Å²	164	142.2 Å²	142.2	86%	0.859	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-59.5	143	171.5	-82.9	145.6	0	0	0	111	L40	L40-L42 PolarHBondContact O-N 3.26Å
43	P	51.1	Low	46.7	Very low	106 Å²	106	140.3 Å²	140.3	69%	0.688	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.5	150.4	178.2	30.1	-32.5	0	0	0	110.8	R45	P43-R45 PolarHBondContact O-N 3.46Å
44	P	43.8	Very low	46.7	Very low	135 Å²	135	138.7 Å²	138.7	88%	0.877	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.4	118.3	-171.6	29	-32	0	0	0	110.5
45	R	44.5	Very low	47	Very low	246 Å²	246	135.5 Å²	135.5	93%	0.928	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-102.1	131.9	164.7	-112.6	-177.5	171.9	-179.4	-1.9	109.3	P43	P43-R45 PolarHBondContact O-N 3.46Å
46	Q	42.7	Very low	47.6	Very low	198 Å²	198	135.1 Å²	135.1	93%	0.925	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-47.1	131.3	-176.3	-68.8	163.5	-25.8	0	0	113.5
47	A	43.7	Very low	47.9	Very low	98 Å²	98	135.2 Å²	135.2	81%	0.81	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-89.2	134.7	169.5	0	0	0	0	0	110.7
48	P	56.6	Low	48	Very low	116 Å²	116	134.6 Å²	134.6	75%	0.753	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-82.9	161.6	166.4	34	-30.2	0	0	0	111.1
49	P	52.3	Low	48.2	Very low	131 Å²	131	132 Å²	132	85%	0.851	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-84.4	145.6	-165.8	33.8	-33	0	0	0	113
50	M	51.8	Low	47.9	Very low	180 Å²	180	135.7 Å²	135.7	89%	0.887	82%	0.818	S	S	*	*			trans	-108.3	151.4	172.1	-88.7	-83	-73.4	0	0	111.4
51	P	52.7	Low	47.5	Very low	104 Å²	104	131.3 Å²	131.3	68%	0.675	81%	0.811	S	S	*	*			trans	-89.7	175.2	-161.4	38.8	-36.5	0	0	0	114
52	P	51.9	Low	47.1	Very low	129 Å²	129	134.6 Å²	134.6	84%	0.838	82%	0.816	S	S	*	*			trans	-90.7	162.7	-158.6	36	-32.7	0	0	0	115.3
53	A	41.7	Very low	47	Very low	97 Å²	97	134.3 Å²	134.3	80%	0.802	81%	0.814	S	S	*	*			trans	-76.4	162.7	-177.8	0	0	0	0	0	115.1
54	P	53.2	Low	46.7	Very low	131 Å²	131	134.4 Å²	134.4	85%	0.851	81%	0.814	S	S	*	*			trans	-118.4	150.3	148.7	30.8	-15.5	0	0	0	112.9
55	A	51.6	Low	46.5	Very low	95 Å²	95	132.7 Å²	132.7	79%	0.785	81%	0.811	S	S	*	*			trans	-98.2	-164.2	-172.1	0	0	0	0	0	112.1
56	P	49.2	Very low	46.3	Very low	123 Å²	123	125 Å²	125	80%	0.799	80%	0.8	S	S	*	*				-121.6	177.2	-112.9	29.8	-7.2	0	0	0	114.2
57	A	43.1	Very low	46	Very low	105 Å²	105	121.1 Å²	121.1	87%	0.868	80%	0.795	S	S	*	*			trans	-140.6	130	163	0	0	0	0	0	111.1
58	S	43.9	Very low	45.4	Very low	110 Å²	110	124.3 Å²	124.3	77%	0.769	80%	0.798	S	S	*	*			trans	-100.7	-164.4	-178.9	-39.1	0	0	0	0	110.1
59	P	49.6	Very low	44.7	Very low	106 Å²	106	124.1 Å²	124.1	69%	0.688	80%	0.797	S	S	*	*				-130.6	-178.2	-66	33.5	-13.9	0	0	0	111.8
60	H	42	Very low	43.9	Very low	197 Å²	197	129.1 Å²	129.1	91%	0.912	80%	0.8	S	S	*	*			trans	160.1	132.6	151.1	-82.3	-50.3	0	0	0	108
61	G	38.1	Very low	43	Very low	67 Å²	67	123.9 Å²	123.9	69%	0.691	79%	0.792	S	S	*	*			cis	-171.6	166	-1.3	0	0	0	0	0	111.9
62	Q	40.7	Very low	41.9	Very low	188 Å²	188	123.2 Å²	123.2	88%	0.879	80%	0.804	S	S	*	*			trans	56.1	114.2	150.2	-61.9	174.6	-12.5	0	0	119.1
63	I	43	Very low	40.8	Very low	158 Å²	158	120.7 Å²	120.7	81%	0.81	80%	0.801	S	S	*	*			cis	69.9	145.4	43.3	-53.6	-177	0	0	0	113.1
64	P	45.1	Very low	40.2	Very low	109 Å²	109	120.1 Å²	120.1	71%	0.708	80%	0.797	S	S	*	*			cis	-143.3	175.3	-10.8	30.8	-9.1	0	0	0	118.9
65	A	40.1	Very low	39	Very low	98 Å²	98	125.4 Å²	125.4	81%	0.81	80%	0.8	S	S	*	*			trans	68.8	150.3	135.3	0	0	0	0	0	120.7
66	A	38.3	Very low	37.9	Very low	84 Å²	84	125.5 Å²	125.5	69%	0.694	80%	0.795	S	S	*	*			cis	-162.7	154.2	27.5	0	0	0	0	0	114.5
67	S	37.6	Very low	36.9	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	80%	0.8	S	S	*	*			trans	70.2	116.4	137.3	42.1	0	0	0	0	124.1
68	L	30.8	Very low	36.3	Very low	164 Å²	164	128 Å²	128	86%	0.859	79%	0.794	S	S	*	*			trans	-77.6	-165.9	150.2	-63.6	159.4	0	0	0	110.5
69	P	41.4	Very low	35.5	Very low	113 Å²	113	129.4 Å²	129.4	73%	0.734	79%	0.793	S	S	*	*			cis	-139.3	-172.3	-14.5	23.5	2.8	0	0	0	114.9
70	Y	35.3	Very low	34.7	Very low	236 Å²	236	132.4 Å²	132.4	93%	0.925	80%	0.797	S	S	*	*			trans	101.6	132.2	135.8	-141.6	-95.1	0	0	0	120.4
71	G	33.4	Very low	34	Very low	69 Å²	69	131.5 Å²	131.5	71%	0.711	79%	0.791	S	S	*	*			trans	133.8	102.3	154.2	0	0	0	0	0	115.3
72	G	29	Very low	33.6	Very low	90 Å²	90	137.9 Å²	137.9	93%	0.928	80%	0.8	S	S	*	*			trans	-92	173.5	174.1	0	0	0	0	0	114.4
73	G	29.5	Very low	33.4	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	79%	0.787	S	S	*	*			trans	137.4	82.4	159.8	0	0	0	0	0	117.6
74	A	29.2	Very low	32.6	Very low	86 Å²	86	133.3 Å²	133.3	71%	0.711	79%	0.788	S	S	*	*				67.7	141.4	125.6	0	0	0	0	0	124.5
75	W	28.5	Very low	31.8	Very low	242 Å²	242	132.1 Å²	132.1	92%	0.917	79%	0.787	S	S	*	*			trans	93.8	125.3	154.9	-58.1	88.6	0	0	0	122.1
76	S	28.9	Very low	31.4	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	79%	0.794	S	S	*	*			trans	73	111.4	149.5	-79.3	0	0	0	0	123
77	Q	27.7	Very low	31	Very low	191 Å²	191	140.1 Å²	140.1	89%	0.893	80%	0.8	S	S	*	*				56.6	109.2	116.9	-159	178	31.2	0	0	118.7
78	A	29.4	Very low	30.7	Very low	90 Å²	90	137.5 Å²	137.5	74%	0.744	79%	0.791	S	S	*	*			trans	175.2	157.3	130.1	0	0	0	0	0	110.5
79	D	26.9	Very low	30.8	Very low	139 Å²	139	136.1 Å²	136.1	74%	0.743	79%	0.79	S	S	*	*			trans	-49.7	166.5	-177.4	-58.7	-66.6	0	0	0	116.1
80	H	33	Very low	30.2	Very low	168 Å²	168	136.1 Å²	136.1	78%	0.778	79%	0.792	S	S	*	*			trans	155.2	114.8	134.7	-74.1	-48	0	0	0	112
81	F	28	Very low	30.3	Very low	178 Å²	178	130.3 Å²	130.3	78%	0.781	78%	0.783	S	S	*	*				40.5	129	124.6	-89.3	-98.3	0	0	0	119.6
82	F	30.1	Very low	30.3	Very low	202 Å²	202	131.1 Å²	131.1	89%	0.886	78%	0.784	S	S	*	*				177.5	137.7	117.9	-98.8	-73.8	0	0	0	110.9
83	P	35.3	Very low	30.4	Very low	94 Å²	94	134.5 Å²	134.5	61%	0.61	78%	0.78	S	S	*	*			trans	-100.7	176.8	175.9	38.9	-31.6	0	0	0	113.8
84	D	27.8	Very low	30.4	Very low	155 Å²	155	135.8 Å²	135.8	83%	0.829	78%	0.783	S	S	*	*			trans	91.4	118.2	153.4	-69.2	-23.4	0	0	0	122.9
85	A	28	Very low	30.4	Very low	84 Å²	84	137.5 Å²	137.5	69%	0.694	79%	0.785	S	S	*	*				72.1	116.6	129.1	0	0	0	0	0	121
86	F	30.9	Very low	30.4	Very low	217 Å²	217	135.9 Å²	135.9	95%	0.952	79%	0.785	S	S	*	*			trans	-132.1	123.1	141.2	-123.2	-90.5	0	0	0	111.3
87	V	30.2	Very low	30.4	Very low	134 Å²	134	136.1 Å²	136.1	81%	0.812	78%	0.784	S	S	*	*			trans	-86.2	145.3	176.5	167.9	0	0	0	0	109.4
88	G	32.4	Very low	30.4	Very low	62 Å²	62	133.2 Å²	133.2	64%	0.639	77%	0.774	S	S	*	*			trans	178.9	71.5	170.6	0	0	0	0	0	116.8
89	T	32.7	Very low	30.4	Very low	136 Å²	136	137.7 Å²	137.7	83%	0.834	79%	0.785	S	S	*	*			trans	57.9	95.9	139	59	0	0	0	0	121.8
90	S	28.4	Very low	30.6	Very low	113 Å²	113	135.9 Å²	135.9	79%	0.79	78%	0.783	S	S	*	*				14.3	171.3	117.1	-139.3	0	0	0	0	121.8
91	P	36.7	Very low	30.5	Very low	113 Å²	113	131.6 Å²	131.6	73%	0.734	78%	0.777	S	S	*	*			cis	-136	166.1	-11.4	13.3	12.9	0	0	0	115.3
92	A	33.9	Very low	30.7	Very low	87 Å²	87	128.2 Å²	128.2	72%	0.719	78%	0.781	S	S	*	*				171.6	105.1	126.1	0	0	0	0	0	112.7
93	D	30.4	Very low	30.8	Very low	161 Å²	161	122.5 Å²	122.5	86%	0.861	77%	0.772	S	S	*	*			trans	46.4	102.5	134.7	-54.4	-26.6	0	0	0	121.5
94	A	30.8	Very low	30.6	Very low	102 Å²	102	125.7 Å²	125.7	84%	0.843	78%	0.784	S	S	*	*			trans	-158.7	110.9	131.3	0	0	0	0	0	110.6
95	V	29.3	Very low	30.9	Very low	122 Å²	122	126.2 Å²	126.2	74%	0.739	78%	0.779	S	S	*	*			trans	-72.5	131.2	176.1	170.3	0	0	0	0	110.6
96	F	28.3	Very low	31.3	Very low	209 Å²	209	127.1 Å²	127.1	92%	0.917	77%	0.772	S	S	*	*			trans	-144.9	117.3	146.4	-92.4	-75.7	0	0	0	109.9
97	P	28.1	Very low	31.5	Very low	102 Å²	102	118.9 Å²	118.9	66%	0.662	74%	0.741	S	S	*	*			trans	-90	121.9	171.7	33.9	-25.2	0	0	0	109.5
98	D	29	Very low	31.6	Very low	129 Å²	129	117.3 Å²	117.3	69%	0.69	73%	0.728	S	S	*	*			trans	164.6	85.6	145.7	-107.6	-24.1	0	0	0	108.3
99	L	29.4	Very low	31.8	Very low	185 Å²	185	118.9 Å²	118.9	97%	0.969	73%	0.725	S	S	*	*	S	Bend	trans	-116.8	17.7	170.4	-85.2	167.9	0	0	0	111.7
100	S	30.1	Very low	32.1	Very low	101 Å²	101	117.3 Å²	117.3	71%	0.706	70%	0.704	S	S	*	*	S	Bend	trans	-124	7.2	-178.9	57.6	0	0	0	0	115
101	A	30.5	Very low	32.3	Very low	78 Å²	78	114.4 Å²	114.4	65%	0.645	68%	0.679	S	S	*	*	S	Bend	trans	-109.7	1.1	-178.8	0	0	0	0	0	114.9
102	A	32.4	Very low	32.4	Very low	106 Å²	106	114.8 Å²	114.8	88%	0.876	68%	0.675	S	S	*	*	S	Bend	trans	-97.7	13.9	173.5	0	0	0	0	0	113.1
103	A	32.3	Very low	32.7	Very low	83 Å²	83	115.6 Å²	115.6	69%	0.686	68%	0.675	S	S	*	*			trans	-99	-0.3	-176.3	0	0	0	0	0	114.4
104	D	30.3	Very low	32.8	Very low	161 Å²	161	113 Å²	113	86%	0.861	66%	0.66	S	S	*	*			trans	-112.1	73.1	175.7	-73.1	-20.8	0	0	0	110.3
105	F	36	Very low	33.1	Very low	165 Å²	165	112.6 Å²	112.6	72%	0.724	64%	0.643	S	S	*	*			trans	-109.2	98.4	160.6	-171.6	-97	0	0	0	108	S107	F105-S107 PolarHBondContact O-N 3.49Å
106	D	34.9	Very low	33.2	Very low	104 Å²	104	109.6 Å²	109.6	56%	0.556	64%	0.637	S	S	*	*			trans	-69.4	94.2	-178.6	-165	-5	0	0	0	110.1	D108	D106-D108 PolarHBondContact O-N 3.49Å; D106-D108 VanDerWaalsContact O-N 3.14Å
107	S	34.9	Very low	33.4	Very low	43 Å²	43	107.1 Å²	107.1	30%	0.301	63%	0.633	S	S	.	*	H	α-helix	trans	-61.3	-16.6	-176.2	-178.1	0	0	0	0	113.6	F105	F105-S107 PolarHBondContact O-N 3.49Å
108	D	32.4	Very low	33.7	Very low	101 Å²	101	106.8 Å²	106.8	54%	0.54	64%	0.639	S	S	.	*	H	α-helix	trans	-81.9	-33.1	-171.2	-65.9	-19.8	0	0	0	112.3	D106 W110 M111 D112	D106-D108 PolarHBondContact O-N 3.49Å; D106-D108 VanDerWaalsContact O-N 3.14Å; D108-W110 PolarHBondContact O-N 3.17Å; D108-M111 PolarHBondContact O-N 3.48Å; D108-M111 WeakPolarHBondContact OD1-CE 3.39Å; D108-D112 PolarHBondContact O-N 3.41Å
109	V	37.7	Very low	33.9	Very low	96 Å²	96	104.9 Å²	104.9	58%	0.582	63%	0.634	S	S	*	*	H	α-helix	trans	-72.9	-30	-179.5	-174.3	0	0	0	0	112.3
110	W	38.9	Very low	33.9	Very low	103 Å²	103	103.1 Å²	103.1	39%	0.39	63%	0.63	S	S	.	*	H	α-helix	trans	-77	-31.4	175.7	168.3	78.3	0	0	0	112.5	D108 S113 L114	D108-W110 PolarHBondContact O-N 3.17Å; W110-S113 PolarHBondContact O-N 3.36Å; W110-L114 HydrophobicContact CD2-CD1 4.12Å; W110-L114 HydrophobicContact CH2-CD1 3.93Å; W110-L114 HydrophobicContact CZ2-CD1 3.46Å; W110-L114 VanDerWaalsContact CZ2-CD1 3.46Å; W110-L114 HydrophobicContact CZ3-CD1 4.43Å
111	M	33.3	Very low	34.2	Very low	51 Å²	51	105.9 Å²	105.9	25%	0.251	63%	0.63	S	S	.	*	H	α-helix	trans	-66.8	-38.3	174.6	-79.8	-169.7	-65.9	0	0	112.5	D108 S113 L114 I115	D108-M111 PolarHBondContact O-N 3.48Å; D108-M111 WeakPolarHBondContact OD1-CE 3.39Å; M111-S113 VanDerWaalsContact C-N 3.28Å; M111-S113 PolarHBondContact O-N 3.48Å; M111-L114 PolarHBondContact O-N 3.35Å; M111-L114 VanDerWaalsContact O-N 3.17Å; M111-I115 WeakPolarHBondContact O-CG1 3.45Å; M111-I115 PolarHBondContact O-N 3.22Å
112	D	37.6	Very low	34.2	Very low	122 Å²	122	105.2 Å²	105.2	65%	0.652	63%	0.625	S	S	*	*	H	α-helix	trans	-67.5	-26.8	178.7	-80.3	-18.1	0	0	0	113.1	D108 L114 I115 G116	D108-D112 PolarHBondContact O-N 3.41Å; D112-L114 VanDerWaalsContact C-N 3.31Å; D112-L114 PolarHBondContact O-N 2.9Å; D112-I115 PolarHBondContact O-N 3.32Å; D112-G116 PolarHBondContact O-N 2.82Å
113	S	40.1	Very low	34.2	Very low	103 Å²	103	107.5 Å²	107.5	72%	0.72	62%	0.622	S	S	*	*	H	α-helix	trans	-76	-16.8	175.2	-66.6	0	0	0	0	113.8	W110 M111	W110-S113 PolarHBondContact O-N 3.36Å; M111-S113 VanDerWaalsContact C-N 3.28Å; M111-S113 PolarHBondContact O-N 3.48Å
114	L	33.7	Very low	34.2	Very low	107 Å²	107	107.2 Å²	107.2	56%	0.56	62%	0.615	S	S	*	*	H	α-helix	trans	-93.2	-12.7	176.2	-81.6	160.7	0	0	0	113.2	W110 M111 D112	W110-L114 HydrophobicContact CD2-CD1 4.12Å; W110-L114 HydrophobicContact CH2-CD1 3.93Å; W110-L114 HydrophobicContact CZ2-CD1 3.46Å; W110-L114 VanDerWaalsContact CZ2-CD1 3.46Å; W110-L114 HydrophobicContact CZ3-CD1 4.43Å; M111-L114 PolarHBondContact O-N 3.35Å; M111-L114 VanDerWaalsContact O-N 3.17Å; D112-L114 VanDerWaalsContact C-N 3.31Å; D112-L114 PolarHBondContact O-N 2.9Å
115	I	36.9	Very low	34.4	Very low	94 Å²	94	103.6 Å²	103.6	48%	0.482	60%	0.595	S	S	.	*	H	α-helix	trans	-105	-6.8	-175.9	-62.7	170.4	0	0	0	111.8	M111 D112 D117	M111-I115 WeakPolarHBondContact O-CG1 3.45Å; M111-I115 PolarHBondContact O-N 3.22Å; D112-I115 PolarHBondContact O-N 3.32Å; I115-D117 PolarHBondContact O-N 3.47Å
116	G	31.2	Very low	34.2	Very low	58 Å²	58	100.3 Å²	100.3	60%	0.598	59%	0.585	S	S	*	*	S	Bend	trans	-74.2	118.6	179.6	0	0	0	0	0	115.1	D112	D112-G116 PolarHBondContact O-N 2.82Å
117	D	32	Very low	34	Very low	157 Å²	157	101.9 Å²	101.9	84%	0.84	59%	0.589	S	S	*	*			trans	33.8	88.6	162.6	-71.1	-14.7	0	0	0	118.4	I115 P119	I115-D117 PolarHBondContact O-N 3.47Å; D117-P119 WeakPolarHBondContact O-CD 3.34Å
118	A	33.4	Very low	33.9	Very low	96 Å²	96	109.9 Å²	109.9	79%	0.793	61%	0.613	S	S	*	*			trans	-64.3	123.8	161.6	0	0	0	0	0	110.4
119	P	34.1	Very low	33.9	Very low	89 Å²	89	112.1 Å²	112.1	58%	0.578	62%	0.624	S	S	*	*			trans	-68.7	138.3	175.6	-12.8	26.7	0	0	0	111	D117 F121	D117-P119 WeakPolarHBondContact O-CD 3.34Å; P119-F121 HydrophobicContact CB-CE2 4.08Å; P119-F121 HydrophobicContact CB-CZ 4.23Å; P119-F121 HydrophobicContact CG-CE2 4.13Å; P119-F121 HydrophobicContact CG-CZ 4.19Å; P119-F121 WeakPolarHBondContact O-CD2 3.22Å; P119-F121 PolarHBondContact O-N 3.39Å; P119-F121 VanDerWaalsContact O-N 3.08Å
120	V	30.5	Very low	33.9	Very low	147 Å²	147	112.8 Å²	112.8	89%	0.891	62%	0.623	S	S	*	*			trans	-67.3	101.9	166.5	179.8	0	0	0	0	107.8
121	F	34.7	Very low	33.3	Very low	159 Å²	159	115.7 Å²	115.7	70%	0.697	64%	0.639	S	S	*	*			trans	-80.2	123.8	172.2	-71.8	-78.9	0	0	0	109.9	P119	P119-F121 HydrophobicContact CB-CE2 4.08Å; P119-F121 HydrophobicContact CB-CZ 4.23Å; P119-F121 HydrophobicContact CG-CE2 4.13Å; P119-F121 HydrophobicContact CG-CZ 4.19Å; P119-F121 WeakPolarHBondContact O-CD2 3.22Å; P119-F121 PolarHBondContact O-N 3.39Å; P119-F121 VanDerWaalsContact O-N 3.08Å
122	A	30.4	Very low	33.3	Very low	65 Å²	65	119.7 Å²	119.7	54%	0.537	67%	0.666	S	S	.	*			trans	-72.1	145.9	171.4	0	0	0	0	0	110.4	S124 D125	A122-S124 PolarHBondContact O-N 2.81Å; A122-D125 PolarHBondContact O-N 3.38Å
123	D	32.9	Very low	33	Very low	153 Å²	153	120 Å²	120	82%	0.818	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	-11	-176.7	-103.1	-28	0	0	0	115.7
124	S	33.2	Very low	32.6	Very low	77 Å²	77	120.5 Å²	120.5	54%	0.538	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-12.5	-174.3	57	0	0	0	0	115.9	A122	A122-S124 PolarHBondContact O-N 2.81Å
125	D	32.9	Very low	32.8	Very low	85 Å²	85	121 Å²	121	46%	0.455	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93	-17.3	-178.2	-74.1	-29.8	0	0	0	113.6	A122	A122-D125 PolarHBondContact O-N 3.38Å
126	L	32	Very low	32.7	Very low	96 Å²	96	122 Å²	122	50%	0.503	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.3	-33.1	176	-142.8	83.6	0	0	0	112	R128 L129 I130	L126-R128 VanDerWaalsContact C-N 3.25Å; L126-R128 PolarHBondContact O-N 2.7Å; L126-L129 PolarHBondContact O-N 2.75Å; L126-I130 WeakPolarHBondContact O-CG1 3.35Å
127	E	30.6	Very low	32.8	Very low	138 Å²	138	125.1 Å²	125.1	65%	0.645	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-68	-24.3	179.2	-67.6	-164.9	153	0	0	113	L129 F131	E127-L129 VanDerWaalsContact C-N 3.32Å; E127-L129 PolarHBondContact O-N 2.95Å; E127-F131 WeakPolarHBondContact O-CD2 3.15Å
128	R	34.5	Very low	33.2	Very low	210 Å²	210	124.6 Å²	124.6	79%	0.792	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-75.8	-17.5	176.9	-83	-178.1	148.4	164	-4.6	114.2	L126	L126-R128 VanDerWaalsContact C-N 3.25Å; L126-R128 PolarHBondContact O-N 2.7Å
129	L	32.4	Very low	33.3	Very low	149 Å²	149	127.6 Å²	127.6	78%	0.78	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-93.6	-9.1	177.5	-76.4	160.2	0	0	0	113.1	L126 E127	L126-L129 PolarHBondContact O-N 2.75Å; E127-L129 VanDerWaalsContact C-N 3.32Å; E127-L129 PolarHBondContact O-N 2.95Å
130	I	36.1	Very low	33.3	Very low	110 Å²	110	128 Å²	128	56%	0.564	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-13.2	-177.5	-63.4	168.8	0	0	0	111.9	L126	L126-I130 WeakPolarHBondContact O-CG1 3.35Å
131	F	27.6	Very low	33.3	Very low	163 Å²	163	125.8 Å²	125.8	72%	0.715	72%	0.718	S	S	*	*			trans	-124.5	87.4	-178.8	-66.3	-76	0	0	0	112.2	E127	E127-F131 WeakPolarHBondContact O-CD2 3.15Å
132	T	33.4	Very low	33.3	Very low	135 Å²	135	123.1 Å²	123.1	83%	0.828	73%	0.726	S	S	*	*			trans	-80.4	113.3	155.9	51.8	0	0	0	0	108.3
133	T	30.2	Very low	33.5	Very low	128 Å²	128	129 Å²	129	79%	0.785	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-51.8	136.8	178	44.1	0	0	0	0	112.6
134	P	32.4	Very low	33.8	Very low	115 Å²	115	126.8 Å²	126.8	75%	0.747	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-75.9	153	178.4	31.6	-31.5	0	0	0	111.5
135	P	37.8	Very low	33.9	Very low	118 Å²	118	132.4 Å²	132.4	77%	0.766	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-69.5	156.4	171.7	29.9	-32.6	0	0	0	111.4
136	P	35	Very low	33.8	Very low	113 Å²	113	134.1 Å²	134.1	73%	0.734	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-71	156.3	-177.3	30.8	-34.1	0	0	0	112.1
137	P	32.7	Very low	34	Very low	125 Å²	125	133.7 Å²	133.7	81%	0.812	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-78.9	140.9	-174.9	33.2	-32.1	0	0	0	111
138	V	39.7	Very low	34.2	Very low	145 Å²	145	133.5 Å²	133.5	88%	0.879	79%	0.791	S	S	*	*			trans	-110.2	124.3	165.3	-179	0	0	0	0	108.2
139	D	36.2	Very low	34	Very low	160 Å²	160	135.7 Å²	135.7	86%	0.856	80%	0.799	S	S	*	*			trans	-64.1	149.9	-175.2	-90.3	-42.5	0	0	0	114.7
140	A	33.1	Very low	34.2	Very low	98 Å²	98	133 Å²	133	81%	0.81	80%	0.798	S	S	*	*			trans	-75	153.8	-177.2	0	0	0	0	0	114.4
141	A	31.7	Very low	34.1	Very low	100 Å²	100	133.5 Å²	133.5	83%	0.826	81%	0.812	S	S	*	*				-178	120.5	126.1	0	0	0	0	0	112.1
142	A	35.5	Very low	34.5	Very low	103 Å²	103	133.6 Å²	133.6	85%	0.851	82%	0.819	S	S	*	*			trans	147.3	107.8	131	0	0	0	0	0	111.6
143	Q	34.6	Very low	34.5	Very low	188 Å²	188	132.6 Å²	132.6	88%	0.879	81%	0.814	S	S	*	*			trans	-86.9	-165.5	173	-58.5	-171	-56.3	0	0	111.4
144	P	39.3	Very low	34.7	Very low	106 Å²	106	135.5 Å²	135.5	69%	0.688	82%	0.819	S	S	*	*				-132	157.3	-86.4	39.5	-21.8	0	0	0	112.4
145	E	33.4	Very low	35	Very low	196 Å²	196	135.4 Å²	135.4	92%	0.916	82%	0.819	S	S	*	*			trans	-139	109.7	162.9	-77.1	-164.6	157	0	0	113.1
146	S	31.8	Very low	34.8	Very low	120 Å²	120	134 Å²	134	84%	0.839	82%	0.817	S	S	*	*			trans	23.8	111.7	134.7	168.1	0	0	0	0	118.7
147	A	36.5	Very low	34.6	Very low	87 Å²	87	133.6 Å²	133.6	72%	0.719	82%	0.823	S	S	*	*			trans	-155	107.3	142.4	0	0	0	0	0	112.8
148	T	34.2	Very low	34.6	Very low	134 Å²	134	133.2 Å²	133.2	82%	0.822	82%	0.818	S	S	*	*			trans	48.9	108.1	141	30.5	0	0	0	0	120.6	A150	T148-A150 PolarHBondContact O-N 3.27Å
149	R	30.5	Very low	34.1	Very low	257 Å²	257	131.1 Å²	131.1	97%	0.97	82%	0.816	S	S	*	*			trans	-56.2	110.6	156.2	-86.6	177.6	170.5	168.4	-2.9	110.3
150	A	36.1	Very low	33.8	Very low	91 Å²	91	128.1 Å²	128.1	75%	0.752	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.7	121.2	161.8	0	0	0	0	0	109.2	T148 L152	T148-A150 PolarHBondContact O-N 3.27Å; A150-L152 PolarHBondContact O-N 3.09Å
151	S	33.6	Very low	33.6	Very low	122 Å²	122	128.1 Å²	128.1	85%	0.853	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-62.8	122.5	174.6	-15.3	0	0	0	0	110
152	L	36.1	Very low	33.7	Very low	164 Å²	164	125.6 Å²	125.6	86%	0.859	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-77.7	138.3	172.2	-78.6	158.8	0	0	0	110.2	A150	A150-L152 PolarHBondContact O-N 3.09Å
153	P	34.7	Very low	33.3	Very low	114 Å²	114	125.5 Å²	125.5	74%	0.74	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.3	131.9	179.5	11.7	0.3	0	0	0	111
154	Q	33.2	Very low	33.1	Very low	189 Å²	189	121.8 Å²	121.8	88%	0.883	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.3	126.5	163.7	-95.4	177.3	-22.8	0	0	109.4	A156	Q154-A156 PolarHBondContact O-N 3.45Å
155	P	40.2	Very low	32.8	Very low	114 Å²	114	120.6 Å²	120.6	74%	0.74	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.9	123	165.6	-5.2	21.9	0	0	0	108.5	A157	P155-A157 PolarHBondContact O-N 3.39Å
156	A	33.9	Very low	32.7	Very low	87 Å²	87	114.6 Å²	114.6	72%	0.719	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-55.1	133.9	169.7	0	0	0	0	0	109.8	Q154 V158	Q154-A156 PolarHBondContact O-N 3.45Å; A156-V158 PolarHBondContact O-N 2.86Å
157	A	30.5	Very low	33.1	Very low	106 Å²	106	113.5 Å²	113.5	88%	0.876	74%	0.74	S	S	*	*			trans	-60.1	95.9	175.5	0	0	0	0	0	110.1	P155 A159	P155-A157 PolarHBondContact O-N 3.39Å; A157-A159 PolarHBondContact O-N 3.29Å
158	V	33.1	Very low	33.3	Very low	116 Å²	116	113.8 Å²	113.8	70%	0.703	74%	0.736	S	S	*	*			trans	-82.8	93.3	166.1	-171.7	0	0	0	0	106.6	A156 T160	A156-V158 PolarHBondContact O-N 2.86Å; V158-T160 HydrophobicContact CG1-CG2 4.01Å; V158-T160 PolarHBondContact O-N 3.26Å
159	A	29	Very low	34	Very low	102 Å²	102	110.1 Å²	110.1	84%	0.843	72%	0.716	S	S	*	*			trans	-63.9	82.2	164.7	0	0	0	0	0	108.7	A157 A161	A157-A159 PolarHBondContact O-N 3.29Å; A159-A161 PolarHBondContact O-N 2.94Å
160	T	30.1	Very low	34.9	Very low	97 Å²	97	99.7 Å²	99.7	60%	0.595	68%	0.68	S	S	*	*			trans	-83.2	110.9	163.8	32.1	0	0	0	0	107	V158 A162	V158-T160 HydrophobicContact CG1-CG2 4.01Å; V158-T160 PolarHBondContact O-N 3.26Å; T160-A162 PolarHBondContact O-N 3.09Å
161	A	28.7	Very low	35.5	Very low	98 Å²	98	97.9 Å²	97.9	81%	0.81	66%	0.657	S	S	*	*			trans	-47.3	104.5	173.2	0	0	0	0	0	109.3	A159 A163	A159-A161 PolarHBondContact O-N 2.94Å; A161-A163 PolarHBondContact O-N 3.14Å
162	A	32.4	Very low	36.3	Very low	47 Å²	47	96 Å²	96	39%	0.388	65%	0.649	S	S	.	*			trans	-57.3	139	156.4	0	0	0	0	0	106.3	T160 C164	T160-A162 PolarHBondContact O-N 3.09Å; A162-C164 PolarHBondContact O-N 3.5Å
163	A	28.6	Very low	37.4	Very low	101 Å²	101	90.8 Å²	90.8	84%	0.835	63%	0.626	S	S	*	*			trans	-62.4	77.6	167.9	0	0	0	0	0	108.1	A161 S165	A161-A163 PolarHBondContact O-N 3.14Å; A163-S165 PolarHBondContact O-N 3.41Å; A163-S165 VanDerWaalsContact O-N 3.14Å
164	C	29.8	Very low	38.8	Very low	110 Å²	110	85.3 Å²	85.3	74%	0.743	59%	0.591	S	S	*	*			trans	-67.5	104.9	162.3	-66.8	0	0	0	0	104.4	A162 S166	A162-C164 PolarHBondContact O-N 3.5Å; C164-S166 PolarHBondContact O-N 3.08Å; C164-S166 VanDerWaalsContact O-N 3.12Å
165	S	33.2	Very low	40.9	Very low	80 Å²	80	81.4 Å²	81.4	56%	0.559	58%	0.584	S	S	*	*			trans	-46.1	123.1	165.6	-39.9	0	0	0	0	107.1	A163 S169	A163-S165 PolarHBondContact O-N 3.41Å; A163-S165 VanDerWaalsContact O-N 3.14Å; S165-S169 WeakPolarHBondContact CB-OG 3.33Å
166	S	30	Very low	43.3	Very low	70 Å²	70	77 Å²	77	49%	0.49	56%	0.557	S	S	.	*			trans	-52.4	148.4	-175	-42.9	0	0	0	0	109.9	C164 S168 S169	C164-S166 PolarHBondContact O-N 3.08Å; C164-S166 VanDerWaalsContact O-N 3.12Å; S166-S168 WeakPolarHBondContact CB-OG 3.42Å; S166-S168 PolarHBondContact O-N 3.33Å; S166-S169 PolarHBondContact O-N 3.12Å; S166-S169 PolarHBondContact O-OG 2.9Å
167	P	40.6	Very low	46.1	Very low	98 Å²	98	77.9 Å²	77.9	64%	0.636	56%	0.556	S	S	*	*	H	α-helix	trans	-48.6	-32.5	-179.9	-25.6	31.4	0	0	0	113.2	S169 L170	P167-S169 VanDerWaalsContact C-N 3.33Å; P167-S169 PolarHBondContact O-N 3.44Å; P167-L170 PolarHBondContact O-N 2.87Å
168	S	41.1	Very low	49.3	Very low	92 Å²	92	74 Å²	74	64%	0.643	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-27.6	176.6	48.2	0	0	0	0	115.3	S166	S166-S168 WeakPolarHBondContact CB-OG 3.42Å; S166-S168 PolarHBondContact O-N 3.33Å
169	S	48.9	Very low	52.3	Low	57 Å²	57	68.4 Å²	68.4	40%	0.399	49%	0.486	S	S	.	.	H	α-helix	trans	-79.9	-26	177	65.6	0	0	0	0	113.2	S165 S166 P167	S165-S169 WeakPolarHBondContact CB-OG 3.33Å; S166-S169 PolarHBondContact O-N 3.12Å; S166-S169 PolarHBondContact O-OG 2.9Å; P167-S169 VanDerWaalsContact C-N 3.33Å; P167-S169 PolarHBondContact O-N 3.44Å
170	L	49.2	Very low	55.4	Low	39 Å²	39	66.1 Å²	66.1	20%	0.204	46%	0.458	C	S	.	.	H	α-helix	trans	-74.1	-39.2	-179.1	-61.6	168.1	0	0	0	110.2	P167 A172 S173 L436	P167-L170 PolarHBondContact O-N 2.87Å; L170-A172 VanDerWaalsContact C-N 3.25Å; L170-A172 PolarHBondContact O-N 3.3Å; L170-S173 PolarHBondContact O-N 3.11Å; L170-S173 PolarHBondContact O-OG 3.47Å; L170-L436 HydrophobicContact CB-CD1 4.25Å; L170-L436 HydrophobicContact CD2-CD1 3.31Å; L170-L436 HydrophobicContact CG-CD1 4.31Å
171	D	47.9	Very low	58.6	Low	52 Å²	52	64.3 Å²	64.3	28%	0.278	45%	0.449	S	S	.	.	H	α-helix	trans	-62.3	-29.2	178.4	-71.6	-13.1	0	0	0	112.5	S173 Q180 R187	D171-S173 VanDerWaalsContact C-N 3.34Å; D171-S173 PolarHBondContact O-N 3.42Å; D171-Q180 PolarHBondContact O-NE2 3.41Å; D171-R187 IonicContact OD1-CZ 2.98Å; D171-R187 IonicContact OD1-NH1 2.74Å; D171-R187 IonicContact OD1-NH2 3.25Å; D171-R187 PolarHBondContact OD1-NH2 3.17Å; D171-R187 IonicContact OD2-NH1 3.12Å; D171-R187 IonicContact OD2-NH2 3.32Å
172	A	50.8	Low	61.8	Low	82 Å²	82	59.6 Å²	59.6	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-71.4	-25.4	178.6	0	0	0	0	0	113.9	L170	L170-A172 VanDerWaalsContact C-N 3.25Å; L170-A172 PolarHBondContact O-N 3.3Å
173	S	59.2	Low	64.8	Low	55 Å²	55	57.6 Å²	57.6	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-84	-18	-174.5	64.2	0	0	0	0	114.3	L170 D171 L436	L170-S173 PolarHBondContact O-N 3.11Å; L170-S173 PolarHBondContact O-OG 3.47Å; D171-S173 VanDerWaalsContact C-N 3.34Å; D171-S173 PolarHBondContact O-N 3.42Å; S173-L436 WeakPolarHBondContact OG-CD2 3.42Å
174	C	64.6	Low	68	Low	0 Å²	0	54.8 Å²	54.8	0%	0	37%	0.37	C	S	.	.			trans	-100.8	71.3	173.2	-80.1	0	0	0	0	110.3	A176 L179 Q180 L183	C174-A176 PolarHBondContact O-N 2.86Å; C174-L179 HydrophobicContact CB-CB 4.11Å; C174-Q180 VanDerWaalsContact O-CG 3.31Å; C174-Q180 WeakPolarHBondContact O-CG 3.31Å; C174-Q180 PolarHBondContact O-NE2 2.9Å; C174-L183 HydrophobicContact CB-CD1 4.28Å
175	S	77.3	Confident	71.2	Confident	106 Å²	106	49.7 Å²	49.7	74%	0.741	34%	0.336	S	S	*	.			trans	-63.5	-22.1	-178.1	57	0	0	0	0	114.4
176	A	90.2	Very high	74.2	Confident	22 Å²	22	45.9 Å²	45.9	18%	0.182	31%	0.309	C	S	.	.	S	Bend	trans	-71	125	-178.8	0	0	0	0	0	112	C174 I178 L179 Q180 A214	C174-A176 PolarHBondContact O-N 2.86Å; A176-I178 HydrophobicContact CB-CG2 4.42Å; A176-I178 PolarHBondContact O-N 2.92Å; A176-I178 VanDerWaalsContact O-N 3.15Å; A176-L179 HydrophobicContact CB-CB 4.47Å; A176-L179 HydrophobicContact CB-CD1 4.14Å; A176-L179 HydrophobicContact CB-CG 4.03Å; A176-L179 PolarHBondContact O-N 3.03Å; A176-Q180 PolarHBondContact O-N 3.43Å; A176-A214 HydrophobicContact CB-CB 3.83Å
177	P	94	Very high	77.4	Confident	105 Å²	105	47.1 Å²	47.1	68%	0.682	30%	0.303	S	S	*	.	H	α-helix	trans	-56.6	-33.4	-177.7	-27.9	35	0	0	0	114.7	L179 Q180 S181	P177-L179 VanDerWaalsContact C-N 3.34Å; P177-Q180 PolarHBondContact O-N 2.98Å; P177-S181 WeakPolarHBondContact O-CB 3.35Å; P177-S181 PolarHBondContact O-N 3.33Å; P177-S181 PolarHBondContact O-OG 2.94Å
178	I	96	Very high	80.1	Confident	24 Å²	24	43.8 Å²	43.8	12%	0.123	28%	0.281	C	S	.	.	H	α-helix	trans	-65.5	-37.4	178.1	-165.4	172	0	0	0	112.1	A176 S181 L182 V203 A206 A207 A214 A218	A176-I178 HydrophobicContact CB-CG2 4.42Å; A176-I178 PolarHBondContact O-N 2.92Å; A176-I178 VanDerWaalsContact O-N 3.15Å; I178-S181 PolarHBondContact O-N 3.17Å; I178-L182 WeakPolarHBondContact O-CB 3.47Å; I178-L182 PolarHBondContact O-N 3.12Å; I178-V203 HydrophobicContact CG1-CG1 4.24Å; I178-A206 HydrophobicContact CD1-CB 3.77Å; I178-A206 WeakPolarHBondContact CD1-O 3.32Å; I178-A206 HydrophobicContact CG1-CB 4.37Å; I178-A207 HydrophobicContact CD1-CB 4.16Å; I178-A214 HydrophobicContact CG2-CB 4.08Å; I178-A218 HydrophobicContact CD1-CB 3.46Å; I178-A218 VanDerWaalsContact CD1-CB 3.46Å; I178-A218 HydrophobicContact CG1-CB 3.64Å; I178-A218 HydrophobicContact CG2-CB 4.37Å
179	L	96.4	Very high	82.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-74.1	-36.9	178.2	-57.6	-174.5	0	0	0	111.4	C174 A176 P177 L182 L183 A214 V217 A218 L435 K439	C174-L179 HydrophobicContact CB-CB 4.11Å; A176-L179 HydrophobicContact CB-CB 4.47Å; A176-L179 HydrophobicContact CB-CD1 4.14Å; A176-L179 HydrophobicContact CB-CG 4.03Å; A176-L179 PolarHBondContact O-N 3.03Å; P177-L179 VanDerWaalsContact C-N 3.34Å; L179-L182 WeakPolarHBondContact O-CB 3.39Å; L179-L182 PolarHBondContact O-N 3.26Å; L179-L183 WeakPolarHBondContact O-CG 3.44Å; L179-L183 PolarHBondContact O-N 3.21Å; L179-A214 HydrophobicContact CD1-CB 4.07Å; L179-A214 HydrophobicContact CD2-CB 4.34Å; L179-A214 WeakPolarHBondContact CD2-O 3.42Å; L179-A214 HydrophobicContact CG-CB 4.09Å; L179-V217 HydrophobicContact CD2-CB 4.29Å; L179-V217 HydrophobicContact CD2-CG1 3.95Å; L179-A218 HydrophobicContact CD2-CB 4.4Å; L179-L435 HydrophobicContact CB-CD2 4.31Å; L179-L435 HydrophobicContact CD2-CD1 4.26Å; L179-K439 HydrophobicContact CD1-CD 4Å; L179-K439 HydrophobicContact CD1-CG 4.42Å
180	Q	95.4	Very high	84.7	Confident	54 Å²	54	40.3 Å²	40.3	25%	0.252	26%	0.261	S	S	.	.	H	α-helix	trans	-62.6	-43.1	171.8	-70.6	-61.7	-33.6	0	0	112	D171 C174 A176 P177 L182 L183 A184	D171-Q180 PolarHBondContact O-NE2 3.41Å; C174-Q180 VanDerWaalsContact O-CG 3.31Å; C174-Q180 WeakPolarHBondContact O-CG 3.31Å; C174-Q180 PolarHBondContact O-NE2 2.9Å; A176-Q180 PolarHBondContact O-N 3.43Å; P177-Q180 PolarHBondContact O-N 2.98Å; Q180-L182 VanDerWaalsContact C-N 3.27Å; Q180-L182 PolarHBondContact O-N 2.86Å; Q180-L183 PolarHBondContact O-N 2.79Å; Q180-A184 WeakPolarHBondContact O-CB 3.13Å; Q180-A184 PolarHBondContact O-N 3.46Å
181	S	96.1	Very high	86.8	Confident	58 Å²	58	42.8 Å²	42.8	41%	0.406	29%	0.288	S	S	.	.	H	α-helix	trans	-61.2	-40.5	175.8	-57.2	0	0	0	0	111	P177 I178 A184 C185	P177-S181 WeakPolarHBondContact O-CB 3.35Å; P177-S181 PolarHBondContact O-N 3.33Å; P177-S181 PolarHBondContact O-OG 2.94Å; I178-S181 PolarHBondContact O-N 3.17Å; S181-A184 PolarHBondContact O-N 3.36Å; S181-C185 WeakPolarHBondContact O-CB 3.27Å; S181-C185 PolarHBondContact O-N 2.74Å; S181-C185 PolarHBondContact O-SG 3.32Å
182	L	96.3	Very high	89.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-41.2	177.5	-174.1	75.5	0	0	0	112.5	I178 L179 Q180 C185 S186 V203 F221 F431 L435	I178-L182 WeakPolarHBondContact O-CB 3.47Å; I178-L182 PolarHBondContact O-N 3.12Å; L179-L182 WeakPolarHBondContact O-CB 3.39Å; L179-L182 PolarHBondContact O-N 3.26Å; Q180-L182 VanDerWaalsContact C-N 3.27Å; Q180-L182 PolarHBondContact O-N 2.86Å; L182-C185 PolarHBondContact O-N 3.33Å; L182-S186 PolarHBondContact O-N 2.8Å; L182-V203 HydrophobicContact CB-CG1 4.29Å; L182-V203 HydrophobicContact CD1-CG1 3.9Å; L182-F221 HydrophobicContact CD1-CB 4.16Å; L182-F221 HydrophobicContact CD2-CB 3.35Å; L182-F221 HydrophobicContact CD2-CD1 4.15Å; L182-F221 HydrophobicContact CD2-CG 3.89Å; L182-F221 HydrophobicContact CG-CB 4.27Å; L182-F431 HydrophobicContact CD1-CZ 3.93Å; L182-F431 HydrophobicContact CD2-CE1 4.02Å; L182-F431 HydrophobicContact CD2-CZ 3.92Å; L182-F431 HydrophobicContact CG-CE1 3.78Å; L182-F431 HydrophobicContact CG-CZ 3.57Å; L182-L435 HydrophobicContact CD2-CD1 3.65Å
183	L	96.1	Very high	91.1	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-45.6	172	-74.4	169.6	0	0	0	111.2	C174 L179 Q180 S186 R187 F431 L435	C174-L183 HydrophobicContact CB-CD1 4.28Å; L179-L183 WeakPolarHBondContact O-CG 3.44Å; L179-L183 PolarHBondContact O-N 3.21Å; Q180-L183 PolarHBondContact O-N 2.79Å; L183-S186 PolarHBondContact O-N 3.3Å; L183-S186 PolarHBondContact O-OG 2.99Å; L183-R187 WeakPolarHBondContact O-CG 3.16Å; L183-R187 PolarHBondContact O-N 3.46Å; L183-R187 VanDerWaalsContact O-N 3.15Å; L183-F431 HydrophobicContact CD2-CD1 4.24Å; L183-L435 HydrophobicContact CD1-CD2 4.03Å; L183-L435 HydrophobicContact CD2-CD2 3.65Å; L183-L435 HydrophobicContact CG-CD2 3.55Å
184	A	96	Very high	92.7	Very high	42 Å²	42	43.2 Å²	43.2	35%	0.347	29%	0.289	S	S	.	.	H	α-helix	trans	-58.2	-49.1	174.5	0	0	0	0	0	111.3	Q180 S181 S186 R187 T188	Q180-A184 WeakPolarHBondContact O-CB 3.13Å; Q180-A184 PolarHBondContact O-N 3.46Å; S181-A184 PolarHBondContact O-N 3.36Å; A184-S186 VanDerWaalsContact C-N 3.26Å; A184-S186 PolarHBondContact O-N 3.31Å; A184-R187 WeakPolarHBondContact O-CB 3.5Å; A184-R187 PolarHBondContact O-N 3.32Å; A184-T188 PolarHBondContact O-N 3.22Å; A184-T188 PolarHBondContact O-OG1 2.53Å; A184-T188 VanDerWaalsContact O-OG1 3.08Å
185	C	96.7	Very high	94.2	Very high	4 Å²	4	47 Å²	47	3%	0.027	31%	0.309	C	S	.	.	H	α-helix	trans	-55.9	-38.1	176	-72.8	0	0	0	0	112.5	S181 L182 T188 A189 E199 L225	S181-C185 WeakPolarHBondContact O-CB 3.27Å; S181-C185 PolarHBondContact O-N 2.74Å; S181-C185 PolarHBondContact O-SG 3.32Å; L182-C185 PolarHBondContact O-N 3.33Å; C185-T188 PolarHBondContact O-N 3.42Å; C185-A189 VanDerWaalsContact O-CB 3.26Å; C185-A189 WeakPolarHBondContact O-CB 3.47Å; C185-A189 PolarHBondContact O-N 3.14Å; C185-E199 VanDerWaalsContact SG-CB 3.51Å; C185-L225 HydrophobicContact CB-CD2 4Å
186	S	96.2	Very high	95.1	Very high	0 Å²	0	42 Å²	42	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.1	-37.8	177.3	77	0	0	0	0	112.8	L182 L183 A184 A189 A190 F431	L182-S186 PolarHBondContact O-N 2.8Å; L183-S186 PolarHBondContact O-N 3.3Å; L183-S186 PolarHBondContact O-OG 2.99Å; A184-S186 VanDerWaalsContact C-N 3.26Å; A184-S186 PolarHBondContact O-N 3.31Å; S186-A189 PolarHBondContact O-N 3.07Å; S186-A190 PolarHBondContact O-N 3.39Å; S186-F431 VanDerWaalsContact CB-CD1 3.49Å; S186-F431 VanDerWaalsContact CB-CG 3.46Å; S186-F431 WeakPolarHBondContact OG-CD1 3.49Å
187	R	96.8	Very high	95.4	Very high	96 Å²	96	43 Å²	43	36%	0.362	28%	0.282	S	S	.	.	H	α-helix	trans	-67.6	-44.6	174.4	-65.5	169.3	-171.7	158.5	4.1	110.3	D171 L183 A184 A189 A190 V428	D171-R187 IonicContact OD1-CZ 2.98Å; D171-R187 IonicContact OD1-NH1 2.74Å; D171-R187 IonicContact OD1-NH2 3.25Å; D171-R187 PolarHBondContact OD1-NH2 3.17Å; D171-R187 IonicContact OD2-NH1 3.12Å; D171-R187 IonicContact OD2-NH2 3.32Å; L183-R187 WeakPolarHBondContact O-CG 3.16Å; L183-R187 PolarHBondContact O-N 3.46Å; L183-R187 VanDerWaalsContact O-N 3.15Å; A184-R187 WeakPolarHBondContact O-CB 3.5Å; A184-R187 PolarHBondContact O-N 3.32Å; R187-A189 VanDerWaalsContact C-N 3.34Å; R187-A189 PolarHBondContact O-N 2.92Å; R187-A190 PolarHBondContact O-N 3.09Å; R187-V428 HydrophobicContact CG-CG1 3.88Å
188	T	96.9	Very high	95.5	Very high	27 Å²	27	42.6 Å²	42.6	17%	0.166	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-45.3	173.1	-50.7	0	0	0	0	110.5	A184 C185 A190 A191 D192 L195 A196 E199	A184-T188 PolarHBondContact O-N 3.22Å; A184-T188 PolarHBondContact O-OG1 2.53Å; A184-T188 VanDerWaalsContact O-OG1 3.08Å; C185-T188 PolarHBondContact O-N 3.42Å; T188-A190 PolarHBondContact O-N 3.37Å; T188-A190 VanDerWaalsContact O-N 3.14Å; T188-A191 CarbonylContact O-C 3.56Å; T188-A191 PolarHBondContact O-N 2.93Å; T188-D192 CarbonylContact O-C 3.56Å; T188-D192 PolarHBondContact O-N 3.34Å; T188-L195 HydrophobicContact CG2-CB 3.87Å; T188-L195 HydrophobicContact CG2-CD2 3.8Å; T188-L195 HydrophobicContact CG2-CG 3.76Å; T188-A196 HydrophobicContact CG2-CB 3.95Å; T188-E199 WeakPolarHBondContact CB-OE2 3.24Å; T188-E199 WeakPolarHBondContact CG2-OE2 3.38Å; T188-E199 PolarHBondContact OG1-OE2 3.49Å
189	A	95.4	Very high	95.5	Very high	11 Å²	11	44.1 Å²	44.1	9%	0.091	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-28.7	-177.6	0	0	0	0	0	113.6	C185 S186 R187 A196 L225 L229 F427	C185-A189 VanDerWaalsContact O-CB 3.26Å; C185-A189 WeakPolarHBondContact O-CB 3.47Å; C185-A189 PolarHBondContact O-N 3.14Å; S186-A189 PolarHBondContact O-N 3.07Å; R187-A189 VanDerWaalsContact C-N 3.34Å; R187-A189 PolarHBondContact O-N 2.92Å; A189-A196 VanDerWaalsContact CA-CB 3.42Å; A189-A196 HydrophobicContact CB-CB 3.68Å; A189-L225 HydrophobicContact CB-CD1 4.01Å; A189-L229 HydrophobicContact CB-CD2 3.92Å; A189-F427 HydrophobicContact CB-CE1 4.36Å
190	A	92.3	Very high	95.5	Very high	66 Å²	66	44.4 Å²	44.4	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-75.5	-23.7	175.7	0	0	0	0	0	113.3	S186 R187 T188 V428	S186-A190 PolarHBondContact O-N 3.39Å; R187-A190 PolarHBondContact O-N 3.09Å; T188-A190 PolarHBondContact O-N 3.37Å; T188-A190 VanDerWaalsContact O-N 3.14Å; A190-V428 HydrophobicContact CB-CG2 3.72Å
191	A	92.9	Very high	95.6	Very high	91 Å²	91	46.6 Å²	46.6	75%	0.752	30%	0.302	S	S	*	.	H	α-helix	trans	-105.7	-44.1	-176.9	0	0	0	0	0	113.2	T188	T188-A191 CarbonylContact O-C 3.56Å; T188-A191 PolarHBondContact O-N 2.93Å
192	D	94.8	Very high	95.5	Very high	79 Å²	79	51.4 Å²	51.4	42%	0.422	32%	0.316	S	S	.	.			trans	-140.8	90.2	-179.3	-172.9	-19.1	0	0	0	110.2	T188 G194 L195 A196	T188-D192 CarbonylContact O-C 3.56Å; T188-D192 PolarHBondContact O-N 3.34Å; D192-G194 PolarHBondContact O-N 3.43Å; D192-G194 PolarHBondContact OD1-N 3.08Å; D192-L195 HydrophobicContact CB-CB 4.03Å; D192-L195 VanDerWaalsContact CG-CB 3.49Å; D192-L195 PolarHBondContact O-N 3.26Å; D192-L195 PolarHBondContact OD1-N 3.4Å; D192-L195 WeakPolarHBondContact OD2-CB 3.2Å; D192-A196 WeakPolarHBondContact O-CB 3.35Å; D192-A196 PolarHBondContact O-N 2.99Å
193	P	93.7	Very high	95.5	Very high	72 Å²	72	51.7 Å²	51.7	47%	0.468	32%	0.318	S	S	.	.	H	α-helix	trans	-58.4	-29.7	177.1	-25.4	34.2	0	0	0	114	A197 L229	P193-A197 PolarHBondContact O-N 2.66Å; P193-L229 HydrophobicContact CB-CD2 3.83Å
194	G	93.6	Very high	95.5	Very high	46 Å²	46	56.8 Å²	56.8	47%	0.474	34%	0.337	S	S	.	.	H	α-helix	trans	-71	-48	-179.4	0	0	0	0	0	111.6	D192 A196 A197 V198	D192-G194 PolarHBondContact O-N 3.43Å; D192-G194 PolarHBondContact OD1-N 3.08Å; G194-A196 VanDerWaalsContact C-N 3.34Å; G194-A197 PolarHBondContact O-N 2.82Å; G194-V198 PolarHBondContact O-N 3.36Å
195	L	96.1	Very high	95.6	Very high	80 Å²	80	59 Å²	59	42%	0.419	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-43.3	174.1	-178.8	60.3	0	0	0	111.2	T188 D192 A197 V198 E199	T188-L195 HydrophobicContact CG2-CB 3.87Å; T188-L195 HydrophobicContact CG2-CD2 3.8Å; T188-L195 HydrophobicContact CG2-CG 3.76Å; D192-L195 HydrophobicContact CB-CB 4.03Å; D192-L195 VanDerWaalsContact CG-CB 3.49Å; D192-L195 PolarHBondContact O-N 3.26Å; D192-L195 PolarHBondContact OD1-N 3.4Å; D192-L195 WeakPolarHBondContact OD2-CB 3.2Å; L195-A197 VanDerWaalsContact C-N 3.27Å; L195-A197 PolarHBondContact O-N 2.82Å; L195-V198 WeakPolarHBondContact O-CB 3.37Å; L195-V198 PolarHBondContact O-N 2.9Å; L195-E199 HydrophobicContact CD1-CG 4.42Å; L195-E199 HydrophobicContact CG-CG 4.42Å; L195-E199 WeakPolarHBondContact O-CG 3.49Å; L195-E199 PolarHBondContact O-N 2.95Å
196	A	96.5	Very high	95.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-59.6	-37.4	177.9	0	0	0	0	0	112.7	T188 A189 D192 G194 V198 E199 L200 L229	T188-A196 HydrophobicContact CG2-CB 3.95Å; A189-A196 VanDerWaalsContact CA-CB 3.42Å; A189-A196 HydrophobicContact CB-CB 3.68Å; D192-A196 WeakPolarHBondContact O-CB 3.35Å; D192-A196 PolarHBondContact O-N 2.99Å; G194-A196 VanDerWaalsContact C-N 3.34Å; A196-V198 VanDerWaalsContact C-N 3.31Å; A196-V198 PolarHBondContact O-N 3.1Å; A196-E199 PolarHBondContact O-N 2.95Å; A196-L200 WeakPolarHBondContact O-CB 3.44Å; A196-L200 PolarHBondContact O-N 2.98Å; A196-L229 HydrophobicContact CB-CD1 4.26Å; A196-L229 HydrophobicContact CB-CD2 4.32Å
197	A	95.1	Very high	95.6	Very high	45 Å²	45	62.2 Å²	62.2	37%	0.372	38%	0.382	S	S	.	.	H	α-helix	trans	-62.4	-38.5	175.4	0	0	0	0	0	112	P193 G194 L195 L229	P193-A197 PolarHBondContact O-N 2.66Å; G194-A197 PolarHBondContact O-N 2.82Å; L195-A197 VanDerWaalsContact C-N 3.27Å; L195-A197 PolarHBondContact O-N 2.82Å; A197-L229 HydrophobicContact CB-CD1 4.22Å
198	V	95.9	Very high	95.6	Very high	95 Å²	95	59.8 Å²	59.8	58%	0.576	38%	0.379	S	S	*	.	H	α-helix	trans	-69	-43.4	176	177.5	0	0	0	0	111.4	G194 L195 A196 L200 V201	G194-V198 PolarHBondContact O-N 3.36Å; L195-V198 WeakPolarHBondContact O-CB 3.37Å; L195-V198 PolarHBondContact O-N 2.9Å; A196-V198 VanDerWaalsContact C-N 3.31Å; A196-V198 PolarHBondContact O-N 3.1Å; V198-L200 VanDerWaalsContact C-N 3.35Å; V198-V201 PolarHBondContact O-N 3.41Å
199	E	95.7	Very high	95.6	Very high	57 Å²	57	59.7 Å²	59.7	27%	0.266	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-39.4	177.8	-66.5	-179.9	156.5	0	0	111.8	C185 T188 L195 A196 V201 K202	C185-E199 VanDerWaalsContact SG-CB 3.51Å; T188-E199 WeakPolarHBondContact CB-OE2 3.24Å; T188-E199 WeakPolarHBondContact CG2-OE2 3.38Å; T188-E199 PolarHBondContact OG1-OE2 3.49Å; L195-E199 HydrophobicContact CD1-CG 4.42Å; L195-E199 HydrophobicContact CG-CG 4.42Å; L195-E199 WeakPolarHBondContact O-CG 3.49Å; L195-E199 PolarHBondContact O-N 2.95Å; A196-E199 PolarHBondContact O-N 2.95Å; E199-V201 PolarHBondContact O-N 2.99Å; E199-K202 WeakPolarHBondContact O-CB 3.21Å; E199-K202 PolarHBondContact O-N 3.13Å
200	L	97.1	Very high	95.6	Very high	6 Å²	6	64.1 Å²	64.1	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-61.6	-29.1	-179.9	-176.9	58.2	0	0	0	113.2	A196 V198 K202 V203 R204 L225 A226 L229	A196-L200 WeakPolarHBondContact O-CB 3.44Å; A196-L200 PolarHBondContact O-N 2.98Å; V198-L200 VanDerWaalsContact C-N 3.35Å; L200-K202 PolarHBondContact O-N 2.76Å; L200-V203 HydrophobicContact CD1-CB 4.31Å; L200-V203 PolarHBondContact O-N 3.12Å; L200-R204 HydrophobicContact CD1-CG 4.11Å; L200-R204 HydrophobicContact CG-CG 4.17Å; L200-R204 WeakPolarHBondContact O-CG 3.14Å; L200-R204 PolarHBondContact O-N 2.79Å; L200-L225 HydrophobicContact CD1-CD2 4.19Å; L200-L225 HydrophobicContact CD2-CB 4.21Å; L200-L225 HydrophobicContact CD2-CD2 4.36Å; L200-L225 HydrophobicContact CD2-CG 4.06Å; L200-A226 HydrophobicContact CD2-CB 3.77Å; L200-L229 HydrophobicContact CD2-CD1 3.94Å
201	V	96.9	Very high	95.8	Very high	99 Å²	99	61.4 Å²	61.4	60%	0.6	38%	0.378	S	S	*	.	H	α-helix	trans	-56.6	-41	174.1	175.2	0	0	0	0	110.9	V198 E199 A205	V198-V201 PolarHBondContact O-N 3.41Å; E199-V201 PolarHBondContact O-N 2.99Å; V201-A205 WeakPolarHBondContact O-CB 3.41Å; V201-A205 PolarHBondContact O-N 3.45Å
202	K	95.4	Very high	96	Very high	159 Å²	159	60.1 Å²	60.1	69%	0.691	36%	0.358	S	S	*	.	H	α-helix	trans	-68.1	-41.8	179.4	-60.7	177.2	-177	172.4	0	111.5	E199 L200 A205 A206	E199-K202 WeakPolarHBondContact O-CB 3.21Å; E199-K202 PolarHBondContact O-N 3.13Å; L200-K202 PolarHBondContact O-N 2.76Å; K202-A205 PolarHBondContact O-N 3.04Å; K202-A206 PolarHBondContact O-N 3.3Å
203	V	95.4	Very high	96.1	Very high	6 Å²	6	57 Å²	57	4%	0.036	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-45.8	177.7	177.9	0	0	0	0	110.8	I178 L182 L200 A205 A206 A207 A218	I178-V203 HydrophobicContact CG1-CG1 4.24Å; L182-V203 HydrophobicContact CB-CG1 4.29Å; L182-V203 HydrophobicContact CD1-CG1 3.9Å; L200-V203 HydrophobicContact CD1-CB 4.31Å; L200-V203 PolarHBondContact O-N 3.12Å; V203-A205 VanDerWaalsContact C-N 3.3Å; V203-A205 PolarHBondContact O-N 3.48Å; V203-A206 PolarHBondContact O-N 3.39Å; V203-A206 VanDerWaalsContact O-N 3.14Å; V203-A207 WeakPolarHBondContact O-CB 3.5Å; V203-A207 PolarHBondContact O-N 3.18Å; V203-A218 HydrophobicContact CG1-CB 4.48Å
204	R	97.1	Very high	96.3	Very high	112 Å²	112	54.4 Å²	54.4	42%	0.423	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-32.3	178.3	-71.7	-178.1	66.4	113.1	3.3	112.9	L200 A206 A207 G222 D223	L200-R204 HydrophobicContact CD1-CG 4.11Å; L200-R204 HydrophobicContact CG-CG 4.17Å; L200-R204 WeakPolarHBondContact O-CG 3.14Å; L200-R204 PolarHBondContact O-N 2.79Å; R204-A206 VanDerWaalsContact C-N 3.29Å; R204-A207 PolarHBondContact O-N 3.36Å; R204-G222 PolarHBondContact NH1-O 3.36Å; R204-D223 IonicContact CZ-OD1 3.46Å; R204-D223 IonicContact NH1-OD1 3.32Å; R204-D223 PolarHBondContact NH1-OD1 2.8Å; R204-D223 VanDerWaalsContact NH1-OD1 3.12Å; R204-D223 IonicContact NH2-OD1 3.99Å
205	A	96.9	Very high	96.5	Very high	89 Å²	89	55.4 Å²	55.4	74%	0.736	32%	0.319	S	S	*	.	H	α-helix	trans	-70	-25.7	175.4	0	0	0	0	0	113.2	V201 K202 V203	V201-A205 WeakPolarHBondContact O-CB 3.41Å; V201-A205 PolarHBondContact O-N 3.45Å; K202-A205 PolarHBondContact O-N 3.04Å; V203-A205 VanDerWaalsContact C-N 3.3Å; V203-A205 PolarHBondContact O-N 3.48Å
206	A	96.2	Very high	96.6	Very high	54 Å²	54	51.6 Å²	51.6	45%	0.446	30%	0.299	S	S	.	.	H	α-helix	trans	-93.2	-13.5	176.3	0	0	0	0	0	113.4	I178 K202 V203 R204	I178-A206 HydrophobicContact CD1-CB 3.77Å; I178-A206 WeakPolarHBondContact CD1-O 3.32Å; I178-A206 HydrophobicContact CG1-CB 4.37Å; K202-A206 PolarHBondContact O-N 3.3Å; V203-A206 PolarHBondContact O-N 3.39Å; V203-A206 VanDerWaalsContact O-N 3.14Å; R204-A206 VanDerWaalsContact C-N 3.29Å
207	A	97.6	Very high	96.7	Very high	17 Å²	17	51.6 Å²	51.6	14%	0.14	30%	0.299	C	S	.	.			trans	-85	147.8	-178.6	0	0	0	0	0	111.8	I178 V203 R204 A218 F219	I178-A207 HydrophobicContact CD1-CB 4.16Å; V203-A207 WeakPolarHBondContact O-CB 3.5Å; V203-A207 PolarHBondContact O-N 3.18Å; R204-A207 PolarHBondContact O-N 3.36Å; A207-A218 HydrophobicContact CB-CB 3.97Å; A207-F219 HydrophobicContact CB-CB 4.07Å
208	S	97	Very high	96.8	Very high	44 Å²	44	49.5 Å²	49.5	31%	0.308	28%	0.281	S	S	.	.			trans	-145.2	137.6	-179.9	179.2	0	0	0	0	110.6	D210 G211 E215 R216	S208-D210 VanDerWaalsContact C-N 3.3Å; S208-D210 PolarHBondContact OG-N 3.46Å; S208-G211 PolarHBondContact OG-N 3.24Å; S208-E215 PolarHBondContact N-O 3.36Å; S208-E215 CarbonylContact O-C 3.36Å; S208-E215 VanDerWaalsContact O-C 3.32Å; S208-R216 VanDerWaalsContact O-CA 3.24Å; S208-R216 WeakPolarHBondContact O-CA 3.49Å; S208-R216 VanDerWaalsContact O-CG 3.24Å; S208-R216 WeakPolarHBondContact O-CG 3.47Å; S208-R216 PolarHBondContact O-N 3.4Å
209	E	96.5	Very high	96.9	Very high	26 Å²	26	48.3 Å²	48.3	12%	0.121	27%	0.269	C	S	.	.	S	Bend	trans	-75.2	-20.6	175.8	-166.5	172.9	-151.6	0	0	112.6	R216 F219 Y220 R456 V457 R461	E209-R216 WeakPolarHBondContact O-CD 3.39Å; E209-R216 VanDerWaalsContact O-CG 3.28Å; E209-R216 WeakPolarHBondContact O-CG 3.32Å; E209-F219 HydrophobicContact CB-CD1 4.06Å; E209-F219 HydrophobicContact CB-CD2 4.32Å; E209-F219 HydrophobicContact CB-CE1 3.99Å; E209-F219 HydrophobicContact CB-CE2 4.25Å; E209-F219 HydrophobicContact CB-CG 4.23Å; E209-F219 HydrophobicContact CB-CZ 4.09Å; E209-F219 HydrophobicContact CG-CD1 4.21Å; E209-F219 HydrophobicContact CG-CE1 4.03Å; E209-Y220 WeakPolarHBondContact CG-OH 3.23Å; E209-Y220 PolarHBondContact OE1-OH 2.84Å; E209-R456 PolarHBondContact O-NH2 2.87Å; E209-V457 HydrophobicContact CG-CG1 4.43Å; E209-R461 IonicContact OE1-CZ 3.97Å; E209-R461 VanDerWaalsContact OE1-CZ 3.31Å; E209-R461 IonicContact OE1-NE 3.68Å; E209-R461 PolarHBondContact OE1-NE 2.85Å; E209-R461 IonicContact OE1-NH2 2.69Å; E209-R461 PolarHBondContact OE1-NH2 2.65Å; E209-R461 IonicContact OE2-CZ 3.83Å; E209-R461 IonicContact OE2-NE 3.85Å; E209-R461 IonicContact OE2-NH2 2.73Å; E209-R461 PolarHBondContact OE2-NH2 2.79Å
210	D	95.7	Very high	97.1	Very high	104 Å²	104	46.4 Å²	46.4	56%	0.556	26%	0.259	S	S	*	.	S	Bend	trans	-104.5	-1.9	-179.1	-57.2	-54.5	0	0	0	112.8	S208	S208-D210 VanDerWaalsContact C-N 3.3Å; S208-D210 PolarHBondContact OG-N 3.46Å
211	G	95.8	Very high	97.1	Very high	9 Å²	9	46.1 Å²	46.1	9%	0.093	26%	0.258	C	S	.	.	S	Bend	trans	-75.4	-159	-174.1	0	0	0	0	0	115.1	S208 E215 R216 R451	S208-G211 PolarHBondContact OG-N 3.24Å; G211-E215 WeakPolarHBondContact CA-OE2 3.27Å; G211-R216 WeakPolarHBondContact O-CD 3.36Å; G211-R216 PolarHBondContact O-NE 3.38Å; G211-R216 VanDerWaalsContact O-NE 3.09Å; G211-R451 VanDerWaalsContact O-CD 3.29Å; G211-R451 WeakPolarHBondContact O-CD 3.3Å; G211-R451 PolarHBondContact O-NH1 2.87Å
212	D	96.7	Very high	97.2	Very high	63 Å²	63	41.4 Å²	41.4	34%	0.337	23%	0.229	S	C	.	.			trans	-69.8	167.3	170.6	82.9	25.1	0	0	0	113.3	A214 E215 R216 R451	D212-A214 PolarHBondContact O-N 3.11Å; D212-A214 WeakPolarHBondContact OD1-CA 3.22Å; D212-A214 WeakPolarHBondContact OD1-CB 3.39Å; D212-A214 PolarHBondContact OD1-N 2.91Å; D212-E215 PolarHBondContact N-OE2 3.16Å; D212-E215 PolarHBondContact O-N 3.42Å; D212-E215 PolarHBondContact OD1-N 2.99Å; D212-R216 WeakPolarHBondContact O-CB 3.41Å; D212-R216 VanDerWaalsContact O-CG 3.3Å; D212-R216 WeakPolarHBondContact O-CG 3.46Å; D212-R216 PolarHBondContact O-N 3.46Å; D212-R216 PolarHBondContact O-NE 2.89Å; D212-R451 VanDerWaalsContact CA-CZ 3.5Å
213	P	97.2	Very high	97.3	Very high	15 Å²	15	36 Å²	36	10%	0.097	21%	0.208	C	C	.	.	H	α-helix	trans	-53.4	-37.3	179.9	-28.2	35	0	0	0	113.5	V217 F442 E443 D446	P213-V217 WeakPolarHBondContact O-CB 3.32Å; P213-V217 WeakPolarHBondContact O-CG2 3.47Å; P213-V217 PolarHBondContact O-N 3.09Å; P213-F442 HydrophobicContact CB-CB 4.24Å; P213-E443 HydrophobicContact CB-CG 3.81Å; P213-E443 HydrophobicContact CG-CG 4.11Å; P213-D446 HydrophobicContact CG-CB 3.67Å; P213-D446 VanDerWaalsContact CG-CG 3.43Å
214	A	97.2	Very high	97.3	Very high	16 Å²	16	35.8 Å²	35.8	13%	0.132	21%	0.207	C	C	.	.	H	α-helix	trans	-72	-40.7	-179.3	0	0	0	0	0	111.4	A176 I178 L179 D212 A218	A176-A214 HydrophobicContact CB-CB 3.83Å; I178-A214 HydrophobicContact CG2-CB 4.08Å; L179-A214 HydrophobicContact CD1-CB 4.07Å; L179-A214 HydrophobicContact CD2-CB 4.34Å; L179-A214 WeakPolarHBondContact CD2-O 3.42Å; L179-A214 HydrophobicContact CG-CB 4.09Å; D212-A214 PolarHBondContact O-N 3.11Å; D212-A214 WeakPolarHBondContact OD1-CA 3.22Å; D212-A214 WeakPolarHBondContact OD1-CB 3.39Å; D212-A214 PolarHBondContact OD1-N 2.91Å; A214-A218 VanDerWaalsContact O-CB 3.26Å; A214-A218 WeakPolarHBondContact O-CB 3.28Å; A214-A218 PolarHBondContact O-N 3.22Å
215	E	98	Very high	97.3	Very high	68 Å²	68	30.5 Å²	30.5	32%	0.318	19%	0.187	S	C	.	.	H	α-helix	trans	-62.2	-42.7	174.2	-67.3	175.4	141.2	0	0	111.7	S208 G211 D212 A218 F219	S208-E215 PolarHBondContact N-O 3.36Å; S208-E215 CarbonylContact O-C 3.36Å; S208-E215 VanDerWaalsContact O-C 3.32Å; G211-E215 WeakPolarHBondContact CA-OE2 3.27Å; D212-E215 PolarHBondContact N-OE2 3.16Å; D212-E215 PolarHBondContact O-N 3.42Å; D212-E215 PolarHBondContact OD1-N 2.99Å; E215-A218 PolarHBondContact O-N 2.7Å; E215-F219 PolarHBondContact O-N 3.17Å
216	R	98.3	Very high	97.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.6	-42.8	179.4	-68.2	-178.6	-65.5	142.8	6.5	112.4	S208 E209 G211 D212 A218 F219 Y220 F442 D446 R456 E460	S208-R216 VanDerWaalsContact O-CA 3.24Å; S208-R216 WeakPolarHBondContact O-CA 3.49Å; S208-R216 VanDerWaalsContact O-CG 3.24Å; S208-R216 WeakPolarHBondContact O-CG 3.47Å; S208-R216 PolarHBondContact O-N 3.4Å; E209-R216 WeakPolarHBondContact O-CD 3.39Å; E209-R216 VanDerWaalsContact O-CG 3.28Å; E209-R216 WeakPolarHBondContact O-CG 3.32Å; G211-R216 WeakPolarHBondContact O-CD 3.36Å; G211-R216 PolarHBondContact O-NE 3.38Å; G211-R216 VanDerWaalsContact O-NE 3.09Å; D212-R216 WeakPolarHBondContact O-CB 3.41Å; D212-R216 VanDerWaalsContact O-CG 3.3Å; D212-R216 WeakPolarHBondContact O-CG 3.46Å; D212-R216 PolarHBondContact O-N 3.46Å; D212-R216 PolarHBondContact O-NE 2.89Å; R216-A218 VanDerWaalsContact C-N 3.33Å; R216-A218 PolarHBondContact O-N 3.28Å; R216-F219 WeakPolarHBondContact O-CB 3.3Å; R216-F219 PolarHBondContact O-N 3.17Å; R216-Y220 WeakPolarHBondContact O-CD2 3.39Å; R216-Y220 PolarHBondContact O-N 3.45Å; R216-F442 HydrophobicContact CB-CD1 3.89Å; R216-F442 HydrophobicContact CB-CE1 4Å; R216-D446 IonicContact CZ-OD1 3.56Å; R216-D446 IonicContact NH2-OD1 3.15Å; R216-D446 PolarHBondContact NH2-OD1 3.47Å; R216-R456 VanDerWaalsContact NH1-CD 3.29Å; R216-R456 VanDerWaalsContact NH1-CZ 3.27Å; R216-E460 IonicContact CZ-OE1 2.97Å; R216-E460 IonicContact CZ-OE2 2.57Å; R216-E460 IonicContact NH1-OE1 2.64Å; R216-E460 PolarHBondContact NH1-OE1 3.34Å; R216-E460 IonicContact NH1-OE2 2.74Å; R216-E460 PolarHBondContact NH1-OE2 2.81Å; R216-E460 IonicContact NH2-OE1 3.87Å
217	V	98.3	Very high	97.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.9	-46.4	171.5	168.5	0	0	0	0	110.3	L179 P213 F219 Y220 F221 L435 F442	L179-V217 HydrophobicContact CD2-CB 4.29Å; L179-V217 HydrophobicContact CD2-CG1 3.95Å; P213-V217 WeakPolarHBondContact O-CB 3.32Å; P213-V217 WeakPolarHBondContact O-CG2 3.47Å; P213-V217 PolarHBondContact O-N 3.09Å; V217-F219 PolarHBondContact O-N 3.05Å; V217-Y220 PolarHBondContact O-N 3.32Å; V217-F221 HydrophobicContact CG1-CD2 3.74Å; V217-F221 HydrophobicContact CG1-CE2 3.88Å; V217-F221 WeakPolarHBondContact O-CB 3.4Å; V217-F221 VanDerWaalsContact O-CD2 3.27Å; V217-F221 WeakPolarHBondContact O-CD2 3.32Å; V217-F221 PolarHBondContact O-N 2.81Å; V217-L435 HydrophobicContact CG1-CD1 3.46Å; V217-L435 VanDerWaalsContact CG1-CD1 3.46Å; V217-F442 HydrophobicContact CG2-CB 3.72Å; V217-F442 HydrophobicContact CG2-CD1 3.79Å; V217-F442 HydrophobicContact CG2-CD2 3.82Å; V217-F442 HydrophobicContact CG2-CE1 4.34Å; V217-F442 HydrophobicContact CG2-CE2 4.35Å; V217-F442 HydrophobicContact CG2-CG 3.49Å; V217-F442 VanDerWaalsContact CG2-CG 3.49Å
218	A	98.2	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.3	-33.1	177.6	0	0	0	0	0	112.8	I178 L179 V203 A207 A214 E215 R216 G222	I178-A218 HydrophobicContact CD1-CB 3.46Å; I178-A218 VanDerWaalsContact CD1-CB 3.46Å; I178-A218 HydrophobicContact CG1-CB 3.64Å; I178-A218 HydrophobicContact CG2-CB 4.37Å; L179-A218 HydrophobicContact CD2-CB 4.4Å; V203-A218 HydrophobicContact CG1-CB 4.48Å; A207-A218 HydrophobicContact CB-CB 3.97Å; A214-A218 VanDerWaalsContact O-CB 3.26Å; A214-A218 WeakPolarHBondContact O-CB 3.28Å; A214-A218 PolarHBondContact O-N 3.22Å; E215-A218 PolarHBondContact O-N 2.7Å; R216-A218 VanDerWaalsContact C-N 3.33Å; R216-A218 PolarHBondContact O-N 3.28Å; A218-G222 WeakPolarHBondContact O-CA 3.47Å; A218-G222 PolarHBondContact O-N 2.99Å
219	F	98.5	Very high	97	Very high	71 Å²	71	30.3 Å²	30.3	31%	0.311	15%	0.153	S	C	.	.	H	α-helix	trans	-61.7	-55.1	176.2	177.6	-92.3	0	0	0	111.3	A207 E209 E215 R216 V217 G222 D223	A207-F219 HydrophobicContact CB-CB 4.07Å; E209-F219 HydrophobicContact CB-CD1 4.06Å; E209-F219 HydrophobicContact CB-CD2 4.32Å; E209-F219 HydrophobicContact CB-CE1 3.99Å; E209-F219 HydrophobicContact CB-CE2 4.25Å; E209-F219 HydrophobicContact CB-CG 4.23Å; E209-F219 HydrophobicContact CB-CZ 4.09Å; E209-F219 HydrophobicContact CG-CD1 4.21Å; E209-F219 HydrophobicContact CG-CE1 4.03Å; E215-F219 PolarHBondContact O-N 3.17Å; R216-F219 WeakPolarHBondContact O-CB 3.3Å; R216-F219 PolarHBondContact O-N 3.17Å; V217-F219 PolarHBondContact O-N 3.05Å; F219-G222 PolarHBondContact O-N 3.35Å; F219-D223 PolarHBondContact O-N 3.02Å
220	Y	98.4	Very high	96.8	Very high	17 Å²	17	33.3 Å²	33.3	7%	0.067	18%	0.182	C	C	.	.	H	α-helix	trans	-69.2	-40.6	-177.7	-65.7	-66.6	0	0	0	112.9	E209 R216 V217 D223 A224 F442 E460 R461	E209-Y220 WeakPolarHBondContact CG-OH 3.23Å; E209-Y220 PolarHBondContact OE1-OH 2.84Å; R216-Y220 WeakPolarHBondContact O-CD2 3.39Å; R216-Y220 PolarHBondContact O-N 3.45Å; V217-Y220 PolarHBondContact O-N 3.32Å; Y220-D223 PolarHBondContact O-N 2.78Å; Y220-A224 PolarHBondContact O-N 3.49Å; Y220-F442 AromaticContact CD2-CE1 3.63Å; Y220-F442 HydrophobicContact CD2-CE1 3.63Å; Y220-F442 AromaticContact CD2-CZ 3.55Å; Y220-F442 HydrophobicContact CD2-CZ 3.55Å; Y220-F442 AromaticContact CE2-CE1 3.67Å; Y220-F442 HydrophobicContact CE2-CE1 3.67Å; Y220-F442 AromaticContact CE2-CZ 3.86Å; Y220-F442 HydrophobicContact CE2-CZ 3.86Å; Y220-E460 HydrophobicContact CE2-CB 3.81Å; Y220-R461 HydrophobicContact CE1-CB 4.1Å; Y220-R461 HydrophobicContact CE1-CG 4.28Å; Y220-R461 PolarHBondContact OH-N 2.95Å
221	F	98.5	Very high	96.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-38.8	175.8	-84.4	-107.9	0	0	0	112.1	L182 V217 D223 A224 L225 F431 A434 L435 Y438 I468 I472	L182-F221 HydrophobicContact CD1-CB 4.16Å; L182-F221 HydrophobicContact CD2-CB 3.35Å; L182-F221 HydrophobicContact CD2-CD1 4.15Å; L182-F221 HydrophobicContact CD2-CG 3.89Å; L182-F221 HydrophobicContact CG-CB 4.27Å; V217-F221 HydrophobicContact CG1-CD2 3.74Å; V217-F221 HydrophobicContact CG1-CE2 3.88Å; V217-F221 WeakPolarHBondContact O-CB 3.4Å; V217-F221 VanDerWaalsContact O-CD2 3.27Å; V217-F221 WeakPolarHBondContact O-CD2 3.32Å; V217-F221 PolarHBondContact O-N 2.81Å; F221-D223 VanDerWaalsContact C-N 3.28Å; F221-D223 PolarHBondContact O-N 3.34Å; F221-A224 PolarHBondContact O-N 2.93Å; F221-L225 WeakPolarHBondContact O-CB 3.33Å; F221-L225 PolarHBondContact O-N 2.68Å; F221-F431 HydrophobicContact CB-CZ 4.34Å; F221-F431 HydrophobicContact CD1-CD1 4.49Å; F221-F431 AromaticContact CD1-CE1 3.96Å; F221-F431 HydrophobicContact CD1-CE1 3.96Å; F221-F431 HydrophobicContact CD1-CE2 4.05Å; F221-F431 AromaticContact CD1-CZ 3.71Å; F221-F431 HydrophobicContact CD1-CZ 3.71Å; F221-A434 HydrophobicContact CE1-CB 3.91Å; F221-A434 HydrophobicContact CZ-CB 3.83Å; F221-L435 HydrophobicContact CD1-CD1 3.83Å; F221-L435 HydrophobicContact CD2-CD1 4.05Å; F221-L435 HydrophobicContact CE1-CB 3.92Å; F221-L435 HydrophobicContact CE1-CD1 3.85Å; F221-L435 HydrophobicContact CE2-CD1 4.05Å; F221-L435 HydrophobicContact CG-CD1 3.96Å; F221-L435 VanDerWaalsContact CZ-CA 3.49Å; F221-L435 HydrophobicContact CZ-CB 4.14Å; F221-L435 HydrophobicContact CZ-CD1 3.97Å; F221-Y438 HydrophobicContact CE2-CD2 4.34Å; F221-Y438 HydrophobicContact CE2-CG 4.48Å; F221-Y438 HydrophobicContact CZ-CD2 4.17Å; F221-I468 HydrophobicContact CD1-CG2 4.3Å; F221-I468 HydrophobicContact CD2-CD1 3.89Å; F221-I468 HydrophobicContact CD2-CG1 4.28Å; F221-I468 HydrophobicContact CD2-CG2 3.73Å; F221-I468 HydrophobicContact CE1-CG2 4.37Å; F221-I468 HydrophobicContact CE2-CB 4.44Å; F221-I468 HydrophobicContact CE2-CD1 3.52Å; F221-I468 HydrophobicContact CE2-CG1 3.7Å; F221-I468 HydrophobicContact CE2-CG2 3.83Å; F221-I468 HydrophobicContact CG-CG2 3.97Å; F221-I468 HydrophobicContact CZ-CD1 4.44Å; F221-I468 HydrophobicContact CZ-CG1 4.15Å; F221-I468 HydrophobicContact CZ-CG2 4.13Å; F221-I472 HydrophobicContact CB-CD1 4.29Å; F221-I472 HydrophobicContact CD1-CD1 3.43Å; F221-I472 VanDerWaalsContact CD1-CD1 3.43Å; F221-I472 HydrophobicContact CE1-CD1 3.96Å; F221-I472 HydrophobicContact CG-CD1 4.05Å
222	G	98	Very high	95.1	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.7	-33.5	176.3	0	0	0	0	0	112.3	R204 A218 F219 A226	R204-G222 PolarHBondContact NH1-O 3.36Å; A218-G222 WeakPolarHBondContact O-CA 3.47Å; A218-G222 PolarHBondContact O-N 2.99Å; F219-G222 PolarHBondContact O-N 3.35Å; G222-A226 VanDerWaalsContact O-CB 3.3Å; G222-A226 WeakPolarHBondContact O-CB 3.35Å; G222-A226 PolarHBondContact O-N 2.97Å
223	D	97	Very high	93.3	Very high	46 Å²	46	32 Å²	32	25%	0.246	20%	0.201	C	C	.	.	H	α-helix	trans	-69.5	-47.5	171.7	-162.7	60.6	0	0	0	113	R204 F219 Y220 F221 L225 A226 R227	R204-D223 IonicContact CZ-OD1 3.46Å; R204-D223 IonicContact NH1-OD1 3.32Å; R204-D223 PolarHBondContact NH1-OD1 2.8Å; R204-D223 VanDerWaalsContact NH1-OD1 3.12Å; R204-D223 IonicContact NH2-OD1 3.99Å; F219-D223 PolarHBondContact O-N 3.02Å; Y220-D223 PolarHBondContact O-N 2.78Å; F221-D223 VanDerWaalsContact C-N 3.28Å; F221-D223 PolarHBondContact O-N 3.34Å; D223-L225 VanDerWaalsContact C-N 3.33Å; D223-L225 PolarHBondContact O-N 3.43Å; D223-A226 PolarHBondContact O-N 3.06Å; D223-R227 WeakPolarHBondContact O-CG 3.48Å; D223-R227 PolarHBondContact O-N 3.41Å; D223-R227 IonicContact OD2-CZ 3.16Å; D223-R227 VanDerWaalsContact OD2-CZ 3.32Å; D223-R227 IonicContact OD2-NE 2.59Å; D223-R227 PolarHBondContact OD2-NE 3.37Å; D223-R227 IonicContact OD2-NH2 3.22Å; D223-R227 PolarHBondContact OD2-NH2 3.23Å
224	A	97.1	Very high	91.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-42.2	177.6	0	0	0	0	0	112.3	Y220 F221 R227 R228 I468 I472	Y220-A224 PolarHBondContact O-N 3.49Å; F221-A224 PolarHBondContact O-N 2.93Å; A224-R227 PolarHBondContact O-N 2.97Å; A224-R228 PolarHBondContact O-N 3.34Å; A224-I468 HydrophobicContact CB-CG2 4.11Å; A224-I472 HydrophobicContact CB-CD1 3.69Å; A224-I472 HydrophobicContact CB-CG1 3.73Å
225	L	97.1	Very high	88.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-42.2	176.1	-175.1	56.1	0	0	0	111.9	C185 A189 L200 F221 D223 R227 R228 L229 F427 F431	C185-L225 HydrophobicContact CB-CD2 4Å; A189-L225 HydrophobicContact CB-CD1 4.01Å; L200-L225 HydrophobicContact CD1-CD2 4.19Å; L200-L225 HydrophobicContact CD2-CB 4.21Å; L200-L225 HydrophobicContact CD2-CD2 4.36Å; L200-L225 HydrophobicContact CD2-CG 4.06Å; F221-L225 WeakPolarHBondContact O-CB 3.33Å; F221-L225 PolarHBondContact O-N 2.68Å; D223-L225 VanDerWaalsContact C-N 3.33Å; D223-L225 PolarHBondContact O-N 3.43Å; L225-R227 VanDerWaalsContact C-N 3.31Å; L225-R227 PolarHBondContact O-N 3.5Å; L225-R228 WeakPolarHBondContact O-CB 3.45Å; L225-R228 PolarHBondContact O-N 2.85Å; L225-L229 HydrophobicContact CD1-CG 4.37Å; L225-L229 HydrophobicContact CG-CD1 4.21Å; L225-L229 WeakPolarHBondContact O-CG 3.24Å; L225-L229 PolarHBondContact O-N 3.32Å; L225-F427 HydrophobicContact CD1-CZ 3.82Å; L225-F431 HydrophobicContact CB-CE2 4.36Å; L225-F431 HydrophobicContact CD1-CE2 4.49Å; L225-F431 HydrophobicContact CD2-CE2 4.31Å
226	A	96.5	Very high	86.3	Confident	28 Å²	28	42.7 Å²	42.7	23%	0.231	28%	0.278	C	S	.	.	H	α-helix	trans	-59.6	-43.1	176.8	0	0	0	0	0	111.6	L200 G222 D223 L229 A230	L200-A226 HydrophobicContact CD2-CB 3.77Å; G222-A226 VanDerWaalsContact O-CB 3.3Å; G222-A226 WeakPolarHBondContact O-CB 3.35Å; G222-A226 PolarHBondContact O-N 2.97Å; D223-A226 PolarHBondContact O-N 3.06Å; A226-L229 PolarHBondContact O-N 2.9Å; A226-A230 WeakPolarHBondContact O-CB 3.31Å; A226-A230 PolarHBondContact O-N 2.88Å
227	R	95.2	Very high	83.8	Confident	112 Å²	112	45.2 Å²	45.2	42%	0.423	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-42.8	175.8	-68.5	172.8	-171.9	-91.9	-2.6	112	D223 A224 L225 L229 A230 C231	D223-R227 WeakPolarHBondContact O-CG 3.48Å; D223-R227 PolarHBondContact O-N 3.41Å; D223-R227 IonicContact OD2-CZ 3.16Å; D223-R227 VanDerWaalsContact OD2-CZ 3.32Å; D223-R227 IonicContact OD2-NE 2.59Å; D223-R227 PolarHBondContact OD2-NE 3.37Å; D223-R227 IonicContact OD2-NH2 3.22Å; D223-R227 PolarHBondContact OD2-NH2 3.23Å; A224-R227 PolarHBondContact O-N 2.97Å; L225-R227 VanDerWaalsContact C-N 3.31Å; L225-R227 PolarHBondContact O-N 3.5Å; R227-L229 VanDerWaalsContact C-N 3.35Å; R227-L229 PolarHBondContact O-N 2.88Å; R227-A230 PolarHBondContact O-N 3.3Å; R227-C231 PolarHBondContact O-N 2.8Å; R227-C231 VanDerWaalsContact O-N 3.1Å; R227-C231 PolarHBondContact O-SG 3.46Å
228	R	95.2	Very high	81.1	Confident	28 Å²	28	53.3 Å²	53.3	11%	0.106	34%	0.337	C	S	.	.	H	α-helix	trans	-58.6	-46.9	175.4	-176.8	-179.7	-177.8	85.7	-2.8	111.8	A224 L225 C231 G232 G233 F427 I472 G473 E476	A224-R228 PolarHBondContact O-N 3.34Å; L225-R228 WeakPolarHBondContact O-CB 3.45Å; L225-R228 PolarHBondContact O-N 2.85Å; R228-C231 PolarHBondContact O-N 3.49Å; R228-G232 PolarHBondContact O-N 3.49Å; R228-G233 PolarHBondContact O-N 2.95Å; R228-F427 VanDerWaalsContact CZ-CD2 3.41Å; R228-I472 WeakPolarHBondContact CD-O 3.41Å; R228-G473 WeakPolarHBondContact CG-O 3.08Å; R228-G473 PolarHBondContact NH1-O 3.24Å; R228-E476 IonicContact CZ-OE1 3.24Å; R228-E476 VanDerWaalsContact CZ-OE1 3.24Å; R228-E476 IonicContact NH1-OE1 2.77Å; R228-E476 PolarHBondContact NH1-OE1 3.14Å; R228-E476 IonicContact NH2-OE1 2.82Å; R228-E476 PolarHBondContact NH2-OE1 3.39Å
229	L	94.6	Very high	78.2	Confident	33 Å²	33	58 Å²	58	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-64.8	-40.9	178.9	-68.2	173.5	0	0	0	111.6	A189 P193 A196 A197 L200 L225 A226 R227 C231 G232	A189-L229 HydrophobicContact CB-CD2 3.92Å; P193-L229 HydrophobicContact CB-CD2 3.83Å; A196-L229 HydrophobicContact CB-CD1 4.26Å; A196-L229 HydrophobicContact CB-CD2 4.32Å; A197-L229 HydrophobicContact CB-CD1 4.22Å; L200-L229 HydrophobicContact CD2-CD1 3.94Å; L225-L229 HydrophobicContact CD1-CG 4.37Å; L225-L229 HydrophobicContact CG-CD1 4.21Å; L225-L229 WeakPolarHBondContact O-CG 3.24Å; L225-L229 PolarHBondContact O-N 3.32Å; A226-L229 PolarHBondContact O-N 2.9Å; R227-L229 VanDerWaalsContact C-N 3.35Å; R227-L229 PolarHBondContact O-N 2.88Å; L229-C231 VanDerWaalsContact C-N 3.32Å; L229-C231 PolarHBondContact O-N 3.29Å; L229-G232 PolarHBondContact O-N 3.18Å; L229-G232 VanDerWaalsContact O-N 3.14Å
230	A	91.7	Very high	75.4	Confident	88 Å²	88	61.7 Å²	61.7	73%	0.727	39%	0.389	S	S	*	.	H	α-helix	trans	-64.4	-33.1	178.1	0	0	0	0	0	113.4	A226 R227 G232	A226-A230 WeakPolarHBondContact O-CB 3.31Å; A226-A230 PolarHBondContact O-N 2.88Å; R227-A230 PolarHBondContact O-N 3.3Å; A230-G232 VanDerWaalsContact C-N 3.28Å; A230-G232 PolarHBondContact O-N 3.44Å
231	C	85.6	Confident	72.4	Confident	42 Å²	42	67 Å²	67	28%	0.284	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	7.2	175.9	-64.2	0	0	0	0	113.9	R227 R228 L229 G233 P474	R227-C231 PolarHBondContact O-N 2.8Å; R227-C231 VanDerWaalsContact O-N 3.1Å; R227-C231 PolarHBondContact O-SG 3.46Å; R228-C231 PolarHBondContact O-N 3.49Å; L229-C231 VanDerWaalsContact C-N 3.32Å; L229-C231 PolarHBondContact O-N 3.29Å; C231-G233 VanDerWaalsContact C-N 3.35Å; C231-G233 PolarHBondContact O-N 3.1Å; C231-P474 HydrophobicContact CB-CB 3.67Å
232	G	70.6	Confident	69.5	Low	65 Å²	65	70.1 Å²	70.1	67%	0.67	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	21.8	173.7	0	0	0	0	0	115.5	R228 L229 A230 G234	R228-G232 PolarHBondContact O-N 3.49Å; L229-G232 PolarHBondContact O-N 3.18Å; L229-G232 VanDerWaalsContact O-N 3.14Å; A230-G232 VanDerWaalsContact C-N 3.28Å; A230-G232 PolarHBondContact O-N 3.44Å; G232-G234 PolarHBondContact O-N 3.38Å
233	G	57.5	Low	66.6	Low	42 Å²	42	76.6 Å²	76.6	43%	0.433	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	5.2	174.2	0	0	0	0	0	116.3	R228 C231	R228-G233 PolarHBondContact O-N 2.95Å; C231-G233 VanDerWaalsContact C-N 3.35Å; C231-G233 PolarHBondContact O-N 3.1Å
234	G	51.4	Low	64.3	Low	44 Å²	44	77.2 Å²	77.2	45%	0.454	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-165.8	127.9	-177.4	0	0	0	0	0	114.2	G232 Q236	G232-G234 PolarHBondContact O-N 3.38Å; G234-Q236 VanDerWaalsContact C-N 3.26Å; G234-Q236 PolarHBondContact O-N 2.84Å
235	A	48.8	Very low	62	Low	111 Å²	111	81 Å²	81	92%	0.917	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	-7.4	155.9	0	0	0	0	0	121.5
236	Q	45.7	Very low	59.8	Low	168 Å²	168	84.7 Å²	84.7	79%	0.785	54%	0.537	S	S	*	.			trans	-113.4	47.2	172.2	-68.7	-156.5	12.7	0	0	112.7	G234 Q238	G234-Q236 VanDerWaalsContact C-N 3.26Å; G234-Q236 PolarHBondContact O-N 2.84Å; Q236-Q238 PolarHBondContact O-N 2.8Å; Q236-Q238 VanDerWaalsContact O-N 3.07Å
237	A	45.2	Very low	57.6	Low	53 Å²	53	86.1 Å²	86.1	44%	0.438	54%	0.538	S	S	.	.			trans	-63.4	111	155.6	0	0	0	0	0	106.4
238	Q	41.7	Very low	55.7	Low	171 Å²	171	83.4 Å²	83.4	80%	0.799	54%	0.54	S	S	*	.			trans	-51.2	131.2	160.4	-85.2	-152.1	23.8	0	0	106.1	Q236 L240	Q236-Q238 PolarHBondContact O-N 2.8Å; Q236-Q238 VanDerWaalsContact O-N 3.07Å; Q238-L240 VanDerWaalsContact C-N 3.3Å; Q238-L240 PolarHBondContact O-N 2.83Å
239	P	38.6	Very low	53.9	Low	97 Å²	97	84.8 Å²	84.8	63%	0.63	55%	0.551	S	S	*	*			trans	-59.2	108	168.4	24.8	-28.7	0	0	0	104.4	T241	P239-T241 HydrophobicContact CB-CG2 3.97Å; P239-T241 HydrophobicContact CG-CG2 4.14Å; P239-T241 PolarHBondContact O-N 3.39Å
240	L	39.7	Very low	52.9	Low	149 Å²	149	88.9 Å²	88.9	78%	0.78	57%	0.574	S	S	*	*			trans	-62.9	87.6	155	-78.5	165.7	0	0	0	103	Q238 A242	Q238-L240 VanDerWaalsContact C-N 3.3Å; Q238-L240 PolarHBondContact O-N 2.83Å; L240-A242 PolarHBondContact O-N 2.91Å
241	T	34.1	Very low	52.4	Low	128 Å²	128	88.2 Å²	88.2	79%	0.785	56%	0.555	S	S	*	*			trans	-63.4	13.4	170.4	48.6	0	0	0	0	111.6	P239 V243	P239-T241 HydrophobicContact CB-CG2 3.97Å; P239-T241 HydrophobicContact CG-CG2 4.14Å; P239-T241 PolarHBondContact O-N 3.39Å; T241-V243 PolarHBondContact O-N 2.66Å; T241-V243 VanDerWaalsContact O-N 3.09Å
242	A	37.4	Very low	52.2	Low	67 Å²	67	87.1 Å²	87.1	55%	0.554	55%	0.546	S	S	*	.	S	Bend	trans	-57.5	115.7	157.7	0	0	0	0	0	106.5	L240 D244	L240-A242 PolarHBondContact O-N 2.91Å; A242-D244 PolarHBondContact O-N 3.22Å
243	V	38.5	Very low	52.7	Low	135 Å²	135	85.9 Å²	85.9	82%	0.818	53%	0.526	S	S	*	.			trans	-33.9	121.3	156.4	176.1	0	0	0	0	105.6	T241 A245	T241-V243 PolarHBondContact O-N 2.66Å; T241-V243 VanDerWaalsContact O-N 3.09Å; V243-A245 WeakPolarHBondContact O-CA 3.25Å; V243-A245 PolarHBondContact O-N 3.32Å
244	D	48.6	Very low	54.1	Low	60 Å²	60	86.1 Å²	86.1	32%	0.321	52%	0.517	S	S	.	.			trans	-49.8	90.7	-174.5	-179.1	38.6	0	0	0	110.4	A242 R246 F247	A242-D244 PolarHBondContact O-N 3.22Å; D244-R246 PolarHBondContact O-N 3.4Å; D244-R246 WeakPolarHBondContact OD1-CB 3.48Å; D244-R246 WeakPolarHBondContact OD1-CD 3.39Å; D244-R246 WeakPolarHBondContact OD1-CG 3.39Å; D244-R246 IonicContact OD1-CZ 3.6Å; D244-R246 VanDerWaalsContact OD1-CZ 3.25Å; D244-R246 IonicContact OD1-NE 3.55Å; D244-R246 PolarHBondContact OD1-NE 3.25Å; D244-R246 IonicContact OD1-NH2 2.7Å; D244-R246 PolarHBondContact OD1-NH2 3.35Å; D244-R246 WeakPolarHBondContact OD2-CB 3.27Å; D244-R246 IonicContact OD2-CZ 3.91Å; D244-R246 IonicContact OD2-NE 2.71Å; D244-R246 PolarHBondContact OD2-NE 2.8Å; D244-R246 IonicContact OD2-NH2 3.72Å; D244-R246 PolarHBondContact OD2-NH2 2.97Å; D244-F247 PolarHBondContact O-N 2.79Å
245	A	47.9	Very low	56	Low	80 Å²	80	84 Å²	84	66%	0.661	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-66.6	-5.1	-169.8	0	0	0	0	0	110.7	V243 F247 A248	V243-A245 WeakPolarHBondContact O-CA 3.25Å; V243-A245 PolarHBondContact O-N 3.32Å; A245-F247 PolarHBondContact O-N 3Å; A245-A248 PolarHBondContact O-N 3.46Å
246	R	50.7	Low	57.8	Low	77 Å²	77	79.9 Å²	79.9	29%	0.291	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-35.1	-37	164.1	-75.3	-167.5	-48.1	-145.1	-25.3	112.7	D244 L252 R470 T481	D244-R246 PolarHBondContact O-N 3.4Å; D244-R246 WeakPolarHBondContact OD1-CB 3.48Å; D244-R246 WeakPolarHBondContact OD1-CD 3.39Å; D244-R246 WeakPolarHBondContact OD1-CG 3.39Å; D244-R246 IonicContact OD1-CZ 3.6Å; D244-R246 VanDerWaalsContact OD1-CZ 3.25Å; D244-R246 IonicContact OD1-NE 3.55Å; D244-R246 PolarHBondContact OD1-NE 3.25Å; D244-R246 IonicContact OD1-NH2 2.7Å; D244-R246 PolarHBondContact OD1-NH2 3.35Å; D244-R246 WeakPolarHBondContact OD2-CB 3.27Å; D244-R246 IonicContact OD2-CZ 3.91Å; D244-R246 IonicContact OD2-NE 2.71Å; D244-R246 PolarHBondContact OD2-NE 2.8Å; D244-R246 IonicContact OD2-NH2 3.72Å; D244-R246 PolarHBondContact OD2-NH2 2.97Å; R246-L252 WeakPolarHBondContact O-CD1 3.47Å; R246-L252 WeakPolarHBondContact O-CG 3.33Å; R246-R470 VanDerWaalsContact CD-NE 3.33Å; R246-T481 PolarHBondContact NH1-OG1 3.02Å; R246-T481 VanDerWaalsContact NH1-OG1 3.14Å
247	F	52	Low	59.8	Low	59 Å²	59	73.5 Å²	73.5	26%	0.259	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-119.4	38.2	-174.9	-53.5	-65.1	0	0	0	113.9	D244 A245 T249 L252 P326	D244-F247 PolarHBondContact O-N 2.79Å; A245-F247 PolarHBondContact O-N 3Å; F247-T249 PolarHBondContact O-N 3.15Å; F247-L252 HydrophobicContact CD1-CD1 3.88Å; F247-L252 HydrophobicContact CE1-CD1 4.08Å; F247-P326 WeakPolarHBondContact CD1-O 3.47Å; F247-P326 HydrophobicContact CE1-CB 3.55Å; F247-P326 WeakPolarHBondContact CE1-O 3.37Å; F247-P326 HydrophobicContact CZ-CB 3.71Å
248	A	53.9	Low	62.1	Low	55 Å²	55	72 Å²	72	46%	0.455	41%	0.411	S	S	.	.			trans	-55	100.4	153.3	0	0	0	0	0	106.9	A245 D250 E251	A245-A248 PolarHBondContact O-N 3.46Å; A248-D250 PolarHBondContact O-N 2.91Å; A248-E251 PolarHBondContact O-N 2.79Å
249	T	57.9	Low	64.5	Low	56 Å²	56	64.5 Å²	64.5	34%	0.344	38%	0.377	S	S	.	.	H	α-helix	trans	-52.6	-29.3	-158.7	-52.8	0	0	0	0	113.4	F247 T253 L328	F247-T249 PolarHBondContact O-N 3.15Å; T249-T253 PolarHBondContact O-OG1 3.42Å; T249-L328 WeakPolarHBondContact CG2-O 3.35Å
250	D	73.7	Confident	66.9	Low	120 Å²	120	60.6 Å²	60.6	64%	0.642	35%	0.35	S	S	*	.	H	α-helix	trans	-84.9	-36	-173.8	-58.5	-16.9	0	0	0	112.2	A248 L254	A248-D250 PolarHBondContact O-N 2.91Å; D250-L254 VanDerWaalsContact O-CB 3.32Å; D250-L254 WeakPolarHBondContact O-CB 3.36Å; D250-L254 WeakPolarHBondContact O-CD1 3.23Å; D250-L254 WeakPolarHBondContact O-CG 3.39Å; D250-L254 PolarHBondContact O-N 2.96Å
251	E	80.8	Confident	69.3	Low	73 Å²	73	57.2 Å²	57.2	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-68.3	-48.4	-173.2	-73.1	-63.8	145.6	0	0	112.1	A248 L254 C255 R458	A248-E251 PolarHBondContact O-N 2.79Å; E251-L254 PolarHBondContact O-N 3.19Å; E251-C255 WeakPolarHBondContact O-CB 3.34Å; E251-C255 PolarHBondContact O-N 2.95Å; E251-C255 PolarHBondContact O-SG 3.26Å; E251-R458 WeakPolarHBondContact OE2-CD 2.99Å; E251-R458 WeakPolarHBondContact OE2-CG 3.13Å; E251-R458 IonicContact OE2-NE 3.57Å; E251-R458 PolarHBondContact OE2-NE 3.4Å
252	L	81.4	Confident	72.2	Confident	19 Å²	19	51.8 Å²	51.8	10%	0.099	30%	0.302	C	S	.	.	H	α-helix	trans	-68	-37.9	179.9	-84	-170.9	0	0	0	112.5	R246 F247 L254 C255 Y256 Y327	R246-L252 WeakPolarHBondContact O-CD1 3.47Å; R246-L252 WeakPolarHBondContact O-CG 3.33Å; F247-L252 HydrophobicContact CD1-CD1 3.88Å; F247-L252 HydrophobicContact CE1-CD1 4.08Å; L252-L254 VanDerWaalsContact C-N 3.35Å; L252-C255 PolarHBondContact O-N 3.43Å; L252-Y256 WeakPolarHBondContact O-CB 3.28Å; L252-Y256 PolarHBondContact O-N 2.92Å; L252-Y327 HydrophobicContact CB-CD1 4.07Å; L252-Y327 HydrophobicContact CD1-CD1 3.83Å; L252-Y327 HydrophobicContact CD1-CE1 4.28Å; L252-Y327 HydrophobicContact CD2-CD1 4.34Å; L252-Y327 HydrophobicContact CD2-CE1 4.38Å; L252-Y327 HydrophobicContact CG-CD1 4.32Å
253	T	81.2	Confident	74.9	Confident	39 Å²	39	48.6 Å²	48.6	24%	0.239	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-43.1	175.1	-58.5	0	0	0	0	110.8	T249 Y256 K257 Y327	T249-T253 PolarHBondContact O-OG1 3.42Å; T253-Y256 PolarHBondContact O-N 3.32Å; T253-K257 PolarHBondContact O-N 3.04Å; T253-Y327 PolarHBondContact OG1-O 3.35Å
254	L	87.3	Confident	77.6	Confident	48 Å²	48	42.2 Å²	42.2	25%	0.251	24%	0.236	S	C	.	.	H	α-helix	trans	-65.2	-40.3	174.5	-72.2	170.2	0	0	0	112.2	Y3 D250 E251 L252 K257 T258	Y3-L254 HydrophobicContact CE1-CD2 4.06Å; D250-L254 VanDerWaalsContact O-CB 3.32Å; D250-L254 WeakPolarHBondContact O-CB 3.36Å; D250-L254 WeakPolarHBondContact O-CD1 3.23Å; D250-L254 WeakPolarHBondContact O-CG 3.39Å; D250-L254 PolarHBondContact O-N 2.96Å; E251-L254 PolarHBondContact O-N 3.19Å; L252-L254 VanDerWaalsContact C-N 3.35Å; L254-K257 PolarHBondContact O-N 3.23Å; L254-T258 WeakPolarHBondContact O-CB 3.19Å; L254-T258 PolarHBondContact O-N 3.45Å; L254-T258 PolarHBondContact O-OG1 2.68Å
255	C	90.9	Very high	79.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-45.5	174.8	-68.3	0	0	0	0	111.4	E251 L252 T258 L259 V459 M463	E251-C255 WeakPolarHBondContact O-CB 3.34Å; E251-C255 PolarHBondContact O-N 2.95Å; E251-C255 PolarHBondContact O-SG 3.26Å; L252-C255 PolarHBondContact O-N 3.43Å; C255-T258 PolarHBondContact O-N 3.08Å; C255-L259 VanDerWaalsContact O-CB 3.31Å; C255-L259 WeakPolarHBondContact O-CB 3.38Å; C255-L259 PolarHBondContact O-N 3.2Å; C255-V459 HydrophobicContact CB-CG2 4.15Å; C255-M463 HydrophobicContact CB-CB 4.25Å; C255-M463 HydrophobicContact CB-CE 3.6Å
256	Y	87.1	Confident	82	Confident	24 Å²	24	36.7 Å²	36.7	9%	0.094	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-46.2	178.1	-178.2	-102.3	0	0	0	111.1	L252 T253 L259 N260 H270 V295	L252-Y256 WeakPolarHBondContact O-CB 3.28Å; L252-Y256 PolarHBondContact O-N 2.92Å; T253-Y256 PolarHBondContact O-N 3.32Å; Y256-L259 PolarHBondContact O-N 2.82Å; Y256-N260 WeakPolarHBondContact CD1-ND2 3.4Å; Y256-N260 WeakPolarHBondContact CE1-ND2 3.44Å; Y256-N260 WeakPolarHBondContact O-CB 3.49Å; Y256-N260 PolarHBondContact O-N 2.94Å; Y256-N260 PolarHBondContact O-ND2 2.81Å; Y256-N260 PolarHBondContact O-OD1 2.89Å; Y256-H270 PolarHBondContact OH-CE1 2.91Å; Y256-V295 HydrophobicContact CD1-CB 4.5Å; Y256-V295 HydrophobicContact CD1-CG1 3.9Å; Y256-V295 HydrophobicContact CE1-CB 4.12Å; Y256-V295 HydrophobicContact CE1-CG1 4.02Å; Y256-V295 HydrophobicContact CE1-CG2 4.48Å; Y256-V295 HydrophobicContact CG-CG1 4.47Å
257	K	87.2	Confident	84	Confident	33 Å²	33	34.9 Å²	34.9	14%	0.143	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-52.2	174.8	-179.8	167.9	178.9	143.9	0	111.9	D7 T253 L254 L259 N260 D261	D7-K257 IonicContact OD1-NZ 3.31Å; D7-K257 PolarHBondContact OD1-NZ 3.29Å; T253-K257 PolarHBondContact O-N 3.04Å; L254-K257 PolarHBondContact O-N 3.23Å; K257-L259 VanDerWaalsContact C-N 3.31Å; K257-L259 PolarHBondContact O-N 2.84Å; K257-N260 PolarHBondContact O-N 3.26Å; K257-N260 VanDerWaalsContact O-N 3.13Å; K257-D261 PolarHBondContact O-N 2.94Å
258	T	93.1	Very high	86.1	Confident	21 Å²	21	32.1 Å²	32.1	13%	0.129	18%	0.177	C	C	.	.	H	α-helix	trans	-55.7	-46.5	179.2	-56.6	0	0	0	0	111.4	L254 C255 N260 D261 A262 M449 E455 V459	L254-T258 WeakPolarHBondContact O-CB 3.19Å; L254-T258 PolarHBondContact O-N 3.45Å; L254-T258 PolarHBondContact O-OG1 2.68Å; C255-T258 PolarHBondContact O-N 3.08Å; T258-N260 VanDerWaalsContact C-N 3.34Å; T258-N260 PolarHBondContact O-N 2.73Å; T258-D261 PolarHBondContact O-N 2.87Å; T258-A262 WeakPolarHBondContact O-CB 3.5Å; T258-A262 PolarHBondContact O-N 2.81Å; T258-M449 HydrophobicContact CG2-CE 4.38Å; T258-M449 HydrophobicContact CG2-SD 3.88Å; T258-E455 HydrophobicContact CG2-CB 3.71Å; T258-V459 HydrophobicContact CG2-CG2 3.62Å
259	L	92.9	Very high	88.2	Confident	14 Å²	14	29.6 Å²	29.6	7%	0.073	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-37.3	-180	-175.6	61.9	0	0	0	112.2	C255 Y256 K257 D261 C263 Y265 L445 V459 M463 F464	C255-L259 VanDerWaalsContact O-CB 3.31Å; C255-L259 WeakPolarHBondContact O-CB 3.38Å; C255-L259 PolarHBondContact O-N 3.2Å; Y256-L259 PolarHBondContact O-N 2.82Å; K257-L259 VanDerWaalsContact C-N 3.31Å; K257-L259 PolarHBondContact O-N 2.84Å; L259-D261 VanDerWaalsContact C-N 3.34Å; L259-C263 HydrophobicContact CD1-CB 4.18Å; L259-C263 WeakPolarHBondContact O-CA 3.32Å; L259-C263 WeakPolarHBondContact O-CB 3.44Å; L259-C263 PolarHBondContact O-N 2.84Å; L259-Y265 HydrophobicContact CD1-CD2 3.89Å; L259-Y265 HydrophobicContact CD1-CE2 3.99Å; L259-Y265 HydrophobicContact CD2-CD2 4.44Å; L259-Y265 HydrophobicContact CG-CD2 4.14Å; L259-L445 HydrophobicContact CD1-CD2 3.76Å; L259-V459 HydrophobicContact CD1-CG1 4.44Å; L259-M463 HydrophobicContact CD2-SD 3.81Å; L259-F464 HydrophobicContact CD1-CZ 3.93Å; L259-F464 HydrophobicContact CD2-CE1 4.17Å; L259-F464 HydrophobicContact CD2-CZ 4Å
260	N	89.2	Confident	89.9	Confident	15 Å²	15	28 Å²	28	8%	0.08	15%	0.145	C	C	.	.	H	α-helix	trans	-71.6	-29	178.1	-65.4	-17.7	0	0	0	113.5	Y256 K257 T258 S266	Y256-N260 WeakPolarHBondContact CD1-ND2 3.4Å; Y256-N260 WeakPolarHBondContact CE1-ND2 3.44Å; Y256-N260 WeakPolarHBondContact O-CB 3.49Å; Y256-N260 PolarHBondContact O-N 2.94Å; Y256-N260 PolarHBondContact O-ND2 2.81Å; Y256-N260 PolarHBondContact O-OD1 2.89Å; K257-N260 PolarHBondContact O-N 3.26Å; K257-N260 VanDerWaalsContact O-N 3.13Å; T258-N260 VanDerWaalsContact C-N 3.34Å; T258-N260 PolarHBondContact O-N 2.73Å; N260-S266 WeakPolarHBondContact OD1-CB 3.42Å; N260-S266 PolarHBondContact OD1-OG 2.83Å
261	D	90.3	Very high	90.9	Very high	79 Å²	79	23.6 Å²	23.6	42%	0.422	12%	0.121	S	C	.	.	H	α-helix	trans	-78.7	-38.6	176.2	-68.9	-21.4	0	0	0	110.8	N10 K257 T258 L259	N10-D261 PolarHBondContact ND2-OD1 3.05Å; K257-D261 PolarHBondContact O-N 2.94Å; T258-D261 PolarHBondContact O-N 2.87Å; L259-D261 VanDerWaalsContact C-N 3.34Å
262	A	93.5	Very high	91.7	Very high	14 Å²	14	20.1 Å²	20.1	12%	0.116	11%	0.105	C	C	.	.	H	α-helix	trans	-81.7	-32	-178.6	0	0	0	0	0	114.2	T258 A448 M449	T258-A262 WeakPolarHBondContact O-CB 3.5Å; T258-A262 PolarHBondContact O-N 2.81Å; A262-A448 HydrophobicContact CB-CB 3.95Å; A262-A448 VanDerWaalsContact O-CB 3.32Å; A262-A448 WeakPolarHBondContact O-CB 3.3Å; A262-M449 HydrophobicContact CB-CE 3.86Å; A262-M449 HydrophobicContact CB-CG 4.14Å; A262-M449 HydrophobicContact CB-SD 4.1Å
263	C	95	Very high	92.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.			trans	-133.7	150.7	-170.3	-60.5	0	0	0	0	112.7	L259 Y265 L445 Y525	L259-C263 HydrophobicContact CD1-CB 4.18Å; L259-C263 WeakPolarHBondContact O-CA 3.32Å; L259-C263 WeakPolarHBondContact O-CB 3.44Å; L259-C263 PolarHBondContact O-N 2.84Å; C263-Y265 HydrophobicContact CB-CD2 3.29Å; C263-Y265 HydrophobicContact CB-CE2 3.26Å; C263-Y265 HydrophobicContact CB-CG 4.21Å; C263-Y265 PolarHBondContact O-N 2.81Å; C263-L445 VanDerWaalsContact SG-CD2 3.59Å; C263-Y525 PolarHBondContact SG-OH 3.34Å
264	P	95.4	Very high	93.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-78.7	4.2	-176.4	27.9	-28.1	0	0	0	114.4	S266 K267 F268 L515 L516 Y519 Y525 L537	P264-S266 PolarHBondContact O-N 2.9Å; P264-K267 PolarHBondContact O-N 2.82Å; P264-F268 VanDerWaalsContact O-CB 3.23Å; P264-F268 WeakPolarHBondContact O-CB 3.44Å; P264-F268 PolarHBondContact O-N 3.21Å; P264-L515 HydrophobicContact CB-CD2 4.06Å; P264-L515 HydrophobicContact CB-CG 4.34Å; P264-L516 HydrophobicContact CB-CD2 4.1Å; P264-L516 HydrophobicContact CG-CD2 3.9Å; P264-Y519 WeakPolarHBondContact CA-OH 3.38Å; P264-Y519 HydrophobicContact CB-CE2 3.8Å; P264-Y519 WeakPolarHBondContact CB-OH 3.33Å; P264-Y519 WeakPolarHBondContact CD-OH 3.35Å; P264-Y519 HydrophobicContact CG-CE1 4.24Å; P264-Y519 HydrophobicContact CG-CE2 4.06Å; P264-Y525 WeakPolarHBondContact CD-OH 3.39Å; P264-Y525 HydrophobicContact CG-CD1 4.1Å; P264-Y525 HydrophobicContact CG-CD2 3.72Å; P264-Y525 HydrophobicContact CG-CE1 3.99Å; P264-Y525 HydrophobicContact CG-CE2 3.59Å; P264-Y525 HydrophobicContact CG-CG 3.98Å; P264-L537 HydrophobicContact CB-CD2 4.44Å; P264-L537 HydrophobicContact CG-CD2 4.03Å
265	Y	95.7	Very high	93.7	Very high	19 Å²	19	16.1 Å²	16.1	8%	0.075	8%	0.082	C	C	.	.	H	α-helix	trans	-53.2	-58.5	-168.5	-61	-57.4	0	0	0	113.8	L259 C263 A269 S444 Y525 L537 L544	L259-Y265 HydrophobicContact CD1-CD2 3.89Å; L259-Y265 HydrophobicContact CD1-CE2 3.99Å; L259-Y265 HydrophobicContact CD2-CD2 4.44Å; L259-Y265 HydrophobicContact CG-CD2 4.14Å; C263-Y265 HydrophobicContact CB-CD2 3.29Å; C263-Y265 HydrophobicContact CB-CE2 3.26Å; C263-Y265 HydrophobicContact CB-CG 4.21Å; C263-Y265 PolarHBondContact O-N 2.81Å; Y265-A269 WeakPolarHBondContact O-CB 3.42Å; Y265-A269 PolarHBondContact O-N 2.76Å; Y265-A269 VanDerWaalsContact O-N 3.09Å; Y265-S444 VanDerWaalsContact OH-CB 3.32Å; Y265-S444 WeakPolarHBondContact OH-CB 3.49Å; Y265-S444 PolarHBondContact OH-OG 2.94Å; Y265-Y525 HydrophobicContact CE1-CE1 4.04Å; Y265-L537 HydrophobicContact CD1-CD2 3.67Å; Y265-L537 HydrophobicContact CE1-CD2 4.15Å; Y265-L544 HydrophobicContact CE1-CB 4.45Å; Y265-L544 HydrophobicContact CE1-CD1 3.93Å
266	S	92.4	Very high	94	Very high	5 Å²	5	16.6 Å²	16.6	4%	0.035	9%	0.086	C	C	.	.	H	α-helix	trans	-69.8	-39.6	-179.3	56.7	0	0	0	0	112.2	N260 P264 F268 A269 H270	N260-S266 WeakPolarHBondContact OD1-CB 3.42Å; N260-S266 PolarHBondContact OD1-OG 2.83Å; P264-S266 PolarHBondContact O-N 2.9Å; S266-F268 PolarHBondContact O-N 2.94Å; S266-A269 PolarHBondContact O-N 3.11Å; S266-H270 WeakPolarHBondContact O-CB 3.31Å; S266-H270 PolarHBondContact O-CD2 3.42Å; S266-H270 PolarHBondContact O-N 3.23Å; S266-H270 PolarHBondContact O-ND1 2.86Å
267	K	93.2	Very high	94.5	Very high	40 Å²	40	15.4 Å²	15.4	17%	0.174	8%	0.081	C	C	.	.	H	α-helix	trans	-59.8	-47.4	177.3	-68.5	178.4	-179.8	175	0	111	N10 P264 A269 L271 L515	N10-K267 WeakPolarHBondContact OD1-CE 3.32Å; N10-K267 PolarHBondContact OD1-NZ 3.09Å; P264-K267 PolarHBondContact O-N 2.82Å; K267-A269 VanDerWaalsContact C-N 3.31Å; K267-A269 PolarHBondContact O-N 3.43Å; K267-L271 WeakPolarHBondContact O-CB 3.35Å; K267-L271 VanDerWaalsContact O-CG 3.23Å; K267-L271 WeakPolarHBondContact O-CG 3.41Å; K267-L271 PolarHBondContact O-N 2.71Å; K267-L515 HydrophobicContact CB-CD1 3.84Å; K267-L515 HydrophobicContact CB-CD2 3.77Å; K267-L515 HydrophobicContact CB-CG 4.48Å; K267-L515 HydrophobicContact CD-CD1 4.07Å
268	F	96.3	Very high	95	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.9	-49.5	174.9	161.7	-103.3	0	0	0	110.2	P264 S266 T272 A512 L515 L527 L535 L537 L545 V547	P264-F268 VanDerWaalsContact O-CB 3.23Å; P264-F268 WeakPolarHBondContact O-CB 3.44Å; P264-F268 PolarHBondContact O-N 3.21Å; S266-F268 PolarHBondContact O-N 2.94Å; F268-T272 VanDerWaalsContact O-CB 3.27Å; F268-T272 WeakPolarHBondContact O-CB 3.46Å; F268-T272 PolarHBondContact O-N 3.33Å; F268-T272 PolarHBondContact O-OG1 3.35Å; F268-A512 HydrophobicContact CD2-CB 3.72Å; F268-A512 HydrophobicContact CE2-CB 3.8Å; F268-L515 VanDerWaalsContact CA-CD2 3.44Å; F268-L515 HydrophobicContact CB-CD2 3.79Å; F268-L527 HydrophobicContact CD2-CD2 4.07Å; F268-L527 HydrophobicContact CE2-CD2 3.73Å; F268-L535 HydrophobicContact CE2-CD2 3.95Å; F268-L535 HydrophobicContact CE2-CG 4.08Å; F268-L535 HydrophobicContact CZ-CD2 4.32Å; F268-L535 HydrophobicContact CZ-CG 4.06Å; F268-L537 HydrophobicContact CB-CD2 3.99Å; F268-L537 HydrophobicContact CD1-CB 3.48Å; F268-L537 VanDerWaalsContact CD1-CB 3.48Å; F268-L537 HydrophobicContact CD1-CD2 4.15Å; F268-L537 HydrophobicContact CD1-CG 4.43Å; F268-L537 HydrophobicContact CD2-CB 4.24Å; F268-L537 HydrophobicContact CE1-CB 3.6Å; F268-L537 HydrophobicContact CE2-CB 4.34Å; F268-L537 HydrophobicContact CG-CB 3.82Å; F268-L537 HydrophobicContact CG-CD2 4.14Å; F268-L537 HydrophobicContact CG-CG 4.47Å; F268-L537 HydrophobicContact CZ-CB 4.04Å; F268-L545 HydrophobicContact CD1-CD2 3.92Å; F268-L545 HydrophobicContact CE1-CD2 3.9Å; F268-L545 WeakPolarHBondContact CE1-O 3.38Å; F268-V547 HydrophobicContact CD1-CG2 4.46Å; F268-V547 HydrophobicContact CE1-CG2 3.82Å; F268-V547 HydrophobicContact CZ-CG2 4.29Å
269	A	96.6	Very high	95.1	Very high	3 Å²	3	18.1 Å²	18.1	3%	0.025	9%	0.093	C	C	.	.	H	α-helix	trans	-61.5	-53.9	-177.2	0	0	0	0	0	110.9	Y265 S266 K267 L271 T272 A273 M384 L545 V547	Y265-A269 WeakPolarHBondContact O-CB 3.42Å; Y265-A269 PolarHBondContact O-N 2.76Å; Y265-A269 VanDerWaalsContact O-N 3.09Å; S266-A269 PolarHBondContact O-N 3.11Å; K267-A269 VanDerWaalsContact C-N 3.31Å; K267-A269 PolarHBondContact O-N 3.43Å; A269-L271 PolarHBondContact O-N 3.1Å; A269-T272 PolarHBondContact O-N 3.28Å; A269-A273 WeakPolarHBondContact O-CB 3.38Å; A269-A273 PolarHBondContact O-N 3.26Å; A269-M384 HydrophobicContact CB-CE 3.21Å; A269-M384 WeakPolarHBondContact O-CE 3.45Å; A269-L545 HydrophobicContact CB-CD1 4.3Å; A269-L545 HydrophobicContact CB-CD2 3.66Å; A269-V547 HydrophobicContact CB-CG2 4.17Å
270	H	95.3	Very high	95.3	Very high	22 Å²	22	19.3 Å²	19.3	10%	0.102	11%	0.105	C	C	.	.	H	α-helix	trans	-60.9	-46.5	-177.7	-62.9	162.4	0	0	0	112.6	Y256 S266 A273 N274 Q299	Y256-H270 PolarHBondContact OH-CE1 2.91Å; S266-H270 WeakPolarHBondContact O-CB 3.31Å; S266-H270 PolarHBondContact O-CD2 3.42Å; S266-H270 PolarHBondContact O-N 3.23Å; S266-H270 PolarHBondContact O-ND1 2.86Å; H270-A273 PolarHBondContact O-N 3.01Å; H270-N274 WeakPolarHBondContact O-CB 3.41Å; H270-N274 PolarHBondContact O-N 3.31Å; H270-N274 PolarHBondContact O-OD1 2.61Å; H270-Q299 HydrophobicContact CB-CB 4.05Å; H270-Q299 HydrophobicContact CB-CG 3.88Å; H270-Q299 PolarHBondContact CD2-OE1 2.9Å; H270-Q299 VanDerWaalsContact CD2-OE1 3.3Å
271	L	94.7	Very high	95.6	Very high	28 Å²	28	18.6 Å²	18.6	15%	0.147	10%	0.101	C	C	.	.	H	α-helix	trans	-65.2	-44.3	-179.5	-68.1	175.4	0	0	0	111.1	K267 A269 A273 N274 Q275 Q511 L515	K267-L271 WeakPolarHBondContact O-CB 3.35Å; K267-L271 VanDerWaalsContact O-CG 3.23Å; K267-L271 WeakPolarHBondContact O-CG 3.41Å; K267-L271 PolarHBondContact O-N 2.71Å; A269-L271 PolarHBondContact O-N 3.1Å; L271-A273 PolarHBondContact O-N 3.22Å; L271-N274 PolarHBondContact O-N 2.65Å; L271-Q275 PolarHBondContact O-N 3.3Å; L271-Q511 PolarHBondContact O-OE1 3.24Å; L271-L515 HydrophobicContact CD1-CB 4.46Å; L271-L515 HydrophobicContact CD1-CD2 4.45Å
272	T	97	Very high	95.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-45	178.4	-53.6	0	0	0	0	111.5	F268 A269 Q275 A276 L504 A508 L535 V547	F268-T272 VanDerWaalsContact O-CB 3.27Å; F268-T272 WeakPolarHBondContact O-CB 3.46Å; F268-T272 PolarHBondContact O-N 3.33Å; F268-T272 PolarHBondContact O-OG1 3.35Å; A269-T272 PolarHBondContact O-N 3.28Å; T272-Q275 PolarHBondContact O-N 3.38Å; T272-A276 PolarHBondContact O-N 2.87Å; T272-L504 HydrophobicContact CG2-CD1 3.88Å; T272-L504 HydrophobicContact CG2-CD2 4.46Å; T272-A508 HydrophobicContact CG2-CB 4.31Å; T272-L535 HydrophobicContact CG2-CD2 4.04Å; T272-V547 HydrophobicContact CG2-CB 3.9Å; T272-V547 HydrophobicContact CG2-CG1 3.66Å; T272-V547 HydrophobicContact CG2-CG2 4.46Å
273	A	97.6	Very high	95.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.8	-45.1	176.3	0	0	0	0	0	111.8	A269 H270 L271 Q275 A276 I277 M384 T414	A269-A273 WeakPolarHBondContact O-CB 3.38Å; A269-A273 PolarHBondContact O-N 3.26Å; H270-A273 PolarHBondContact O-N 3.01Å; L271-A273 PolarHBondContact O-N 3.22Å; A273-Q275 VanDerWaalsContact C-N 3.29Å; A273-Q275 PolarHBondContact O-N 2.83Å; A273-A276 PolarHBondContact O-N 2.83Å; A273-I277 WeakPolarHBondContact O-CG1 3.47Å; A273-I277 PolarHBondContact O-N 3Å; A273-M384 HydrophobicContact CB-CE 3.81Å; A273-M384 HydrophobicContact CB-SD 4Å; A273-T414 HydrophobicContact CB-CG2 4.09Å
274	N	97.5	Very high	95.8	Very high	9 Å²	9	22.9 Å²	22.9	5%	0.048	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-37.5	178.1	-76.4	-2.2	0	0	0	112.1	H270 L271 I277 L278 Q299 L303	H270-N274 WeakPolarHBondContact O-CB 3.41Å; H270-N274 PolarHBondContact O-N 3.31Å; H270-N274 PolarHBondContact O-OD1 2.61Å; L271-N274 PolarHBondContact O-N 2.65Å; N274-I277 PolarHBondContact O-N 3.16Å; N274-L278 VanDerWaalsContact O-CB 3.24Å; N274-L278 WeakPolarHBondContact O-CB 3.34Å; N274-L278 PolarHBondContact O-N 3.39Å; N274-Q299 PolarHBondContact ND2-O 2.9Å; N274-Q299 VanDerWaalsContact OD1-CG 3.28Å; N274-Q299 WeakPolarHBondContact OD1-CG 3.45Å; N274-Q299 PolarHBondContact OD1-NE2 3.41Å; N274-L303 HydrophobicContact CB-CD1 4.14Å; N274-L303 PolarHBondContact ND2-N 3.41Å
275	Q	96.5	Very high	95.8	Very high	13 Å²	13	26.1 Å²	26.1	6%	0.061	16%	0.157	C	C	.	.	H	α-helix	trans	-64.9	-42	176.4	-171.6	58.3	38.6	0	0	111.8	L271 T272 A273 L278 E279 A508	L271-Q275 PolarHBondContact O-N 3.3Å; T272-Q275 PolarHBondContact O-N 3.38Å; A273-Q275 VanDerWaalsContact C-N 3.29Å; A273-Q275 PolarHBondContact O-N 2.83Å; Q275-L278 PolarHBondContact O-N 2.87Å; Q275-E279 PolarHBondContact NE2-OE1 2.86Å; Q275-E279 WeakPolarHBondContact O-CG 3.3Å; Q275-E279 PolarHBondContact O-N 2.93Å; Q275-E279 VanDerWaalsContact O-N 3.08Å; Q275-A508 HydrophobicContact CB-CB 4.12Å; Q275-A508 HydrophobicContact CG-CB 3.94Å
276	A	97.5	Very high	95.9	Very high	9 Å²	9	27.6 Å²	27.6	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-41.1	174.8	0	0	0	0	0	112.1	T272 A273 A280 T414 L504 A549	T272-A276 PolarHBondContact O-N 2.87Å; A273-A276 PolarHBondContact O-N 2.83Å; A276-A280 WeakPolarHBondContact O-CB 3.25Å; A276-A280 PolarHBondContact O-N 3.18Å; A276-T414 HydrophobicContact CB-CG2 3.95Å; A276-L504 HydrophobicContact CB-CD2 3.97Å; A276-A549 HydrophobicContact CB-CB 4Å
277	I	98	Very high	96.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-45.6	175.8	-67.1	167.4	0	0	0	111.1	A273 N274 E279 A280 T281 I289 W300 L303 A380 V412 T414	A273-I277 WeakPolarHBondContact O-CG1 3.47Å; A273-I277 PolarHBondContact O-N 3Å; N274-I277 PolarHBondContact O-N 3.16Å; I277-E279 VanDerWaalsContact C-N 3.28Å; I277-E279 PolarHBondContact O-N 2.63Å; I277-A280 PolarHBondContact O-N 2.76Å; I277-T281 HydrophobicContact CG2-CG2 4.35Å; I277-T281 WeakPolarHBondContact O-CB 3.09Å; I277-T281 WeakPolarHBondContact O-CG2 3.32Å; I277-T281 PolarHBondContact O-N 3.34Å; I277-T281 PolarHBondContact O-OG1 3.17Å; I277-I289 HydrophobicContact CG2-CD1 3.74Å; I277-W300 HydrophobicContact CD1-CH2 4.36Å; I277-W300 HydrophobicContact CD1-CZ3 4.2Å; I277-L303 HydrophobicContact CG2-CD1 4.28Å; I277-L303 HydrophobicContact CG2-CD2 3.91Å; I277-A380 HydrophobicContact CG1-CB 4.17Å; I277-A380 HydrophobicContact CG2-CB 3.91Å; I277-V412 HydrophobicContact CG1-CG1 4.12Å; I277-T414 HydrophobicContact CD1-CG2 4.35Å; I277-T414 HydrophobicContact CG1-CG2 3.96Å
278	L	96.9	Very high	96.5	Very high	30 Å²	30	25.5 Å²	25.5	16%	0.157	15%	0.154	C	C	.	.	H	α-helix	trans	-58	-42.1	179.5	-178.8	65.6	0	0	0	111.5	N274 Q275 G282 A306 L307 R310	N274-L278 VanDerWaalsContact O-CB 3.24Å; N274-L278 WeakPolarHBondContact O-CB 3.34Å; N274-L278 PolarHBondContact O-N 3.39Å; Q275-L278 PolarHBondContact O-N 2.87Å; L278-G282 PolarHBondContact O-N 3.02Å; L278-A306 HydrophobicContact CD1-CB 4.48Å; L278-A306 HydrophobicContact CD2-CB 4.21Å; L278-L307 HydrophobicContact CD1-CD2 3.74Å; L278-L307 HydrophobicContact CD1-CG 4.34Å; L278-R310 HydrophobicContact CD1-CB 4.21Å
279	E	95.4	Very high	96.6	Very high	80 Å²	80	25.5 Å²	25.5	37%	0.374	15%	0.154	S	C	.	.	H	α-helix	trans	-71.1	-45.9	178.6	-71.9	171.2	-169.8	0	0	112.3	Q275 I277 T281 G282 S505	Q275-E279 PolarHBondContact NE2-OE1 2.86Å; Q275-E279 WeakPolarHBondContact O-CG 3.3Å; Q275-E279 PolarHBondContact O-N 2.93Å; Q275-E279 VanDerWaalsContact O-N 3.08Å; I277-E279 VanDerWaalsContact C-N 3.28Å; I277-E279 PolarHBondContact O-N 2.63Å; E279-T281 PolarHBondContact O-N 3.34Å; E279-G282 PolarHBondContact O-N 2.76Å; E279-S505 VanDerWaalsContact CD-OG 3.3Å; E279-S505 WeakPolarHBondContact OE1-CB 3.34Å; E279-S505 PolarHBondContact OE1-OG 2.81Å; E279-S505 WeakPolarHBondContact OE2-CB 3.43Å; E279-S505 PolarHBondContact OE2-OG 2.81Å
280	A	96.8	Very high	96.7	Very high	39 Å²	39	25.4 Å²	25.4	32%	0.322	15%	0.153	S	C	.	.	H	α-helix	trans	-65.9	-25.9	179.8	0	0	0	0	0	113.4	A276 I277 V412	A276-A280 WeakPolarHBondContact O-CB 3.25Å; A276-A280 PolarHBondContact O-N 3.18Å; I277-A280 PolarHBondContact O-N 2.76Å; A280-V412 HydrophobicContact CB-CB 3.61Å; A280-V412 HydrophobicContact CB-CG1 3.46Å; A280-V412 VanDerWaalsContact CB-CG1 3.46Å; A280-V412 HydrophobicContact CB-CG2 4.46Å
281	T	96.7	Very high	96.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	12.4	-179	62.5	0	0	0	0	113.3	I277 E279 T283 A284 I287 R310 T378 A380	I277-T281 HydrophobicContact CG2-CG2 4.35Å; I277-T281 WeakPolarHBondContact O-CB 3.09Å; I277-T281 WeakPolarHBondContact O-CG2 3.32Å; I277-T281 PolarHBondContact O-N 3.34Å; I277-T281 PolarHBondContact O-OG1 3.17Å; E279-T281 PolarHBondContact O-N 3.34Å; T281-T283 PolarHBondContact O-N 2.88Å; T281-T283 VanDerWaalsContact O-N 3.1Å; T281-A284 WeakPolarHBondContact O-CB 3.5Å; T281-A284 PolarHBondContact O-N 3.34Å; T281-I287 HydrophobicContact CG2-CD1 4.44Å; T281-I287 HydrophobicContact CG2-CG1 4.44Å; T281-I287 HydrophobicContact CG2-CG2 4.13Å; T281-R310 PolarHBondContact O-NH1 3.41Å; T281-T378 HydrophobicContact CG2-CG2 4.02Å; T281-A380 HydrophobicContact CG2-CB 4.41Å
282	G	93.2	Very high	96.9	Very high	34 Å²	34	23.4 Å²	23.4	35%	0.351	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-30	-170.4	0	0	0	0	0	115.4	L278 E279 R310	L278-G282 PolarHBondContact O-N 3.02Å; E279-G282 PolarHBondContact O-N 2.76Å; G282-R310 PolarHBondContact O-NH1 3.45Å
283	T	92.2	Very high	96.7	Very high	143 Å²	143	23.9 Å²	23.9	88%	0.877	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-4.9	178.4	56.9	0	0	0	0	113.9	T281	T281-T283 PolarHBondContact O-N 2.88Å; T281-T283 VanDerWaalsContact O-N 3.1Å
284	A	96	Very high	96.5	Very high	6 Å²	6	24 Å²	24	5%	0.05	15%	0.148	C	C	.	.			trans	-79.4	131.5	-175	0	0	0	0	0	111.2	T281 I287 R310 T378	T281-A284 WeakPolarHBondContact O-CB 3.5Å; T281-A284 PolarHBondContact O-N 3.34Å; A284-I287 HydrophobicContact CB-CG1 3.88Å; A284-R310 PolarHBondContact O-NH2 2.88Å; A284-T378 HydrophobicContact CB-CG2 4.28Å; A284-T378 WeakPolarHBondContact CB-OG1 3.46Å
285	T	96.4	Very high	95.9	Very high	68 Å²	68	24 Å²	24	42%	0.417	15%	0.149	S	C	.	.	S	Bend	trans	-88.1	-29.8	173.3	54.8	0	0	0	0	111.9	P315 S316 R317	T285-P315 CarbonylContact O-C 3.55Å; T285-P315 WeakPolarHBondContact O-CA 3.31Å; T285-P315 WeakPolarHBondContact O-CB 2.93Å; T285-S316 PolarHBondContact O-N 3.31Å; T285-S316 PolarHBondContact O-OG 3.19Å; T285-S316 VanDerWaalsContact O-OG 3.12Å; T285-R317 PolarHBondContact O-N 3.13Å
286	K	98.1	Very high	95.3	Very high	51 Å²	51	25.2 Å²	25.2	22%	0.222	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.5	171.9	-64.9	-180	172.5	-173.6	0	109.5	R317 D376 E377 T378	K286-R317 WeakPolarHBondContact CA-O 3.36Å; K286-R317 HydrophobicContact CG-CB 4.24Å; K286-D376 WeakPolarHBondContact CD-OD2 3.29Å; K286-D376 WeakPolarHBondContact CE-OD2 3.48Å; K286-D376 IonicContact NZ-OD1 2.66Å; K286-D376 IonicContact NZ-OD2 2.66Å; K286-D376 PolarHBondContact NZ-OD2 3.19Å; K286-E377 HydrophobicContact CB-CB 3.83Å; K286-E377 WeakPolarHBondContact O-CA 3.42Å; K286-T378 PolarHBondContact O-N 3.38Å
287	I	98.5	Very high	94.8	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.4	-177.2	-61.1	171.4	0	0	0	109.1	T281 A284 I289 L307 P315 R317 V318 R319 T378	T281-I287 HydrophobicContact CG2-CD1 4.44Å; T281-I287 HydrophobicContact CG2-CG1 4.44Å; T281-I287 HydrophobicContact CG2-CG2 4.13Å; A284-I287 HydrophobicContact CB-CG1 3.88Å; I287-I289 HydrophobicContact CG2-CD1 3.62Å; I287-I289 HydrophobicContact CG2-CG1 4.18Å; I287-L307 HydrophobicContact CD1-CD1 4.11Å; I287-L307 HydrophobicContact CD1-CD2 3.6Å; I287-P315 HydrophobicContact CD1-CB 4.18Å; I287-P315 HydrophobicContact CD1-CG 3.65Å; I287-P315 HydrophobicContact CG1-CG 4.49Å; I287-R317 PolarHBondContact N-O 3Å; I287-V318 CarbonylContact O-C 3.58Å; I287-V318 WeakPolarHBondContact O-CA 3.49Å; I287-R319 PolarHBondContact O-N 3.21Å; I287-T378 WeakPolarHBondContact CA-O 3.09Å
288	H	98.7	Very high	94.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.9	172.7	174.4	-160.7	0	0	0	110.3	R319 S321 F371 E377 T378 V379 A380	H288-R319 CarbonylContact C-O 3.59Å; H288-R319 WeakPolarHBondContact CA-O 3.32Å; H288-R319 HydrophobicContact CB-CB 4.49Å; H288-R319 PolarHBondContact CE1-NH1 2.93Å; H288-R319 PolarHBondContact CE1-NH2 2.84Å; H288-R319 VanDerWaalsContact ND1-CZ 3.31Å; H288-R319 PolarHBondContact ND1-NH2 3.31Å; H288-R319 PolarHBondContact NE2-NH1 3.25Å; H288-S321 WeakPolarHBondContact NE2-CB 3.37Å; H288-S321 PolarHBondContact NE2-OG 2.97Å; H288-F371 PolarHBondContact CE1-O 3.14Å; H288-E377 HydrophobicContact CB-CG 3.87Å; H288-E377 WeakPolarHBondContact CB-OE1 3.38Å; H288-E377 WeakPolarHBondContact CB-OE2 3.39Å; H288-E377 IonicContact CE1-OE1 3.39Å; H288-E377 IonicContact CG-OE1 2.66Å; H288-E377 IonicContact CG-OE2 3.87Å; H288-E377 IonicContact ND1-OE1 3.39Å; H288-E377 PolarHBondContact ND1-OE1 2.78Å; H288-T378 PolarHBondContact N-O 2.87Å; H288-V379 HydrophobicContact CB-CG2 4.47Å; H288-V379 CarbonylContact O-C 3.32Å; H288-V379 VanDerWaalsContact O-CA 3.28Å; H288-V379 WeakPolarHBondContact O-CA 3.32Å; H288-A380 PolarHBondContact O-N 3.45Å
289	I	98.7	Very high	94.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128	175.7	-52.7	-55.7	0	0	0	109.2	I277 I287 W300 L303 R319 I320 S321 A380	I277-I289 HydrophobicContact CG2-CD1 3.74Å; I287-I289 HydrophobicContact CG2-CD1 3.62Å; I287-I289 HydrophobicContact CG2-CG1 4.18Å; I289-W300 HydrophobicContact CG2-CE3 4.06Å; I289-W300 HydrophobicContact CG2-CH2 3.44Å; I289-W300 VanDerWaalsContact CG2-CH2 3.44Å; I289-W300 HydrophobicContact CG2-CZ2 3.94Å; I289-W300 HydrophobicContact CG2-CZ3 3.51Å; I289-L303 HydrophobicContact CD1-CD2 4.17Å; I289-L303 HydrophobicContact CG1-CD2 4.22Å; I289-R319 PolarHBondContact N-O 3.36Å; I289-I320 HydrophobicContact CB-CG1 4.16Å; I289-I320 HydrophobicContact CG1-CG1 4.49Å; I289-I320 CarbonylContact O-C 3.55Å; I289-I320 VanDerWaalsContact O-CA 3.3Å; I289-I320 WeakPolarHBondContact O-CA 3.02Å; I289-S321 PolarHBondContact O-N 3.34Å; I289-A380 CarbonylContact C-O 3.58Å; I289-A380 WeakPolarHBondContact CA-O 3.4Å; I289-A380 HydrophobicContact CD1-CB 3.62Å
290	V	98.5	Very high	94.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	110.5	169.2	-175.7	0	0	0	0	108.4	F292 S321 L323 F371 V379 A380 V381 N382 L408	V290-F292 HydrophobicContact CB-CE2 4.45Å; V290-F292 HydrophobicContact CG1-CD2 3.95Å; V290-F292 HydrophobicContact CG1-CE2 3.44Å; V290-F292 VanDerWaalsContact CG1-CE2 3.44Å; V290-F292 HydrophobicContact CG1-CZ 4.14Å; V290-S321 WeakPolarHBondContact CA-O 3.38Å; V290-L323 HydrophobicContact CG1-CD1 4.22Å; V290-F371 HydrophobicContact CB-CD1 4.44Å; V290-F371 HydrophobicContact CG1-CD1 3.54Å; V290-F371 HydrophobicContact CG1-CE1 3.38Å; V290-F371 HydrophobicContact CG2-CD1 3.98Å; V290-V379 HydrophobicContact CG2-CG1 4.24Å; V290-A380 PolarHBondContact N-O 3.22Å; V290-V381 HydrophobicContact CB-CG1 4.39Å; V290-V381 HydrophobicContact CB-CG2 4.06Å; V290-V381 HydrophobicContact CG2-CG2 4.42Å; V290-V381 WeakPolarHBondContact O-CA 3.49Å; V290-N382 PolarHBondContact O-N 2.61Å; V290-L408 HydrophobicContact CG2-CD1 4.23Å
291	D	98.1	Very high	94.3	Very high	5 Å²	5	20.8 Å²	20.8	3%	0.027	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	109.5	-178.6	-171.7	20.1	0	0	0	111	I294 W300 S321 L323 N382	D291-I294 WeakPolarHBondContact OD2-CA 3.28Å; D291-I294 WeakPolarHBondContact OD2-CB 3.2Å; D291-I294 WeakPolarHBondContact OD2-CG1 3.5Å; D291-W300 HydrophobicContact CB-CZ2 3.55Å; D291-W300 WeakPolarHBondContact OD2-CZ2 3.13Å; D291-W300 PolarHBondContact OD2-NE1 3.41Å; D291-S321 PolarHBondContact N-O 3.19Å; D291-L323 WeakPolarHBondContact O-CD1 3.26Å; D291-L323 PolarHBondContact O-N 2.66Å; D291-N382 PolarHBondContact OD1-ND2 2.93Å
292	F	97.3	Very high	94.2	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.018	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	106.9	171.3	-72	-99.3	0	0	0	108.9	V290 L323 V363 F371 V381 N382 F383 Q386 V401 V405	V290-F292 HydrophobicContact CB-CE2 4.45Å; V290-F292 HydrophobicContact CG1-CD2 3.95Å; V290-F292 HydrophobicContact CG1-CE2 3.44Å; V290-F292 VanDerWaalsContact CG1-CE2 3.44Å; V290-F292 HydrophobicContact CG1-CZ 4.14Å; F292-L323 HydrophobicContact CD1-CD1 3.9Å; F292-L323 HydrophobicContact CD1-CD2 3.51Å; F292-L323 HydrophobicContact CD1-CG 4.25Å; F292-L323 HydrophobicContact CD2-CD1 4.35Å; F292-L323 HydrophobicContact CE1-CD1 3.99Å; F292-L323 HydrophobicContact CE1-CD2 3.58Å; F292-L323 HydrophobicContact CE1-CG 4.45Å; F292-L323 HydrophobicContact CE2-CD1 4.44Å; F292-L323 HydrophobicContact CG-CD1 4.08Å; F292-L323 HydrophobicContact CG-CD2 4.41Å; F292-L323 HydrophobicContact CZ-CD1 4.26Å; F292-V363 HydrophobicContact CD1-CG2 4.01Å; F292-V363 HydrophobicContact CE1-CG2 3.8Å; F292-F371 HydrophobicContact CE1-CZ 4.41Å; F292-F371 HydrophobicContact CE2-CE1 4.35Å; F292-F371 AromaticContact CZ-CE1 3.88Å; F292-F371 HydrophobicContact CZ-CE1 3.88Å; F292-F371 AromaticContact CZ-CZ 3.79Å; F292-F371 HydrophobicContact CZ-CZ 3.79Å; F292-V381 HydrophobicContact CD2-CG1 3.71Å; F292-V381 HydrophobicContact CE2-CG1 3.62Å; F292-N382 PolarHBondContact N-O 3.11Å; F292-F383 HydrophobicContact CB-CD1 3.38Å; F292-F383 HydrophobicContact CB-CE1 3.31Å; F292-F383 HydrophobicContact CB-CG 4.34Å; F292-F383 HydrophobicContact CB-CZ 4.24Å; F292-F383 AromaticContact CD1-CE1 3.66Å; F292-F383 HydrophobicContact CD1-CE1 3.66Å; F292-F383 HydrophobicContact CD1-CZ 4.19Å; F292-F383 HydrophobicContact CD2-CD1 4.18Å; F292-F383 AromaticContact CD2-CE1 3.51Å; F292-F383 HydrophobicContact CD2-CE1 3.51Å; F292-F383 HydrophobicContact CD2-CE2 4.24Å; F292-F383 AromaticContact CD2-CZ 3.55Å; F292-F383 HydrophobicContact CD2-CZ 3.55Å; F292-F383 HydrophobicContact CE1-CE1 4.32Å; F292-F383 HydrophobicContact CE1-CZ 4.45Å; F292-F383 HydrophobicContact CE2-CE1 4.19Å; F292-F383 AromaticContact CE2-CZ 3.84Å; F292-F383 HydrophobicContact CE2-CZ 3.84Å; F292-F383 AromaticContact CG-CD1 3.84Å; F292-F383 HydrophobicContact CG-CD1 3.84Å; F292-F383 AromaticContact CG-CE1 3.2Å; F292-F383 HydrophobicContact CG-CE1 3.2Å; F292-F383 AromaticContact CG-CZ 3.75Å; F292-F383 HydrophobicContact CG-CZ 3.75Å; F292-F383 HydrophobicContact CZ-CZ 4.3Å; F292-Q386 HydrophobicContact CB-CG 4.21Å; F292-Q386 VanDerWaalsContact O-CB 3.27Å; F292-Q386 WeakPolarHBondContact O-CB 3.44Å; F292-Q386 VanDerWaalsContact O-CG 3.29Å; F292-Q386 WeakPolarHBondContact O-CG 3.42Å; F292-V401 HydrophobicContact CD1-CG1 4.39Å; F292-V401 HydrophobicContact CE1-CG1 4Å; F292-V401 HydrophobicContact CZ-CG1 4.45Å; F292-V405 HydrophobicContact CE2-CG2 3.64Å; F292-V405 HydrophobicContact CZ-CG2 3.78Å
293	G	92.7	Very high	94.3	Very high	9 Å²	9	20 Å²	20	9%	0.093	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.4	40.5	175.9	0	0	0	0	0	114	V295 L323 S325	G293-V295 PolarHBondContact O-N 3.29Å; G293-L323 CarbonylContact C-O 3.59Å; G293-L323 WeakPolarHBondContact CA-O 3.33Å; G293-L323 PolarHBondContact N-O 2.81Å; G293-S325 WeakPolarHBondContact O-CB 3.23Å
294	I	92.6	Very high	94.6	Very high	2 Å²	2	13.4 Å²	13.4	1%	0.01	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	126.1	175.8	-163.4	173.1	0	0	0	110.3	D291 L323 S325 L328 L336 T339 F356	D291-I294 WeakPolarHBondContact OD2-CA 3.28Å; D291-I294 WeakPolarHBondContact OD2-CB 3.2Å; D291-I294 WeakPolarHBondContact OD2-CG1 3.5Å; I294-L323 WeakPolarHBondContact CG2-O 3.38Å; I294-L323 PolarHBondContact N-O 3.17Å; I294-S325 WeakPolarHBondContact O-CB 3.37Å; I294-S325 PolarHBondContact O-N 2.86Å; I294-L328 WeakPolarHBondContact O-CD1 3.47Å; I294-L336 HydrophobicContact CG2-CD2 3.42Å; I294-L336 VanDerWaalsContact CG2-CD2 3.42Å; I294-T339 HydrophobicContact CD1-CG2 4.14Å; I294-F356 HydrophobicContact CD1-CE2 3.61Å; I294-F356 HydrophobicContact CD1-CZ 3.94Å
295	V	86.1	Confident	94.6	Very high	11 Å²	11	14.8 Å²	14.8	7%	0.067	8%	0.084	C	C	.	.			trans	-102.4	-56.9	172.2	-170.9	0	0	0	0	109.5	Y256 G293 Y327 L328	Y256-V295 HydrophobicContact CD1-CB 4.5Å; Y256-V295 HydrophobicContact CD1-CG1 3.9Å; Y256-V295 HydrophobicContact CE1-CB 4.12Å; Y256-V295 HydrophobicContact CE1-CG1 4.02Å; Y256-V295 HydrophobicContact CE1-CG2 4.48Å; Y256-V295 HydrophobicContact CG-CG1 4.47Å; G293-V295 PolarHBondContact O-N 3.29Å; V295-Y327 HydrophobicContact CG2-CD2 4Å; V295-L328 HydrophobicContact CG1-CD2 4.18Å
296	Q	82.1	Confident	94.5	Very high	38 Å²	38	12.6 Å²	12.6	18%	0.178	7%	0.073	C	C	.	.			trans	-136.7	162.7	177.9	-61.8	-179.4	14.9	0	0	109.5	I298	Q296-I298 VanDerWaalsContact C-N 3.26Å; Q296-I298 PolarHBondContact O-N 2.76Å
297	G	87.1	Confident	94.4	Very high	8 Å²	8	10.2 Å²	10.2	8%	0.082	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	4.9	-178.1	0	0	0	0	0	115.9	Q299 W300 A301 L343	G297-Q299 PolarHBondContact O-N 3.37Å; G297-W300 PolarHBondContact O-N 3.44Å; G297-W300 VanDerWaalsContact O-N 3.1Å; G297-A301 PolarHBondContact O-N 3.35Å; G297-L343 WeakPolarHBondContact O-CD2 3.3Å
298	I	89.3	Confident	94.2	Very high	36 Å²	36	11.3 Å²	11.3	19%	0.185	7%	0.072	C	C	.	.	H	α-helix	trans	-65.1	-38.4	-168.8	-167.1	161.6	0	0	0	113.7	L11 I14 Q296 W300 A301 A302	L11-I298 HydrophobicContact CD2-CD1 4.14Å; L11-I298 HydrophobicContact CD2-CG1 3.89Å; I14-I298 HydrophobicContact CD1-CD1 3.79Å; I14-I298 HydrophobicContact CD1-CG1 4.03Å; Q296-I298 VanDerWaalsContact C-N 3.26Å; Q296-I298 PolarHBondContact O-N 2.76Å; I298-W300 VanDerWaalsContact C-N 3.26Å; I298-W300 PolarHBondContact O-N 3Å; I298-A301 PolarHBondContact O-N 2.96Å; I298-A302 PolarHBondContact O-N 3.42Å
299	Q	94.4	Very high	93.9	Very high	8 Å²	8	13.8 Å²	13.8	4%	0.037	9%	0.087	C	C	.	.	H	α-helix	trans	-57.1	-44.8	173.3	177.3	173.2	-0.4	0	0	110.5	H270 N274 G297 A302 L303 N382	H270-Q299 HydrophobicContact CB-CB 4.05Å; H270-Q299 HydrophobicContact CB-CG 3.88Å; H270-Q299 PolarHBondContact CD2-OE1 2.9Å; H270-Q299 VanDerWaalsContact CD2-OE1 3.3Å; N274-Q299 PolarHBondContact ND2-O 2.9Å; N274-Q299 VanDerWaalsContact OD1-CG 3.28Å; N274-Q299 WeakPolarHBondContact OD1-CG 3.45Å; N274-Q299 PolarHBondContact OD1-NE2 3.41Å; G297-Q299 PolarHBondContact O-N 3.37Å; Q299-A302 PolarHBondContact O-N 2.88Å; Q299-L303 PolarHBondContact O-N 2.94Å; Q299-N382 PolarHBondContact NE2-OD1 3.21Å; Q299-N382 PolarHBondContact OE1-ND2 2.88Å
300	W	97.8	Very high	93.6	Very high	1 Å²	1	15 Å²	15	0%	0.004	9%	0.091	C	C	.	.	H	α-helix	trans	-76.2	-32.9	-175.3	-54.4	125.6	0	0	0	113.3	I277 I289 D291 G297 I298 A302 L303 L304 I320 L343 N382	I277-W300 HydrophobicContact CD1-CH2 4.36Å; I277-W300 HydrophobicContact CD1-CZ3 4.2Å; I289-W300 HydrophobicContact CG2-CE3 4.06Å; I289-W300 HydrophobicContact CG2-CH2 3.44Å; I289-W300 VanDerWaalsContact CG2-CH2 3.44Å; I289-W300 HydrophobicContact CG2-CZ2 3.94Å; I289-W300 HydrophobicContact CG2-CZ3 3.51Å; D291-W300 HydrophobicContact CB-CZ2 3.55Å; D291-W300 WeakPolarHBondContact OD2-CZ2 3.13Å; D291-W300 PolarHBondContact OD2-NE1 3.41Å; G297-W300 PolarHBondContact O-N 3.44Å; G297-W300 VanDerWaalsContact O-N 3.1Å; I298-W300 VanDerWaalsContact C-N 3.26Å; I298-W300 PolarHBondContact O-N 3Å; W300-A302 VanDerWaalsContact C-N 3.34Å; W300-L303 HydrophobicContact CE3-CB 4.31Å; W300-L303 HydrophobicContact CE3-CD2 3.77Å; W300-L303 HydrophobicContact CZ3-CD2 3.73Å; W300-L303 PolarHBondContact O-N 3.26Å; W300-L304 WeakPolarHBondContact O-CB 3.35Å; W300-L304 VanDerWaalsContact O-CG 3.27Å; W300-L304 WeakPolarHBondContact O-CG 3.49Å; W300-L304 PolarHBondContact O-N 3.33Å; W300-I320 HydrophobicContact CB-CD1 3.58Å; W300-I320 HydrophobicContact CD2-CD1 3.96Å; W300-I320 HydrophobicContact CE3-CD1 4.34Å; W300-I320 HydrophobicContact CG-CD1 3.59Å; W300-L343 HydrophobicContact CB-CD1 4.14Å; W300-L343 HydrophobicContact CB-CD2 3.88Å; W300-N382 HydrophobicContact CH2-CB 3.68Å; W300-N382 HydrophobicContact CZ2-CB 4.08Å
301	A	95.6	Very high	93	Very high	12 Å²	12	20.5 Å²	20.5	10%	0.099	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-45.9	169.6	0	0	0	0	0	110.9	L11 G297 I298 L303 L304 Q305 L343 F346	L11-A301 HydrophobicContact CD2-CB 4.36Å; G297-A301 PolarHBondContact O-N 3.35Å; I298-A301 PolarHBondContact O-N 2.96Å; A301-L303 PolarHBondContact O-N 3.48Å; A301-L304 PolarHBondContact O-N 3.1Å; A301-Q305 PolarHBondContact O-N 2.82Å; A301-Q305 VanDerWaalsContact O-N 3.08Å; A301-L343 HydrophobicContact CB-CD2 4.31Å; A301-F346 HydrophobicContact CB-CD1 4.14Å; A301-F346 HydrophobicContact CB-CE1 4.2Å; A301-F346 WeakPolarHBondContact O-CE1 3.22Å
302	A	94	Very high	92.4	Very high	15 Å²	15	22.5 Å²	22.5	12%	0.124	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-40.8	175.8	0	0	0	0	0	112.3	I14 I298 Q299 W300 Q305 A306	I14-A302 HydrophobicContact CG2-CB 4.11Å; I298-A302 PolarHBondContact O-N 3.42Å; Q299-A302 PolarHBondContact O-N 2.88Å; W300-A302 VanDerWaalsContact C-N 3.34Å; A302-Q305 PolarHBondContact O-N 3.46Å; A302-A306 PolarHBondContact O-N 2.93Å; A302-A306 VanDerWaalsContact O-N 3.09Å
303	L	97.2	Very high	92	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-43.7	176.6	-176.8	62.3	0	0	0	112.1	N274 I277 I289 Q299 W300 A301 Q305 A306 L307	N274-L303 HydrophobicContact CB-CD1 4.14Å; N274-L303 PolarHBondContact ND2-N 3.41Å; I277-L303 HydrophobicContact CG2-CD1 4.28Å; I277-L303 HydrophobicContact CG2-CD2 3.91Å; I289-L303 HydrophobicContact CD1-CD2 4.17Å; I289-L303 HydrophobicContact CG1-CD2 4.22Å; Q299-L303 PolarHBondContact O-N 2.94Å; W300-L303 HydrophobicContact CE3-CB 4.31Å; W300-L303 HydrophobicContact CE3-CD2 3.77Å; W300-L303 HydrophobicContact CZ3-CD2 3.73Å; W300-L303 PolarHBondContact O-N 3.26Å; A301-L303 PolarHBondContact O-N 3.48Å; L303-Q305 VanDerWaalsContact C-N 3.3Å; L303-Q305 PolarHBondContact O-N 2.88Å; L303-A306 PolarHBondContact O-N 3.47Å; L303-A306 VanDerWaalsContact O-N 3.14Å; L303-L307 HydrophobicContact CD1-CD1 4.34Å; L303-L307 HydrophobicContact CD1-CG 4.18Å; L303-L307 HydrophobicContact CD2-CD1 4.38Å; L303-L307 HydrophobicContact CG-CD1 3.9Å; L303-L307 HydrophobicContact CG-CG 4.2Å; L303-L307 WeakPolarHBondContact O-CB 3.47Å; L303-L307 WeakPolarHBondContact O-CG 3.3Å; L303-L307 PolarHBondContact O-N 3.13Å
304	L	97.5	Very high	92.1	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-58.3	-44.1	177.5	-77	169.6	0	0	0	111.1	W300 A301 L307 A308 V318 L343 F346 A347 L350 F354	W300-L304 WeakPolarHBondContact O-CB 3.35Å; W300-L304 VanDerWaalsContact O-CG 3.27Å; W300-L304 WeakPolarHBondContact O-CG 3.49Å; W300-L304 PolarHBondContact O-N 3.33Å; A301-L304 PolarHBondContact O-N 3.1Å; L304-L307 PolarHBondContact O-N 2.87Å; L304-A308 WeakPolarHBondContact O-CB 3.42Å; L304-A308 PolarHBondContact O-N 3.03Å; L304-V318 HydrophobicContact CD2-CB 4.11Å; L304-V318 HydrophobicContact CD2-CG1 3.96Å; L304-V318 HydrophobicContact CD2-CG2 4.33Å; L304-L343 HydrophobicContact CD1-CD2 4.19Å; L304-F346 HydrophobicContact CB-CD1 4.22Å; L304-F346 HydrophobicContact CB-CE1 4.17Å; L304-F346 HydrophobicContact CD1-CD1 4.21Å; L304-A347 HydrophobicContact CD1-CB 4.2Å; L304-L350 HydrophobicContact CB-CD1 3.84Å; L304-F354 HydrophobicContact CD1-CD2 4.23Å; L304-F354 HydrophobicContact CD1-CE2 4.04Å; L304-F354 HydrophobicContact CD2-CD2 3.92Å; L304-F354 HydrophobicContact CD2-CE2 4.19Å
305	Q	95.5	Very high	92.3	Very high	36 Å²	36	32.8 Å²	32.8	17%	0.168	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-49.2	174	-179.2	64.3	35.8	0	0	111.1	V18 A301 A302 L303 L307 A308 T309 F346	V18-Q305 HydrophobicContact CG1-CG 4.02Å; A301-Q305 PolarHBondContact O-N 2.82Å; A301-Q305 VanDerWaalsContact O-N 3.08Å; A302-Q305 PolarHBondContact O-N 3.46Å; L303-Q305 VanDerWaalsContact C-N 3.3Å; L303-Q305 PolarHBondContact O-N 2.88Å; Q305-L307 PolarHBondContact O-N 2.81Å; Q305-A308 PolarHBondContact O-N 2.67Å; Q305-T309 PolarHBondContact O-N 2.97Å; Q305-T309 PolarHBondContact O-OG1 2.88Å; Q305-F346 HydrophobicContact CB-CE1 4.38Å; Q305-F346 HydrophobicContact CB-CZ 4.33Å
306	A	94.8	Very high	92.7	Very high	21 Å²	21	35.2 Å²	35.2	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-63.5	-39.4	-179.4	0	0	0	0	0	112.6	L278 A302 L303 T309 R310	L278-A306 HydrophobicContact CD1-CB 4.48Å; L278-A306 HydrophobicContact CD2-CB 4.21Å; A302-A306 PolarHBondContact O-N 2.93Å; A302-A306 VanDerWaalsContact O-N 3.09Å; L303-A306 PolarHBondContact O-N 3.47Å; L303-A306 VanDerWaalsContact O-N 3.14Å; A306-T309 PolarHBondContact O-N 3.2Å; A306-T309 PolarHBondContact O-OG1 3.23Å; A306-R310 PolarHBondContact O-N 2.86Å
307	L	96.7	Very high	93.5	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-66.4	-37.8	175.3	-73.7	172	0	0	0	112.3	L278 I287 L303 L304 Q305 T309 R310 P315 V318	L278-L307 HydrophobicContact CD1-CD2 3.74Å; L278-L307 HydrophobicContact CD1-CG 4.34Å; I287-L307 HydrophobicContact CD1-CD1 4.11Å; I287-L307 HydrophobicContact CD1-CD2 3.6Å; L303-L307 HydrophobicContact CD1-CD1 4.34Å; L303-L307 HydrophobicContact CD1-CG 4.18Å; L303-L307 HydrophobicContact CD2-CD1 4.38Å; L303-L307 HydrophobicContact CG-CD1 3.9Å; L303-L307 HydrophobicContact CG-CG 4.2Å; L303-L307 WeakPolarHBondContact O-CB 3.47Å; L303-L307 WeakPolarHBondContact O-CG 3.3Å; L303-L307 PolarHBondContact O-N 3.13Å; L304-L307 PolarHBondContact O-N 2.87Å; Q305-L307 PolarHBondContact O-N 2.81Å; L307-T309 PolarHBondContact O-N 2.84Å; L307-R310 WeakPolarHBondContact O-CG 3.35Å; L307-P315 HydrophobicContact CB-CG 4.21Å; L307-P315 HydrophobicContact CD2-CG 4.11Å; L307-V318 HydrophobicContact CD1-CG2 3.97Å
308	A	94.4	Very high	94	Very high	25 Å²	25	34 Å²	34	21%	0.207	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-19.4	178.7	0	0	0	0	0	113.8	L304 Q305 K314 L350	L304-A308 WeakPolarHBondContact O-CB 3.42Å; L304-A308 PolarHBondContact O-N 3.03Å; Q305-A308 PolarHBondContact O-N 2.67Å; A308-K314 HydrophobicContact CB-CD 4.14Å; A308-L350 HydrophobicContact CB-CB 4Å; A308-L350 HydrophobicContact CB-CD1 4.14Å; A308-L350 HydrophobicContact CB-CD2 4.12Å; A308-L350 HydrophobicContact CB-CG 4.32Å
309	T	91.3	Very high	94.5	Very high	51 Å²	51	32.7 Å²	32.7	31%	0.313	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.1	9.5	-171.4	49.1	0	0	0	0	113.1	Q22 Q305 A306 L307	Q22-T309 PolarHBondContact NE2-OG1 3.43Å; Q305-T309 PolarHBondContact O-N 2.97Å; Q305-T309 PolarHBondContact O-OG1 2.88Å; A306-T309 PolarHBondContact O-N 3.2Å; A306-T309 PolarHBondContact O-OG1 3.23Å; L307-T309 PolarHBondContact O-N 2.84Å
310	R	92	Very high	94.7	Very high	26 Å²	26	32.4 Å²	32.4	10%	0.098	19%	0.194	C	C	.	.	S	Bend	trans	-62.9	155.6	176.9	73.1	-174.1	-175.7	172.6	-0	110.9	L278 T281 G282 A284 A306 L307 G312 E313	L278-R310 HydrophobicContact CD1-CB 4.21Å; T281-R310 PolarHBondContact O-NH1 3.41Å; G282-R310 PolarHBondContact O-NH1 3.45Å; A284-R310 PolarHBondContact O-NH2 2.88Å; A306-R310 PolarHBondContact O-N 2.86Å; L307-R310 WeakPolarHBondContact O-CG 3.35Å; R310-G312 PolarHBondContact O-N 3.18Å; R310-G312 VanDerWaalsContact O-N 3.17Å; R310-G312 VanDerWaalsContact O-O 3.11Å; R310-E313 PolarHBondContact NE-O 2.66Å; R310-E313 PolarHBondContact NH2-O 2.89Å
311	P	87.2	Confident	94.7	Very high	116 Å²	116	32.5 Å²	32.5	75%	0.753	19%	0.194	S	C	*	.	S	Bend	trans	-61.9	-24.6	-178.8	-24.9	34.6	0	0	0	115
312	G	84.4	Confident	94.7	Very high	46 Å²	46	31.9 Å²	31.9	47%	0.474	19%	0.189	S	C	.	.	S	Bend	trans	-86.7	-173.4	176.8	0	0	0	0	0	113.3	R310 K314	R310-G312 PolarHBondContact O-N 3.18Å; R310-G312 VanDerWaalsContact O-N 3.17Å; R310-G312 VanDerWaalsContact O-O 3.11Å; G312-K314 PolarHBondContact O-N 2.88Å
313	E	89.3	Confident	94.8	Very high	152 Å²	152	31.7 Å²	31.7	71%	0.71	19%	0.186	S	C	*	.	P	Polyproline II helix	trans	-62.1	134.7	175	-168.6	177.3	-179.9	0	0	110.3	R310	R310-E313 PolarHBondContact NE-O 2.66Å; R310-E313 PolarHBondContact NH2-O 2.89Å
314	K	94.5	Very high	94.6	Very high	78 Å²	78	33 Å²	33	34%	0.339	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-57.3	136.1	171.8	-178.9	172.5	77.8	-179.4	0	109.6	A308 G312 S316 L350 G351 V352	A308-K314 HydrophobicContact CB-CD 4.14Å; G312-K314 PolarHBondContact O-N 2.88Å; K314-S316 PolarHBondContact O-N 3.37Å; K314-L350 PolarHBondContact NZ-O 2.87Å; K314-G351 WeakPolarHBondContact CE-O 3.33Å; K314-G351 PolarHBondContact NZ-O 3.12Å; K314-V352 HydrophobicContact CD-CG2 3.59Å; K314-V352 HydrophobicContact CG-CG2 3.87Å
315	P	96.8	Very high	94.2	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-54.6	137.8	175.5	-21.1	30.8	0	0	0	110.7	T285 I287 L307 R317 V318	T285-P315 CarbonylContact O-C 3.55Å; T285-P315 WeakPolarHBondContact O-CA 3.31Å; T285-P315 WeakPolarHBondContact O-CB 2.93Å; I287-P315 HydrophobicContact CD1-CB 4.18Å; I287-P315 HydrophobicContact CD1-CG 3.65Å; I287-P315 HydrophobicContact CG1-CG 4.49Å; L307-P315 HydrophobicContact CB-CG 4.21Å; L307-P315 HydrophobicContact CD2-CG 4.11Å; P315-R317 VanDerWaalsContact C-N 3.32Å; P315-V318 HydrophobicContact CB-CG2 4.02Å; P315-V318 HydrophobicContact CG-CG2 4.31Å
316	S	95.8	Very high	93.7	Very high	62 Å²	62	33.1 Å²	33.1	43%	0.434	20%	0.199	S	C	.	.	S	Bend	trans	-66.9	-38.4	173.2	55.1	0	0	0	0	110.8	T285 K314 E353	T285-S316 PolarHBondContact O-N 3.31Å; T285-S316 PolarHBondContact O-OG 3.19Å; T285-S316 VanDerWaalsContact O-OG 3.12Å; K314-S316 PolarHBondContact O-N 3.37Å; S316-E353 WeakPolarHBondContact O-CB 3.24Å; S316-E353 PolarHBondContact O-N 3.4Å
317	R	98	Very high	93	Very high	20 Å²	20	32.7 Å²	32.7	8%	0.075	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	137.8	179.2	-166.8	-179.6	68.4	-177.3	-2.1	112.8	T285 K286 I287 P315 E353 E374 E377	T285-R317 PolarHBondContact O-N 3.13Å; K286-R317 WeakPolarHBondContact CA-O 3.36Å; K286-R317 HydrophobicContact CG-CB 4.24Å; I287-R317 PolarHBondContact N-O 3Å; P315-R317 VanDerWaalsContact C-N 3.32Å; R317-E353 CarbonylContact C-O 3.59Å; R317-E353 VanDerWaalsContact CA-O 3.32Å; R317-E353 WeakPolarHBondContact CA-O 3.43Å; R317-E353 HydrophobicContact CB-CB 4.23Å; R317-E353 WeakPolarHBondContact CD-OE1 3.29Å; R317-E353 HydrophobicContact CG-CB 4.15Å; R317-E353 HydrophobicContact CG-CG 4.02Å; R317-E374 IonicContact CZ-OE1 2.65Å; R317-E374 IonicContact CZ-OE2 2.66Å; R317-E374 IonicContact NH1-OE1 3Å; R317-E374 PolarHBondContact NH1-OE1 3.24Å; R317-E374 IonicContact NH1-OE2 3.92Å; R317-E374 PolarHBondContact NH1-OE2 2.97Å; R317-E374 VanDerWaalsContact NH2-CD 3.27Å; R317-E374 IonicContact NH2-OE1 3.9Å; R317-E374 IonicContact NH2-OE2 3.69Å; R317-E374 PolarHBondContact NH2-OE2 2.82Å; R317-E377 IonicContact NH2-OE2 3.36Å
318	V	98.4	Very high	92.4	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.8	169.3	179.1	0	0	0	0	109.3	I287 L304 L307 P315 V352 E353 F354 E355	I287-V318 CarbonylContact O-C 3.58Å; I287-V318 WeakPolarHBondContact O-CA 3.49Å; L304-V318 HydrophobicContact CD2-CB 4.11Å; L304-V318 HydrophobicContact CD2-CG1 3.96Å; L304-V318 HydrophobicContact CD2-CG2 4.33Å; L307-V318 HydrophobicContact CD1-CG2 3.97Å; P315-V318 HydrophobicContact CB-CG2 4.02Å; P315-V318 HydrophobicContact CG-CG2 4.31Å; V318-V352 HydrophobicContact CB-CG1 4.11Å; V318-V352 HydrophobicContact CG2-CG1 3.71Å; V318-E353 PolarHBondContact N-O 3.36Å; V318-F354 HydrophobicContact CB-CD2 4.24Å; V318-F354 HydrophobicContact CG1-CD2 4.27Å; V318-F354 HydrophobicContact CG1-CE2 4.41Å; V318-F354 VanDerWaalsContact O-CA 3.3Å; V318-F354 WeakPolarHBondContact O-CA 3.3Å; V318-F354 VanDerWaalsContact O-CD2 3.28Å; V318-F354 WeakPolarHBondContact O-CD2 3.35Å; V318-E355 PolarHBondContact O-N 3.04Å; V318-E355 VanDerWaalsContact O-N 3.11Å
319	R	98.3	Very high	91.7	Very high	8 Å²	8	32.2 Å²	32.2	3%	0.03	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.9	176.1	-176.6	167.5	61.9	111.4	-17.8	110.5	I287 H288 I289 E355 F371 L372 E377	I287-R319 PolarHBondContact O-N 3.21Å; H288-R319 CarbonylContact C-O 3.59Å; H288-R319 WeakPolarHBondContact CA-O 3.32Å; H288-R319 HydrophobicContact CB-CB 4.49Å; H288-R319 PolarHBondContact CE1-NH1 2.93Å; H288-R319 PolarHBondContact CE1-NH2 2.84Å; H288-R319 VanDerWaalsContact ND1-CZ 3.31Å; H288-R319 PolarHBondContact ND1-NH2 3.31Å; H288-R319 PolarHBondContact NE2-NH1 3.25Å; I289-R319 PolarHBondContact N-O 3.36Å; R319-E355 CarbonylContact C-O 3.36Å; R319-E355 VanDerWaalsContact CA-O 3.32Å; R319-E355 WeakPolarHBondContact CA-O 3.34Å; R319-E355 HydrophobicContact CB-CB 4.3Å; R319-E355 WeakPolarHBondContact CD-OE2 3.34Å; R319-E355 HydrophobicContact CG-CB 3.94Å; R319-F371 PolarHBondContact NH1-O 2.87Å; R319-L372 PolarHBondContact NH2-O 3.27Å; R319-E377 IonicContact CZ-OE1 3.97Å; R319-E377 IonicContact CZ-OE2 3.07Å; R319-E377 IonicContact NE-OE2 2.72Å; R319-E377 PolarHBondContact NE-OE2 2.86Å; R319-E377 IonicContact NH2-OE1 3.37Å; R319-E377 PolarHBondContact NH2-OE1 2.95Å; R319-E377 IonicContact NH2-OE2 3.96Å; R319-E377 PolarHBondContact NH2-OE2 3.39Å
320	I	98.4	Very high	91.3	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	116.8	175.4	-55.1	-171.7	0	0	0	109.5	I289 W300 F354 E355 F356 V357	I289-I320 HydrophobicContact CB-CG1 4.16Å; I289-I320 HydrophobicContact CG1-CG1 4.49Å; I289-I320 CarbonylContact O-C 3.55Å; I289-I320 VanDerWaalsContact O-CA 3.3Å; I289-I320 WeakPolarHBondContact O-CA 3.02Å; W300-I320 HydrophobicContact CB-CD1 3.58Å; W300-I320 HydrophobicContact CD2-CD1 3.96Å; W300-I320 HydrophobicContact CE3-CD1 4.34Å; W300-I320 HydrophobicContact CG-CD1 3.59Å; I320-F354 HydrophobicContact CB-CZ 4.48Å; I320-F354 HydrophobicContact CD1-CE2 3.66Å; I320-F354 HydrophobicContact CD1-CZ 3.91Å; I320-F354 HydrophobicContact CG1-CE2 3.74Å; I320-F354 HydrophobicContact CG1-CZ 4.09Å; I320-E355 PolarHBondContact N-O 2.91Å; I320-F356 HydrophobicContact CB-CD2 3.97Å; I320-F356 HydrophobicContact CB-CE2 4.5Å; I320-F356 HydrophobicContact CG2-CD2 3.98Å; I320-F356 HydrophobicContact CG2-CE2 4Å; I320-F356 CarbonylContact O-C 3.5Å; I320-F356 WeakPolarHBondContact O-CA 3.14Å; I320-V357 PolarHBondContact O-N 2.91Å
321	S	97.9	Very high	91.1	Very high	2 Å²	2	42 Å²	42	1%	0.014	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	109.1	167.2	-65.4	0	0	0	0	108.8	H288 I289 V290 D291 V357	H288-S321 WeakPolarHBondContact NE2-CB 3.37Å; H288-S321 PolarHBondContact NE2-OG 2.97Å; I289-S321 PolarHBondContact O-N 3.34Å; V290-S321 WeakPolarHBondContact CA-O 3.38Å; D291-S321 PolarHBondContact N-O 3.19Å; S321-V357 CarbonylContact C-O 3.59Å; S321-V357 VanDerWaalsContact CA-O 3.32Å; S321-V357 WeakPolarHBondContact CA-O 3.32Å
322	G	96.9	Very high	91.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.3	-173.3	0	0	0	0	0	112.9	V357 P358 L359	G322-V357 PolarHBondContact N-O 3.48Å; G322-P358 WeakPolarHBondContact O-CA 3.33Å; G322-L359 PolarHBondContact O-N 3.32Å
323	L	96.1	Very high	91.5	Very high	10 Å²	10	37 Å²	37	5%	0.052	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.1	167.7	-64.5	82.9	0	0	0	108.9	V290 D291 F292 G293 I294 S325 L359 V363 L366 F371	V290-L323 HydrophobicContact CG1-CD1 4.22Å; D291-L323 WeakPolarHBondContact O-CD1 3.26Å; D291-L323 PolarHBondContact O-N 2.66Å; F292-L323 HydrophobicContact CD1-CD1 3.9Å; F292-L323 HydrophobicContact CD1-CD2 3.51Å; F292-L323 HydrophobicContact CD1-CG 4.25Å; F292-L323 HydrophobicContact CD2-CD1 4.35Å; F292-L323 HydrophobicContact CE1-CD1 3.99Å; F292-L323 HydrophobicContact CE1-CD2 3.58Å; F292-L323 HydrophobicContact CE1-CG 4.45Å; F292-L323 HydrophobicContact CE2-CD1 4.44Å; F292-L323 HydrophobicContact CG-CD1 4.08Å; F292-L323 HydrophobicContact CG-CD2 4.41Å; F292-L323 HydrophobicContact CZ-CD1 4.26Å; G293-L323 CarbonylContact C-O 3.59Å; G293-L323 WeakPolarHBondContact CA-O 3.33Å; G293-L323 PolarHBondContact N-O 2.81Å; I294-L323 WeakPolarHBondContact CG2-O 3.38Å; I294-L323 PolarHBondContact N-O 3.17Å; L323-S325 PolarHBondContact O-N 2.83Å; L323-L359 HydrophobicContact CD1-CB 4.43Å; L323-L359 HydrophobicContact CD1-CD1 3.95Å; L323-L359 HydrophobicContact CG-CB 4Å; L323-L359 HydrophobicContact CG-CD1 4.35Å; L323-V363 HydrophobicContact CD2-CB 4.42Å; L323-V363 HydrophobicContact CD2-CG2 4.02Å; L323-L366 HydrophobicContact CD2-CD1 3.37Å; L323-L366 HydrophobicContact CG-CD1 4.19Å; L323-F371 HydrophobicContact CD1-CE1 4.22Å
324	P	93.4	Very high	91.5	Very high	32 Å²	32	35.4 Å²	35.4	21%	0.208	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	136.1	-178.6	22.7	-29.7	0	0	0	111.7	L328 P332 L336 L359 L360	P324-L328 HydrophobicContact CB-CD1 4.17Å; P324-P332 HydrophobicContact CB-CB 3.61Å; P324-P332 HydrophobicContact CB-CG 3.77Å; P324-P332 HydrophobicContact CG-CB 4.23Å; P324-P332 HydrophobicContact CG-CG 3.81Å; P324-L336 HydrophobicContact CB-CD1 4.01Å; P324-L336 HydrophobicContact CG-CD1 4.27Å; P324-L359 WeakPolarHBondContact CD-O 3.36Å; P324-L360 HydrophobicContact CG-CD2 4.32Å
325	S	89.1	Confident	91.3	Very high	4 Å²	4	33.6 Å²	33.6	3%	0.028	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-64.8	147.8	167	-171.3	0	0	0	0	111.3	G293 I294 L323 Y327 L328	G293-S325 WeakPolarHBondContact O-CB 3.23Å; I294-S325 WeakPolarHBondContact O-CB 3.37Å; I294-S325 PolarHBondContact O-N 2.86Å; L323-S325 PolarHBondContact O-N 2.83Å; S325-Y327 PolarHBondContact O-N 2.91Å; S325-Y327 WeakPolarHBondContact OG-CD2 3.42Å; S325-Y327 PolarHBondContact OG-N 3.32Å; S325-L328 PolarHBondContact O-N 3.16Å
326	P	83.6	Confident	91.1	Very high	36 Å²	36	33.8 Å²	33.8	23%	0.234	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-51	-29.4	166.5	-26.6	35.2	0	0	0	113	F247 L328 G329	F247-P326 WeakPolarHBondContact CD1-O 3.47Å; F247-P326 HydrophobicContact CE1-CB 3.55Å; F247-P326 WeakPolarHBondContact CE1-O 3.37Å; F247-P326 HydrophobicContact CZ-CB 3.71Å; P326-L328 PolarHBondContact O-N 2.59Å; P326-L328 VanDerWaalsContact O-N 3.09Å; P326-G329 PolarHBondContact O-N 3.26Å
327	Y	79.9	Confident	91.1	Very high	13 Å²	13	33.3 Å²	33.3	5%	0.051	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-58.1	-23.4	176.9	-64.9	-67	0	0	0	114.2	L252 T253 V295 S325 G329 Y388 M463 R467	L252-Y327 HydrophobicContact CB-CD1 4.07Å; L252-Y327 HydrophobicContact CD1-CD1 3.83Å; L252-Y327 HydrophobicContact CD1-CE1 4.28Å; L252-Y327 HydrophobicContact CD2-CD1 4.34Å; L252-Y327 HydrophobicContact CD2-CE1 4.38Å; L252-Y327 HydrophobicContact CG-CD1 4.32Å; T253-Y327 PolarHBondContact OG1-O 3.35Å; V295-Y327 HydrophobicContact CG2-CD2 4Å; S325-Y327 PolarHBondContact O-N 2.91Å; S325-Y327 WeakPolarHBondContact OG-CD2 3.42Å; S325-Y327 PolarHBondContact OG-N 3.32Å; Y327-G329 PolarHBondContact O-N 2.64Å; Y327-Y388 PolarHBondContact OH-OH 3.32Å; Y327-Y388 VanDerWaalsContact OH-OH 3.05Å; Y327-M463 HydrophobicContact CE1-CE 4.38Å; Y327-R467 PolarHBondContact OH-NH2 3.18Å
328	L	84.6	Confident	90.8	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-81.2	-3.9	175.5	-63.5	-175.9	0	0	0	113.7	T249 I294 V295 P324 S325 P326 P332 S335 L336	T249-L328 WeakPolarHBondContact CG2-O 3.35Å; I294-L328 WeakPolarHBondContact O-CD1 3.47Å; V295-L328 HydrophobicContact CG1-CD2 4.18Å; P324-L328 HydrophobicContact CB-CD1 4.17Å; S325-L328 PolarHBondContact O-N 3.16Å; P326-L328 PolarHBondContact O-N 2.59Å; P326-L328 VanDerWaalsContact O-N 3.09Å; L328-P332 HydrophobicContact CB-CB 3.76Å; L328-P332 HydrophobicContact CD1-CB 4.06Å; L328-S335 WeakPolarHBondContact CD2-OG 3.47Å; L328-L336 HydrophobicContact CD1-CD2 3.99Å; L328-L336 HydrophobicContact CD1-CG 4.24Å
329	G	80.6	Confident	90.6	Very high	11 Å²	11	34.6 Å²	34.6	11%	0.113	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	-166.8	179.5	0	0	0	0	0	114.5	P326 Y327 K331	P326-G329 PolarHBondContact O-N 3.26Å; Y327-G329 PolarHBondContact O-N 2.64Å; G329-K331 PolarHBondContact O-N 2.7Å
330	P	82.3	Confident	90.5	Very high	105 Å²	105	35.1 Å²	35.1	68%	0.682	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.4	-169.5	29	-36.1	0	0	0	114.4	P332	P330-P332 VanDerWaalsContact C-CD 3.44Å
331	K	86.5	Confident	90.4	Very high	178 Å²	178	37.2 Å²	37.2	77%	0.774	24%	0.237	S	C	*	.			trans	-126.9	64.7	-177.8	-63.7	-177.5	-178.9	179.9	0	111.1	G329 A333	G329-K331 PolarHBondContact O-N 2.7Å; K331-A333 VanDerWaalsContact C-N 3.27Å; K331-A333 PolarHBondContact O-N 3.27Å
332	P	89.6	Confident	90.3	Very high	20 Å²	20	42.6 Å²	42.6	13%	0.13	26%	0.258	C	S	.	.			trans	-76.7	-11.2	-172.5	32.5	-37.2	0	0	0	113.8	P324 L328 P330 T334 S335 L336 L360	P324-P332 HydrophobicContact CB-CB 3.61Å; P324-P332 HydrophobicContact CB-CG 3.77Å; P324-P332 HydrophobicContact CG-CB 4.23Å; P324-P332 HydrophobicContact CG-CG 3.81Å; L328-P332 HydrophobicContact CB-CB 3.76Å; L328-P332 HydrophobicContact CD1-CB 4.06Å; P330-P332 VanDerWaalsContact C-CD 3.44Å; P332-T334 PolarHBondContact O-N 3.42Å; P332-S335 PolarHBondContact O-N 2.89Å; P332-S335 VanDerWaalsContact O-N 3.1Å; P332-L336 HydrophobicContact CB-CD1 4.18Å; P332-L336 HydrophobicContact CB-CG 4.36Å; P332-L336 HydrophobicContact CG-CD1 4.47Å; P332-L336 WeakPolarHBondContact O-CG 3.32Å; P332-L336 PolarHBondContact O-N 3.13Å; P332-L360 HydrophobicContact CG-CD2 4.21Å
333	A	91.2	Very high	90.3	Very high	35 Å²	35	42.9 Å²	42.9	29%	0.289	26%	0.259	S	S	.	.	H	α-helix	trans	-54.5	-46.5	-167.9	0	0	0	0	0	113.7	K331 L336 A337	K331-A333 VanDerWaalsContact C-N 3.27Å; K331-A333 PolarHBondContact O-N 3.27Å; A333-L336 PolarHBondContact O-N 2.95Å; A333-A337 WeakPolarHBondContact O-CB 3.45Å; A333-A337 PolarHBondContact O-N 3.35Å
334	T	90.5	Very high	90.3	Very high	119 Å²	119	46.5 Å²	46.5	73%	0.73	27%	0.272	S	S	*	.	H	α-helix	trans	-64.5	-42	179.2	-51.4	0	0	0	0	112.1	P332 A337 A338	P332-T334 PolarHBondContact O-N 3.42Å; T334-A337 PolarHBondContact O-N 2.96Å; T334-A338 PolarHBondContact O-N 3.5Å
335	S	89.4	Confident	90.5	Very high	41 Å²	41	49 Å²	49	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-66.1	-41.7	178	-176.5	0	0	0	0	111.8	L328 P332 A338 T339	L328-S335 WeakPolarHBondContact CD2-OG 3.47Å; P332-S335 PolarHBondContact O-N 2.89Å; P332-S335 VanDerWaalsContact O-N 3.1Å; S335-A338 PolarHBondContact O-N 3.46Å; S335-T339 WeakPolarHBondContact O-CB 3.32Å; S335-T339 PolarHBondContact O-N 3.22Å; S335-T339 PolarHBondContact O-OG1 3.18Å
336	L	93.5	Very high	90.8	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-67.2	-39.2	176.1	-69.3	177.8	0	0	0	112.1	I294 P324 L328 P332 A333 T339 S340 F356 P358 L360	I294-L336 HydrophobicContact CG2-CD2 3.42Å; I294-L336 VanDerWaalsContact CG2-CD2 3.42Å; P324-L336 HydrophobicContact CB-CD1 4.01Å; P324-L336 HydrophobicContact CG-CD1 4.27Å; L328-L336 HydrophobicContact CD1-CD2 3.99Å; L328-L336 HydrophobicContact CD1-CG 4.24Å; P332-L336 HydrophobicContact CB-CD1 4.18Å; P332-L336 HydrophobicContact CB-CG 4.36Å; P332-L336 HydrophobicContact CG-CD1 4.47Å; P332-L336 WeakPolarHBondContact O-CG 3.32Å; P332-L336 PolarHBondContact O-N 3.13Å; A333-L336 PolarHBondContact O-N 2.95Å; L336-T339 PolarHBondContact O-N 3.09Å; L336-S340 VanDerWaalsContact O-CB 3.31Å; L336-S340 WeakPolarHBondContact O-CB 3.35Å; L336-S340 PolarHBondContact O-N 3.39Å; L336-F356 HydrophobicContact CD2-CZ 4.29Å; L336-P358 HydrophobicContact CD1-CB 3.93Å; L336-L360 HydrophobicContact CD1-CD2 3.58Å
337	A	94.3	Very high	91.4	Very high	53 Å²	53	50.1 Å²	50.1	44%	0.438	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-45.7	175.1	0	0	0	0	0	111.4	A333 T334 T339 S340 A341	A333-A337 WeakPolarHBondContact O-CB 3.45Å; A333-A337 PolarHBondContact O-N 3.35Å; T334-A337 PolarHBondContact O-N 2.96Å; A337-T339 VanDerWaalsContact C-N 3.31Å; A337-T339 PolarHBondContact O-N 2.86Å; A337-S340 WeakPolarHBondContact O-CB 3.13Å; A337-S340 PolarHBondContact O-N 2.93Å; A337-A341 PolarHBondContact O-N 3.5Å
338	A	92.9	Very high	92.2	Very high	48 Å²	48	56.3 Å²	56.3	40%	0.397	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-36	174.8	0	0	0	0	0	112.4	T334 S335 R342	T334-A338 PolarHBondContact O-N 3.5Å; S335-A338 PolarHBondContact O-N 3.46Å; A338-R342 VanDerWaalsContact O-CG 3.31Å; A338-R342 WeakPolarHBondContact O-CG 3.39Å; A338-R342 PolarHBondContact O-N 3.46Å; A338-R342 VanDerWaalsContact O-N 3.16Å; A338-R342 PolarHBondContact O-NE 3.34Å
339	T	93.1	Very high	92.7	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-68.3	-43.5	174.9	-63.7	0	0	0	0	111.9	I294 S335 L336 A337 R342 L343	I294-T339 HydrophobicContact CD1-CG2 4.14Å; S335-T339 WeakPolarHBondContact O-CB 3.32Å; S335-T339 PolarHBondContact O-N 3.22Å; S335-T339 PolarHBondContact O-OG1 3.18Å; L336-T339 PolarHBondContact O-N 3.09Å; A337-T339 VanDerWaalsContact C-N 3.31Å; A337-T339 PolarHBondContact O-N 2.86Å; T339-R342 PolarHBondContact O-N 2.56Å; T339-R342 PolarHBondContact OG1-NH2 2.87Å; T339-R342 VanDerWaalsContact OG1-NH2 3.15Å; T339-L343 HydrophobicContact CG2-CD1 3.97Å; T339-L343 HydrophobicContact CG2-CG 4.48Å; T339-L343 WeakPolarHBondContact O-CB 3.38Å; T339-L343 WeakPolarHBondContact O-CG 3.28Å; T339-L343 PolarHBondContact O-N 3.01Å
340	S	96.5	Very high	93.4	Very high	19 Å²	19	63.7 Å²	63.7	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-57.6	-48.2	174.5	-178.9	0	0	0	0	111.4	L336 A337 L343 R344 F356	L336-S340 VanDerWaalsContact O-CB 3.31Å; L336-S340 WeakPolarHBondContact O-CB 3.35Å; L336-S340 PolarHBondContact O-N 3.39Å; A337-S340 WeakPolarHBondContact O-CB 3.13Å; A337-S340 PolarHBondContact O-N 2.93Å; S340-L343 PolarHBondContact O-N 3.44Å; S340-R344 WeakPolarHBondContact O-CB 3.4Å; S340-R344 VanDerWaalsContact O-CG 3.24Å; S340-R344 WeakPolarHBondContact O-CG 3.34Å; S340-R344 PolarHBondContact O-N 3.17Å; S340-R344 PolarHBondContact OG-NE 2.67Å; S340-F356 VanDerWaalsContact CB-CD1 3.49Å
341	A	96.7	Very high	94	Very high	46 Å²	46	61.1 Å²	61.1	38%	0.38	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-51.9	178	0	0	0	0	0	111.8	A337 L343 R344 D345	A337-A341 PolarHBondContact O-N 3.5Å; A341-L343 PolarHBondContact O-N 2.85Å; A341-R344 PolarHBondContact O-N 3.11Å; A341-D345 PolarHBondContact O-N 3.5Å
342	R	95	Very high	94.4	Very high	116 Å²	116	53.1 Å²	53.1	44%	0.438	31%	0.306	S	S	.	.	H	α-helix	trans	-57.7	-44.3	178.5	-72.4	-179.1	-67.7	171.2	0.3	112.7	D7 A338 T339 F346	D7-R342 IonicContact OD2-NH1 2.83Å; D7-R342 PolarHBondContact OD2-NH1 3.2Å; A338-R342 VanDerWaalsContact O-CG 3.31Å; A338-R342 WeakPolarHBondContact O-CG 3.39Å; A338-R342 PolarHBondContact O-N 3.46Å; A338-R342 VanDerWaalsContact O-N 3.16Å; A338-R342 PolarHBondContact O-NE 3.34Å; T339-R342 PolarHBondContact O-N 2.56Å; T339-R342 PolarHBondContact OG1-NH2 2.87Å; T339-R342 VanDerWaalsContact OG1-NH2 3.15Å; R342-F346 WeakPolarHBondContact O-CB 3.42Å; R342-F346 PolarHBondContact O-N 3.19Å
343	L	97	Very high	94.8	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-68.4	-40.2	178.6	-72.5	174.1	0	0	0	112.4	G297 W300 A301 L304 T339 S340 A341 F346 A347 F354 F356	G297-L343 WeakPolarHBondContact O-CD2 3.3Å; W300-L343 HydrophobicContact CB-CD1 4.14Å; W300-L343 HydrophobicContact CB-CD2 3.88Å; A301-L343 HydrophobicContact CB-CD2 4.31Å; L304-L343 HydrophobicContact CD1-CD2 4.19Å; T339-L343 HydrophobicContact CG2-CD1 3.97Å; T339-L343 HydrophobicContact CG2-CG 4.48Å; T339-L343 WeakPolarHBondContact O-CB 3.38Å; T339-L343 WeakPolarHBondContact O-CG 3.28Å; T339-L343 PolarHBondContact O-N 3.01Å; S340-L343 PolarHBondContact O-N 3.44Å; A341-L343 PolarHBondContact O-N 2.85Å; L343-F346 PolarHBondContact O-N 3.19Å; L343-A347 VanDerWaalsContact O-CB 3.31Å; L343-A347 WeakPolarHBondContact O-CB 3.38Å; L343-A347 PolarHBondContact O-N 3.3Å; L343-F354 HydrophobicContact CB-CE1 3.57Å; L343-F354 HydrophobicContact CB-CZ 3.64Å; L343-F354 HydrophobicContact CD1-CZ 4.16Å; L343-F354 HydrophobicContact CG-CZ 4.45Å; L343-F356 HydrophobicContact CD1-CD2 4.07Å; L343-F356 HydrophobicContact CD1-CE2 4.36Å
344	R	97.5	Very high	95.1	Very high	87 Å²	87	56.4 Å²	56.4	33%	0.328	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-45	175.4	-76.3	172.1	-172.2	-82	6.6	111.3	S340 A341 A347 K348 F354 F356	S340-R344 WeakPolarHBondContact O-CB 3.4Å; S340-R344 VanDerWaalsContact O-CG 3.24Å; S340-R344 WeakPolarHBondContact O-CG 3.34Å; S340-R344 PolarHBondContact O-N 3.17Å; S340-R344 PolarHBondContact OG-NE 2.67Å; A341-R344 PolarHBondContact O-N 3.11Å; R344-A347 PolarHBondContact O-N 2.93Å; R344-K348 VanDerWaalsContact O-CG 3.32Å; R344-K348 WeakPolarHBondContact O-CG 3.32Å; R344-K348 PolarHBondContact O-N 3.09Å; R344-F354 HydrophobicContact CB-CD1 4.3Å; R344-F354 HydrophobicContact CG-CD1 3.64Å; R344-F354 HydrophobicContact CG-CE1 3.92Å; R344-F354 PolarHBondContact NH1-O 3.3Å; R344-F354 VanDerWaalsContact NH1-O 3.17Å; R344-F356 VanDerWaalsContact NH2-N 3.12Å; R344-F356 PolarHBondContact NH2-O 2.87Å
345	D	96.9	Very high	95.5	Very high	85 Å²	85	53.9 Å²	53.9	46%	0.455	29%	0.293	S	S	.	.	H	α-helix	trans	-67.9	-40.2	179.2	-67.2	-24.5	0	0	0	111.7	A341 K348 L349	A341-D345 PolarHBondContact O-N 3.5Å; D345-K348 WeakPolarHBondContact O-CB 3.29Å; D345-K348 PolarHBondContact O-N 3.39Å; D345-K348 IonicContact OD1-NZ 2.79Å; D345-K348 PolarHBondContact OD1-NZ 2.87Å; D345-L349 PolarHBondContact O-N 3.31Å
346	F	95.2	Very high	95.9	Very high	62 Å²	62	52.1 Å²	52.1	27%	0.272	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-43.1	173.9	-170.5	-110.4	0	0	0	112.5	A301 L304 Q305 R342 L343 K348 L349 L350	A301-F346 HydrophobicContact CB-CD1 4.14Å; A301-F346 HydrophobicContact CB-CE1 4.2Å; A301-F346 WeakPolarHBondContact O-CE1 3.22Å; L304-F346 HydrophobicContact CB-CD1 4.22Å; L304-F346 HydrophobicContact CB-CE1 4.17Å; L304-F346 HydrophobicContact CD1-CD1 4.21Å; Q305-F346 HydrophobicContact CB-CE1 4.38Å; Q305-F346 HydrophobicContact CB-CZ 4.33Å; R342-F346 WeakPolarHBondContact O-CB 3.42Å; R342-F346 PolarHBondContact O-N 3.19Å; L343-F346 PolarHBondContact O-N 3.19Å; F346-K348 VanDerWaalsContact C-N 3.33Å; F346-K348 PolarHBondContact O-N 3.02Å; F346-L349 WeakPolarHBondContact O-CB 3.47Å; F346-L349 PolarHBondContact O-N 3.32Å; F346-L350 HydrophobicContact CD1-CD1 3.92Å; F346-L350 HydrophobicContact CE1-CD1 3.51Å; F346-L350 HydrophobicContact CE1-CG 4.34Å; F346-L350 HydrophobicContact CZ-CD1 4.05Å; F346-L350 PolarHBondContact O-N 2.86Å
347	A	96.9	Very high	96	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-34.7	177.1	0	0	0	0	0	113.1	L304 L343 R344 L349 L350 G351 V352 F354	L304-A347 HydrophobicContact CD1-CB 4.2Å; L343-A347 VanDerWaalsContact O-CB 3.31Å; L343-A347 WeakPolarHBondContact O-CB 3.38Å; L343-A347 PolarHBondContact O-N 3.3Å; R344-A347 PolarHBondContact O-N 2.93Å; A347-L349 VanDerWaalsContact C-N 3.33Å; A347-L349 PolarHBondContact O-N 3.49Å; A347-L350 CarbonylContact O-C 3.54Å; A347-L350 PolarHBondContact O-N 3.49Å; A347-G351 PolarHBondContact O-N 3.09Å; A347-V352 PolarHBondContact O-N 2.93Å; A347-V352 VanDerWaalsContact O-N 3.11Å; A347-F354 HydrophobicContact CB-CB 3.29Å; A347-F354 HydrophobicContact CB-CD1 4.14Å; A347-F354 HydrophobicContact CB-CD2 4.14Å; A347-F354 HydrophobicContact CB-CG 3.6Å
348	K	96.3	Very high	96	Very high	144 Å²	144	54.5 Å²	54.5	63%	0.626	29%	0.291	S	S	*	.	H	α-helix	trans	-59.5	-42.6	172.3	-72.3	169.8	-164.6	160.2	0	111.5	R344 D345 F346 L350 G351	R344-K348 VanDerWaalsContact O-CG 3.32Å; R344-K348 WeakPolarHBondContact O-CG 3.32Å; R344-K348 PolarHBondContact O-N 3.09Å; D345-K348 WeakPolarHBondContact O-CB 3.29Å; D345-K348 PolarHBondContact O-N 3.39Å; D345-K348 IonicContact OD1-NZ 2.79Å; D345-K348 PolarHBondContact OD1-NZ 2.87Å; F346-K348 VanDerWaalsContact C-N 3.33Å; F346-K348 PolarHBondContact O-N 3.02Å; K348-L350 PolarHBondContact O-N 3.48Å; K348-G351 PolarHBondContact O-N 3.07Å
349	L	95.9	Very high	96.1	Very high	140 Å²	140	53 Å²	53	73%	0.733	28%	0.276	S	S	*	.	H	α-helix	trans	-62.1	-32.1	177.1	-64	173.9	0	0	0	112.3	D345 F346 A347 G351	D345-L349 PolarHBondContact O-N 3.31Å; F346-L349 WeakPolarHBondContact O-CB 3.47Å; F346-L349 PolarHBondContact O-N 3.32Å; A347-L349 VanDerWaalsContact C-N 3.33Å; A347-L349 PolarHBondContact O-N 3.49Å; L349-G351 VanDerWaalsContact C-N 3.32Å
350	L	95.1	Very high	96.1	Very high	30 Å²	30	57.7 Å²	57.7	16%	0.157	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-6	176.9	-59.6	176.4	0	0	0	113.3	L304 A308 K314 F346 A347 K348 V352	L304-L350 HydrophobicContact CB-CD1 3.84Å; A308-L350 HydrophobicContact CB-CB 4Å; A308-L350 HydrophobicContact CB-CD1 4.14Å; A308-L350 HydrophobicContact CB-CD2 4.12Å; A308-L350 HydrophobicContact CB-CG 4.32Å; K314-L350 PolarHBondContact NZ-O 2.87Å; F346-L350 HydrophobicContact CD1-CD1 3.92Å; F346-L350 HydrophobicContact CE1-CD1 3.51Å; F346-L350 HydrophobicContact CE1-CG 4.34Å; F346-L350 HydrophobicContact CZ-CD1 4.05Å; F346-L350 PolarHBondContact O-N 2.86Å; A347-L350 CarbonylContact O-C 3.54Å; A347-L350 PolarHBondContact O-N 3.49Å; K348-L350 PolarHBondContact O-N 3.48Å; L350-V352 VanDerWaalsContact C-N 3.35Å; L350-V352 HydrophobicContact CB-CG2 4.19Å; L350-V352 PolarHBondContact O-N 3Å
351	G	94.6	Very high	95.8	Very high	51 Å²	51	62.2 Å²	62.2	53%	0.526	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	39.7	-176.5	0	0	0	0	0	113.2	K314 A347 K348 L349	K314-G351 WeakPolarHBondContact CE-O 3.33Å; K314-G351 PolarHBondContact NZ-O 3.12Å; A347-G351 PolarHBondContact O-N 3.09Å; K348-G351 PolarHBondContact O-N 3.07Å; L349-G351 VanDerWaalsContact C-N 3.32Å
352	V	94.7	Very high	95.4	Very high	10 Å²	10	62.6 Å²	62.6	6%	0.061	32%	0.315	C	S	.	.			trans	-108.8	130.9	175.7	179.2	0	0	0	0	108.5	K314 V318 A347 L350 F354	K314-V352 HydrophobicContact CD-CG2 3.59Å; K314-V352 HydrophobicContact CG-CG2 3.87Å; V318-V352 HydrophobicContact CB-CG1 4.11Å; V318-V352 HydrophobicContact CG2-CG1 3.71Å; A347-V352 PolarHBondContact O-N 2.93Å; A347-V352 VanDerWaalsContact O-N 3.11Å; L350-V352 VanDerWaalsContact C-N 3.35Å; L350-V352 HydrophobicContact CB-CG2 4.19Å; L350-V352 PolarHBondContact O-N 3Å; V352-F354 PolarHBondContact O-N 2.93Å
353	E	97.4	Very high	95.2	Very high	108 Å²	108	58.3 Å²	58.3	51%	0.505	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	123.5	170.4	-171.9	-167.8	155.5	0	0	108.7	S316 R317 V318	S316-E353 WeakPolarHBondContact O-CB 3.24Å; S316-E353 PolarHBondContact O-N 3.4Å; R317-E353 CarbonylContact C-O 3.59Å; R317-E353 VanDerWaalsContact CA-O 3.32Å; R317-E353 WeakPolarHBondContact CA-O 3.43Å; R317-E353 HydrophobicContact CB-CB 4.23Å; R317-E353 WeakPolarHBondContact CD-OE1 3.29Å; R317-E353 HydrophobicContact CG-CB 4.15Å; R317-E353 HydrophobicContact CG-CG 4.02Å; V318-E353 PolarHBondContact N-O 3.36Å
354	F	98.3	Very high	94.7	Very high	16 Å²	16	62.4 Å²	62.4	7%	0.07	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.5	-169.8	-179.9	-94.6	0	0	0	113.9	L304 V318 I320 L343 R344 A347 V352 F356	L304-F354 HydrophobicContact CD1-CD2 4.23Å; L304-F354 HydrophobicContact CD1-CE2 4.04Å; L304-F354 HydrophobicContact CD2-CD2 3.92Å; L304-F354 HydrophobicContact CD2-CE2 4.19Å; V318-F354 HydrophobicContact CB-CD2 4.24Å; V318-F354 HydrophobicContact CG1-CD2 4.27Å; V318-F354 HydrophobicContact CG1-CE2 4.41Å; V318-F354 VanDerWaalsContact O-CA 3.3Å; V318-F354 WeakPolarHBondContact O-CA 3.3Å; V318-F354 VanDerWaalsContact O-CD2 3.28Å; V318-F354 WeakPolarHBondContact O-CD2 3.35Å; I320-F354 HydrophobicContact CB-CZ 4.48Å; I320-F354 HydrophobicContact CD1-CE2 3.66Å; I320-F354 HydrophobicContact CD1-CZ 3.91Å; I320-F354 HydrophobicContact CG1-CE2 3.74Å; I320-F354 HydrophobicContact CG1-CZ 4.09Å; L343-F354 HydrophobicContact CB-CE1 3.57Å; L343-F354 HydrophobicContact CB-CZ 3.64Å; L343-F354 HydrophobicContact CD1-CZ 4.16Å; L343-F354 HydrophobicContact CG-CZ 4.45Å; R344-F354 HydrophobicContact CB-CD1 4.3Å; R344-F354 HydrophobicContact CG-CD1 3.64Å; R344-F354 HydrophobicContact CG-CE1 3.92Å; R344-F354 PolarHBondContact NH1-O 3.3Å; R344-F354 VanDerWaalsContact NH1-O 3.17Å; A347-F354 HydrophobicContact CB-CB 3.29Å; A347-F354 HydrophobicContact CB-CD1 4.14Å; A347-F354 HydrophobicContact CB-CD2 4.14Å; A347-F354 HydrophobicContact CB-CG 3.6Å; V352-F354 PolarHBondContact O-N 2.93Å; F354-F356 HydrophobicContact CE1-CB 3.83Å; F354-F356 HydrophobicContact CZ-CB 4.11Å
355	E	97.8	Very high	94.4	Very high	66 Å²	66	63.5 Å²	63.5	31%	0.308	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.1	176.7	-67.1	-179.2	-175.6	0	0	110.9	V318 R319 I320	V318-E355 PolarHBondContact O-N 3.04Å; V318-E355 VanDerWaalsContact O-N 3.11Å; R319-E355 CarbonylContact C-O 3.36Å; R319-E355 VanDerWaalsContact CA-O 3.32Å; R319-E355 WeakPolarHBondContact CA-O 3.34Å; R319-E355 HydrophobicContact CB-CB 4.3Å; R319-E355 WeakPolarHBondContact CD-OE2 3.34Å; R319-E355 HydrophobicContact CG-CB 3.94Å; I320-E355 PolarHBondContact N-O 2.91Å
356	F	97.7	Very high	94.3	Very high	5 Å²	5	59.5 Å²	59.5	2%	0.022	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.9	170.2	-177.6	-85.2	0	0	0	109.3	I294 I320 L336 S340 L343 R344 F354 P358	I294-F356 HydrophobicContact CD1-CE2 3.61Å; I294-F356 HydrophobicContact CD1-CZ 3.94Å; I320-F356 HydrophobicContact CB-CD2 3.97Å; I320-F356 HydrophobicContact CB-CE2 4.5Å; I320-F356 HydrophobicContact CG2-CD2 3.98Å; I320-F356 HydrophobicContact CG2-CE2 4Å; I320-F356 CarbonylContact O-C 3.5Å; I320-F356 WeakPolarHBondContact O-CA 3.14Å; L336-F356 HydrophobicContact CD2-CZ 4.29Å; S340-F356 VanDerWaalsContact CB-CD1 3.49Å; L343-F356 HydrophobicContact CD1-CD2 4.07Å; L343-F356 HydrophobicContact CD1-CE2 4.36Å; R344-F356 VanDerWaalsContact NH2-N 3.12Å; R344-F356 PolarHBondContact NH2-O 2.87Å; F354-F356 HydrophobicContact CE1-CB 3.83Å; F354-F356 HydrophobicContact CZ-CB 4.11Å; F356-P358 HydrophobicContact CE1-CB 4.18Å
357	V	96.1	Very high	94.3	Very high	46 Å²	46	59.8 Å²	59.8	28%	0.279	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	110.5	-177.6	-175.9	0	0	0	0	109	I320 S321 G322	I320-V357 PolarHBondContact O-N 2.91Å; S321-V357 CarbonylContact C-O 3.59Å; S321-V357 VanDerWaalsContact CA-O 3.32Å; S321-V357 WeakPolarHBondContact CA-O 3.32Å; G322-V357 PolarHBondContact N-O 3.48Å
358	P	95.3	Very high	94.2	Very high	60 Å²	60	66.2 Å²	66.2	39%	0.39	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	133.4	175.1	30.4	-32.7	0	0	0	111.1	G322 L336 F356 L360	G322-P358 WeakPolarHBondContact O-CA 3.33Å; L336-P358 HydrophobicContact CD1-CB 3.93Å; F356-P358 HydrophobicContact CE1-CB 4.18Å; P358-L360 HydrophobicContact CB-CD2 4.26Å
359	L	94.6	Very high	94.2	Very high	18 Å²	18	63.1 Å²	63.1	9%	0.094	33%	0.333	C	S	.	.			trans	-106.4	97.5	173.3	-66.7	179.5	0	0	0	109.3	G322 L323 P324 F371	G322-L359 PolarHBondContact O-N 3.32Å; L323-L359 HydrophobicContact CD1-CB 4.43Å; L323-L359 HydrophobicContact CD1-CD1 3.95Å; L323-L359 HydrophobicContact CG-CB 4Å; L323-L359 HydrophobicContact CG-CD1 4.35Å; P324-L359 WeakPolarHBondContact CD-O 3.36Å; L359-F371 HydrophobicContact CD1-CD1 3.79Å; L359-F371 HydrophobicContact CD1-CE1 3.7Å; L359-F371 HydrophobicContact CD1-CZ 4.43Å
360	L	92.7	Very high	94.2	Very high	98 Å²	98	58 Å²	58	51%	0.513	31%	0.306	S	S	.	.			trans	-90.2	-10.9	-171.7	-58.6	-178	0	0	0	114.5	P324 P332 L336 P358	P324-L360 HydrophobicContact CG-CD2 4.32Å; P332-L360 HydrophobicContact CG-CD2 4.21Å; L336-L360 HydrophobicContact CD1-CD2 3.58Å; P358-L360 HydrophobicContact CB-CD2 4.26Å
361	R	90.4	Very high	94.3	Very high	113 Å²	113	56.7 Å²	56.7	43%	0.426	30%	0.299	S	S	.	.	S	Bend	trans	-69.4	152.4	177	-67.6	175.8	62.4	-157.1	-4.4	110.3	V363 E365 L366 D370	R361-V363 PolarHBondContact O-N 2.81Å; R361-E365 PolarHBondContact NH2-O 3.44Å; R361-L366 HydrophobicContact CB-CD2 3.86Å; R361-D370 IonicContact CZ-OD1 3.64Å; R361-D370 IonicContact CZ-OD2 3.62Å; R361-D370 VanDerWaalsContact NH1-CG 3.28Å; R361-D370 IonicContact NH1-OD1 3.62Å; R361-D370 PolarHBondContact NH1-OD1 3.11Å; R361-D370 IonicContact NH1-OD2 3.7Å; R361-D370 PolarHBondContact NH1-OD2 3.06Å; R361-D370 VanDerWaalsContact NH1-OD2 3.07Å
362	S	87.7	Confident	94.3	Very high	54 Å²	54	59.9 Å²	59.9	38%	0.378	30%	0.304	S	S	.	.			trans	-57.9	138.5	175.8	176.7	0	0	0	0	110.6	H364 E365 L366	S362-H364 PolarHBondContact O-N 2.9Å; S362-E365 WeakPolarHBondContact O-CB 3.4Å; S362-E365 PolarHBondContact O-N 2.73Å; S362-L366 PolarHBondContact O-N 3.27Å
363	V	90.3	Very high	94.4	Very high	26 Å²	26	61.3 Å²	61.3	16%	0.158	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-25.9	179.9	76.3	0	0	0	0	112.8	F292 L323 R361 E365 L390 R400 V401	F292-V363 HydrophobicContact CD1-CG2 4.01Å; F292-V363 HydrophobicContact CE1-CG2 3.8Å; L323-V363 HydrophobicContact CD2-CB 4.42Å; L323-V363 HydrophobicContact CD2-CG2 4.02Å; R361-V363 PolarHBondContact O-N 2.81Å; V363-E365 VanDerWaalsContact C-N 3.29Å; V363-E365 PolarHBondContact O-N 3.06Å; V363-L390 HydrophobicContact CG1-CD1 4.4Å; V363-L390 HydrophobicContact CG1-CD2 3.96Å; V363-R400 PolarHBondContact O-NH1 3Å; V363-R400 VanDerWaalsContact O-NH1 3.17Å; V363-V401 HydrophobicContact CG1-CG2 4.38Å; V363-V401 HydrophobicContact CG2-CG1 4.34Å; V363-V401 HydrophobicContact CG2-CG2 3.67Å
364	H	88	Confident	94.4	Very high	91 Å²	91	59.4 Å²	59.4	42%	0.421	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-17.1	177.2	-54.6	-57.9	0	0	0	113.8	S362 R400	S362-H364 PolarHBondContact O-N 2.9Å; H364-R400 PolarHBondContact O-NE 2.66Å; H364-R400 PolarHBondContact O-NH1 2.83Å; H364-R400 PolarHBondContact O-NH2 2.86Å
365	E	91.3	Very high	94.3	Very high	111 Å²	111	65.3 Å²	65.3	52%	0.519	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-16.5	-178.2	-61.7	175.2	177.6	0	0	112.5	R361 S362 V363	R361-E365 PolarHBondContact NH2-O 3.44Å; S362-E365 WeakPolarHBondContact O-CB 3.4Å; S362-E365 PolarHBondContact O-N 2.73Å; V363-E365 VanDerWaalsContact C-N 3.29Å; V363-E365 PolarHBondContact O-N 3.06Å
366	L	94.3	Very high	94.2	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.35	C	S	.	.			trans	-66.2	141.3	179.8	-64.7	176.3	0	0	0	111.6	L323 R361 S362 D370 F371 R400 L404	L323-L366 HydrophobicContact CD2-CD1 3.37Å; L323-L366 HydrophobicContact CG-CD1 4.19Å; R361-L366 HydrophobicContact CB-CD2 3.86Å; S362-L366 PolarHBondContact O-N 3.27Å; L366-D370 VanDerWaalsContact CA-OD2 3.3Å; L366-D370 WeakPolarHBondContact CA-OD2 3.29Å; L366-D370 HydrophobicContact CD2-CB 3.91Å; L366-F371 HydrophobicContact CB-CE2 4.4Å; L366-F371 HydrophobicContact CB-CZ 4.49Å; L366-F371 HydrophobicContact CD1-CZ 4.09Å; L366-R400 PolarHBondContact O-NH1 2.75Å; L366-R400 VanDerWaalsContact O-NH1 3.12Å; L366-R400 PolarHBondContact O-NH2 3.42Å; L366-L404 HydrophobicContact CB-CD2 4.11Å
367	D	94.7	Very high	94.2	Very high	68 Å²	68	66.7 Å²	66.7	36%	0.364	35%	0.353	S	S	.	.			trans	-121.7	177.6	170.6	67.2	50	0	0	0	111	S369 D370 F371 L404	D367-S369 PolarHBondContact O-N 3.33Å; D367-S369 WeakPolarHBondContact OD1-CA 3.45Å; D367-S369 VanDerWaalsContact OD1-CB 3.3Å; D367-S369 WeakPolarHBondContact OD1-CB 3.33Å; D367-S369 PolarHBondContact OD1-N 2.93Å; D367-S369 PolarHBondContact OD1-OG 3.46Å; D367-D370 PolarHBondContact N-OD2 2.66Å; D367-D370 PolarHBondContact O-N 2.82Å; D367-D370 PolarHBondContact OD1-N 3.3Å; D367-F371 VanDerWaalsContact O-CD2 3.26Å; D367-F371 WeakPolarHBondContact O-CD2 3.27Å; D367-F371 VanDerWaalsContact O-CE2 3.27Å; D367-F371 WeakPolarHBondContact O-CE2 3.26Å; D367-L404 VanDerWaalsContact C-CD1 3.48Å
368	R	95.4	Very high	94.3	Very high	134 Å²	134	66.6 Å²	66.6	51%	0.506	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-60.5	-33.5	-177.3	172.7	170	-178.9	160	8.4	112.4	D370 F371 L404 S407 L408	R368-D370 VanDerWaalsContact C-N 3.32Å; R368-D370 PolarHBondContact O-N 3.37Å; R368-F371 PolarHBondContact O-N 3.29Å; R368-L404 HydrophobicContact CB-CD1 4.36Å; R368-S407 PolarHBondContact NE-O 2.92Å; R368-S407 PolarHBondContact NH1-O 3.24Å; R368-L408 HydrophobicContact CB-CD2 4.44Å; R368-L408 HydrophobicContact CG-CD2 3.94Å
369	S	95.6	Very high	94.4	Very high	79 Å²	79	64 Å²	64	55%	0.552	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-72	-27.7	-174.6	73.2	0	0	0	0	112.5	D367 F371 L372	D367-S369 PolarHBondContact O-N 3.33Å; D367-S369 WeakPolarHBondContact OD1-CA 3.45Å; D367-S369 VanDerWaalsContact OD1-CB 3.3Å; D367-S369 WeakPolarHBondContact OD1-CB 3.33Å; D367-S369 PolarHBondContact OD1-N 2.93Å; D367-S369 PolarHBondContact OD1-OG 3.46Å; S369-F371 PolarHBondContact O-N 2.97Å; S369-L372 WeakPolarHBondContact O-CD2 3.29Å; S369-L372 PolarHBondContact O-N 2.91Å; S369-L372 VanDerWaalsContact O-N 3.11Å
370	D	96.1	Very high	94.6	Very high	34 Å²	34	63.2 Å²	63.2	18%	0.182	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-59.4	-27.3	176.8	-69.5	-63.2	0	0	0	113.3	R361 L366 D367 R368 L372	R361-D370 IonicContact CZ-OD1 3.64Å; R361-D370 IonicContact CZ-OD2 3.62Å; R361-D370 VanDerWaalsContact NH1-CG 3.28Å; R361-D370 IonicContact NH1-OD1 3.62Å; R361-D370 PolarHBondContact NH1-OD1 3.11Å; R361-D370 IonicContact NH1-OD2 3.7Å; R361-D370 PolarHBondContact NH1-OD2 3.06Å; R361-D370 VanDerWaalsContact NH1-OD2 3.07Å; L366-D370 VanDerWaalsContact CA-OD2 3.3Å; L366-D370 WeakPolarHBondContact CA-OD2 3.29Å; L366-D370 HydrophobicContact CD2-CB 3.91Å; D367-D370 PolarHBondContact N-OD2 2.66Å; D367-D370 PolarHBondContact O-N 2.82Å; D367-D370 PolarHBondContact OD1-N 3.3Å; R368-D370 VanDerWaalsContact C-N 3.32Å; R368-D370 PolarHBondContact O-N 3.37Å; D370-L372 VanDerWaalsContact C-N 3.35Å
371	F	96.4	Very high	94.9	Very high	1 Å²	1	58.5 Å²	58.5	0%	0.004	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-82.7	-12.7	-178.7	-61.3	-87.9	0	0	0	113.3	H288 V290 F292 R319 L323 L359 L366 D367 R368 S369 V373 L404 L408	H288-F371 PolarHBondContact CE1-O 3.14Å; V290-F371 HydrophobicContact CB-CD1 4.44Å; V290-F371 HydrophobicContact CG1-CD1 3.54Å; V290-F371 HydrophobicContact CG1-CE1 3.38Å; V290-F371 HydrophobicContact CG2-CD1 3.98Å; F292-F371 HydrophobicContact CE1-CZ 4.41Å; F292-F371 HydrophobicContact CE2-CE1 4.35Å; F292-F371 AromaticContact CZ-CE1 3.88Å; F292-F371 HydrophobicContact CZ-CE1 3.88Å; F292-F371 AromaticContact CZ-CZ 3.79Å; F292-F371 HydrophobicContact CZ-CZ 3.79Å; R319-F371 PolarHBondContact NH1-O 2.87Å; L323-F371 HydrophobicContact CD1-CE1 4.22Å; L359-F371 HydrophobicContact CD1-CD1 3.79Å; L359-F371 HydrophobicContact CD1-CE1 3.7Å; L359-F371 HydrophobicContact CD1-CZ 4.43Å; L366-F371 HydrophobicContact CB-CE2 4.4Å; L366-F371 HydrophobicContact CB-CZ 4.49Å; L366-F371 HydrophobicContact CD1-CZ 4.09Å; D367-F371 VanDerWaalsContact O-CD2 3.26Å; D367-F371 WeakPolarHBondContact O-CD2 3.27Å; D367-F371 VanDerWaalsContact O-CE2 3.27Å; D367-F371 WeakPolarHBondContact O-CE2 3.26Å; R368-F371 PolarHBondContact O-N 3.29Å; S369-F371 PolarHBondContact O-N 2.97Å; F371-V373 HydrophobicContact CB-CG2 4.03Å; F371-V373 PolarHBondContact O-N 3.02Å; F371-V373 VanDerWaalsContact O-N 3.16Å; F371-L404 HydrophobicContact CE2-CD1 4.03Å; F371-L404 HydrophobicContact CE2-CD2 3.86Å; F371-L404 HydrophobicContact CE2-CG 4.03Å; F371-L404 HydrophobicContact CZ-CD2 4.15Å; F371-L408 HydrophobicContact CB-CD1 4.36Å; F371-L408 HydrophobicContact CB-CD2 4.17Å; F371-L408 HydrophobicContact CD1-CD1 4Å; F371-L408 HydrophobicContact CD2-CD1 4.11Å; F371-L408 HydrophobicContact CD2-CD2 3.85Å; F371-L408 HydrophobicContact CE1-CD1 4.35Å; F371-L408 HydrophobicContact CE2-CD1 4.46Å; F371-L408 HydrophobicContact CG-CD1 3.87Å; F371-L408 HydrophobicContact CG-CD2 4.09Å
372	L	95.8	Very high	95.3	Very high	118 Å²	118	53.1 Å²	53.1	62%	0.618	29%	0.286	S	S	*	.			trans	50	42.2	178.5	-55.8	173.6	0	0	0	112.6	R319 S369 D370 E374	R319-L372 PolarHBondContact NH2-O 3.27Å; S369-L372 WeakPolarHBondContact O-CD2 3.29Å; S369-L372 PolarHBondContact O-N 2.91Å; S369-L372 VanDerWaalsContact O-N 3.11Å; D370-L372 VanDerWaalsContact C-N 3.35Å; L372-E374 PolarHBondContact O-N 2.96Å
373	V	96.7	Very high	95.8	Very high	41 Å²	41	50.6 Å²	50.6	25%	0.248	27%	0.269	C	S	.	.			trans	-63.8	127	-178.9	175.6	0	0	0	0	109.8	F371 E377 V379 L408	F371-V373 HydrophobicContact CB-CG2 4.03Å; F371-V373 PolarHBondContact O-N 3.02Å; F371-V373 VanDerWaalsContact O-N 3.16Å; V373-E377 WeakPolarHBondContact CA-OE1 3.38Å; V373-V379 HydrophobicContact CB-CG2 4.49Å; V373-V379 HydrophobicContact CG1-CG2 3.58Å; V373-V379 HydrophobicContact CG2-CG2 4.08Å; V373-L408 HydrophobicContact CG2-CD2 4.14Å
374	E	97.1	Very high	96.1	Very high	67 Å²	67	50.3 Å²	50.3	31%	0.313	27%	0.265	S	S	.	.			trans	-91.7	147.1	177.1	-64.9	-177.8	-165.7	0	0	110.7	R317 L372 D376 E377	R317-E374 IonicContact CZ-OE1 2.65Å; R317-E374 IonicContact CZ-OE2 2.66Å; R317-E374 IonicContact NH1-OE1 3Å; R317-E374 PolarHBondContact NH1-OE1 3.24Å; R317-E374 IonicContact NH1-OE2 3.92Å; R317-E374 PolarHBondContact NH1-OE2 2.97Å; R317-E374 VanDerWaalsContact NH2-CD 3.27Å; R317-E374 IonicContact NH2-OE1 3.9Å; R317-E374 IonicContact NH2-OE2 3.69Å; R317-E374 PolarHBondContact NH2-OE2 2.82Å; L372-E374 PolarHBondContact O-N 2.96Å; E374-D376 PolarHBondContact O-N 3.35Å; E374-E377 HydrophobicContact CB-CG 4.24Å; E374-E377 PolarHBondContact N-OE1 2.99Å; E374-E377 WeakPolarHBondContact O-CG 3.35Å
375	P	95.4	Very high	96.4	Very high	140 Å²	140	47 Å²	47	91%	0.909	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-16.3	-177.6	27.9	-35.3	0	0	0	114.3
376	D	96.4	Very high	96.6	Very high	85 Å²	85	42.9 Å²	42.9	46%	0.455	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	9.7	-176.7	70.3	-31.1	0	0	0	113.7	K286 E374	K286-D376 WeakPolarHBondContact CD-OD2 3.29Å; K286-D376 WeakPolarHBondContact CE-OD2 3.48Å; K286-D376 IonicContact NZ-OD1 2.66Å; K286-D376 IonicContact NZ-OD2 2.66Å; K286-D376 PolarHBondContact NZ-OD2 3.19Å; E374-D376 PolarHBondContact O-N 3.35Å
377	E	97.3	Very high	96.7	Very high	16 Å²	16	42.9 Å²	42.9	8%	0.075	23%	0.232	C	C	.	.	S	Bend	trans	-111.3	153.8	173.6	79.3	-166.6	179.6	0	0	111.7	K286 H288 R317 R319 V373 E374 V379	K286-E377 HydrophobicContact CB-CB 3.83Å; K286-E377 WeakPolarHBondContact O-CA 3.42Å; H288-E377 HydrophobicContact CB-CG 3.87Å; H288-E377 WeakPolarHBondContact CB-OE1 3.38Å; H288-E377 WeakPolarHBondContact CB-OE2 3.39Å; H288-E377 IonicContact CE1-OE1 3.39Å; H288-E377 IonicContact CG-OE1 2.66Å; H288-E377 IonicContact CG-OE2 3.87Å; H288-E377 IonicContact ND1-OE1 3.39Å; H288-E377 PolarHBondContact ND1-OE1 2.78Å; R317-E377 IonicContact NH2-OE2 3.36Å; R319-E377 IonicContact CZ-OE1 3.97Å; R319-E377 IonicContact CZ-OE2 3.07Å; R319-E377 IonicContact NE-OE2 2.72Å; R319-E377 PolarHBondContact NE-OE2 2.86Å; R319-E377 IonicContact NH2-OE1 3.37Å; R319-E377 PolarHBondContact NH2-OE1 2.95Å; R319-E377 IonicContact NH2-OE2 3.96Å; R319-E377 PolarHBondContact NH2-OE2 3.39Å; V373-E377 WeakPolarHBondContact CA-OE1 3.38Å; E374-E377 HydrophobicContact CB-CG 4.24Å; E374-E377 PolarHBondContact N-OE1 2.99Å; E374-E377 WeakPolarHBondContact O-CG 3.35Å; E377-V379 HydrophobicContact CG-CG2 4.47Å
378	T	98.2	Very high	96.7	Very high	44 Å²	44	39.7 Å²	39.7	27%	0.27	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.7	172.4	-59.2	0	0	0	0	109.9	T281 A284 K286 I287 H288 S411	T281-T378 HydrophobicContact CG2-CG2 4.02Å; A284-T378 HydrophobicContact CB-CG2 4.28Å; A284-T378 WeakPolarHBondContact CB-OG1 3.46Å; K286-T378 PolarHBondContact O-N 3.38Å; I287-T378 WeakPolarHBondContact CA-O 3.09Å; H288-T378 PolarHBondContact N-O 2.87Å; T378-S411 WeakPolarHBondContact CG2-OG 3.49Å
379	V	98.7	Very high	96.6	Very high	6 Å²	6	35.4 Å²	35.4	4%	0.036	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	135.4	-179.1	-178.5	0	0	0	0	110.8	H288 V290 V373 E377 V381 L408 P410 S411	H288-V379 HydrophobicContact CB-CG2 4.47Å; H288-V379 CarbonylContact O-C 3.32Å; H288-V379 VanDerWaalsContact O-CA 3.28Å; H288-V379 WeakPolarHBondContact O-CA 3.32Å; V290-V379 HydrophobicContact CG2-CG1 4.24Å; V373-V379 HydrophobicContact CB-CG2 4.49Å; V373-V379 HydrophobicContact CG1-CG2 3.58Å; V373-V379 HydrophobicContact CG2-CG2 4.08Å; E377-V379 HydrophobicContact CG-CG2 4.47Å; V379-V381 HydrophobicContact CG1-CG2 4.03Å; V379-L408 HydrophobicContact CG1-CB 4.49Å; V379-P410 HydrophobicContact CG1-CB 4.32Å; V379-S411 PolarHBondContact O-N 3Å; V379-S411 PolarHBondContact O-OG 3.32Å
380	A	98.8	Very high	96.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.3	166.1	0	0	0	0	0	109	I277 T281 H288 I289 V290 V412	I277-A380 HydrophobicContact CG1-CB 4.17Å; I277-A380 HydrophobicContact CG2-CB 3.91Å; T281-A380 HydrophobicContact CG2-CB 4.41Å; H288-A380 PolarHBondContact O-N 3.45Å; I289-A380 CarbonylContact C-O 3.58Å; I289-A380 WeakPolarHBondContact CA-O 3.4Å; I289-A380 HydrophobicContact CD1-CB 3.62Å; V290-A380 PolarHBondContact N-O 3.22Å; A380-V412 WeakPolarHBondContact CA-O 3.18Å; A380-V412 HydrophobicContact CB-CG1 3.94Å
381	V	98.8	Very high	96.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.8	-179.7	-176	0	0	0	0	110.4	V290 F292 V379 F383 V405 P410 V412 V413 T414	V290-V381 HydrophobicContact CB-CG1 4.39Å; V290-V381 HydrophobicContact CB-CG2 4.06Å; V290-V381 HydrophobicContact CG2-CG2 4.42Å; V290-V381 WeakPolarHBondContact O-CA 3.49Å; F292-V381 HydrophobicContact CD2-CG1 3.71Å; F292-V381 HydrophobicContact CE2-CG1 3.62Å; V379-V381 HydrophobicContact CG1-CG2 4.03Å; V381-F383 HydrophobicContact CG1-CD2 4.26Å; V381-F383 HydrophobicContact CG1-CE2 3.76Å; V381-F383 HydrophobicContact CG1-CZ 4.27Å; V381-V405 HydrophobicContact CB-CG1 3.94Å; V381-V405 HydrophobicContact CG1-CG1 3.83Å; V381-V405 HydrophobicContact CG1-CG2 3.92Å; V381-V405 HydrophobicContact CG2-CG1 3.87Å; V381-P410 HydrophobicContact CG2-CB 3.95Å; V381-P410 HydrophobicContact CG2-CG 4.5Å; V381-V412 PolarHBondContact N-O 2.73Å; V381-V413 HydrophobicContact CB-CG1 4.32Å; V381-V413 HydrophobicContact CB-CG2 4.22Å; V381-V413 HydrophobicContact CG1-CG1 4.48Å; V381-V413 CarbonylContact O-C 3.31Å; V381-V413 VanDerWaalsContact O-CA 3.3Å; V381-V413 WeakPolarHBondContact O-CA 3.19Å; V381-T414 PolarHBondContact O-N 3.03Å; V381-T414 PolarHBondContact O-OG1 3.48Å
382	N	98.7	Very high	96.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.1	-174.3	-179.6	82.5	0	0	0	110.7	V290 D291 F292 Q299 W300 M384 T414	V290-N382 PolarHBondContact O-N 2.61Å; D291-N382 PolarHBondContact OD1-ND2 2.93Å; F292-N382 PolarHBondContact N-O 3.11Å; Q299-N382 PolarHBondContact NE2-OD1 3.21Å; Q299-N382 PolarHBondContact OE1-ND2 2.88Å; W300-N382 HydrophobicContact CH2-CB 3.68Å; W300-N382 HydrophobicContact CZ2-CB 4.08Å; N382-M384 WeakPolarHBondContact ND2-CG 3.49Å; N382-M384 VanDerWaalsContact OD1-CG 3.26Å; N382-M384 WeakPolarHBondContact OD1-CG 3.4Å; N382-T414 WeakPolarHBondContact CA-OG1 3.15Å; N382-T414 PolarHBondContact OD1-OG1 2.84Å; N382-T414 VanDerWaalsContact OD1-OG1 3.11Å
383	F	98.3	Very high	96.4	Very high	1 Å²	1	31.7 Å²	31.7	0%	0.004	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	99.9	172.5	-70.6	-76.9	0	0	0	109	F292 V381 L387 V401 V405 V413 T414 L415 G416	F292-F383 HydrophobicContact CB-CD1 3.38Å; F292-F383 HydrophobicContact CB-CE1 3.31Å; F292-F383 HydrophobicContact CB-CG 4.34Å; F292-F383 HydrophobicContact CB-CZ 4.24Å; F292-F383 AromaticContact CD1-CE1 3.66Å; F292-F383 HydrophobicContact CD1-CE1 3.66Å; F292-F383 HydrophobicContact CD1-CZ 4.19Å; F292-F383 HydrophobicContact CD2-CD1 4.18Å; F292-F383 AromaticContact CD2-CE1 3.51Å; F292-F383 HydrophobicContact CD2-CE1 3.51Å; F292-F383 HydrophobicContact CD2-CE2 4.24Å; F292-F383 AromaticContact CD2-CZ 3.55Å; F292-F383 HydrophobicContact CD2-CZ 3.55Å; F292-F383 HydrophobicContact CE1-CE1 4.32Å; F292-F383 HydrophobicContact CE1-CZ 4.45Å; F292-F383 HydrophobicContact CE2-CE1 4.19Å; F292-F383 AromaticContact CE2-CZ 3.84Å; F292-F383 HydrophobicContact CE2-CZ 3.84Å; F292-F383 AromaticContact CG-CD1 3.84Å; F292-F383 HydrophobicContact CG-CD1 3.84Å; F292-F383 AromaticContact CG-CE1 3.2Å; F292-F383 HydrophobicContact CG-CE1 3.2Å; F292-F383 AromaticContact CG-CZ 3.75Å; F292-F383 HydrophobicContact CG-CZ 3.75Å; F292-F383 HydrophobicContact CZ-CZ 4.3Å; V381-F383 HydrophobicContact CG1-CD2 4.26Å; V381-F383 HydrophobicContact CG1-CE2 3.76Å; V381-F383 HydrophobicContact CG1-CZ 4.27Å; F383-L387 HydrophobicContact CD1-CB 4.28Å; F383-L387 HydrophobicContact CD1-CD1 3.9Å; F383-L387 HydrophobicContact CE1-CD1 3.74Å; F383-L387 HydrophobicContact CZ-CD1 4.25Å; F383-V401 HydrophobicContact CE1-CG1 3.98Å; F383-V401 HydrophobicContact CZ-CG1 3.83Å; F383-V405 HydrophobicContact CE2-CG1 4.44Å; F383-V405 HydrophobicContact CE2-CG2 3.93Å; F383-V405 HydrophobicContact CZ-CG2 3.69Å; F383-V413 HydrophobicContact CD2-CG1 3.86Å; F383-V413 HydrophobicContact CE2-CG1 4.02Å; F383-T414 PolarHBondContact N-O 3.29Å; F383-L415 HydrophobicContact CB-CD1 3.83Å; F383-L415 WeakPolarHBondContact O-CA 3.39Å; F383-G416 PolarHBondContact O-N 3.45Å
384	M	96.9	Very high	96.3	Very high	19 Å²	19	32.8 Å²	32.8	9%	0.094	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	104.1	-178.6	-60.7	-59.1	-86.9	0	0	110	A269 A273 N382 Q386	A269-M384 HydrophobicContact CB-CE 3.21Å; A269-M384 WeakPolarHBondContact O-CE 3.45Å; A273-M384 HydrophobicContact CB-CE 3.81Å; A273-M384 HydrophobicContact CB-SD 4Å; N382-M384 WeakPolarHBondContact ND2-CG 3.49Å; N382-M384 VanDerWaalsContact OD1-CG 3.26Å; N382-M384 WeakPolarHBondContact OD1-CG 3.4Å; M384-Q386 VanDerWaalsContact C-N 3.27Å; M384-Q386 PolarHBondContact O-N 3.21Å
385	L	94.5	Very high	96.2	Very high	21 Å²	21	30.3 Å²	30.3	11%	0.11	18%	0.178	C	C	.	.	S	Bend	trans	52.6	45.7	-177.3	-52.9	176.7	0	0	0	111.9	Y388 G416 Y418 L545	L385-Y388 HydrophobicContact CB-CE1 4.5Å; L385-Y388 VanDerWaalsContact O-CE1 3.28Å; L385-Y388 WeakPolarHBondContact O-CE1 3.46Å; L385-G416 PolarHBondContact N-O 3.05Å; L385-Y418 HydrophobicContact CB-CE2 4.44Å; L385-Y418 HydrophobicContact CD1-CE1 4.02Å; L385-Y418 HydrophobicContact CD2-CD1 3.9Å; L385-Y418 HydrophobicContact CD2-CD2 4.17Å; L385-Y418 HydrophobicContact CD2-CE1 3.74Å; L385-Y418 HydrophobicContact CD2-CE2 4Å; L385-Y418 HydrophobicContact CD2-CG 4.14Å; L385-Y418 HydrophobicContact CG-CE1 4.46Å; L385-L545 HydrophobicContact CD1-CD1 4.17Å; L385-L545 HydrophobicContact CD2-CD1 4.11Å; L385-L545 HydrophobicContact CD2-CG 4.29Å
386	Q	93.9	Very high	96.2	Very high	26 Å²	26	27.3 Å²	27.3	12%	0.121	15%	0.151	C	C	.	.			trans	-127.1	-38.6	-174.2	180	61.3	44.1	0	0	113.1	F292 M384 Y388 H389	F292-Q386 HydrophobicContact CB-CG 4.21Å; F292-Q386 VanDerWaalsContact O-CB 3.27Å; F292-Q386 WeakPolarHBondContact O-CB 3.44Å; F292-Q386 VanDerWaalsContact O-CG 3.29Å; F292-Q386 WeakPolarHBondContact O-CG 3.42Å; M384-Q386 VanDerWaalsContact C-N 3.27Å; M384-Q386 PolarHBondContact O-N 3.21Å; Q386-Y388 VanDerWaalsContact C-N 3.32Å; Q386-Y388 PolarHBondContact O-N 2.92Å; Q386-H389 WeakPolarHBondContact O-CB 3.42Å; Q386-H389 PolarHBondContact O-CD2 3.33Å; Q386-H389 PolarHBondContact O-N 2.94Å
387	L	96.1	Very high	96.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-74.2	-28.9	-165.7	-161.6	63.4	0	0	0	111.5	F383 H389 L390 V398 V401 L402 L415 E417 W490	F383-L387 HydrophobicContact CD1-CB 4.28Å; F383-L387 HydrophobicContact CD1-CD1 3.9Å; F383-L387 HydrophobicContact CE1-CD1 3.74Å; F383-L387 HydrophobicContact CZ-CD1 4.25Å; L387-H389 PolarHBondContact O-N 3.48Å; L387-L390 HydrophobicContact CD1-CD1 4.04Å; L387-L390 WeakPolarHBondContact O-CB 3.47Å; L387-L390 PolarHBondContact O-N 3.29Å; L387-V398 HydrophobicContact CD1-CG2 3.97Å; L387-V398 HydrophobicContact CD2-CG2 4.05Å; L387-V398 HydrophobicContact CG-CG2 3.78Å; L387-V401 HydrophobicContact CD1-CG1 4.41Å; L387-L402 HydrophobicContact CD2-CD2 3.89Å; L387-L402 HydrophobicContact CD2-CG 4.38Å; L387-L415 HydrophobicContact CB-CD1 4.17Å; L387-L415 HydrophobicContact CD2-CD1 3.9Å; L387-E417 WeakPolarHBondContact CA-OE1 3.28Å; L387-E417 WeakPolarHBondContact CB-OE1 3.49Å; L387-E417 PolarHBondContact N-OE1 3.22Å; L387-W490 HydrophobicContact CB-CH2 3.82Å; L387-W490 HydrophobicContact CB-CZ3 4.1Å; L387-W490 HydrophobicContact CD2-CE3 4.11Å; L387-W490 HydrophobicContact CD2-CH2 4.07Å; L387-W490 HydrophobicContact CD2-CZ3 3.45Å; L387-W490 VanDerWaalsContact CD2-CZ3 3.45Å; L387-W490 HydrophobicContact CG-CH2 3.83Å; L387-W490 HydrophobicContact CG-CZ3 3.69Å
388	Y	96.5	Very high	96.1	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-56	-29.1	174.8	82.7	-94.8	0	0	0	113.9	Y327 L385 Q386 L390 L391 E417 Y418 D482 R483 M484	Y327-Y388 PolarHBondContact OH-OH 3.32Å; Y327-Y388 VanDerWaalsContact OH-OH 3.05Å; L385-Y388 HydrophobicContact CB-CE1 4.5Å; L385-Y388 VanDerWaalsContact O-CE1 3.28Å; L385-Y388 WeakPolarHBondContact O-CE1 3.46Å; Q386-Y388 VanDerWaalsContact C-N 3.32Å; Q386-Y388 PolarHBondContact O-N 2.92Å; Y388-L390 PolarHBondContact O-N 3.05Å; Y388-L390 VanDerWaalsContact O-N 3.16Å; Y388-L391 WeakPolarHBondContact O-CB 3.49Å; Y388-L391 PolarHBondContact O-N 3.42Å; Y388-L391 VanDerWaalsContact O-N 3.09Å; Y388-E417 WeakPolarHBondContact CB-OE2 3.26Å; Y388-E417 PolarHBondContact N-OE1 3.25Å; Y388-Y418 HydrophobicContact CD1-CD2 4.17Å; Y388-Y418 HydrophobicContact CD1-CE2 4.1Å; Y388-Y418 HydrophobicContact CE1-CD2 4.08Å; Y388-Y418 AromaticContact CE1-CE2 3.55Å; Y388-Y418 HydrophobicContact CE1-CE2 3.55Å; Y388-Y418 AromaticContact CZ-CE2 3.86Å; Y388-D482 HydrophobicContact CE2-CB 4.14Å; Y388-R483 VanDerWaalsContact CB-O 3.29Å; Y388-R483 WeakPolarHBondContact CB-O 3.26Å; Y388-R483 WeakPolarHBondContact CD2-O 3.42Å; Y388-R483 VanDerWaalsContact O-O 3.1Å; Y388-M484 HydrophobicContact CD2-CG 4.26Å; Y388-M484 HydrophobicContact CE2-CE 4.35Å
389	H	93.3	Very high	96.1	Very high	44 Å²	44	24.7 Å²	24.7	20%	0.204	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-63.3	-20.4	175.9	-70	-66.9	0	0	0	113.2	Q386 L387 D482	Q386-H389 WeakPolarHBondContact O-CB 3.42Å; Q386-H389 PolarHBondContact O-CD2 3.33Å; Q386-H389 PolarHBondContact O-N 2.94Å; L387-H389 PolarHBondContact O-N 3.48Å; H389-D482 IonicContact CE1-OD1 3.46Å; H389-D482 PolarHBondContact CE1-OD1 3.37Å; H389-D482 IonicContact ND1-OD1 3.64Å; H389-D482 PolarHBondContact ND1-OD1 3.14Å
390	L	94.9	Very high	96	Very high	21 Å²	21	28.2 Å²	28.2	11%	0.11	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-93	-5.2	178.8	-53.1	-173.3	0	0	0	113.2	V363 L387 Y388 P397 V398 V401	V363-L390 HydrophobicContact CG1-CD1 4.4Å; V363-L390 HydrophobicContact CG1-CD2 3.96Å; L387-L390 HydrophobicContact CD1-CD1 4.04Å; L387-L390 WeakPolarHBondContact O-CB 3.47Å; L387-L390 PolarHBondContact O-N 3.29Å; Y388-L390 PolarHBondContact O-N 3.05Å; Y388-L390 VanDerWaalsContact O-N 3.16Å; L390-P397 HydrophobicContact CB-CB 4.45Å; L390-V398 HydrophobicContact CB-CB 4.03Å; L390-V401 HydrophobicContact CD1-CB 3.98Å; L390-V401 HydrophobicContact CD1-CG1 4.32Å; L390-V401 HydrophobicContact CD1-CG2 3.56Å
391	L	96.9	Very high	96	Very high	6 Å²	6	28.2 Å²	28.2	3%	0.031	15%	0.148	C	C	.	.			trans	-71.4	132.7	173	-66.7	176.4	0	0	0	109.5	Y388 V398 R483 A485 W490 L493	Y388-L391 WeakPolarHBondContact O-CB 3.49Å; Y388-L391 PolarHBondContact O-N 3.42Å; Y388-L391 VanDerWaalsContact O-N 3.09Å; L391-V398 HydrophobicContact CD2-CG1 4.1Å; L391-R483 HydrophobicContact CB-CB 3.73Å; L391-R483 HydrophobicContact CD1-CB 4.46Å; L391-R483 WeakPolarHBondContact O-CD 3.46Å; L391-A485 HydrophobicContact CD1-CB 3.78Å; L391-W490 HydrophobicContact CD1-CH2 3.83Å; L391-W490 HydrophobicContact CD1-CZ2 3.7Å; L391-W490 HydrophobicContact CD2-CH2 4.09Å; L391-W490 HydrophobicContact CD2-CZ3 4.41Å; L391-W490 HydrophobicContact CG-CH2 3.91Å; L391-W490 HydrophobicContact CG-CZ2 4.3Å; L391-L493 HydrophobicContact CD2-CD1 3.97Å
392	G	94.3	Very high	95.9	Very high	19 Å²	19	28.2 Å²	28.2	20%	0.196	15%	0.148	C	C	.	.	S	Bend	trans	-143.6	-163.7	179.1	0	0	0	0	0	111.2	S394	G392-S394 PolarHBondContact O-N 2.79Å
393	D	92.2	Very high	95.9	Very high	107 Å²	107	33.7 Å²	33.7	57%	0.572	17%	0.169	S	C	*	.	S	Bend	trans	-64	-34.5	170.5	-158.5	56	0	0	0	111.4
394	S	94.4	Very high	95.9	Very high	64 Å²	64	34.4 Å²	34.4	45%	0.448	17%	0.173	S	C	.	.	S	Bend	trans	-104.3	139.9	168.9	178.2	0	0	0	0	111	G392 E396 P397	G392-S394 PolarHBondContact O-N 2.79Å; S394-E396 PolarHBondContact O-N 2.81Å; S394-E396 WeakPolarHBondContact OG-CB 3.18Å; S394-E396 PolarHBondContact OG-N 2.71Å; S394-P397 WeakPolarHBondContact O-CD 3.44Å
395	D	95.6	Very high	95.9	Very high	16 Å²	16	33.5 Å²	33.5	9%	0.086	17%	0.168	C	C	.	.	S	Bend	trans	-81.5	2.5	172.7	-65.4	-17.1	0	0	0	112.9	V398 R399 R424 L493	D395-V398 HydrophobicContact CB-CG1 3.93Å; D395-V398 WeakPolarHBondContact O-CG1 3.35Å; D395-V398 PolarHBondContact O-N 3.14Å; D395-R399 HydrophobicContact CB-CG 4.24Å; D395-R399 WeakPolarHBondContact O-CB 3.39Å; D395-R399 WeakPolarHBondContact O-CG 3.21Å; D395-R399 PolarHBondContact O-N 3.36Å; D395-R399 IonicContact OD2-NH1 3.8Å; D395-R424 IonicContact OD1-CZ 2.96Å; D395-R424 IonicContact OD1-NH2 2.75Å; D395-R424 PolarHBondContact OD1-NH2 3.26Å; D395-R424 IonicContact OD2-CZ 3.02Å; D395-R424 IonicContact OD2-NH2 3.56Å; D395-R424 PolarHBondContact OD2-NH2 3.35Å; D395-L493 HydrophobicContact CB-CD2 4.17Å
396	E	95.6	Very high	96.1	Very high	77 Å²	77	35.6 Å²	35.6	36%	0.36	18%	0.176	S	C	.	.	H	α-helix	trans	-59.9	-40.4	-175.8	-168.6	53.9	-151.7	0	0	114.4	S394 V398 R399 R400 R403	S394-E396 PolarHBondContact O-N 2.81Å; S394-E396 WeakPolarHBondContact OG-CB 3.18Å; S394-E396 PolarHBondContact OG-N 2.71Å; E396-V398 PolarHBondContact O-N 3.27Å; E396-R399 PolarHBondContact O-N 2.79Å; E396-R399 IonicContact OE2-CZ 3.54Å; E396-R399 IonicContact OE2-NE 3.72Å; E396-R399 PolarHBondContact OE2-NE 3.07Å; E396-R399 IonicContact OE2-NH2 3.98Å; E396-R399 PolarHBondContact OE2-NH2 2.72Å; E396-R400 WeakPolarHBondContact O-CB 3.42Å; E396-R400 PolarHBondContact O-N 3.29Å; E396-R403 IonicContact OE1-CZ 3.97Å; E396-R403 IonicContact OE1-NH1 2.63Å; E396-R403 PolarHBondContact OE1-NH1 3.14Å; E396-R403 IonicContact OE2-NH1 3.47Å; E396-R403 IonicContact OE2-NH2 2.87Å
397	P	95.4	Very high	96.2	Very high	47 Å²	47	36.4 Å²	36.4	31%	0.305	19%	0.185	S	C	.	.	H	α-helix	trans	-60	-47.2	176.7	-23.8	34.9	0	0	0	113	L390 S394 R400 V401	L390-P397 HydrophobicContact CB-CB 4.45Å; S394-P397 WeakPolarHBondContact O-CD 3.44Å; P397-R400 PolarHBondContact O-N 2.56Å; P397-V401 PolarHBondContact O-N 3.46Å
398	V	97.2	Very high	96.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.5	-43.5	177.4	60.9	0	0	0	0	111.6	L387 L390 L391 D395 E396 R400 V401 L402 W490 L493	L387-V398 HydrophobicContact CD1-CG2 3.97Å; L387-V398 HydrophobicContact CD2-CG2 4.05Å; L387-V398 HydrophobicContact CG-CG2 3.78Å; L390-V398 HydrophobicContact CB-CB 4.03Å; L391-V398 HydrophobicContact CD2-CG1 4.1Å; D395-V398 HydrophobicContact CB-CG1 3.93Å; D395-V398 WeakPolarHBondContact O-CG1 3.35Å; D395-V398 PolarHBondContact O-N 3.14Å; E396-V398 PolarHBondContact O-N 3.27Å; V398-R400 PolarHBondContact O-N 3.07Å; V398-V401 PolarHBondContact O-N 3.44Å; V398-L402 HydrophobicContact CG2-CD1 4.1Å; V398-L402 HydrophobicContact CG2-CG 4.34Å; V398-L402 WeakPolarHBondContact O-CG 3.49Å; V398-L402 PolarHBondContact O-N 2.74Å; V398-W490 HydrophobicContact CG2-CZ3 4.13Å; V398-L493 HydrophobicContact CG1-CD2 4.4Å
399	R	97.3	Very high	96.4	Very high	42 Å²	42	42.7 Å²	42.7	16%	0.158	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-37.2	178.2	-72.7	-170.9	-57.2	-119.4	-4.2	112.5	D395 E396 V401 L402 R403 L493	D395-R399 HydrophobicContact CB-CG 4.24Å; D395-R399 WeakPolarHBondContact O-CB 3.39Å; D395-R399 WeakPolarHBondContact O-CG 3.21Å; D395-R399 PolarHBondContact O-N 3.36Å; D395-R399 IonicContact OD2-NH1 3.8Å; E396-R399 PolarHBondContact O-N 2.79Å; E396-R399 IonicContact OE2-CZ 3.54Å; E396-R399 IonicContact OE2-NE 3.72Å; E396-R399 PolarHBondContact OE2-NE 3.07Å; E396-R399 IonicContact OE2-NH2 3.98Å; E396-R399 PolarHBondContact OE2-NH2 2.72Å; R399-V401 VanDerWaalsContact C-N 3.33Å; R399-V401 PolarHBondContact O-N 2.84Å; R399-L402 PolarHBondContact O-N 3.07Å; R399-R403 WeakPolarHBondContact O-CB 3.08Å; R399-R403 VanDerWaalsContact O-CG 3.24Å; R399-R403 WeakPolarHBondContact O-CG 3.3Å; R399-R403 PolarHBondContact O-N 3.23Å; R399-L493 HydrophobicContact CG-CD2 4.46Å
400	R	96.9	Very high	96.6	Very high	81 Å²	81	40.8 Å²	40.8	31%	0.306	21%	0.21	S	C	.	.	H	α-helix	trans	-58.1	-48.2	174.6	-177.2	-169.1	177.7	-72.7	-3.8	110.4	V363 H364 L366 E396 P397 V398 R403 L404	V363-R400 PolarHBondContact O-NH1 3Å; V363-R400 VanDerWaalsContact O-NH1 3.17Å; H364-R400 PolarHBondContact O-NE 2.66Å; H364-R400 PolarHBondContact O-NH1 2.83Å; H364-R400 PolarHBondContact O-NH2 2.86Å; L366-R400 PolarHBondContact O-NH1 2.75Å; L366-R400 VanDerWaalsContact O-NH1 3.12Å; L366-R400 PolarHBondContact O-NH2 3.42Å; E396-R400 WeakPolarHBondContact O-CB 3.42Å; E396-R400 PolarHBondContact O-N 3.29Å; P397-R400 PolarHBondContact O-N 2.56Å; V398-R400 PolarHBondContact O-N 3.07Å; R400-R403 PolarHBondContact O-N 2.76Å; R400-L404 WeakPolarHBondContact O-CB 3.3Å; R400-L404 PolarHBondContact O-N 3.33Å
401	V	97.5	Very high	96.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-43.7	179.5	173.9	0	0	0	0	111.5	F292 V363 F383 L387 L390 P397 V398 R399 R403 L404 V405	F292-V401 HydrophobicContact CD1-CG1 4.39Å; F292-V401 HydrophobicContact CE1-CG1 4Å; F292-V401 HydrophobicContact CZ-CG1 4.45Å; V363-V401 HydrophobicContact CG1-CG2 4.38Å; V363-V401 HydrophobicContact CG2-CG1 4.34Å; V363-V401 HydrophobicContact CG2-CG2 3.67Å; F383-V401 HydrophobicContact CE1-CG1 3.98Å; F383-V401 HydrophobicContact CZ-CG1 3.83Å; L387-V401 HydrophobicContact CD1-CG1 4.41Å; L390-V401 HydrophobicContact CD1-CB 3.98Å; L390-V401 HydrophobicContact CD1-CG1 4.32Å; L390-V401 HydrophobicContact CD1-CG2 3.56Å; P397-V401 PolarHBondContact O-N 3.46Å; V398-V401 PolarHBondContact O-N 3.44Å; R399-V401 VanDerWaalsContact C-N 3.33Å; R399-V401 PolarHBondContact O-N 2.84Å; V401-R403 PolarHBondContact O-N 2.89Å; V401-L404 WeakPolarHBondContact O-CB 3.45Å; V401-L404 PolarHBondContact O-N 2.79Å; V401-V405 WeakPolarHBondContact O-CG2 3.37Å; V401-V405 PolarHBondContact O-N 2.77Å
402	L	98.3	Very high	96.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-40.4	176.5	-71	178.8	0	0	0	112.7	L387 V398 R399 V405 K406 L493 M494 C497 F499	L387-L402 HydrophobicContact CD2-CD2 3.89Å; L387-L402 HydrophobicContact CD2-CG 4.38Å; V398-L402 HydrophobicContact CG2-CD1 4.1Å; V398-L402 HydrophobicContact CG2-CG 4.34Å; V398-L402 WeakPolarHBondContact O-CG 3.49Å; V398-L402 PolarHBondContact O-N 2.74Å; R399-L402 PolarHBondContact O-N 3.07Å; L402-V405 PolarHBondContact O-N 3.43Å; L402-K406 WeakPolarHBondContact O-CB 3.38Å; L402-K406 PolarHBondContact O-N 3.19Å; L402-L493 HydrophobicContact CD1-CB 4.39Å; L402-M494 HydrophobicContact CD1-SD 3.98Å; L402-M494 HydrophobicContact CD2-CE 4.38Å; L402-M494 HydrophobicContact CD2-SD 3.51Å; L402-M494 VanDerWaalsContact CD2-SD 3.51Å; L402-M494 HydrophobicContact CG-SD 4.4Å; L402-C497 HydrophobicContact CB-CB 3.72Å; L402-C497 VanDerWaalsContact CB-SG 3.56Å; L402-C497 HydrophobicContact CD1-CB 4.26Å; L402-F499 HydrophobicContact CB-CE2 4.32Å; L402-F499 HydrophobicContact CD2-CE2 4.4Å
403	R	97.7	Very high	97.1	Very high	115 Å²	115	40.6 Å²	40.6	43%	0.434	21%	0.208	S	C	.	.	H	α-helix	trans	-65.9	-39.4	173.9	-70.4	179.3	-154.2	123.6	-3.3	112.1	E396 R399 R400 V401 K406 S407	E396-R403 IonicContact OE1-CZ 3.97Å; E396-R403 IonicContact OE1-NH1 2.63Å; E396-R403 PolarHBondContact OE1-NH1 3.14Å; E396-R403 IonicContact OE2-NH1 3.47Å; E396-R403 IonicContact OE2-NH2 2.87Å; R399-R403 WeakPolarHBondContact O-CB 3.08Å; R399-R403 VanDerWaalsContact O-CG 3.24Å; R399-R403 WeakPolarHBondContact O-CG 3.3Å; R399-R403 PolarHBondContact O-N 3.23Å; R400-R403 PolarHBondContact O-N 2.76Å; V401-R403 PolarHBondContact O-N 2.89Å; R403-K406 PolarHBondContact O-N 3.27Å; R403-S407 WeakPolarHBondContact O-CB 3.49Å; R403-S407 PolarHBondContact O-N 3.03Å
404	L	97.7	Very high	97.4	Very high	16 Å²	16	35.5 Å²	35.5	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-47.9	173.6	171.3	61.5	0	0	0	110.5	L366 D367 R368 F371 R400 V401 S407 L408	L366-L404 HydrophobicContact CB-CD2 4.11Å; D367-L404 VanDerWaalsContact C-CD1 3.48Å; R368-L404 HydrophobicContact CB-CD1 4.36Å; F371-L404 HydrophobicContact CE2-CD1 4.03Å; F371-L404 HydrophobicContact CE2-CD2 3.86Å; F371-L404 HydrophobicContact CE2-CG 4.03Å; F371-L404 HydrophobicContact CZ-CD2 4.15Å; R400-L404 WeakPolarHBondContact O-CB 3.3Å; R400-L404 PolarHBondContact O-N 3.33Å; V401-L404 WeakPolarHBondContact O-CB 3.45Å; V401-L404 PolarHBondContact O-N 2.79Å; L404-S407 WeakPolarHBondContact O-CA 3.27Å; L404-S407 WeakPolarHBondContact O-CB 3.33Å; L404-S407 PolarHBondContact O-N 3.19Å; L404-S407 VanDerWaalsContact O-N 3.11Å; L404-S407 PolarHBondContact O-OG 3.15Å; L404-L408 PolarHBondContact O-N 3.38Å
405	V	97.9	Very high	97.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-45	175.8	167.4	0	0	0	0	111.7	F292 V381 F383 V401 L402 S407 L408 P410 V413 F499	F292-V405 HydrophobicContact CE2-CG2 3.64Å; F292-V405 HydrophobicContact CZ-CG2 3.78Å; V381-V405 HydrophobicContact CB-CG1 3.94Å; V381-V405 HydrophobicContact CG1-CG1 3.83Å; V381-V405 HydrophobicContact CG1-CG2 3.92Å; V381-V405 HydrophobicContact CG2-CG1 3.87Å; F383-V405 HydrophobicContact CE2-CG1 4.44Å; F383-V405 HydrophobicContact CE2-CG2 3.93Å; F383-V405 HydrophobicContact CZ-CG2 3.69Å; V401-V405 WeakPolarHBondContact O-CG2 3.37Å; V401-V405 PolarHBondContact O-N 2.77Å; L402-V405 PolarHBondContact O-N 3.43Å; V405-S407 PolarHBondContact O-N 2.81Å; V405-L408 WeakPolarHBondContact O-CB 3.42Å; V405-L408 PolarHBondContact O-N 2.99Å; V405-P410 HydrophobicContact CG1-CG 4.26Å; V405-P410 WeakPolarHBondContact O-CD 3.39Å; V405-V413 HydrophobicContact CG1-CG1 4.43Å; V405-V413 HydrophobicContact CG1-CG2 3.73Å; V405-F499 HydrophobicContact CB-CZ 4.47Å; V405-F499 HydrophobicContact CG1-CZ 3.97Å
406	K	98.1	Very high	97.7	Very high	64 Å²	64	31.8 Å²	31.8	28%	0.278	16%	0.156	S	C	.	.	H	α-helix	trans	-59.4	-35.2	175.6	-168.7	70.6	-172.1	-173.8	0	111.1	L402 R403 L408 D409 G498 F499 R551	L402-K406 WeakPolarHBondContact O-CB 3.38Å; L402-K406 PolarHBondContact O-N 3.19Å; R403-K406 PolarHBondContact O-N 3.27Å; K406-L408 PolarHBondContact O-N 3.27Å; K406-D409 PolarHBondContact O-N 3.47Å; K406-D409 VanDerWaalsContact O-N 3.12Å; K406-G498 WeakPolarHBondContact CE-O 3.07Å; K406-G498 PolarHBondContact NZ-O 2.93Å; K406-F499 HydrophobicContact CB-CE1 4.24Å; K406-F499 HydrophobicContact CB-CE2 4Å; K406-F499 HydrophobicContact CB-CZ 3.6Å; K406-F499 HydrophobicContact CD-CD1 3.79Å; K406-F499 HydrophobicContact CD-CD2 4.47Å; K406-F499 HydrophobicContact CD-CE1 3.44Å; K406-F499 VanDerWaalsContact CD-CE1 3.44Å; K406-F499 HydrophobicContact CD-CE2 4.18Å; K406-F499 HydrophobicContact CD-CG 4.29Å; K406-F499 HydrophobicContact CD-CZ 3.66Å; K406-F499 HydrophobicContact CG-CE1 4.45Å; K406-F499 HydrophobicContact CG-CZ 4.22Å; K406-R551 VanDerWaalsContact NZ-C 3.31Å; K406-R551 PolarHBondContact NZ-O 3.24Å; K406-R551 PolarHBondContact NZ-OXT 2.81Å
407	S	97.3	Very high	97.8	Very high	43 Å²	43	28.3 Å²	28.3	30%	0.301	14%	0.14	S	C	.	.	H	α-helix	trans	-66.1	-18.1	175.1	88.6	0	0	0	0	113.5	R368 R403 L404 V405 D409	R368-S407 PolarHBondContact NE-O 2.92Å; R368-S407 PolarHBondContact NH1-O 3.24Å; R403-S407 WeakPolarHBondContact O-CB 3.49Å; R403-S407 PolarHBondContact O-N 3.03Å; L404-S407 WeakPolarHBondContact O-CA 3.27Å; L404-S407 WeakPolarHBondContact O-CB 3.33Å; L404-S407 PolarHBondContact O-N 3.19Å; L404-S407 VanDerWaalsContact O-N 3.11Å; L404-S407 PolarHBondContact O-OG 3.15Å; V405-S407 PolarHBondContact O-N 2.81Å; S407-D409 PolarHBondContact O-N 3.28Å
408	L	97.7	Very high	98	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-5.3	174.4	-53.6	-176.1	0	0	0	113	V290 R368 F371 V373 V379 L404 V405 K406	V290-L408 HydrophobicContact CG2-CD1 4.23Å; R368-L408 HydrophobicContact CB-CD2 4.44Å; R368-L408 HydrophobicContact CG-CD2 3.94Å; F371-L408 HydrophobicContact CB-CD1 4.36Å; F371-L408 HydrophobicContact CB-CD2 4.17Å; F371-L408 HydrophobicContact CD1-CD1 4Å; F371-L408 HydrophobicContact CD2-CD1 4.11Å; F371-L408 HydrophobicContact CD2-CD2 3.85Å; F371-L408 HydrophobicContact CE1-CD1 4.35Å; F371-L408 HydrophobicContact CE2-CD1 4.46Å; F371-L408 HydrophobicContact CG-CD1 3.87Å; F371-L408 HydrophobicContact CG-CD2 4.09Å; V373-L408 HydrophobicContact CG2-CD2 4.14Å; V379-L408 HydrophobicContact CG1-CB 4.49Å; L404-L408 PolarHBondContact O-N 3.38Å; V405-L408 WeakPolarHBondContact O-CB 3.42Å; V405-L408 PolarHBondContact O-N 2.99Å; K406-L408 PolarHBondContact O-N 3.27Å
409	D	97.4	Very high	98	Very high	132 Å²	132	27.8 Å²	27.8	71%	0.706	13%	0.133	S	C	*	.			trans	51.7	55.6	-175.5	-161.7	34	0	0	0	113.4	K406 S407	K406-D409 PolarHBondContact O-N 3.47Å; K406-D409 VanDerWaalsContact O-N 3.12Å; S407-D409 PolarHBondContact O-N 3.28Å
410	P	98.3	Very high	98.1	Very high	5 Å²	5	26 Å²	26	3%	0.032	13%	0.126	C	C	.	.			trans	-72.7	140.6	-174.7	31.9	-36.1	0	0	0	112.1	V379 V381 V405 V412 V413 F499	V379-P410 HydrophobicContact CG1-CB 4.32Å; V381-P410 HydrophobicContact CG2-CB 3.95Å; V381-P410 HydrophobicContact CG2-CG 4.5Å; V405-P410 HydrophobicContact CG1-CG 4.26Å; V405-P410 WeakPolarHBondContact O-CD 3.39Å; P410-V412 VanDerWaalsContact C-N 3.25Å; P410-V412 PolarHBondContact O-N 3.11Å; P410-V413 HydrophobicContact CB-CG2 4.08Å; P410-V413 HydrophobicContact CG-CG2 3.52Å; P410-F499 HydrophobicContact CG-CE1 4.3Å
411	S	98.1	Very high	98.1	Very high	39 Å²	39	24.1 Å²	24.1	27%	0.273	13%	0.126	S	C	.	.	S	Bend	trans	-64.2	-32.2	170.9	61.6	0	0	0	0	112.8	T378 V379	T378-S411 WeakPolarHBondContact CG2-OG 3.49Å; V379-S411 PolarHBondContact O-N 3Å; V379-S411 PolarHBondContact O-OG 3.32Å
412	V	98.7	Very high	98.1	Very high	3 Å²	3	24.3 Å²	24.3	2%	0.018	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	143.8	173.1	66.7	0	0	0	0	110.8	I277 A280 A380 V381 P410 T414 A549 W550	I277-V412 HydrophobicContact CG1-CG1 4.12Å; A280-V412 HydrophobicContact CB-CB 3.61Å; A280-V412 HydrophobicContact CB-CG1 3.46Å; A280-V412 VanDerWaalsContact CB-CG1 3.46Å; A280-V412 HydrophobicContact CB-CG2 4.46Å; A380-V412 WeakPolarHBondContact CA-O 3.18Å; A380-V412 HydrophobicContact CB-CG1 3.94Å; V381-V412 PolarHBondContact N-O 2.73Å; P410-V412 VanDerWaalsContact C-N 3.25Å; P410-V412 PolarHBondContact O-N 3.11Å; V412-T414 HydrophobicContact CG2-CG2 4.34Å; V412-A549 HydrophobicContact CG2-CB 3.9Å; V412-W550 CarbonylContact C-O 3.5Å; V412-W550 VanDerWaalsContact CA-O 3.29Å; V412-W550 WeakPolarHBondContact CA-O 3.43Å
413	V	98.8	Very high	98.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.1	165	-175.1	0	0	0	0	108	V381 F383 V405 P410 M494 F499 A549 W550	V381-V413 HydrophobicContact CB-CG1 4.32Å; V381-V413 HydrophobicContact CB-CG2 4.22Å; V381-V413 HydrophobicContact CG1-CG1 4.48Å; V381-V413 CarbonylContact O-C 3.31Å; V381-V413 VanDerWaalsContact O-CA 3.3Å; V381-V413 WeakPolarHBondContact O-CA 3.19Å; F383-V413 HydrophobicContact CD2-CG1 3.86Å; F383-V413 HydrophobicContact CE2-CG1 4.02Å; V405-V413 HydrophobicContact CG1-CG1 4.43Å; V405-V413 HydrophobicContact CG1-CG2 3.73Å; P410-V413 HydrophobicContact CB-CG2 4.08Å; P410-V413 HydrophobicContact CG-CG2 3.52Å; V413-M494 HydrophobicContact CB-CE 4.48Å; V413-M494 HydrophobicContact CG1-CE 4.19Å; V413-F499 HydrophobicContact CB-CE1 4.48Å; V413-F499 HydrophobicContact CG2-CD1 4.17Å; V413-F499 HydrophobicContact CG2-CE1 3.52Å; V413-F499 HydrophobicContact CG2-CZ 4.11Å; V413-A549 CarbonylContact O-C 3.28Å; V413-A549 WeakPolarHBondContact O-CA 3.47Å; V413-W550 HydrophobicContact CB-CB 4.23Å; V413-W550 PolarHBondContact N-O 3.18Å; V413-W550 PolarHBondContact O-N 3.36Å
414	T	98.8	Very high	97.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.7	175.2	49.7	0	0	0	0	109.9	A273 A276 I277 V381 N382 F383 V412 S548	A273-T414 HydrophobicContact CB-CG2 4.09Å; A276-T414 HydrophobicContact CB-CG2 3.95Å; I277-T414 HydrophobicContact CD1-CG2 4.35Å; I277-T414 HydrophobicContact CG1-CG2 3.96Å; V381-T414 PolarHBondContact O-N 3.03Å; V381-T414 PolarHBondContact O-OG1 3.48Å; N382-T414 WeakPolarHBondContact CA-OG1 3.15Å; N382-T414 PolarHBondContact OD1-OG1 2.84Å; N382-T414 VanDerWaalsContact OD1-OG1 3.11Å; F383-T414 PolarHBondContact N-O 3.29Å; V412-T414 HydrophobicContact CG2-CG2 4.34Å; T414-S548 WeakPolarHBondContact CA-O 3.17Å
415	L	98.7	Very high	97.8	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	112.5	-177.3	178.7	67.3	0	0	0	109.5	F383 L387 E417 W490 M494 V547 S548	F383-L415 HydrophobicContact CB-CD1 3.83Å; F383-L415 WeakPolarHBondContact O-CA 3.39Å; L387-L415 HydrophobicContact CB-CD1 4.17Å; L387-L415 HydrophobicContact CD2-CD1 3.9Å; L415-E417 HydrophobicContact CD1-CG 3.68Å; L415-E417 HydrophobicContact CG-CG 4.04Å; L415-W490 HydrophobicContact CD2-CB 4.06Å; L415-W490 HydrophobicContact CD2-CD2 4.25Å; L415-W490 HydrophobicContact CD2-CE3 4.25Å; L415-W490 HydrophobicContact CD2-CG 4.2Å; L415-M494 HydrophobicContact CD2-CG 4.25Å; L415-M494 HydrophobicContact CD2-SD 4.41Å; L415-V547 CarbonylContact O-C 3.56Å; L415-V547 VanDerWaalsContact O-CA 3.3Å; L415-V547 WeakPolarHBondContact O-CA 3.46Å; L415-S548 PolarHBondContact N-O 2.95Å; L415-S548 PolarHBondContact O-N 3.07Å; L415-S548 PolarHBondContact O-OG 3.39Å
416	G	98.4	Very high	97.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117	171.6	0	0	0	0	0	110.6	F383 L385 T546	F383-G416 PolarHBondContact O-N 3.45Å; L385-G416 PolarHBondContact N-O 3.05Å; G416-T546 CarbonylContact C-O 3.55Å; G416-T546 VanDerWaalsContact CA-O 3.32Å; G416-T546 WeakPolarHBondContact CA-O 3.48Å
417	E	98.5	Very high	97.5	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.019	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.6	-173.6	-80.5	-66.3	170.7	0	0	112.9	L387 Y388 L415 W490 T546	L387-E417 WeakPolarHBondContact CA-OE1 3.28Å; L387-E417 WeakPolarHBondContact CB-OE1 3.49Å; L387-E417 PolarHBondContact N-OE1 3.22Å; Y388-E417 WeakPolarHBondContact CB-OE2 3.26Å; Y388-E417 PolarHBondContact N-OE1 3.25Å; L415-E417 HydrophobicContact CD1-CG 3.68Å; L415-E417 HydrophobicContact CG-CG 4.04Å; E417-W490 HydrophobicContact CG-CD2 4.28Å; E417-W490 HydrophobicContact CG-CZ2 3.8Å; E417-T546 PolarHBondContact N-O 3.33Å; E417-T546 PolarHBondContact O-N 3.41Å
418	Y	98.3	Very high	97.5	Very high	14 Å²	14	25 Å²	25	6%	0.055	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129	175	-59.1	-65.1	0	0	0	110.7	L385 Y388 V420 Y437 R467 M484 A485	L385-Y418 HydrophobicContact CB-CE2 4.44Å; L385-Y418 HydrophobicContact CD1-CE1 4.02Å; L385-Y418 HydrophobicContact CD2-CD1 3.9Å; L385-Y418 HydrophobicContact CD2-CD2 4.17Å; L385-Y418 HydrophobicContact CD2-CE1 3.74Å; L385-Y418 HydrophobicContact CD2-CE2 4Å; L385-Y418 HydrophobicContact CD2-CG 4.14Å; L385-Y418 HydrophobicContact CG-CE1 4.46Å; Y388-Y418 HydrophobicContact CD1-CD2 4.17Å; Y388-Y418 HydrophobicContact CD1-CE2 4.1Å; Y388-Y418 HydrophobicContact CE1-CD2 4.08Å; Y388-Y418 AromaticContact CE1-CE2 3.55Å; Y388-Y418 HydrophobicContact CE1-CE2 3.55Å; Y388-Y418 AromaticContact CZ-CE2 3.86Å; Y418-V420 VanDerWaalsContact C-N 3.32Å; Y418-V420 PolarHBondContact O-N 2.85Å; Y418-Y437 WeakPolarHBondContact CD1-OH 3.09Å; Y418-R467 VanDerWaalsContact OH-CZ 3.24Å; Y418-R467 PolarHBondContact OH-NH1 3.19Å; Y418-R467 VanDerWaalsContact OH-NH1 3.13Å; Y418-R467 PolarHBondContact OH-NH2 3.15Å; Y418-M484 HydrophobicContact CD2-CE 3.46Å; Y418-M484 VanDerWaalsContact CD2-CE 3.46Å; Y418-M484 HydrophobicContact CD2-CG 4.14Å; Y418-M484 HydrophobicContact CD2-SD 3.72Å; Y418-M484 HydrophobicContact CE2-CE 3.73Å; Y418-M484 HydrophobicContact CG-CE 4.16Å; Y418-M484 HydrophobicContact CG-SD 3.98Å; Y418-A485 VanDerWaalsContact O-O 3.09Å
419	E	98.4	Very high	97.5	Very high	22 Å²	22	29.5 Å²	29.5	10%	0.103	17%	0.166	C	C	.	.			trans	-85.2	70.2	-175.9	-166.1	57.8	-146.7	0	0	111.9	S487 L530 P543 L544 T546	E419-S487 WeakPolarHBondContact OE1-CB 3.27Å; E419-S487 PolarHBondContact OE1-N 3.19Å; E419-S487 PolarHBondContact OE1-OG 3.46Å; E419-S487 WeakPolarHBondContact OE2-CB 3.49Å; E419-S487 PolarHBondContact OE2-N 2.95Å; E419-S487 VanDerWaalsContact OE2-N 3.14Å; E419-L530 HydrophobicContact CG-CD1 4.14Å; E419-P543 HydrophobicContact CB-CB 4.1Å; E419-P543 HydrophobicContact CG-CB 3.6Å; E419-L544 PolarHBondContact N-O 3.03Å; E419-T546 WeakPolarHBondContact CB-OG1 3.37Å; E419-T546 WeakPolarHBondContact CG-OG1 3.26Å; E419-T546 VanDerWaalsContact OE2-CB 3.29Å; E419-T546 WeakPolarHBondContact OE2-CB 3.44Å; E419-T546 PolarHBondContact OE2-OG1 3.1Å
420	V	98.2	Very high	97.5	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.024	13%	0.134	C	C	.	.			trans	-150.8	133.7	178.2	64	0	0	0	0	112.6	Y418 L422 N433 Y437 M484 A485	Y418-V420 VanDerWaalsContact C-N 3.32Å; Y418-V420 PolarHBondContact O-N 2.85Å; V420-L422 HydrophobicContact CB-CG 4.38Å; V420-L422 HydrophobicContact CG1-CD1 3.83Å; V420-L422 HydrophobicContact CG1-CG 3.94Å; V420-L422 HydrophobicContact CG2-CD1 4.11Å; V420-L422 HydrophobicContact CG2-CD2 3.82Å; V420-L422 HydrophobicContact CG2-CG 3.71Å; V420-L422 PolarHBondContact O-N 3.45Å; V420-N433 HydrophobicContact CG2-CB 4.2Å; V420-Y437 HydrophobicContact CB-CD1 4.49Å; V420-Y437 HydrophobicContact CB-CD2 3.67Å; V420-Y437 HydrophobicContact CB-CE2 4.3Å; V420-Y437 HydrophobicContact CB-CG 3.77Å; V420-Y437 HydrophobicContact CG1-CD1 4.22Å; V420-Y437 HydrophobicContact CG1-CD2 4.01Å; V420-Y437 HydrophobicContact CG1-CE1 4.46Å; V420-Y437 HydrophobicContact CG1-CE2 4.26Å; V420-Y437 HydrophobicContact CG1-CG 3.99Å; V420-Y437 HydrophobicContact CG2-CD2 4.28Å; V420-Y437 HydrophobicContact CG2-CG 3.95Å; V420-M484 HydrophobicContact CG1-CB 3.72Å; V420-M484 HydrophobicContact CG1-CG 4.32Å; V420-M484 HydrophobicContact CG1-SD 3.66Å; V420-M484 CarbonylContact O-C 3.56Å; V420-A485 CarbonylContact O-C 3.52Å; V420-A485 VanDerWaalsContact O-C 3.28Å; V420-A485 WeakPolarHBondContact O-CA 3.24Å; V420-A485 PolarHBondContact O-N 2.82Å
421	S	97.7	Very high	97.5	Very high	42 Å²	42	23.3 Å²	23.3	29%	0.294	13%	0.132	S	C	.	.			trans	-86.4	87.4	179.5	174.8	0	0	0	0	111.8	N433	S421-N433 PolarHBondContact O-ND2 3.39Å
422	L	97.9	Very high	97.5	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.016	12%	0.122	C	C	.	.			trans	-116.4	7.2	178	-53.8	-179.4	0	0	0	113.4	V420 R430 N433 A434 A471 R480 M484	V420-L422 HydrophobicContact CB-CG 4.38Å; V420-L422 HydrophobicContact CG1-CD1 3.83Å; V420-L422 HydrophobicContact CG1-CG 3.94Å; V420-L422 HydrophobicContact CG2-CD1 4.11Å; V420-L422 HydrophobicContact CG2-CD2 3.82Å; V420-L422 HydrophobicContact CG2-CG 3.71Å; V420-L422 PolarHBondContact O-N 3.45Å; L422-R430 HydrophobicContact CD2-CB 4.37Å; L422-R430 WeakPolarHBondContact CD2-O 3.05Å; L422-R430 VanDerWaalsContact O-CD 3.26Å; L422-R430 WeakPolarHBondContact O-CD 3.41Å; L422-N433 HydrophobicContact CD2-CB 3.93Å; L422-A434 HydrophobicContact CD1-CB 4.26Å; L422-A434 HydrophobicContact CD2-CB 3.77Å; L422-A471 HydrophobicContact CD1-CB 4Å; L422-R480 PolarHBondContact O-NH1 3.39Å; L422-M484 CarbonylContact C-O 3.48Å; L422-M484 VanDerWaalsContact C-O 3.31Å; L422-M484 WeakPolarHBondContact CA-O 3.27Å; L422-M484 HydrophobicContact CB-CB 4.26Å; L422-M484 HydrophobicContact CD1-CB 4.37Å; L422-M484 HydrophobicContact CD1-SD 4.2Å; L422-M484 HydrophobicContact CG-CB 4.45Å; L422-M484 PolarHBondContact N-O 3.42Å
423	N	97.4	Very high	97.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-80.3	-81.1	-178	-172.3	13.4	0	0	0	111.9	R480 R483 M484 E489	N423-R480 PolarHBondContact O-NH1 3.42Å; N423-R480 VanDerWaalsContact O-NH1 3.16Å; N423-R480 PolarHBondContact O-NH2 2.9Å; N423-R483 HydrophobicContact CB-CB 4.34Å; N423-R483 PolarHBondContact O-NH1 2.89Å; N423-R483 WeakPolarHBondContact OD1-CD 3.41Å; N423-R483 PolarHBondContact OD1-NH1 3.4Å; N423-M484 PolarHBondContact N-O 3.01Å; N423-E489 PolarHBondContact ND2-OE1 3.24Å
424	R	94.5	Very high	97.4	Very high	131 Å²	131	23.3 Å²	23.3	49%	0.494	13%	0.13	S	C	.	.	S	Bend	trans	-91.5	-11.9	-167.8	-57.3	-168.7	174	-71.7	2.5	115	D395 E489	D395-R424 IonicContact OD1-CZ 2.96Å; D395-R424 IonicContact OD1-NH2 2.75Å; D395-R424 PolarHBondContact OD1-NH2 3.26Å; D395-R424 IonicContact OD2-CZ 3.02Å; D395-R424 IonicContact OD2-NH2 3.56Å; D395-R424 PolarHBondContact OD2-NH2 3.35Å; R424-E489 IonicContact NE-OE1 3.42Å
425	A	94.3	Very high	97.4	Very high	21 Å²	21	23.3 Å²	23.3	17%	0.174	13%	0.13	C	C	.	.	S	Bend	trans	-64.3	151.6	-177.7	0	0	0	0	0	111.9	D429 R430	A425-D429 HydrophobicContact CB-CB 3.86Å; A425-R430 HydrophobicContact CB-CG 3.8Å; A425-R430 WeakPolarHBondContact O-CD 3.44Å; A425-R430 VanDerWaalsContact O-CG 3.27Å; A425-R430 WeakPolarHBondContact O-CG 3.37Å; A425-R430 PolarHBondContact O-NH1 2.93Å
426	G	94.9	Very high	97.2	Very high	42 Å²	42	23.7 Å²	23.7	43%	0.433	13%	0.132	S	C	.	.			trans	-66.7	167.5	173.8	0	0	0	0	0	111.9	V428 D429 R430	G426-V428 PolarHBondContact O-N 3.24Å; G426-D429 PolarHBondContact O-N 2.9Å; G426-R430 WeakPolarHBondContact O-CG 3.42Å; G426-R430 PolarHBondContact O-N 2.94Å
427	F	96.3	Very high	97.2	Very high	20 Å²	20	24.1 Å²	24.1	9%	0.088	13%	0.134	C	C	.	.	H	α-helix	trans	-53.2	-49.2	-173.9	167.9	-106.9	0	0	0	113.8	A189 L225 R228 D429 R430 F431 I472	A189-F427 HydrophobicContact CB-CE1 4.36Å; L225-F427 HydrophobicContact CD1-CZ 3.82Å; R228-F427 VanDerWaalsContact CZ-CD2 3.41Å; F427-D429 PolarHBondContact O-N 3.43Å; F427-R430 PolarHBondContact O-N 2.85Å; F427-F431 HydrophobicContact CE2-CD2 4.06Å; F427-F431 AromaticContact CZ-CD2 3.84Å; F427-F431 HydrophobicContact CZ-CD2 3.84Å; F427-F431 WeakPolarHBondContact O-CB 3.32Å; F427-F431 PolarHBondContact O-N 3.36Å; F427-I472 HydrophobicContact CE2-CB 4.25Å; F427-I472 WeakPolarHBondContact CE2-O 3.45Å
428	V	96.8	Very high	97.2	Very high	40 Å²	40	24 Å²	24	24%	0.242	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-40.5	-177.7	178.7	0	0	0	0	111.9	R187 A190 G426 F431 S432	R187-V428 HydrophobicContact CG-CG1 3.88Å; A190-V428 HydrophobicContact CB-CG2 3.72Å; G426-V428 PolarHBondContact O-N 3.24Å; V428-F431 PolarHBondContact O-N 3.42Å; V428-S432 WeakPolarHBondContact O-CB 3.47Å; V428-S432 PolarHBondContact O-N 3.43Å; V428-S432 PolarHBondContact O-OG 3.26Å
429	D	97.3	Very high	97.2	Very high	96 Å²	96	24.9 Å²	24.9	51%	0.513	14%	0.137	S	C	.	.	H	α-helix	trans	-69.2	-43.7	177.3	-66.6	-33	0	0	0	111.2	A425 G426 F427 F431 S432 N433	A425-D429 HydrophobicContact CB-CB 3.86Å; G426-D429 PolarHBondContact O-N 2.9Å; F427-D429 PolarHBondContact O-N 3.43Å; D429-F431 VanDerWaalsContact C-N 3.3Å; D429-F431 PolarHBondContact O-N 3.5Å; D429-S432 PolarHBondContact O-N 3.31Å; D429-N433 VanDerWaalsContact O-CB 3.27Å; D429-N433 WeakPolarHBondContact O-CB 3.41Å; D429-N433 PolarHBondContact O-N 3.09Å; D429-N433 PolarHBondContact O-ND2 3.17Å
430	R	97.5	Very high	97.1	Very high	6 Å²	6	24.2 Å²	24.2	2%	0.023	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-41.7	173.7	-69.3	-163.8	-43.2	-94.7	5.2	111.4	L422 A425 G426 F427 N433 A434 A471 E476	L422-R430 HydrophobicContact CD2-CB 4.37Å; L422-R430 WeakPolarHBondContact CD2-O 3.05Å; L422-R430 VanDerWaalsContact O-CD 3.26Å; L422-R430 WeakPolarHBondContact O-CD 3.41Å; A425-R430 HydrophobicContact CB-CG 3.8Å; A425-R430 WeakPolarHBondContact O-CD 3.44Å; A425-R430 VanDerWaalsContact O-CG 3.27Å; A425-R430 WeakPolarHBondContact O-CG 3.37Å; A425-R430 PolarHBondContact O-NH1 2.93Å; G426-R430 WeakPolarHBondContact O-CG 3.42Å; G426-R430 PolarHBondContact O-N 2.94Å; F427-R430 PolarHBondContact O-N 2.85Å; R430-N433 PolarHBondContact O-N 3.16Å; R430-A434 WeakPolarHBondContact O-CB 3.38Å; R430-A434 PolarHBondContact O-N 3.12Å; R430-A471 PolarHBondContact NE-O 3.49Å; R430-E476 IonicContact CZ-OE1 3.58Å; R430-E476 IonicContact CZ-OE2 3.95Å; R430-E476 IonicContact NH1-OE1 2.56Å; R430-E476 IonicContact NH1-OE2 3.5Å; R430-E476 PolarHBondContact NH1-OE2 2.92Å; R430-E476 IonicContact NH2-OE1 2.86Å; R430-E476 PolarHBondContact NH2-OE1 3.49Å; R430-E476 IonicContact NH2-OE2 3.83Å; R430-E476 PolarHBondContact NH2-OE2 3.36Å
431	F	97.9	Very high	97.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.8	-50.6	177.5	-165.9	-75.9	0	0	0	111.1	L182 L183 S186 F221 L225 F427 V428 D429 A434 L435 I472	L182-F431 HydrophobicContact CD1-CZ 3.93Å; L182-F431 HydrophobicContact CD2-CE1 4.02Å; L182-F431 HydrophobicContact CD2-CZ 3.92Å; L182-F431 HydrophobicContact CG-CE1 3.78Å; L182-F431 HydrophobicContact CG-CZ 3.57Å; L183-F431 HydrophobicContact CD2-CD1 4.24Å; S186-F431 VanDerWaalsContact CB-CD1 3.49Å; S186-F431 VanDerWaalsContact CB-CG 3.46Å; S186-F431 WeakPolarHBondContact OG-CD1 3.49Å; F221-F431 HydrophobicContact CB-CZ 4.34Å; F221-F431 HydrophobicContact CD1-CD1 4.49Å; F221-F431 AromaticContact CD1-CE1 3.96Å; F221-F431 HydrophobicContact CD1-CE1 3.96Å; F221-F431 HydrophobicContact CD1-CE2 4.05Å; F221-F431 AromaticContact CD1-CZ 3.71Å; F221-F431 HydrophobicContact CD1-CZ 3.71Å; L225-F431 HydrophobicContact CB-CE2 4.36Å; L225-F431 HydrophobicContact CD1-CE2 4.49Å; L225-F431 HydrophobicContact CD2-CE2 4.31Å; F427-F431 HydrophobicContact CE2-CD2 4.06Å; F427-F431 AromaticContact CZ-CD2 3.84Å; F427-F431 HydrophobicContact CZ-CD2 3.84Å; F427-F431 WeakPolarHBondContact O-CB 3.32Å; F427-F431 PolarHBondContact O-N 3.36Å; V428-F431 PolarHBondContact O-N 3.42Å; D429-F431 VanDerWaalsContact C-N 3.3Å; D429-F431 PolarHBondContact O-N 3.5Å; F431-A434 PolarHBondContact O-N 2.8Å; F431-L435 WeakPolarHBondContact O-CB 3.47Å; F431-L435 PolarHBondContact O-N 3.03Å; F431-I472 HydrophobicContact CB-CG2 4.21Å; F431-I472 HydrophobicContact CD2-CB 4.04Å; F431-I472 HydrophobicContact CD2-CD1 3.66Å; F431-I472 HydrophobicContact CD2-CG1 4.48Å; F431-I472 HydrophobicContact CD2-CG2 4.04Å; F431-I472 HydrophobicContact CE2-CD1 3.42Å; F431-I472 VanDerWaalsContact CE2-CD1 3.42Å; F431-I472 HydrophobicContact CG-CG2 4.41Å; F431-I472 HydrophobicContact CZ-CD1 4.26Å
432	S	97.7	Very high	97.1	Very high	8 Å²	8	22.2 Å²	22.2	6%	0.056	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-46.7	179.1	-55.1	0	0	0	0	111.4	V428 D429 A434 L435 L436	V428-S432 WeakPolarHBondContact O-CB 3.47Å; V428-S432 PolarHBondContact O-N 3.43Å; V428-S432 PolarHBondContact O-OG 3.26Å; D429-S432 PolarHBondContact O-N 3.31Å; S432-A434 PolarHBondContact O-N 3.3Å; S432-L435 PolarHBondContact O-N 3.01Å; S432-L436 VanDerWaalsContact O-CG 3.26Å; S432-L436 WeakPolarHBondContact O-CG 3.19Å; S432-L436 PolarHBondContact O-N 2.97Å
433	N	97.9	Very high	97.1	Very high	34 Å²	34	23.9 Å²	23.9	18%	0.182	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-44.3	178.5	-71.3	-14.5	0	0	0	112.2	V420 S421 L422 D429 R430 L435 L436 Y437	V420-N433 HydrophobicContact CG2-CB 4.2Å; S421-N433 PolarHBondContact O-ND2 3.39Å; L422-N433 HydrophobicContact CD2-CB 3.93Å; D429-N433 VanDerWaalsContact O-CB 3.27Å; D429-N433 WeakPolarHBondContact O-CB 3.41Å; D429-N433 PolarHBondContact O-N 3.09Å; D429-N433 PolarHBondContact O-ND2 3.17Å; R430-N433 PolarHBondContact O-N 3.16Å; N433-L435 VanDerWaalsContact C-N 3.35Å; N433-L436 PolarHBondContact O-N 2.96Å; N433-Y437 WeakPolarHBondContact O-CB 3.35Å; N433-Y437 PolarHBondContact O-N 3.17Å
434	A	98.1	Very high	97.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-43.5	177.3	0	0	0	0	0	110.6	F221 L422 R430 F431 S432 L436 Y437 Y438 I472	F221-A434 HydrophobicContact CE1-CB 3.91Å; F221-A434 HydrophobicContact CZ-CB 3.83Å; L422-A434 HydrophobicContact CD1-CB 4.26Å; L422-A434 HydrophobicContact CD2-CB 3.77Å; R430-A434 WeakPolarHBondContact O-CB 3.38Å; R430-A434 PolarHBondContact O-N 3.12Å; F431-A434 PolarHBondContact O-N 2.8Å; S432-A434 PolarHBondContact O-N 3.3Å; A434-L436 VanDerWaalsContact C-N 3.35Å; A434-L436 PolarHBondContact O-N 3.41Å; A434-Y437 PolarHBondContact O-N 2.92Å; A434-Y438 HydrophobicContact CB-CD2 4.39Å; A434-Y438 WeakPolarHBondContact O-CD2 3.3Å; A434-Y438 PolarHBondContact O-N 3.01Å; A434-I472 HydrophobicContact CB-CG2 4.35Å
435	L	97.9	Very high	97.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-45	180	-167	71.6	0	0	0	111.5	L179 L182 L183 V217 F221 F431 S432 N433 Y437 K439	L179-L435 HydrophobicContact CB-CD2 4.31Å; L179-L435 HydrophobicContact CD2-CD1 4.26Å; L182-L435 HydrophobicContact CD2-CD1 3.65Å; L183-L435 HydrophobicContact CD1-CD2 4.03Å; L183-L435 HydrophobicContact CD2-CD2 3.65Å; L183-L435 HydrophobicContact CG-CD2 3.55Å; V217-L435 HydrophobicContact CG1-CD1 3.46Å; V217-L435 VanDerWaalsContact CG1-CD1 3.46Å; F221-L435 HydrophobicContact CD1-CD1 3.83Å; F221-L435 HydrophobicContact CD2-CD1 4.05Å; F221-L435 HydrophobicContact CE1-CB 3.92Å; F221-L435 HydrophobicContact CE1-CD1 3.85Å; F221-L435 HydrophobicContact CE2-CD1 4.05Å; F221-L435 HydrophobicContact CG-CD1 3.96Å; F221-L435 VanDerWaalsContact CZ-CA 3.49Å; F221-L435 HydrophobicContact CZ-CB 4.14Å; F221-L435 HydrophobicContact CZ-CD1 3.97Å; F431-L435 WeakPolarHBondContact O-CB 3.47Å; F431-L435 PolarHBondContact O-N 3.03Å; S432-L435 PolarHBondContact O-N 3.01Å; N433-L435 VanDerWaalsContact C-N 3.35Å; L435-Y437 PolarHBondContact O-N 3.46Å; L435-K439 VanDerWaalsContact O-CB 3.26Å; L435-K439 WeakPolarHBondContact O-CB 3.5Å; L435-K439 PolarHBondContact O-N 3.25Å
436	L	96.3	Very high	97.3	Very high	10 Å²	10	18.5 Å²	18.5	5%	0.052	11%	0.107	C	C	.	.	H	α-helix	trans	-69.3	-20.7	178.1	-66.5	178.3	0	0	0	114	L170 S173 S432 N433 A434 P440	L170-L436 HydrophobicContact CB-CD1 4.25Å; L170-L436 HydrophobicContact CD2-CD1 3.31Å; L170-L436 HydrophobicContact CG-CD1 4.31Å; S173-L436 WeakPolarHBondContact OG-CD2 3.42Å; S432-L436 VanDerWaalsContact O-CG 3.26Å; S432-L436 WeakPolarHBondContact O-CG 3.19Å; S432-L436 PolarHBondContact O-N 2.97Å; N433-L436 PolarHBondContact O-N 2.96Å; A434-L436 VanDerWaalsContact C-N 3.35Å; A434-L436 PolarHBondContact O-N 3.41Å; L436-P440 WeakPolarHBondContact O-CD 3.32Å; L436-P440 WeakPolarHBondContact O-CG 3.14Å
437	Y	98.1	Very high	97.4	Very high	10 Å²	10	18.5 Å²	18.5	4%	0.039	10%	0.098	C	C	.	.	H	α-helix	trans	-86.4	-47.5	174.1	174.5	-95.3	0	0	0	111.9	Y418 V420 N433 A434 L435 P440 V441 L544	Y418-Y437 WeakPolarHBondContact CD1-OH 3.09Å; V420-Y437 HydrophobicContact CB-CD1 4.49Å; V420-Y437 HydrophobicContact CB-CD2 3.67Å; V420-Y437 HydrophobicContact CB-CE2 4.3Å; V420-Y437 HydrophobicContact CB-CG 3.77Å; V420-Y437 HydrophobicContact CG1-CD1 4.22Å; V420-Y437 HydrophobicContact CG1-CD2 4.01Å; V420-Y437 HydrophobicContact CG1-CE1 4.46Å; V420-Y437 HydrophobicContact CG1-CE2 4.26Å; V420-Y437 HydrophobicContact CG1-CG 3.99Å; V420-Y437 HydrophobicContact CG2-CD2 4.28Å; V420-Y437 HydrophobicContact CG2-CG 3.95Å; N433-Y437 WeakPolarHBondContact O-CB 3.35Å; N433-Y437 PolarHBondContact O-N 3.17Å; A434-Y437 PolarHBondContact O-N 2.92Å; L435-Y437 PolarHBondContact O-N 3.46Å; Y437-P440 VanDerWaalsContact O-CD 3.27Å; Y437-P440 WeakPolarHBondContact O-CD 3.08Å; Y437-P440 VanDerWaalsContact O-CG 3.24Å; Y437-P440 WeakPolarHBondContact O-CG 3.38Å; Y437-V441 HydrophobicContact CD1-CG2 4.45Å; Y437-V441 HydrophobicContact CE1-CG2 4.03Å; Y437-V441 WeakPolarHBondContact O-CG2 3.24Å; Y437-L544 HydrophobicContact CD2-CD2 4.08Å; Y437-L544 HydrophobicContact CE2-CB 4.31Å; Y437-L544 HydrophobicContact CE2-CD2 4.12Å; Y437-L544 WeakPolarHBondContact CE2-O 3.38Å
438	Y	98.3	Very high	97.4	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-75.8	-28.1	-176.7	-78.9	-71.9	0	0	0	113	F221 A434 V441 F442 F464 R467 I468	F221-Y438 HydrophobicContact CE2-CD2 4.34Å; F221-Y438 HydrophobicContact CE2-CG 4.48Å; F221-Y438 HydrophobicContact CZ-CD2 4.17Å; A434-Y438 HydrophobicContact CB-CD2 4.39Å; A434-Y438 WeakPolarHBondContact O-CD2 3.3Å; A434-Y438 PolarHBondContact O-N 3.01Å; Y438-V441 PolarHBondContact O-N 3.41Å; Y438-F442 HydrophobicContact CD1-CE2 4.12Å; Y438-F442 WeakPolarHBondContact O-CD2 3.24Å; Y438-F442 PolarHBondContact O-N 3.39Å; Y438-F464 HydrophobicContact CD1-CB 4.12Å; Y438-F464 HydrophobicContact CD1-CG 4.32Å; Y438-F464 HydrophobicContact CE1-CB 3.86Å; Y438-F464 HydrophobicContact CE1-CD1 4.01Å; Y438-F464 HydrophobicContact CE1-CG 4.03Å; Y438-R467 WeakPolarHBondContact OH-CB 3.48Å; Y438-R467 WeakPolarHBondContact OH-CD 3.28Å; Y438-I468 HydrophobicContact CD1-CD1 4.17Å; Y438-I468 HydrophobicContact CD1-CG1 4.26Å; Y438-I468 HydrophobicContact CD2-CD1 4.1Å; Y438-I468 HydrophobicContact CD2-CG1 3.53Å; Y438-I468 HydrophobicContact CE1-CG1 4.33Å; Y438-I468 HydrophobicContact CE2-CG1 3.63Å; Y438-I468 HydrophobicContact CG-CD1 3.93Å; Y438-I468 HydrophobicContact CG-CG1 3.89Å
439	K	97.2	Very high	97.4	Very high	32 Å²	32	18 Å²	18	14%	0.139	10%	0.098	C	C	.	.	H	α-helix	trans	-50.4	-60.3	172.3	172	-175.7	179.1	-68	0	112.5	L179 L435 V441 F442 E443	L179-K439 HydrophobicContact CD1-CD 4Å; L179-K439 HydrophobicContact CD1-CG 4.42Å; L435-K439 VanDerWaalsContact O-CB 3.26Å; L435-K439 WeakPolarHBondContact O-CB 3.5Å; L435-K439 PolarHBondContact O-N 3.25Å; K439-V441 VanDerWaalsContact C-N 3.29Å; K439-V441 PolarHBondContact O-N 3.38Å; K439-F442 PolarHBondContact O-N 3.21Å; K439-E443 WeakPolarHBondContact CE-OE1 3.27Å; K439-E443 WeakPolarHBondContact CG-OE1 3.28Å; K439-E443 IonicContact NZ-OE1 2.79Å; K439-E443 PolarHBondContact NZ-OE1 2.82Å; K439-E443 IonicContact NZ-OE2 3.35Å; K439-E443 WeakPolarHBondContact O-CG 3.19Å; K439-E443 PolarHBondContact O-N 3.37Å
440	P	97.4	Very high	97.3	Very high	7 Å²	7	17.5 Å²	17.5	5%	0.045	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-29.3	178.7	24.3	-34.4	0	0	0	113.5	L436 Y437 E443 S444 W539 R542 L544	L436-P440 WeakPolarHBondContact O-CD 3.32Å; L436-P440 WeakPolarHBondContact O-CG 3.14Å; Y437-P440 VanDerWaalsContact O-CD 3.27Å; Y437-P440 WeakPolarHBondContact O-CD 3.08Å; Y437-P440 VanDerWaalsContact O-CG 3.24Å; Y437-P440 WeakPolarHBondContact O-CG 3.38Å; P440-E443 PolarHBondContact O-N 3.12Å; P440-S444 WeakPolarHBondContact O-CB 3.22Å; P440-S444 PolarHBondContact O-N 3.09Å; P440-W539 HydrophobicContact CB-CB 3.98Å; P440-W539 VanDerWaalsContact CB-CD1 3.4Å; P440-W539 HydrophobicContact CB-CG 3.91Å; P440-R542 HydrophobicContact CG-CG 4.29Å; P440-L544 HydrophobicContact CB-CD2 4.22Å; P440-L544 HydrophobicContact CG-CD2 3.71Å
441	V	97.8	Very high	97.2	Very high	4 Å²	4	21.9 Å²	21.9	2%	0.024	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-46.3	173.7	172.1	0	0	0	0	110.9	Y437 Y438 K439 S444 L445 F464 L544	Y437-V441 HydrophobicContact CD1-CG2 4.45Å; Y437-V441 HydrophobicContact CE1-CG2 4.03Å; Y437-V441 WeakPolarHBondContact O-CG2 3.24Å; Y438-V441 PolarHBondContact O-N 3.41Å; K439-V441 VanDerWaalsContact C-N 3.29Å; K439-V441 PolarHBondContact O-N 3.38Å; V441-S444 PolarHBondContact O-N 2.73Å; V441-S444 PolarHBondContact O-OG 3.37Å; V441-L445 PolarHBondContact O-N 2.83Å; V441-F464 HydrophobicContact CG1-CD2 3.89Å; V441-F464 HydrophobicContact CG1-CE1 4.15Å; V441-F464 HydrophobicContact CG1-CE2 3.27Å; V441-F464 HydrophobicContact CG1-CZ 3.45Å; V441-F464 VanDerWaalsContact CG1-CZ 3.45Å; V441-L544 HydrophobicContact CG2-CD1 4.21Å; V441-L544 HydrophobicContact CG2-CD2 4.27Å
442	F	98.1	Very high	97.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.5	-39.4	177	-84.6	-116.2	0	0	0	112.1	P213 R216 V217 Y220 Y438 K439 S444 L445 D446 E460 F464 I468	P213-F442 HydrophobicContact CB-CB 4.24Å; R216-F442 HydrophobicContact CB-CD1 3.89Å; R216-F442 HydrophobicContact CB-CE1 4Å; V217-F442 HydrophobicContact CG2-CB 3.72Å; V217-F442 HydrophobicContact CG2-CD1 3.79Å; V217-F442 HydrophobicContact CG2-CD2 3.82Å; V217-F442 HydrophobicContact CG2-CE1 4.34Å; V217-F442 HydrophobicContact CG2-CE2 4.35Å; V217-F442 HydrophobicContact CG2-CG 3.49Å; V217-F442 VanDerWaalsContact CG2-CG 3.49Å; Y220-F442 AromaticContact CD2-CE1 3.63Å; Y220-F442 HydrophobicContact CD2-CE1 3.63Å; Y220-F442 AromaticContact CD2-CZ 3.55Å; Y220-F442 HydrophobicContact CD2-CZ 3.55Å; Y220-F442 AromaticContact CE2-CE1 3.67Å; Y220-F442 HydrophobicContact CE2-CE1 3.67Å; Y220-F442 AromaticContact CE2-CZ 3.86Å; Y220-F442 HydrophobicContact CE2-CZ 3.86Å; Y438-F442 HydrophobicContact CD1-CE2 4.12Å; Y438-F442 WeakPolarHBondContact O-CD2 3.24Å; Y438-F442 PolarHBondContact O-N 3.39Å; K439-F442 PolarHBondContact O-N 3.21Å; F442-S444 VanDerWaalsContact C-N 3.27Å; F442-S444 PolarHBondContact O-N 2.86Å; F442-L445 PolarHBondContact O-N 3.49Å; F442-D446 WeakPolarHBondContact O-CB 3.37Å; F442-D446 PolarHBondContact O-N 2.86Å; F442-E460 HydrophobicContact CD1-CG 4.25Å; F442-E460 HydrophobicContact CE1-CB 4.05Å; F442-E460 HydrophobicContact CE1-CG 3.8Å; F442-E460 HydrophobicContact CZ-CB 4.19Å; F442-E460 HydrophobicContact CZ-CG 4.12Å; F442-F464 HydrophobicContact CD2-CD2 4.27Å; F442-F464 HydrophobicContact CE2-CB 3.85Å; F442-F464 AromaticContact CE2-CD2 3.83Å; F442-F464 HydrophobicContact CE2-CD2 3.83Å; F442-F464 HydrophobicContact CE2-CG 4.26Å; F442-F464 HydrophobicContact CZ-CB 4.17Å; F442-F464 HydrophobicContact CZ-CD2 4.38Å; F442-I468 HydrophobicContact CE2-CD1 4.3Å; F442-I468 HydrophobicContact CZ-CD1 4.46Å
443	E	97.5	Very high	97.1	Very high	38 Å²	38	28.5 Å²	28.5	18%	0.178	15%	0.153	C	C	.	.	H	α-helix	trans	-59.7	-38.6	172.2	-71.7	167.3	177.2	0	0	111.5	P213 K439 P440 D446 V447 W539	P213-E443 HydrophobicContact CB-CG 3.81Å; P213-E443 HydrophobicContact CG-CG 4.11Å; K439-E443 WeakPolarHBondContact CE-OE1 3.27Å; K439-E443 WeakPolarHBondContact CG-OE1 3.28Å; K439-E443 IonicContact NZ-OE1 2.79Å; K439-E443 PolarHBondContact NZ-OE1 2.82Å; K439-E443 IonicContact NZ-OE2 3.35Å; K439-E443 WeakPolarHBondContact O-CG 3.19Å; K439-E443 PolarHBondContact O-N 3.37Å; P440-E443 PolarHBondContact O-N 3.12Å; E443-D446 WeakPolarHBondContact O-CB 3.23Å; E443-D446 PolarHBondContact O-N 3.03Å; E443-V447 WeakPolarHBondContact O-CG2 3.47Å; E443-V447 PolarHBondContact O-N 3.04Å; E443-W539 HydrophobicContact CB-CZ2 4.18Å; E443-W539 PolarHBondContact OE2-NE1 3.35Å
444	S	97	Very high	97	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-38	178	82.1	0	0	0	0	113.5	Y265 P440 V441 F442 D446 A448 Y525	Y265-S444 VanDerWaalsContact OH-CB 3.32Å; Y265-S444 WeakPolarHBondContact OH-CB 3.49Å; Y265-S444 PolarHBondContact OH-OG 2.94Å; P440-S444 WeakPolarHBondContact O-CB 3.22Å; P440-S444 PolarHBondContact O-N 3.09Å; V441-S444 PolarHBondContact O-N 2.73Å; V441-S444 PolarHBondContact O-OG 3.37Å; F442-S444 VanDerWaalsContact C-N 3.27Å; F442-S444 PolarHBondContact O-N 2.86Å; S444-D446 VanDerWaalsContact C-N 3.32Å; S444-A448 PolarHBondContact O-N 2.79Å; S444-Y525 WeakPolarHBondContact CB-OH 3.37Å
445	L	96.8	Very high	96.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.3	-34.2	174	-69.1	-176.1	0	0	0	111.8	L259 C263 V441 F442 V447 A448 M449 V459 E460 F464	L259-L445 HydrophobicContact CD1-CD2 3.76Å; C263-L445 VanDerWaalsContact SG-CD2 3.59Å; V441-L445 PolarHBondContact O-N 2.83Å; F442-L445 PolarHBondContact O-N 3.49Å; L445-V447 PolarHBondContact O-N 3.15Å; L445-A448 PolarHBondContact O-N 2.57Å; L445-A448 VanDerWaalsContact O-N 3.1Å; L445-M449 HydrophobicContact CB-CE 4.11Å; L445-M449 HydrophobicContact CD1-CE 4.32Å; L445-M449 HydrophobicContact CD2-CE 3.4Å; L445-M449 VanDerWaalsContact CD2-CE 3.4Å; L445-M449 HydrophobicContact CG-CE 4.14Å; L445-M449 PolarHBondContact O-N 2.74Å; L445-V459 HydrophobicContact CD1-CG1 4.04Å; L445-E460 HydrophobicContact CD1-CG 3.77Å; L445-F464 HydrophobicContact CD1-CD2 4.18Å; L445-F464 HydrophobicContact CD1-CE2 3.53Å; L445-F464 HydrophobicContact CD1-CZ 4.49Å; L445-F464 HydrophobicContact CG-CE2 4.29Å
446	D	97.2	Very high	96.9	Very high	40 Å²	40	34.5 Å²	34.5	21%	0.214	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-37.1	178.5	-153.8	63.6	0	0	0	113.3	P213 R216 F442 E443 S444 R451	P213-D446 HydrophobicContact CG-CB 3.67Å; P213-D446 VanDerWaalsContact CG-CG 3.43Å; R216-D446 IonicContact CZ-OD1 3.56Å; R216-D446 IonicContact NH2-OD1 3.15Å; R216-D446 PolarHBondContact NH2-OD1 3.47Å; F442-D446 WeakPolarHBondContact O-CB 3.37Å; F442-D446 PolarHBondContact O-N 2.86Å; E443-D446 WeakPolarHBondContact O-CB 3.23Å; E443-D446 PolarHBondContact O-N 3.03Å; S444-D446 VanDerWaalsContact C-N 3.32Å; D446-R451 VanDerWaalsContact CG-NH2 3.31Å; D446-R451 IonicContact OD1-CZ 2.83Å; D446-R451 VanDerWaalsContact OD1-CZ 3.22Å; D446-R451 IonicContact OD1-NE 3.04Å; D446-R451 PolarHBondContact OD1-NE 3.34Å; D446-R451 IonicContact OD1-NH2 3.22Å; D446-R451 PolarHBondContact OD1-NH2 2.97Å; D446-R451 VanDerWaalsContact OD1-NH2 3.16Å; D446-R451 IonicContact OD2-CZ 3.41Å; D446-R451 IonicContact OD2-NE 2.73Å; D446-R451 IonicContact OD2-NH2 3.8Å; D446-R451 PolarHBondContact OD2-NH2 2.9Å
447	V	97	Very high	96.9	Very high	41 Å²	41	35 Å²	35	25%	0.248	19%	0.189	C	C	.	.	H	α-helix	trans	-78.7	-28.2	178.1	176.3	0	0	0	0	111.3	E443 L445 K522 Y523 W539	E443-V447 WeakPolarHBondContact O-CG2 3.47Å; E443-V447 PolarHBondContact O-N 3.04Å; L445-V447 PolarHBondContact O-N 3.15Å; V447-K522 HydrophobicContact CG1-CB 4.04Å; V447-K522 HydrophobicContact CG1-CD 3.73Å; V447-K522 HydrophobicContact CG1-CG 3.41Å; V447-K522 VanDerWaalsContact CG1-CG 3.41Å; V447-K522 WeakPolarHBondContact O-CE 3.42Å; V447-Y523 HydrophobicContact CB-CD1 4.43Å; V447-Y523 HydrophobicContact CB-CE1 4.4Å; V447-Y523 HydrophobicContact CG1-CD1 3.73Å; V447-Y523 HydrophobicContact CG1-CD2 4.3Å; V447-Y523 HydrophobicContact CG1-CE1 3.78Å; V447-Y523 HydrophobicContact CG1-CE2 4.34Å; V447-Y523 HydrophobicContact CG1-CG 4.01Å; V447-W539 HydrophobicContact CB-CH2 4.09Å; V447-W539 HydrophobicContact CG1-CH2 4.49Å; V447-W539 HydrophobicContact CG2-CH2 3.82Å; V447-W539 HydrophobicContact CG2-CZ2 4.13Å
448	A	95.8	Very high	96.7	Very high	28 Å²	28	37.7 Å²	37.7	23%	0.231	20%	0.2	C	C	.	.	H	α-helix	trans	-88.3	-29.8	-175.9	0	0	0	0	0	114.4	A262 S444 L445 Y523	A262-A448 HydrophobicContact CB-CB 3.95Å; A262-A448 VanDerWaalsContact O-CB 3.32Å; A262-A448 WeakPolarHBondContact O-CB 3.3Å; S444-A448 PolarHBondContact O-N 2.79Å; L445-A448 PolarHBondContact O-N 2.57Å; L445-A448 VanDerWaalsContact O-N 3.1Å; A448-Y523 HydrophobicContact CB-CE1 4.14Å
449	M	96.6	Very high	96.6	Very high	23 Å²	23	37.6 Å²	37.6	11%	0.113	20%	0.199	C	C	.	.	S	Bend	trans	-136.2	146	-172.2	-69.1	-177	-77.9	0	0	112.7	T258 A262 L445 R456	T258-M449 HydrophobicContact CG2-CE 4.38Å; T258-M449 HydrophobicContact CG2-SD 3.88Å; A262-M449 HydrophobicContact CB-CE 3.86Å; A262-M449 HydrophobicContact CB-CG 4.14Å; A262-M449 HydrophobicContact CB-SD 4.1Å; L445-M449 HydrophobicContact CB-CE 4.11Å; L445-M449 HydrophobicContact CD1-CE 4.32Å; L445-M449 HydrophobicContact CD2-CE 3.4Å; L445-M449 VanDerWaalsContact CD2-CE 3.4Å; L445-M449 HydrophobicContact CG-CE 4.14Å; L445-M449 PolarHBondContact O-N 2.74Å; M449-R456 HydrophobicContact CB-CB 4.14Å; M449-R456 HydrophobicContact CB-CG 4.35Å; M449-R456 HydrophobicContact CE-CB 3.83Å; M449-R456 HydrophobicContact CE-CG 3.88Å; M449-R456 HydrophobicContact SD-CB 3.89Å
450	P	96	Very high	96.6	Very high	84 Å²	84	36.1 Å²	36.1	55%	0.545	19%	0.193	S	C	.	.			trans	-57.9	153.4	173.8	-24.5	34.7	0	0	0	113.6	D452 S453	P450-D452 VanDerWaalsContact CB-OD1 3.23Å; P450-D452 WeakPolarHBondContact CB-OD1 3.39Å; P450-D452 PolarHBondContact O-N 2.63Å; P450-S453 WeakPolarHBondContact O-CB 3.22Å; P450-S453 PolarHBondContact O-N 3.33Å
451	R	95.8	Very high	96.5	Very high	98 Å²	98	41.9 Å²	41.9	37%	0.37	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.1	-177.6	-70.6	-79.7	179.3	93.1	2.3	114.5	G211 D212 D446 R456	G211-R451 VanDerWaalsContact O-CD 3.29Å; G211-R451 WeakPolarHBondContact O-CD 3.3Å; G211-R451 PolarHBondContact O-NH1 2.87Å; D212-R451 VanDerWaalsContact CA-CZ 3.5Å; D446-R451 VanDerWaalsContact CG-NH2 3.31Å; D446-R451 IonicContact OD1-CZ 2.83Å; D446-R451 VanDerWaalsContact OD1-CZ 3.22Å; D446-R451 IonicContact OD1-NE 3.04Å; D446-R451 PolarHBondContact OD1-NE 3.34Å; D446-R451 IonicContact OD1-NH2 3.22Å; D446-R451 PolarHBondContact OD1-NH2 2.97Å; D446-R451 VanDerWaalsContact OD1-NH2 3.16Å; D446-R451 IonicContact OD2-CZ 3.41Å; D446-R451 IonicContact OD2-NE 2.73Å; D446-R451 IonicContact OD2-NH2 3.8Å; D446-R451 PolarHBondContact OD2-NH2 2.9Å; R451-R456 VanDerWaalsContact CA-NH1 3.26Å; R451-R456 VanDerWaalsContact CD-NH1 3.29Å; R451-R456 PolarHBondContact O-NH1 2.66Å; R451-R456 PolarHBondContact O-NH2 2.64Å
452	D	95.1	Very high	96.2	Very high	134 Å²	134	43.6 Å²	43.6	72%	0.717	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	4.1	179.8	61.4	-27.3	0	0	0	112.6	P450 P454	P450-D452 VanDerWaalsContact CB-OD1 3.23Å; P450-D452 WeakPolarHBondContact CB-OD1 3.39Å; P450-D452 PolarHBondContact O-N 2.63Å; D452-P454 WeakPolarHBondContact O-CD 3.28Å
453	S	96.9	Very high	95.9	Very high	14 Å²	14	43.9 Å²	43.9	10%	0.098	23%	0.227	C	C	.	.			trans	-64.9	120.1	179.1	167.8	0	0	0	0	111.1	P450 E455 R456 V457	P450-S453 WeakPolarHBondContact O-CB 3.22Å; P450-S453 PolarHBondContact O-N 3.33Å; S453-E455 VanDerWaalsContact C-N 3.25Å; S453-E455 PolarHBondContact O-N 3.5Å; S453-E455 PolarHBondContact OG-N 3.37Å; S453-E455 PolarHBondContact OG-OE2 2.83Å; S453-R456 WeakPolarHBondContact O-CB 3.02Å; S453-R456 PolarHBondContact O-N 3.12Å; S453-R456 PolarHBondContact OG-N 2.93Å; S453-V457 PolarHBondContact O-N 3.49Å
454	P	96.1	Very high	95.9	Very high	77 Å²	77	42.3 Å²	42.3	50%	0.5	22%	0.219	S	C	.	.	H	α-helix	trans	-67.4	-27.5	175.2	26.1	-32.1	0	0	0	112.1	D452 V457 R458	D452-P454 WeakPolarHBondContact O-CD 3.28Å; P454-V457 PolarHBondContact O-N 2.73Å; P454-R458 WeakPolarHBondContact O-CB 2.91Å; P454-R458 PolarHBondContact O-N 3.48Å
455	E	95.8	Very high	95.8	Very high	82 Å²	82	42.7 Å²	42.7	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-43.6	174.1	-62.3	68.4	-145.8	0	0	111.5	T258 S453 R458 V459	T258-E455 HydrophobicContact CG2-CB 3.71Å; S453-E455 VanDerWaalsContact C-N 3.25Å; S453-E455 PolarHBondContact O-N 3.5Å; S453-E455 PolarHBondContact OG-N 3.37Å; S453-E455 PolarHBondContact OG-OE2 2.83Å; E455-R458 WeakPolarHBondContact O-CB 2.93Å; E455-R458 PolarHBondContact O-N 2.83Å; E455-V459 WeakPolarHBondContact O-CG2 3.43Å; E455-V459 PolarHBondContact O-N 2.97Å
456	R	97.5	Very high	95.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-51.1	173.7	-175.6	-152.7	72	168.1	-9.3	111	E209 R216 M449 R451 S453 R458 V459 E460	E209-R456 PolarHBondContact O-NH2 2.87Å; R216-R456 VanDerWaalsContact NH1-CD 3.29Å; R216-R456 VanDerWaalsContact NH1-CZ 3.27Å; M449-R456 HydrophobicContact CB-CB 4.14Å; M449-R456 HydrophobicContact CB-CG 4.35Å; M449-R456 HydrophobicContact CE-CB 3.83Å; M449-R456 HydrophobicContact CE-CG 3.88Å; M449-R456 HydrophobicContact SD-CB 3.89Å; R451-R456 VanDerWaalsContact CA-NH1 3.26Å; R451-R456 VanDerWaalsContact CD-NH1 3.29Å; R451-R456 PolarHBondContact O-NH1 2.66Å; R451-R456 PolarHBondContact O-NH2 2.64Å; S453-R456 WeakPolarHBondContact O-CB 3.02Å; S453-R456 PolarHBondContact O-N 3.12Å; S453-R456 PolarHBondContact OG-N 2.93Å; R456-R458 VanDerWaalsContact C-N 3.26Å; R456-R458 PolarHBondContact O-N 2.89Å; R456-V459 PolarHBondContact O-N 2.88Å; R456-E460 IonicContact CZ-OE2 2.79Å; R456-E460 IonicContact NE-OE2 3.71Å; R456-E460 WeakPolarHBondContact O-CG 3.27Å; R456-E460 PolarHBondContact O-N 3.34Å
457	V	96.6	Very high	95.6	Very high	20 Å²	20	44.6 Å²	44.6	12%	0.121	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-39	178.6	175.1	0	0	0	0	111.1	E209 S453 P454 E460 R461	E209-V457 HydrophobicContact CG-CG1 4.43Å; S453-V457 PolarHBondContact O-N 3.49Å; P454-V457 PolarHBondContact O-N 2.73Å; V457-E460 PolarHBondContact O-N 2.74Å; V457-R461 WeakPolarHBondContact O-CB 3.31Å; V457-R461 PolarHBondContact O-N 3.44Å
458	R	95	Very high	95.6	Very high	68 Å²	68	42.6 Å²	42.6	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-61.4	-48.3	175.8	-172.8	-171.7	-70.1	105.3	7.2	112	E251 P454 E455 R456 E460 R461 C462	E251-R458 WeakPolarHBondContact OE2-CD 2.99Å; E251-R458 WeakPolarHBondContact OE2-CG 3.13Å; E251-R458 IonicContact OE2-NE 3.57Å; E251-R458 PolarHBondContact OE2-NE 3.4Å; P454-R458 WeakPolarHBondContact O-CB 2.91Å; P454-R458 PolarHBondContact O-N 3.48Å; E455-R458 WeakPolarHBondContact O-CB 2.93Å; E455-R458 PolarHBondContact O-N 2.83Å; R456-R458 VanDerWaalsContact C-N 3.26Å; R456-R458 PolarHBondContact O-N 2.89Å; R458-E460 VanDerWaalsContact C-N 3.35Å; R458-E460 PolarHBondContact O-N 2.69Å; R458-R461 PolarHBondContact O-N 3.41Å; R458-C462 VanDerWaalsContact O-CB 3.28Å; R458-C462 WeakPolarHBondContact O-CB 3.26Å; R458-C462 PolarHBondContact O-N 3.04Å
459	V	95.4	Very high	95.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-59.3	-48	176	172.9	0	0	0	0	110.5	C255 T258 L259 L445 E455 R456 R461 M463 F464	C255-V459 HydrophobicContact CB-CG2 4.15Å; T258-V459 HydrophobicContact CG2-CG2 3.62Å; L259-V459 HydrophobicContact CD1-CG1 4.44Å; L445-V459 HydrophobicContact CD1-CG1 4.04Å; E455-V459 WeakPolarHBondContact O-CG2 3.43Å; E455-V459 PolarHBondContact O-N 2.97Å; R456-V459 PolarHBondContact O-N 2.88Å; V459-R461 PolarHBondContact O-N 3.34Å; V459-M463 WeakPolarHBondContact O-CA 3.37Å; V459-M463 VanDerWaalsContact O-CB 3.23Å; V459-M463 WeakPolarHBondContact O-CB 3.27Å; V459-M463 PolarHBondContact O-N 3.43Å; V459-M463 VanDerWaalsContact O-N 3.07Å; V459-F464 HydrophobicContact CG1-CD2 4.28Å; V459-F464 HydrophobicContact CG1-CE1 4.47Å; V459-F464 HydrophobicContact CG1-CE2 3.83Å; V459-F464 HydrophobicContact CG1-CZ 3.92Å; V459-F464 PolarHBondContact O-N 2.92Å; V459-F464 VanDerWaalsContact O-N 3.14Å
460	E	97.5	Very high	95.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-63.9	-40.8	-177.6	-71.7	177.4	168.5	0	0	112.2	R216 Y220 F442 L445 R456 V457 R458 F464 G465	R216-E460 IonicContact CZ-OE1 2.97Å; R216-E460 IonicContact CZ-OE2 2.57Å; R216-E460 IonicContact NH1-OE1 2.64Å; R216-E460 PolarHBondContact NH1-OE1 3.34Å; R216-E460 IonicContact NH1-OE2 2.74Å; R216-E460 PolarHBondContact NH1-OE2 2.81Å; R216-E460 IonicContact NH2-OE1 3.87Å; Y220-E460 HydrophobicContact CE2-CB 3.81Å; F442-E460 HydrophobicContact CD1-CG 4.25Å; F442-E460 HydrophobicContact CE1-CB 4.05Å; F442-E460 HydrophobicContact CE1-CG 3.8Å; F442-E460 HydrophobicContact CZ-CB 4.19Å; F442-E460 HydrophobicContact CZ-CG 4.12Å; L445-E460 HydrophobicContact CD1-CG 3.77Å; R456-E460 IonicContact CZ-OE2 2.79Å; R456-E460 IonicContact NE-OE2 3.71Å; R456-E460 WeakPolarHBondContact O-CG 3.27Å; R456-E460 PolarHBondContact O-N 3.34Å; V457-E460 PolarHBondContact O-N 2.74Å; R458-E460 VanDerWaalsContact C-N 3.35Å; R458-E460 PolarHBondContact O-N 2.69Å; E460-F464 HydrophobicContact CG-CD2 4.41Å; E460-F464 CarbonylContact O-C 3.49Å; E460-G465 WeakPolarHBondContact O-CA 3.49Å; E460-G465 PolarHBondContact O-N 2.66Å
461	R	94.8	Very high	95.6	Very high	128 Å²	128	39.4 Å²	39.4	48%	0.483	19%	0.189	S	C	.	.	I	π-helix	trans	-78.6	-58.3	-179.7	-172	-175.4	-68.3	170.2	-4.5	112.7	E209 Y220 V457 R458 V459 E466	E209-R461 IonicContact OE1-CZ 3.97Å; E209-R461 VanDerWaalsContact OE1-CZ 3.31Å; E209-R461 IonicContact OE1-NE 3.68Å; E209-R461 PolarHBondContact OE1-NE 2.85Å; E209-R461 IonicContact OE1-NH2 2.69Å; E209-R461 PolarHBondContact OE1-NH2 2.65Å; E209-R461 IonicContact OE2-CZ 3.83Å; E209-R461 IonicContact OE2-NE 3.85Å; E209-R461 IonicContact OE2-NH2 2.73Å; E209-R461 PolarHBondContact OE2-NH2 2.79Å; Y220-R461 HydrophobicContact CE1-CB 4.1Å; Y220-R461 HydrophobicContact CE1-CG 4.28Å; Y220-R461 PolarHBondContact OH-N 2.95Å; V457-R461 WeakPolarHBondContact O-CB 3.31Å; V457-R461 PolarHBondContact O-N 3.44Å; R458-R461 PolarHBondContact O-N 3.41Å; V459-R461 PolarHBondContact O-N 3.34Å; R461-E466 PolarHBondContact O-N 2.93Å
462	C	92	Very high	95.6	Very high	41 Å²	41	34.8 Å²	34.8	28%	0.277	17%	0.172	S	C	.	.	I	π-helix	trans	-80.1	-23.2	-168.4	-60.9	0	0	0	0	113	R458	R458-C462 VanDerWaalsContact O-CB 3.28Å; R458-C462 WeakPolarHBondContact O-CB 3.26Å; R458-C462 PolarHBondContact O-N 3.04Å
463	M	92.5	Very high	95.6	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.025	14%	0.138	C	C	.	.	I	π-helix	trans	-105.7	-61.4	177.5	-172.3	-177.9	-77.7	0	0	111.9	C255 L259 Y327 V459 R467	C255-M463 HydrophobicContact CB-CB 4.25Å; C255-M463 HydrophobicContact CB-CE 3.6Å; L259-M463 HydrophobicContact CD2-SD 3.81Å; Y327-M463 HydrophobicContact CE1-CE 4.38Å; V459-M463 WeakPolarHBondContact O-CA 3.37Å; V459-M463 VanDerWaalsContact O-CB 3.23Å; V459-M463 WeakPolarHBondContact O-CB 3.27Å; V459-M463 PolarHBondContact O-N 3.43Å; V459-M463 VanDerWaalsContact O-N 3.07Å; M463-R467 WeakPolarHBondContact O-CD 3.48Å; M463-R467 VanDerWaalsContact O-CG 3.22Å; M463-R467 WeakPolarHBondContact O-CG 3.42Å; M463-R467 PolarHBondContact O-N 3.29Å; M463-R467 PolarHBondContact SD-NH2 3.47Å
464	F	96.2	Very high	95.5	Very high	6 Å²	6	29 Å²	29	3%	0.026	14%	0.141	C	C	.	.	I	π-helix	trans	-77.2	-44.7	-172.7	-58.7	-24.8	0	0	0	112.9	L259 Y438 V441 F442 L445 V459 E460 E466 R467 I468	L259-F464 HydrophobicContact CD1-CZ 3.93Å; L259-F464 HydrophobicContact CD2-CE1 4.17Å; L259-F464 HydrophobicContact CD2-CZ 4Å; Y438-F464 HydrophobicContact CD1-CB 4.12Å; Y438-F464 HydrophobicContact CD1-CG 4.32Å; Y438-F464 HydrophobicContact CE1-CB 3.86Å; Y438-F464 HydrophobicContact CE1-CD1 4.01Å; Y438-F464 HydrophobicContact CE1-CG 4.03Å; V441-F464 HydrophobicContact CG1-CD2 3.89Å; V441-F464 HydrophobicContact CG1-CE1 4.15Å; V441-F464 HydrophobicContact CG1-CE2 3.27Å; V441-F464 HydrophobicContact CG1-CZ 3.45Å; V441-F464 VanDerWaalsContact CG1-CZ 3.45Å; F442-F464 HydrophobicContact CD2-CD2 4.27Å; F442-F464 HydrophobicContact CE2-CB 3.85Å; F442-F464 AromaticContact CE2-CD2 3.83Å; F442-F464 HydrophobicContact CE2-CD2 3.83Å; F442-F464 HydrophobicContact CE2-CG 4.26Å; F442-F464 HydrophobicContact CZ-CB 4.17Å; F442-F464 HydrophobicContact CZ-CD2 4.38Å; L445-F464 HydrophobicContact CD1-CD2 4.18Å; L445-F464 HydrophobicContact CD1-CE2 3.53Å; L445-F464 HydrophobicContact CD1-CZ 4.49Å; L445-F464 HydrophobicContact CG-CE2 4.29Å; V459-F464 HydrophobicContact CG1-CD2 4.28Å; V459-F464 HydrophobicContact CG1-CE1 4.47Å; V459-F464 HydrophobicContact CG1-CE2 3.83Å; V459-F464 HydrophobicContact CG1-CZ 3.92Å; V459-F464 PolarHBondContact O-N 2.92Å; V459-F464 VanDerWaalsContact O-N 3.14Å; E460-F464 HydrophobicContact CG-CD2 4.41Å; E460-F464 CarbonylContact O-C 3.49Å; F464-E466 VanDerWaalsContact C-N 3.31Å; F464-E466 PolarHBondContact O-N 2.83Å; F464-R467 PolarHBondContact O-N 3.41Å; F464-R467 VanDerWaalsContact O-N 3.12Å; F464-I468 WeakPolarHBondContact O-CB 3.32Å; F464-I468 VanDerWaalsContact O-CG1 3.26Å; F464-I468 WeakPolarHBondContact O-CG1 3.17Å; F464-I468 PolarHBondContact O-N 2.81Å
465	G	96.1	Very high	95.3	Very high	8 Å²	8	27.3 Å²	27.3	8%	0.082	13%	0.127	C	C	.	.	I	π-helix	trans	-58.9	-42.7	178.5	0	0	0	0	0	111.9	E460 I468 R469	E460-G465 WeakPolarHBondContact O-CA 3.49Å; E460-G465 PolarHBondContact O-N 2.66Å; G465-I468 PolarHBondContact O-N 2.88Å; G465-R469 WeakPolarHBondContact O-CB 3.24Å; G465-R469 PolarHBondContact O-N 3.3Å
466	E	93.8	Very high	95.1	Very high	64 Å²	64	26.3 Å²	26.3	30%	0.299	12%	0.122	S	C	.	.	H	α-helix	trans	-64.8	-39.9	174.3	-85.2	-50.9	123.3	0	0	113.5	R461 F464 R469 R470	R461-E466 PolarHBondContact O-N 2.93Å; F464-E466 VanDerWaalsContact C-N 3.31Å; F464-E466 PolarHBondContact O-N 2.83Å; E466-R469 PolarHBondContact O-N 2.95Å; E466-R469 IonicContact OE1-NE 2.81Å; E466-R469 IonicContact OE2-CZ 3.88Å; E466-R469 IonicContact OE2-NE 3.34Å; E466-R469 PolarHBondContact OE2-NE 2.97Å; E466-R469 IonicContact OE2-NH2 3.64Å; E466-R469 PolarHBondContact OE2-NH2 3.02Å; E466-R469 VanDerWaalsContact OE2-NH2 3.15Å; E466-R470 WeakPolarHBondContact O-CG 3.49Å; E466-R470 PolarHBondContact O-N 3.16Å; E466-R470 VanDerWaalsContact O-N 3.09Å; E466-R470 IonicContact OE2-CZ 3.13Å; E466-R470 IonicContact OE2-NH2 3.69Å; E466-R470 PolarHBondContact OE2-NH2 2.87Å
467	R	95.3	Very high	94.9	Very high	15 Å²	15	27.7 Å²	27.7	6%	0.057	14%	0.136	C	C	.	.	H	α-helix	trans	-67.8	-40.1	174.4	-69.7	166.4	-177.4	172.1	4.7	111.9	Y327 Y418 Y438 M463 F464 R469 R470 A471 M484	Y327-R467 PolarHBondContact OH-NH2 3.18Å; Y418-R467 VanDerWaalsContact OH-CZ 3.24Å; Y418-R467 PolarHBondContact OH-NH1 3.19Å; Y418-R467 VanDerWaalsContact OH-NH1 3.13Å; Y418-R467 PolarHBondContact OH-NH2 3.15Å; Y438-R467 WeakPolarHBondContact OH-CB 3.48Å; Y438-R467 WeakPolarHBondContact OH-CD 3.28Å; M463-R467 WeakPolarHBondContact O-CD 3.48Å; M463-R467 VanDerWaalsContact O-CG 3.22Å; M463-R467 WeakPolarHBondContact O-CG 3.42Å; M463-R467 PolarHBondContact O-N 3.29Å; M463-R467 PolarHBondContact SD-NH2 3.47Å; F464-R467 PolarHBondContact O-N 3.41Å; F464-R467 VanDerWaalsContact O-N 3.12Å; R467-R469 VanDerWaalsContact C-N 3.34Å; R467-R470 PolarHBondContact O-N 3.37Å; R467-A471 WeakPolarHBondContact O-CB 3.37Å; R467-A471 PolarHBondContact O-N 3.49Å; R467-M484 HydrophobicContact CG-CE 4.4Å
468	I	97.8	Very high	94.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.4	-48.6	173.1	-70.1	161.6	0	0	0	109.2	F221 A224 Y438 F442 F464 G465 R470 A471 I472	F221-I468 HydrophobicContact CD1-CG2 4.3Å; F221-I468 HydrophobicContact CD2-CD1 3.89Å; F221-I468 HydrophobicContact CD2-CG1 4.28Å; F221-I468 HydrophobicContact CD2-CG2 3.73Å; F221-I468 HydrophobicContact CE1-CG2 4.37Å; F221-I468 HydrophobicContact CE2-CB 4.44Å; F221-I468 HydrophobicContact CE2-CD1 3.52Å; F221-I468 HydrophobicContact CE2-CG1 3.7Å; F221-I468 HydrophobicContact CE2-CG2 3.83Å; F221-I468 HydrophobicContact CG-CG2 3.97Å; F221-I468 HydrophobicContact CZ-CD1 4.44Å; F221-I468 HydrophobicContact CZ-CG1 4.15Å; F221-I468 HydrophobicContact CZ-CG2 4.13Å; A224-I468 HydrophobicContact CB-CG2 4.11Å; Y438-I468 HydrophobicContact CD1-CD1 4.17Å; Y438-I468 HydrophobicContact CD1-CG1 4.26Å; Y438-I468 HydrophobicContact CD2-CD1 4.1Å; Y438-I468 HydrophobicContact CD2-CG1 3.53Å; Y438-I468 HydrophobicContact CE1-CG1 4.33Å; Y438-I468 HydrophobicContact CE2-CG1 3.63Å; Y438-I468 HydrophobicContact CG-CD1 3.93Å; Y438-I468 HydrophobicContact CG-CG1 3.89Å; F442-I468 HydrophobicContact CE2-CD1 4.3Å; F442-I468 HydrophobicContact CZ-CD1 4.46Å; F464-I468 WeakPolarHBondContact O-CB 3.32Å; F464-I468 VanDerWaalsContact O-CG1 3.26Å; F464-I468 WeakPolarHBondContact O-CG1 3.17Å; F464-I468 PolarHBondContact O-N 2.81Å; G465-I468 PolarHBondContact O-N 2.88Å; I468-R470 VanDerWaalsContact C-N 3.29Å; I468-R470 PolarHBondContact O-N 3.36Å; I468-A471 PolarHBondContact O-N 3.04Å; I468-A471 VanDerWaalsContact O-N 3.14Å; I468-I472 HydrophobicContact CG2-CD1 3.95Å; I468-I472 HydrophobicContact CG2-CG1 3.95Å; I468-I472 WeakPolarHBondContact O-CG1 3.29Å; I468-I472 PolarHBondContact O-N 3.14Å
469	R	96	Very high	94.4	Very high	45 Å²	45	34.1 Å²	34.1	17%	0.17	18%	0.182	C	C	.	.	H	α-helix	trans	-56.3	-40.7	177.3	-170.3	-166.8	64.9	73	-5.4	112.3	G465 E466 R467 G473 E475	G465-R469 WeakPolarHBondContact O-CB 3.24Å; G465-R469 PolarHBondContact O-N 3.3Å; E466-R469 PolarHBondContact O-N 2.95Å; E466-R469 IonicContact OE1-NE 2.81Å; E466-R469 IonicContact OE2-CZ 3.88Å; E466-R469 IonicContact OE2-NE 3.34Å; E466-R469 PolarHBondContact OE2-NE 2.97Å; E466-R469 IonicContact OE2-NH2 3.64Å; E466-R469 PolarHBondContact OE2-NH2 3.02Å; E466-R469 VanDerWaalsContact OE2-NH2 3.15Å; R467-R469 VanDerWaalsContact C-N 3.34Å; R469-G473 WeakPolarHBondContact O-CA 3.36Å; R469-G473 PolarHBondContact O-N 3.29Å; R469-E475 IonicContact CZ-OE1 3.93Å; R469-E475 IonicContact NH1-OE1 2.94Å; R469-E475 PolarHBondContact NH1-OE1 3.28Å; R469-E475 IonicContact NH2-OE1 3.99Å
470	R	94.3	Very high	94.4	Very high	17 Å²	17	34.7 Å²	34.7	6%	0.064	18%	0.184	C	C	.	.	H	α-helix	trans	-72.9	-35	177.6	-68.9	177.7	-160	111.6	28.9	113.2	R246 E466 R467 I468 R480 D482	R246-R470 VanDerWaalsContact CD-NE 3.33Å; E466-R470 WeakPolarHBondContact O-CG 3.49Å; E466-R470 PolarHBondContact O-N 3.16Å; E466-R470 VanDerWaalsContact O-N 3.09Å; E466-R470 IonicContact OE2-CZ 3.13Å; E466-R470 IonicContact OE2-NH2 3.69Å; E466-R470 PolarHBondContact OE2-NH2 2.87Å; R467-R470 PolarHBondContact O-N 3.37Å; I468-R470 VanDerWaalsContact C-N 3.29Å; I468-R470 PolarHBondContact O-N 3.36Å; R470-R480 WeakPolarHBondContact O-CG 3.38Å; R470-D482 HydrophobicContact CB-CB 4.48Å; R470-D482 WeakPolarHBondContact CD-OD2 3.41Å; R470-D482 IonicContact CZ-OD2 2.73Å; R470-D482 IonicContact NE-OD2 2.66Å; R470-D482 PolarHBondContact NE-OD2 3.2Å; R470-D482 IonicContact NH1-OD2 2.68Å; R470-D482 PolarHBondContact NH1-OD2 3.46Å
471	A	96.7	Very high	94.1	Very high	6 Å²	6	37.1 Å²	37.1	5%	0.05	20%	0.199	C	C	.	.	H	α-helix	trans	-69.4	-40.5	179.9	0	0	0	0	0	113.1	L422 R430 R467 I468	L422-A471 HydrophobicContact CD1-CB 4Å; R430-A471 PolarHBondContact NE-O 3.49Å; R467-A471 WeakPolarHBondContact O-CB 3.37Å; R467-A471 PolarHBondContact O-N 3.49Å; I468-A471 PolarHBondContact O-N 3.04Å; I468-A471 VanDerWaalsContact O-N 3.14Å
472	I	96.8	Very high	93.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-128.8	1.7	-168	63.2	148.9	0	0	0	114.9	F221 A224 R228 F427 F431 A434 I468	F221-I472 HydrophobicContact CB-CD1 4.29Å; F221-I472 HydrophobicContact CD1-CD1 3.43Å; F221-I472 VanDerWaalsContact CD1-CD1 3.43Å; F221-I472 HydrophobicContact CE1-CD1 3.96Å; F221-I472 HydrophobicContact CG-CD1 4.05Å; A224-I472 HydrophobicContact CB-CD1 3.69Å; A224-I472 HydrophobicContact CB-CG1 3.73Å; R228-I472 WeakPolarHBondContact CD-O 3.41Å; F427-I472 HydrophobicContact CE2-CB 4.25Å; F427-I472 WeakPolarHBondContact CE2-O 3.45Å; F431-I472 HydrophobicContact CB-CG2 4.21Å; F431-I472 HydrophobicContact CD2-CB 4.04Å; F431-I472 HydrophobicContact CD2-CD1 3.66Å; F431-I472 HydrophobicContact CD2-CG1 4.48Å; F431-I472 HydrophobicContact CD2-CG2 4.04Å; F431-I472 HydrophobicContact CE2-CD1 3.42Å; F431-I472 VanDerWaalsContact CE2-CD1 3.42Å; F431-I472 HydrophobicContact CG-CG2 4.41Å; F431-I472 HydrophobicContact CZ-CD1 4.26Å; A434-I472 HydrophobicContact CB-CG2 4.35Å; I468-I472 HydrophobicContact CG2-CD1 3.95Å; I468-I472 HydrophobicContact CG2-CG1 3.95Å; I468-I472 WeakPolarHBondContact O-CG1 3.29Å; I468-I472 PolarHBondContact O-N 3.14Å
473	G	95.5	Very high	94.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.01	17%	0.169	C	C	.	.	S	Bend	trans	-78.1	-152.9	179.1	0	0	0	0	0	113.7	R228 R469	R228-G473 WeakPolarHBondContact CG-O 3.08Å; R228-G473 PolarHBondContact NH1-O 3.24Å; R469-G473 WeakPolarHBondContact O-CA 3.36Å; R469-G473 PolarHBondContact O-N 3.29Å
474	P	93.4	Very high	94.4	Very high	24 Å²	24	30.2 Å²	30.2	16%	0.156	17%	0.169	C	C	.	.	S	Bend	trans	-75.7	-25.9	-172.8	29.2	-35	0	0	0	114.5	C231	C231-P474 HydrophobicContact CB-CB 3.67Å
475	E	92.4	Very high	94.5	Very high	43 Å²	43	30 Å²	30	20%	0.201	17%	0.167	C	C	.	.			trans	-68.6	134	-176.1	-66.5	159.4	-148.8	0	0	111.3	R469 E479 R480	R469-E475 IonicContact CZ-OE1 3.93Å; R469-E475 IonicContact NH1-OE1 2.94Å; R469-E475 PolarHBondContact NH1-OE1 3.28Å; R469-E475 IonicContact NH2-OE1 3.99Å; E475-E479 HydrophobicContact CB-CB 4.28Å; E475-E479 HydrophobicContact CG-CB 4.42Å; E475-R480 HydrophobicContact CB-CB 4.3Å
476	E	92.4	Very high	94.6	Very high	61 Å²	61	30.7 Å²	30.7	29%	0.285	17%	0.172	S	C	.	.			trans	-140.8	167.6	176.6	-71.4	-67.3	-175.3	0	0	110.8	R228 R430 A478 E479 R480	R228-E476 IonicContact CZ-OE1 3.24Å; R228-E476 VanDerWaalsContact CZ-OE1 3.24Å; R228-E476 IonicContact NH1-OE1 2.77Å; R228-E476 PolarHBondContact NH1-OE1 3.14Å; R228-E476 IonicContact NH2-OE1 2.82Å; R228-E476 PolarHBondContact NH2-OE1 3.39Å; R430-E476 IonicContact CZ-OE1 3.58Å; R430-E476 IonicContact CZ-OE2 3.95Å; R430-E476 IonicContact NH1-OE1 2.56Å; R430-E476 IonicContact NH1-OE2 3.5Å; R430-E476 PolarHBondContact NH1-OE2 2.92Å; R430-E476 IonicContact NH2-OE1 2.86Å; R430-E476 PolarHBondContact NH2-OE1 3.49Å; R430-E476 IonicContact NH2-OE2 3.83Å; R430-E476 PolarHBondContact NH2-OE2 3.36Å; E476-A478 PolarHBondContact O-N 3.39Å; E476-E479 PolarHBondContact O-N 3.27Å; E476-R480 IonicContact OE2-NE 3.3Å; E476-R480 PolarHBondContact OE2-NE 3Å
477	G	92.2	Very high	94.8	Very high	28 Å²	28	28.3 Å²	28.3	29%	0.289	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	57.6	-131.5	178.8	0	0	0	0	0	112	E479 R480 R483	G477-E479 VanDerWaalsContact C-N 3.27Å; G477-E479 PolarHBondContact O-N 3.03Å; G477-R480 PolarHBondContact O-N 2.89Å; G477-R483 PolarHBondContact O-NH2 2.74Å
478	A	91.1	Very high	94.9	Very high	83 Å²	83	33.6 Å²	33.6	69%	0.686	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-66	-25.4	-179.7	0	0	0	0	0	113.9	E476 R480	E476-A478 PolarHBondContact O-N 3.39Å; A478-R480 VanDerWaalsContact C-N 3.34Å
479	E	90.9	Very high	94.9	Very high	141 Å²	141	35.5 Å²	35.5	66%	0.659	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-75.6	-24.8	-179.9	-59.4	-57.9	130.7	0	0	112.3	E475 E476 G477 T481	E475-E479 HydrophobicContact CB-CB 4.28Å; E475-E479 HydrophobicContact CG-CB 4.42Å; E476-E479 PolarHBondContact O-N 3.27Å; G477-E479 VanDerWaalsContact C-N 3.27Å; G477-E479 PolarHBondContact O-N 3.03Å; E479-T481 PolarHBondContact O-N 2.83Å
480	R	94.1	Very high	95	Very high	12 Å²	12	33.5 Å²	33.5	5%	0.045	18%	0.184	C	C	.	.			trans	-76.4	108.8	-179.2	-176.1	161.4	58.5	78.9	-0.3	110.9	L422 N423 R470 E475 E476 G477 A478 R483	L422-R480 PolarHBondContact O-NH1 3.39Å; N423-R480 PolarHBondContact O-NH1 3.42Å; N423-R480 VanDerWaalsContact O-NH1 3.16Å; N423-R480 PolarHBondContact O-NH2 2.9Å; R470-R480 WeakPolarHBondContact O-CG 3.38Å; E475-R480 HydrophobicContact CB-CB 4.3Å; E476-R480 IonicContact OE2-NE 3.3Å; E476-R480 PolarHBondContact OE2-NE 3Å; G477-R480 PolarHBondContact O-N 2.89Å; A478-R480 VanDerWaalsContact C-N 3.34Å; R480-R483 VanDerWaalsContact CZ-CZ 3.45Å; R480-R483 VanDerWaalsContact NH2-NH1 3.15Å; R480-R483 PolarHBondContact O-NE 2.98Å
481	T	92	Very high	95.2	Very high	50 Å²	50	34.6 Å²	34.6	31%	0.307	19%	0.19	S	C	.	.			trans	-102.5	177.8	179.5	57	0	0	0	0	112.3	R246 E479 R483	R246-T481 PolarHBondContact NH1-OG1 3.02Å; R246-T481 VanDerWaalsContact NH1-OG1 3.14Å; E479-T481 PolarHBondContact O-N 2.83Å; T481-R483 VanDerWaalsContact C-N 3.25Å; T481-R483 PolarHBondContact O-N 3.12Å
482	D	90.8	Very high	95.3	Very high	21 Å²	21	37.6 Å²	37.6	11%	0.112	21%	0.208	C	C	.	.	S	Bend	trans	53.3	39.4	-179.7	-64.6	-30.8	0	0	0	114	Y388 H389 R470	Y388-D482 HydrophobicContact CE2-CB 4.14Å; H389-D482 IonicContact CE1-OD1 3.46Å; H389-D482 PolarHBondContact CE1-OD1 3.37Å; H389-D482 IonicContact ND1-OD1 3.64Å; H389-D482 PolarHBondContact ND1-OD1 3.14Å; R470-D482 HydrophobicContact CB-CB 4.48Å; R470-D482 WeakPolarHBondContact CD-OD2 3.41Å; R470-D482 IonicContact CZ-OD2 2.73Å; R470-D482 IonicContact NE-OD2 2.66Å; R470-D482 PolarHBondContact NE-OD2 3.2Å; R470-D482 IonicContact NH1-OD2 2.68Å; R470-D482 PolarHBondContact NH1-OD2 3.46Å
483	R	97.1	Very high	95.3	Very high	7 Å²	7	37.8 Å²	37.8	3%	0.026	21%	0.209	C	C	.	.			trans	-64.7	140.6	174.7	-74.8	155.8	177.1	-97.8	6	109.6	Y388 L391 N423 G477 R480 T481	Y388-R483 VanDerWaalsContact CB-O 3.29Å; Y388-R483 WeakPolarHBondContact CB-O 3.26Å; Y388-R483 WeakPolarHBondContact CD2-O 3.42Å; Y388-R483 VanDerWaalsContact O-O 3.1Å; L391-R483 HydrophobicContact CB-CB 3.73Å; L391-R483 HydrophobicContact CD1-CB 4.46Å; L391-R483 WeakPolarHBondContact O-CD 3.46Å; N423-R483 HydrophobicContact CB-CB 4.34Å; N423-R483 PolarHBondContact O-NH1 2.89Å; N423-R483 WeakPolarHBondContact OD1-CD 3.41Å; N423-R483 PolarHBondContact OD1-NH1 3.4Å; G477-R483 PolarHBondContact O-NH2 2.74Å; R480-R483 VanDerWaalsContact CZ-CZ 3.45Å; R480-R483 VanDerWaalsContact NH2-NH1 3.15Å; R480-R483 PolarHBondContact O-NE 2.98Å; T481-R483 VanDerWaalsContact C-N 3.25Å; T481-R483 PolarHBondContact O-N 3.12Å
484	M	98.4	Very high	95.5	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.209	C	C	.	.			trans	-119.2	147.3	175.2	-63	173.8	-177.6	0	0	109.6	Y388 Y418 V420 L422 N423 R467	Y388-M484 HydrophobicContact CD2-CG 4.26Å; Y388-M484 HydrophobicContact CE2-CE 4.35Å; Y418-M484 HydrophobicContact CD2-CE 3.46Å; Y418-M484 VanDerWaalsContact CD2-CE 3.46Å; Y418-M484 HydrophobicContact CD2-CG 4.14Å; Y418-M484 HydrophobicContact CD2-SD 3.72Å; Y418-M484 HydrophobicContact CE2-CE 3.73Å; Y418-M484 HydrophobicContact CG-CE 4.16Å; Y418-M484 HydrophobicContact CG-SD 3.98Å; V420-M484 HydrophobicContact CG1-CB 3.72Å; V420-M484 HydrophobicContact CG1-CG 4.32Å; V420-M484 HydrophobicContact CG1-SD 3.66Å; V420-M484 CarbonylContact O-C 3.56Å; L422-M484 CarbonylContact C-O 3.48Å; L422-M484 VanDerWaalsContact C-O 3.31Å; L422-M484 WeakPolarHBondContact CA-O 3.27Å; L422-M484 HydrophobicContact CB-CB 4.26Å; L422-M484 HydrophobicContact CD1-CB 4.37Å; L422-M484 HydrophobicContact CD1-SD 4.2Å; L422-M484 HydrophobicContact CG-CB 4.45Å; L422-M484 PolarHBondContact N-O 3.42Å; N423-M484 PolarHBondContact N-O 3.01Å; R467-M484 HydrophobicContact CG-CE 4.4Å
485	A	98.3	Very high	95.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.			trans	-127.9	146.6	-178.2	0	0	0	0	0	110.2	L391 Y418 V420 E489 W490	L391-A485 HydrophobicContact CD1-CB 3.78Å; Y418-A485 VanDerWaalsContact O-O 3.09Å; V420-A485 CarbonylContact O-C 3.52Å; V420-A485 VanDerWaalsContact O-C 3.28Å; V420-A485 WeakPolarHBondContact O-CA 3.24Å; V420-A485 PolarHBondContact O-N 2.82Å; A485-E489 HydrophobicContact CB-CB 4.03Å; A485-E489 HydrophobicContact CB-CG 3.9Å; A485-E489 WeakPolarHBondContact CB-OE2 3.26Å; A485-W490 HydrophobicContact CB-CD2 4.46Å; A485-W490 HydrophobicContact CB-CZ2 4.33Å; A485-W490 VanDerWaalsContact O-CD1 3.26Å; A485-W490 PolarHBondContact O-NE1 3.31Å
486	A	97.8	Very high	96	Very high	23 Å²	23	46.9 Å²	46.9	19%	0.19	24%	0.242	C	C	.	.			trans	-77.4	161	174.7	0	0	0	0	0	111.1	R488 E489 W490	A486-R488 PolarHBondContact O-N 2.99Å; A486-E489 PolarHBondContact O-N 3.43Å; A486-W490 PolarHBondContact O-N 3.09Å
487	S	98	Very high	96.2	Very high	14 Å²	14	44.5 Å²	44.5	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-41.5	-44.2	178.4	48	0	0	0	0	114.7	E419 E489 W490 Q491 F534	E419-S487 WeakPolarHBondContact OE1-CB 3.27Å; E419-S487 PolarHBondContact OE1-N 3.19Å; E419-S487 PolarHBondContact OE1-OG 3.46Å; E419-S487 WeakPolarHBondContact OE2-CB 3.49Å; E419-S487 PolarHBondContact OE2-N 2.95Å; E419-S487 VanDerWaalsContact OE2-N 3.14Å; S487-E489 PolarHBondContact O-N 2.82Å; S487-W490 PolarHBondContact O-N 3.21Å; S487-Q491 WeakPolarHBondContact O-CB 3.46Å; S487-Q491 PolarHBondContact O-N 2.85Å; S487-F534 VanDerWaalsContact O-CZ 3.27Å; S487-F534 WeakPolarHBondContact O-CZ 3.44Å
488	R	97	Very high	96.5	Very high	127 Å²	127	45.4 Å²	45.4	48%	0.479	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-36.8	179.8	-174.1	175.4	178.7	179.1	-2.5	114	A486 T492	A486-R488 PolarHBondContact O-N 2.99Å; R488-T492 PolarHBondContact O-N 3.37Å; R488-T492 VanDerWaalsContact O-N 3.15Å; R488-T492 PolarHBondContact O-OG1 2.7Å
489	E	97.8	Very high	96.9	Very high	39 Å²	39	41.8 Å²	41.8	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-72.9	-40.5	177.5	178.7	172.6	-177.9	0	0	110.2	N423 R424 A485 A486 S487 T492 L493	N423-E489 PolarHBondContact ND2-OE1 3.24Å; R424-E489 IonicContact NE-OE1 3.42Å; A485-E489 HydrophobicContact CB-CB 4.03Å; A485-E489 HydrophobicContact CB-CG 3.9Å; A485-E489 WeakPolarHBondContact CB-OE2 3.26Å; A486-E489 PolarHBondContact O-N 3.43Å; S487-E489 PolarHBondContact O-N 2.82Å; E489-T492 WeakPolarHBondContact O-CB 3.14Å; E489-T492 PolarHBondContact O-N 3.05Å; E489-L493 PolarHBondContact O-N 3.23Å
490	W	98.4	Very high	97.2	Very high	3 Å²	3	39.6 Å²	39.6	1%	0.011	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-44	171.2	-73.9	120.4	0	0	0	112.7	L387 L391 V398 L415 E417 A485 A486 S487 T492 L493 M494	L387-W490 HydrophobicContact CB-CH2 3.82Å; L387-W490 HydrophobicContact CB-CZ3 4.1Å; L387-W490 HydrophobicContact CD2-CE3 4.11Å; L387-W490 HydrophobicContact CD2-CH2 4.07Å; L387-W490 HydrophobicContact CD2-CZ3 3.45Å; L387-W490 VanDerWaalsContact CD2-CZ3 3.45Å; L387-W490 HydrophobicContact CG-CH2 3.83Å; L387-W490 HydrophobicContact CG-CZ3 3.69Å; L391-W490 HydrophobicContact CD1-CH2 3.83Å; L391-W490 HydrophobicContact CD1-CZ2 3.7Å; L391-W490 HydrophobicContact CD2-CH2 4.09Å; L391-W490 HydrophobicContact CD2-CZ3 4.41Å; L391-W490 HydrophobicContact CG-CH2 3.91Å; L391-W490 HydrophobicContact CG-CZ2 4.3Å; V398-W490 HydrophobicContact CG2-CZ3 4.13Å; L415-W490 HydrophobicContact CD2-CB 4.06Å; L415-W490 HydrophobicContact CD2-CD2 4.25Å; L415-W490 HydrophobicContact CD2-CE3 4.25Å; L415-W490 HydrophobicContact CD2-CG 4.2Å; E417-W490 HydrophobicContact CG-CD2 4.28Å; E417-W490 HydrophobicContact CG-CZ2 3.8Å; A485-W490 HydrophobicContact CB-CD2 4.46Å; A485-W490 HydrophobicContact CB-CZ2 4.33Å; A485-W490 VanDerWaalsContact O-CD1 3.26Å; A485-W490 PolarHBondContact O-NE1 3.31Å; A486-W490 PolarHBondContact O-N 3.09Å; S487-W490 PolarHBondContact O-N 3.21Å; W490-T492 VanDerWaalsContact C-N 3.3Å; W490-T492 PolarHBondContact O-N 3.15Å; W490-L493 HydrophobicContact CE3-CD1 3.98Å; W490-L493 HydrophobicContact CZ3-CD1 4.03Å; W490-L493 PolarHBondContact O-N 3.22Å; W490-M494 VanDerWaalsContact O-CG 3.28Å; W490-M494 WeakPolarHBondContact O-CG 3.45Å; W490-M494 PolarHBondContact O-N 3.45Å
491	Q	98.3	Very high	97.4	Very high	40 Å²	40	41.2 Å²	41.2	19%	0.187	21%	0.212	C	C	.	.	H	α-helix	trans	-53.9	-49.6	173.7	175	-178.3	9.4	0	0	111.2	S487 L493 M494 E495 F534 W550	S487-Q491 WeakPolarHBondContact O-CB 3.46Å; S487-Q491 PolarHBondContact O-N 2.85Å; Q491-L493 VanDerWaalsContact C-N 3.31Å; Q491-L493 PolarHBondContact O-N 2.84Å; Q491-M494 PolarHBondContact O-N 3.02Å; Q491-E495 HydrophobicContact CG-CG 4.29Å; Q491-E495 VanDerWaalsContact CG-OE1 3.3Å; Q491-E495 WeakPolarHBondContact CG-OE1 3.47Å; Q491-E495 PolarHBondContact NE2-OE1 2.86Å; Q491-E495 WeakPolarHBondContact O-CB 3.36Å; Q491-E495 WeakPolarHBondContact O-CG 2.97Å; Q491-E495 PolarHBondContact O-N 3.21Å; Q491-F534 HydrophobicContact CB-CE2 4.12Å; Q491-F534 HydrophobicContact CB-CZ 3.93Å; Q491-W550 HydrophobicContact CB-CH2 4Å; Q491-W550 HydrophobicContact CG-CH2 4Å
492	T	97.9	Very high	97.7	Very high	70 Å²	70	40.8 Å²	40.8	43%	0.429	21%	0.209	S	C	.	.	H	α-helix	trans	-59.9	-42.2	-179.4	-55.3	0	0	0	0	111.3	R488 E489 W490 W496	R488-T492 PolarHBondContact O-N 3.37Å; R488-T492 VanDerWaalsContact O-N 3.15Å; R488-T492 PolarHBondContact O-OG1 2.7Å; E489-T492 WeakPolarHBondContact O-CB 3.14Å; E489-T492 PolarHBondContact O-N 3.05Å; W490-T492 VanDerWaalsContact C-N 3.3Å; W490-T492 PolarHBondContact O-N 3.15Å; T492-W496 VanDerWaalsContact O-CB 3.27Å; T492-W496 WeakPolarHBondContact O-CB 2.88Å; T492-W496 PolarHBondContact O-N 2.96Å
493	L	98.1	Very high	97.9	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-44.2	178	-76.2	169.4	0	0	0	112.5	L391 D395 V398 R399 L402 E489 W490 Q491 W496 C497	L391-L493 HydrophobicContact CD2-CD1 3.97Å; D395-L493 HydrophobicContact CB-CD2 4.17Å; V398-L493 HydrophobicContact CG1-CD2 4.4Å; R399-L493 HydrophobicContact CG-CD2 4.46Å; L402-L493 HydrophobicContact CD1-CB 4.39Å; E489-L493 PolarHBondContact O-N 3.23Å; W490-L493 HydrophobicContact CE3-CD1 3.98Å; W490-L493 HydrophobicContact CZ3-CD1 4.03Å; W490-L493 PolarHBondContact O-N 3.22Å; Q491-L493 VanDerWaalsContact C-N 3.31Å; Q491-L493 PolarHBondContact O-N 2.84Å; L493-W496 PolarHBondContact O-N 2.75Å; L493-C497 PolarHBondContact O-N 3.46Å; L493-C497 VanDerWaalsContact O-N 3.11Å
494	M	98.6	Very high	97.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-48.7	178.6	-68.1	-60.9	-75.2	0	0	111.1	L402 V413 L415 W490 Q491 W496 C497 G498 F499 W550	L402-M494 HydrophobicContact CD1-SD 3.98Å; L402-M494 HydrophobicContact CD2-CE 4.38Å; L402-M494 HydrophobicContact CD2-SD 3.51Å; L402-M494 VanDerWaalsContact CD2-SD 3.51Å; L402-M494 HydrophobicContact CG-SD 4.4Å; V413-M494 HydrophobicContact CB-CE 4.48Å; V413-M494 HydrophobicContact CG1-CE 4.19Å; L415-M494 HydrophobicContact CD2-CG 4.25Å; L415-M494 HydrophobicContact CD2-SD 4.41Å; W490-M494 VanDerWaalsContact O-CG 3.28Å; W490-M494 WeakPolarHBondContact O-CG 3.45Å; W490-M494 PolarHBondContact O-N 3.45Å; Q491-M494 PolarHBondContact O-N 3.02Å; M494-W496 PolarHBondContact O-N 2.99Å; M494-C497 CarbonylContact O-C 3.5Å; M494-C497 PolarHBondContact O-N 3.35Å; M494-C497 VanDerWaalsContact O-N 3.11Å; M494-G498 PolarHBondContact O-N 2.88Å; M494-F499 HydrophobicContact CB-CB 4.26Å; M494-F499 HydrophobicContact CE-CB 4.19Å; M494-F499 HydrophobicContact CE-CD1 4.44Å; M494-F499 HydrophobicContact CE-CD2 3.84Å; M494-F499 HydrophobicContact CE-CE2 4.34Å; M494-F499 HydrophobicContact CE-CG 3.9Å; M494-F499 WeakPolarHBondContact O-CB 3.46Å; M494-F499 WeakPolarHBondContact O-CD2 3.41Å; M494-F499 PolarHBondContact O-N 3.08Å; M494-F499 HydrophobicContact SD-CD2 4.33Å; M494-W550 HydrophobicContact CB-CD2 3.78Å; M494-W550 HydrophobicContact CB-CE3 3.54Å; M494-W550 HydrophobicContact CB-CH2 3.87Å; M494-W550 HydrophobicContact CB-CZ2 4.04Å; M494-W550 HydrophobicContact CB-CZ3 3.58Å; M494-W550 HydrophobicContact CE-CB 3.66Å; M494-W550 HydrophobicContact CE-CD2 3.74Å; M494-W550 HydrophobicContact CE-CE3 4.44Å; M494-W550 HydrophobicContact CE-CG 3.32Å; M494-W550 HydrophobicContact CG-CD2 3.87Å; M494-W550 HydrophobicContact CG-CE3 4.17Å; M494-W550 HydrophobicContact CG-CG 4.44Å; M494-W550 HydrophobicContact CG-CH2 4.28Å; M494-W550 HydrophobicContact CG-CZ2 3.94Å; M494-W550 HydrophobicContact CG-CZ3 4.36Å
495	E	98.3	Very high	97.6	Very high	89 Å²	89	48.6 Å²	48.6	42%	0.416	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-40.4	177.9	-71	174.8	178	0	0	112.1	Q491 C497 G498 F499 W550	Q491-E495 HydrophobicContact CG-CG 4.29Å; Q491-E495 VanDerWaalsContact CG-OE1 3.3Å; Q491-E495 WeakPolarHBondContact CG-OE1 3.47Å; Q491-E495 PolarHBondContact NE2-OE1 2.86Å; Q491-E495 WeakPolarHBondContact O-CB 3.36Å; Q491-E495 WeakPolarHBondContact O-CG 2.97Å; Q491-E495 PolarHBondContact O-N 3.21Å; E495-C497 PolarHBondContact O-N 3.18Å; E495-G498 PolarHBondContact O-N 3.47Å; E495-F499 WeakPolarHBondContact CA-O 3.49Å; E495-W550 HydrophobicContact CG-CZ3 4.28Å
496	W	97.7	Very high	97.3	Very high	169 Å²	169	53.8 Å²	53.8	64%	0.64	27%	0.273	S	S	*	.	H	α-helix	trans	-59.4	-38.6	174.4	-162.6	-37.3	0	0	0	111.3	T492 L493 M494 G498	T492-W496 VanDerWaalsContact O-CB 3.27Å; T492-W496 WeakPolarHBondContact O-CB 2.88Å; T492-W496 PolarHBondContact O-N 2.96Å; L493-W496 PolarHBondContact O-N 2.75Å; M494-W496 PolarHBondContact O-N 2.99Å; W496-G498 PolarHBondContact O-N 3.22Å
497	C	98.2	Very high	97	Very high	12 Å²	12	58.7 Å²	58.7	8%	0.081	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	9.4	177.2	-73	0	0	0	0	114.2	L402 L493 M494 E495 F499	L402-C497 HydrophobicContact CB-CB 3.72Å; L402-C497 VanDerWaalsContact CB-SG 3.56Å; L402-C497 HydrophobicContact CD1-CB 4.26Å; L493-C497 PolarHBondContact O-N 3.46Å; L493-C497 VanDerWaalsContact O-N 3.11Å; M494-C497 CarbonylContact O-C 3.5Å; M494-C497 PolarHBondContact O-N 3.35Å; M494-C497 VanDerWaalsContact O-N 3.11Å; E495-C497 PolarHBondContact O-N 3.18Å; C497-F499 HydrophobicContact CB-CD2 4.08Å; C497-F499 HydrophobicContact CB-CE2 4.18Å
498	G	98	Very high	96.7	Very high	46 Å²	46	58.1 Å²	58.1	47%	0.474	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	19.4	172.8	0	0	0	0	0	114.3	K406 M494 E495 W496	K406-G498 WeakPolarHBondContact CE-O 3.07Å; K406-G498 PolarHBondContact NZ-O 2.93Å; M494-G498 PolarHBondContact O-N 2.88Å; E495-G498 PolarHBondContact O-N 3.47Å; W496-G498 PolarHBondContact O-N 3.22Å
499	F	98.6	Very high	96.4	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.031	27%	0.27	C	S	.	.			trans	-92.3	150.9	171.4	-65.4	-79	0	0	0	111.6	L402 V405 K406 P410 V413 M494 E495 C497 W550 R551	L402-F499 HydrophobicContact CB-CE2 4.32Å; L402-F499 HydrophobicContact CD2-CE2 4.4Å; V405-F499 HydrophobicContact CB-CZ 4.47Å; V405-F499 HydrophobicContact CG1-CZ 3.97Å; K406-F499 HydrophobicContact CB-CE1 4.24Å; K406-F499 HydrophobicContact CB-CE2 4Å; K406-F499 HydrophobicContact CB-CZ 3.6Å; K406-F499 HydrophobicContact CD-CD1 3.79Å; K406-F499 HydrophobicContact CD-CD2 4.47Å; K406-F499 HydrophobicContact CD-CE1 3.44Å; K406-F499 VanDerWaalsContact CD-CE1 3.44Å; K406-F499 HydrophobicContact CD-CE2 4.18Å; K406-F499 HydrophobicContact CD-CG 4.29Å; K406-F499 HydrophobicContact CD-CZ 3.66Å; K406-F499 HydrophobicContact CG-CE1 4.45Å; K406-F499 HydrophobicContact CG-CZ 4.22Å; P410-F499 HydrophobicContact CG-CE1 4.3Å; V413-F499 HydrophobicContact CB-CE1 4.48Å; V413-F499 HydrophobicContact CG2-CD1 4.17Å; V413-F499 HydrophobicContact CG2-CE1 3.52Å; V413-F499 HydrophobicContact CG2-CZ 4.11Å; M494-F499 HydrophobicContact CB-CB 4.26Å; M494-F499 HydrophobicContact CE-CB 4.19Å; M494-F499 HydrophobicContact CE-CD1 4.44Å; M494-F499 HydrophobicContact CE-CD2 3.84Å; M494-F499 HydrophobicContact CE-CE2 4.34Å; M494-F499 HydrophobicContact CE-CG 3.9Å; M494-F499 WeakPolarHBondContact O-CB 3.46Å; M494-F499 WeakPolarHBondContact O-CD2 3.41Å; M494-F499 PolarHBondContact O-N 3.08Å; M494-F499 HydrophobicContact SD-CD2 4.33Å; E495-F499 WeakPolarHBondContact CA-O 3.49Å; C497-F499 HydrophobicContact CB-CD2 4.08Å; C497-F499 HydrophobicContact CB-CE2 4.18Å; F499-W550 HydrophobicContact CB-CB 4.13Å; F499-W550 HydrophobicContact CB-CE3 4.09Å; F499-W550 HydrophobicContact CD1-CB 4.34Å; F499-W550 HydrophobicContact CG-CB 4.46Å; F499-R551 VanDerWaalsContact CA-O 3.3Å; F499-R551 WeakPolarHBondContact CA-O 3.49Å
500	E	98.2	Very high	96.1	Very high	95 Å²	95	55.1 Å²	55.1	44%	0.444	28%	0.283	S	S	.	.			trans	-118.2	146.3	169.1	60.7	177	-154.2	0	0	111.3	W550 R551	E500-W550 CarbonylContact O-C 3.16Å; E500-W550 VanDerWaalsContact O-CA 3.28Å; E500-W550 WeakPolarHBondContact O-CA 3.38Å; E500-R551 HydrophobicContact CG-CG 3.7Å; E500-R551 PolarHBondContact N-O 3.47Å; E500-R551 PolarHBondContact O-N 2.86Å; E500-R551 IonicContact OE1-CZ 3.53Å; E500-R551 IonicContact OE1-NE 3.58Å; E500-R551 PolarHBondContact OE1-NE 2.94Å; E500-R551 IonicContact OE1-NH2 2.91Å; E500-R551 PolarHBondContact OE1-NH2 3.37Å
501	P	98.1	Very high	95.6	Very high	46 Å²	46	56 Å²	56	30%	0.299	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	135.8	-178.5	26.7	-33.6	0	0	0	111.5	P532 A533 W550	P501-P532 HydrophobicContact CB-CG 4.13Å; P501-P532 HydrophobicContact CG-CG 3.98Å; P501-A533 HydrophobicContact CB-CB 4.14Å; P501-W550 HydrophobicContact CB-CE3 4.25Å; P501-W550 HydrophobicContact CB-CH2 4.26Å; P501-W550 HydrophobicContact CB-CZ3 3.92Å; P501-W550 HydrophobicContact CG-CZ3 4.38Å
502	V	97.7	Very high	95.3	Very high	41 Å²	41	54.1 Å²	54.1	25%	0.248	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.5	172.7	179.1	0	0	0	0	108.3	L504 A549 R551	V502-L504 PolarHBondContact O-N 3.05Å; V502-A549 HydrophobicContact CB-CB 3.94Å; V502-A549 HydrophobicContact CG1-CB 4.39Å; V502-A549 PolarHBondContact N-O 3.25Å; V502-R551 HydrophobicContact CG2-CB 3.93Å; V502-R551 HydrophobicContact CG2-CG 3.69Å
503	K	96.5	Very high	95	Very high	155 Å²	155	55.1 Å²	55.1	67%	0.674	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-64.1	122.4	177.8	-173.3	178	178.9	178.8	0	110
504	L	95.5	Very high	94.7	Very high	16 Å²	16	56.7 Å²	56.7	8%	0.084	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-62.4	141.3	170.7	-64.4	173.8	0	0	0	110.3	T272 A276 V502 A508 L535 A549	T272-L504 HydrophobicContact CG2-CD1 3.88Å; T272-L504 HydrophobicContact CG2-CD2 4.46Å; A276-L504 HydrophobicContact CB-CD2 3.97Å; V502-L504 PolarHBondContact O-N 3.05Å; L504-A508 HydrophobicContact CB-CB 4.33Å; L504-L535 HydrophobicContact CD1-CB 3.56Å; L504-A549 HydrophobicContact CD2-CB 3.92Å
505	S	92.9	Very high	94.4	Very high	23 Å²	23	57 Å²	57	16%	0.161	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-75.7	165.1	-177.3	74	0	0	0	0	113.1	E279 Y507 A508 M509	E279-S505 VanDerWaalsContact CD-OG 3.3Å; E279-S505 WeakPolarHBondContact OE1-CB 3.34Å; E279-S505 PolarHBondContact OE1-OG 2.81Å; E279-S505 WeakPolarHBondContact OE2-CB 3.43Å; E279-S505 PolarHBondContact OE2-OG 2.81Å; S505-Y507 PolarHBondContact O-N 3.32Å; S505-Y507 WeakPolarHBondContact OG-CB 3.48Å; S505-Y507 PolarHBondContact OG-N 2.75Å; S505-A508 WeakPolarHBondContact O-CB 3.46Å; S505-A508 PolarHBondContact O-N 3.36Å; S505-A508 VanDerWaalsContact O-N 3.12Å; S505-A508 PolarHBondContact OG-N 3.38Å; S505-M509 PolarHBondContact O-N 3.32Å
506	N	92.3	Very high	94.2	Very high	110 Å²	110	53.8 Å²	53.8	59%	0.588	28%	0.277	S	S	*	.	H	α-helix	trans	-61.8	-23.3	170.5	-63.6	-11.6	0	0	0	112.4	M509 S510	N506-M509 HydrophobicContact CB-CE 4.3Å; N506-M509 WeakPolarHBondContact OD1-CE 3.46Å; N506-S510 WeakPolarHBondContact O-CB 3.49Å; N506-S510 PolarHBondContact O-N 3.21Å; N506-S510 PolarHBondContact O-OG 3.41Å
507	Y	90.9	Very high	93.9	Very high	126 Å²	126	55.8 Å²	55.8	49%	0.494	28%	0.284	S	S	.	.	H	α-helix	trans	-71.1	-37.6	175	-61.1	-66.1	0	0	0	111.7	S505 M509 S510 Q511	S505-Y507 PolarHBondContact O-N 3.32Å; S505-Y507 WeakPolarHBondContact OG-CB 3.48Å; S505-Y507 PolarHBondContact OG-N 2.75Å; Y507-M509 VanDerWaalsContact C-N 3.35Å; Y507-S510 PolarHBondContact O-N 3.04Å; Y507-Q511 WeakPolarHBondContact O-CB 3.5Å; Y507-Q511 WeakPolarHBondContact O-CG 3.33Å; Y507-Q511 PolarHBondContact O-N 2.87Å
508	A	90.9	Very high	93.3	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-63.1	-43.5	175.1	0	0	0	0	0	110.9	T272 Q275 L504 S505 Q511 A512	T272-A508 HydrophobicContact CG2-CB 4.31Å; Q275-A508 HydrophobicContact CB-CB 4.12Å; Q275-A508 HydrophobicContact CG-CB 3.94Å; L504-A508 HydrophobicContact CB-CB 4.33Å; S505-A508 WeakPolarHBondContact O-CB 3.46Å; S505-A508 PolarHBondContact O-N 3.36Å; S505-A508 VanDerWaalsContact O-N 3.12Å; S505-A508 PolarHBondContact OG-N 3.38Å; A508-Q511 PolarHBondContact O-N 3.41Å; A508-A512 WeakPolarHBondContact O-CB 3.48Å; A508-A512 PolarHBondContact O-N 2.95Å; A508-A512 VanDerWaalsContact O-N 3.07Å
509	M	91.2	Very high	93	Very high	39 Å²	39	60.6 Å²	60.6	19%	0.192	30%	0.295	C	S	.	.	H	α-helix	trans	-61.6	-47.3	173.2	-66.8	-171.7	-75.5	0	0	111.9	S505 N506 Y507 Q511 A512 D513 E529 L535	S505-M509 PolarHBondContact O-N 3.32Å; N506-M509 HydrophobicContact CB-CE 4.3Å; N506-M509 WeakPolarHBondContact OD1-CE 3.46Å; Y507-M509 VanDerWaalsContact C-N 3.35Å; M509-Q511 VanDerWaalsContact C-N 3.32Å; M509-Q511 PolarHBondContact O-N 3.43Å; M509-A512 PolarHBondContact O-N 3.48Å; M509-A512 VanDerWaalsContact O-N 3.17Å; M509-D513 PolarHBondContact O-N 3.06Å; M509-E529 HydrophobicContact SD-CG 4.34Å; M509-L535 HydrophobicContact CG-CD1 4.23Å; M509-L535 HydrophobicContact CG-CD2 4.18Å
510	S	91.4	Very high	92.7	Very high	65 Å²	65	64 Å²	64	46%	0.455	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-36.1	179.6	-56	0	0	0	0	112.7	N506 Y507 L514	N506-S510 WeakPolarHBondContact O-CB 3.49Å; N506-S510 PolarHBondContact O-N 3.21Å; N506-S510 PolarHBondContact O-OG 3.41Å; Y507-S510 PolarHBondContact O-N 3.04Å; S510-L514 WeakPolarHBondContact O-CB 3.36Å; S510-L514 PolarHBondContact O-N 2.79Å
511	Q	89.3	Confident	92.4	Very high	20 Å²	20	64.6 Å²	64.6	9%	0.093	33%	0.328	C	S	.	.	H	α-helix	trans	-65.7	-43.1	174.2	-83.2	-175.4	-9.2	0	0	112	L271 Y507 A508 M509 L514 L515	L271-Q511 PolarHBondContact O-OE1 3.24Å; Y507-Q511 WeakPolarHBondContact O-CB 3.5Å; Y507-Q511 WeakPolarHBondContact O-CG 3.33Å; Y507-Q511 PolarHBondContact O-N 2.87Å; A508-Q511 PolarHBondContact O-N 3.41Å; M509-Q511 VanDerWaalsContact C-N 3.32Å; M509-Q511 PolarHBondContact O-N 3.43Å; Q511-L514 PolarHBondContact O-N 3.45Å; Q511-L515 WeakPolarHBondContact O-CB 3.39Å; Q511-L515 PolarHBondContact O-N 3.02Å
512	A	91.4	Very high	92.2	Very high	1 Å²	1	67 Å²	67	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-41.6	177.1	0	0	0	0	0	111	F268 A508 M509 L515 L516 L527 L535	F268-A512 HydrophobicContact CD2-CB 3.72Å; F268-A512 HydrophobicContact CE2-CB 3.8Å; A508-A512 WeakPolarHBondContact O-CB 3.48Å; A508-A512 PolarHBondContact O-N 2.95Å; A508-A512 VanDerWaalsContact O-N 3.07Å; M509-A512 PolarHBondContact O-N 3.48Å; M509-A512 VanDerWaalsContact O-N 3.17Å; A512-L515 WeakPolarHBondContact O-CB 3.48Å; A512-L515 PolarHBondContact O-N 3.4Å; A512-L516 WeakPolarHBondContact O-CG 3.32Å; A512-L516 PolarHBondContact O-N 2.94Å; A512-L516 VanDerWaalsContact O-N 3.14Å; A512-L527 HydrophobicContact CB-CD1 3.42Å; A512-L527 VanDerWaalsContact CB-CD1 3.42Å; A512-L527 HydrophobicContact CB-CD2 3.85Å; A512-L527 HydrophobicContact CB-CG 4.27Å; A512-L535 HydrophobicContact CB-CD2 4.3Å
513	D	91.7	Very high	92.1	Very high	91 Å²	91	67.1 Å²	67.1	49%	0.487	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-43	174.1	-78.3	-33.2	0	0	0	112.2	M509 L515 L516 W517 L527	M509-D513 PolarHBondContact O-N 3.06Å; D513-L515 VanDerWaalsContact C-N 3.31Å; D513-L515 PolarHBondContact O-N 2.72Å; D513-L516 CarbonylContact O-C 3.56Å; D513-L516 PolarHBondContact O-N 2.89Å; D513-L516 VanDerWaalsContact O-N 3.09Å; D513-W517 PolarHBondContact O-N 3.45Å; D513-L527 VanDerWaalsContact OD1-CD1 3.27Å; D513-L527 WeakPolarHBondContact OD1-CD1 3.26Å
514	L	91.4	Very high	92.2	Very high	39 Å²	39	64.1 Å²	64.1	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-36.8	177	-175.6	66.1	0	0	0	112	Q17 Q21 S510 Q511 L516 W517	Q17-L514 HydrophobicContact CG-CD2 4.05Å; Q17-L514 HydrophobicContact CG-CG 4.41Å; Q17-L514 PolarHBondContact NE2-O 3.38Å; Q21-L514 HydrophobicContact CB-CD2 4.44Å; Q21-L514 HydrophobicContact CG-CD2 4.47Å; S510-L514 WeakPolarHBondContact O-CB 3.36Å; S510-L514 PolarHBondContact O-N 2.79Å; Q511-L514 PolarHBondContact O-N 3.45Å; L514-L516 VanDerWaalsContact C-N 3.3Å; L514-L516 PolarHBondContact O-N 3.4Å; L514-W517 VanDerWaalsContact O-CB 3.28Å; L514-W517 WeakPolarHBondContact O-CB 3.43Å; L514-W517 PolarHBondContact O-N 3.19Å
515	L	92.4	Very high	92.3	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-42.8	172.1	171.5	67.5	0	0	0	111.2	P264 K267 F268 L271 Q511 A512 D513 W517	P264-L515 HydrophobicContact CB-CD2 4.06Å; P264-L515 HydrophobicContact CB-CG 4.34Å; K267-L515 HydrophobicContact CB-CD1 3.84Å; K267-L515 HydrophobicContact CB-CD2 3.77Å; K267-L515 HydrophobicContact CB-CG 4.48Å; K267-L515 HydrophobicContact CD-CD1 4.07Å; F268-L515 VanDerWaalsContact CA-CD2 3.44Å; F268-L515 HydrophobicContact CB-CD2 3.79Å; L271-L515 HydrophobicContact CD1-CB 4.46Å; L271-L515 HydrophobicContact CD1-CD2 4.45Å; Q511-L515 WeakPolarHBondContact O-CB 3.39Å; Q511-L515 PolarHBondContact O-N 3.02Å; A512-L515 WeakPolarHBondContact O-CB 3.48Å; A512-L515 PolarHBondContact O-N 3.4Å; D513-L515 VanDerWaalsContact C-N 3.31Å; D513-L515 PolarHBondContact O-N 2.72Å; L515-W517 VanDerWaalsContact C-N 3.28Å; L515-W517 PolarHBondContact O-N 2.88Å
516	L	93.7	Very high	92.5	Very high	23 Å²	23	65.1 Å²	65.1	12%	0.12	32%	0.322	C	S	.	.	H	α-helix	trans	-73.4	-18.9	-179.5	-63.7	-174.8	0	0	0	113.2	P264 A512 D513 L514 N518 Y519 Y525 L527 L537	P264-L516 HydrophobicContact CB-CD2 4.1Å; P264-L516 HydrophobicContact CG-CD2 3.9Å; A512-L516 WeakPolarHBondContact O-CG 3.32Å; A512-L516 PolarHBondContact O-N 2.94Å; A512-L516 VanDerWaalsContact O-N 3.14Å; D513-L516 CarbonylContact O-C 3.56Å; D513-L516 PolarHBondContact O-N 2.89Å; D513-L516 VanDerWaalsContact O-N 3.09Å; L514-L516 VanDerWaalsContact C-N 3.3Å; L514-L516 PolarHBondContact O-N 3.4Å; L516-N518 PolarHBondContact O-N 2.8Å; L516-N518 VanDerWaalsContact O-N 3.13Å; L516-Y519 HydrophobicContact CD2-CD2 4.38Å; L516-Y519 WeakPolarHBondContact O-CB 3.39Å; L516-Y519 PolarHBondContact O-N 3.42Å; L516-Y525 HydrophobicContact CD2-CG 4.25Å; L516-L527 HydrophobicContact CD1-CD2 4Å; L516-L527 HydrophobicContact CD1-CG 4.14Å; L516-L537 HydrophobicContact CD1-CD1 4.07Å; L516-L537 HydrophobicContact CD2-CD1 3.95Å
517	W	91.4	Very high	92.7	Very high	210 Å²	210	61.9 Å²	61.9	80%	0.795	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.4	176.6	-169.2	-90.8	0	0	0	113.8	D513 L514 L515 Y519	D513-W517 PolarHBondContact O-N 3.45Å; L514-W517 VanDerWaalsContact O-CB 3.28Å; L514-W517 WeakPolarHBondContact O-CB 3.43Å; L514-W517 PolarHBondContact O-N 3.19Å; L515-W517 VanDerWaalsContact C-N 3.28Å; L515-W517 PolarHBondContact O-N 2.88Å; W517-Y519 PolarHBondContact O-N 3.48Å
518	N	86.4	Confident	93	Very high	115 Å²	115	57.6 Å²	57.6	62%	0.615	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-4.1	179	-68.6	-28.5	0	0	0	113.8	L516	L516-N518 PolarHBondContact O-N 2.8Å; L516-N518 VanDerWaalsContact O-N 3.13Å
519	Y	91.2	Very high	93.3	Very high	44 Å²	44	63.9 Å²	63.9	17%	0.173	32%	0.321	C	S	.	.	S	Bend	trans	-103.2	116.8	-179.8	-66.2	-95.4	0	0	0	109.8	P264 L516 W517 Y523 Y525	P264-Y519 WeakPolarHBondContact CA-OH 3.38Å; P264-Y519 HydrophobicContact CB-CE2 3.8Å; P264-Y519 WeakPolarHBondContact CB-OH 3.33Å; P264-Y519 WeakPolarHBondContact CD-OH 3.35Å; P264-Y519 HydrophobicContact CG-CE1 4.24Å; P264-Y519 HydrophobicContact CG-CE2 4.06Å; L516-Y519 HydrophobicContact CD2-CD2 4.38Å; L516-Y519 WeakPolarHBondContact O-CB 3.39Å; L516-Y519 PolarHBondContact O-N 3.42Å; W517-Y519 PolarHBondContact O-N 3.48Å; Y519-Y523 AromaticContact CD1-CD1 3.7Å; Y519-Y523 HydrophobicContact CD1-CD1 3.7Å; Y519-Y523 AromaticContact CD1-CD2 3.94Å; Y519-Y523 HydrophobicContact CD1-CD2 3.94Å; Y519-Y523 AromaticContact CD1-CE1 3.8Å; Y519-Y523 HydrophobicContact CD1-CE1 3.8Å; Y519-Y523 HydrophobicContact CD1-CE2 4.03Å; Y519-Y523 AromaticContact CD1-CG 3.76Å; Y519-Y523 HydrophobicContact CD1-CG 3.76Å; Y519-Y523 AromaticContact CD1-CZ 3.97Å; Y519-Y523 HydrophobicContact CE1-CD1 4.43Å; Y519-Y523 HydrophobicContact CE1-CE1 4.25Å; Y519-Y523 HydrophobicContact CG-CD2 4.39Å; Y519-Y523 HydrophobicContact CG-CG 4.31Å; Y519-Y525 HydrophobicContact CD1-CD2 4.11Å; Y519-Y525 HydrophobicContact CD1-CE2 4.07Å; Y519-Y525 HydrophobicContact CE1-CE2 4.15Å; Y519-Y525 HydrophobicContact CG-CD2 4.32Å
520	D	92	Very high	93.6	Very high	80 Å²	80	63.7 Å²	63.7	43%	0.428	32%	0.32	S	S	.	.			trans	-68.9	174.2	-178.3	83	62.4	0	0	0	113.2	K522 Y523	D520-K522 PolarHBondContact O-N 2.72Å; D520-K522 WeakPolarHBondContact OD1-CB 3.34Å; D520-K522 WeakPolarHBondContact OD1-CG 3.46Å; D520-K522 PolarHBondContact OD1-N 3.14Å; D520-K522 IonicContact OD2-NZ 3.54Å; D520-K522 PolarHBondContact OD2-NZ 3.45Å; D520-Y523 WeakPolarHBondContact O-CB 3.33Å; D520-Y523 WeakPolarHBondContact O-CD2 3.09Å; D520-Y523 PolarHBondContact O-N 2.93Å
521	S	91.8	Very high	93.7	Very high	106 Å²	106	65.7 Å²	65.7	74%	0.741	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-19.6	-176.4	67.2	0	0	0	0	117.1	Y523 K524	S521-Y523 VanDerWaalsContact C-N 3.3Å; S521-K524 PolarHBondContact O-NZ 3.33Å
522	K	94.7	Very high	94	Very high	98 Å²	98	68.1 Å²	68.1	43%	0.426	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-32.1	175.1	74.2	179.5	-179.2	-96	0	111.8	V447 D520 K524	V447-K522 HydrophobicContact CG1-CB 4.04Å; V447-K522 HydrophobicContact CG1-CD 3.73Å; V447-K522 HydrophobicContact CG1-CG 3.41Å; V447-K522 VanDerWaalsContact CG1-CG 3.41Å; V447-K522 WeakPolarHBondContact O-CE 3.42Å; D520-K522 PolarHBondContact O-N 2.72Å; D520-K522 WeakPolarHBondContact OD1-CB 3.34Å; D520-K522 WeakPolarHBondContact OD1-CG 3.46Å; D520-K522 PolarHBondContact OD1-N 3.14Å; D520-K522 IonicContact OD2-NZ 3.54Å; D520-K522 PolarHBondContact OD2-NZ 3.45Å; K522-K524 WeakPolarHBondContact O-CE 3.39Å
523	Y	96.3	Very high	94.2	Very high	42 Å²	42	69.1 Å²	69.1	17%	0.165	36%	0.357	C	S	.	.			trans	-75.9	145	174.9	-63.8	-88	0	0	0	110.6	V447 A448 Y519 D520 S521 Y525 W539	V447-Y523 HydrophobicContact CB-CD1 4.43Å; V447-Y523 HydrophobicContact CB-CE1 4.4Å; V447-Y523 HydrophobicContact CG1-CD1 3.73Å; V447-Y523 HydrophobicContact CG1-CD2 4.3Å; V447-Y523 HydrophobicContact CG1-CE1 3.78Å; V447-Y523 HydrophobicContact CG1-CE2 4.34Å; V447-Y523 HydrophobicContact CG1-CG 4.01Å; A448-Y523 HydrophobicContact CB-CE1 4.14Å; Y519-Y523 AromaticContact CD1-CD1 3.7Å; Y519-Y523 HydrophobicContact CD1-CD1 3.7Å; Y519-Y523 AromaticContact CD1-CD2 3.94Å; Y519-Y523 HydrophobicContact CD1-CD2 3.94Å; Y519-Y523 AromaticContact CD1-CE1 3.8Å; Y519-Y523 HydrophobicContact CD1-CE1 3.8Å; Y519-Y523 HydrophobicContact CD1-CE2 4.03Å; Y519-Y523 AromaticContact CD1-CG 3.76Å; Y519-Y523 HydrophobicContact CD1-CG 3.76Å; Y519-Y523 AromaticContact CD1-CZ 3.97Å; Y519-Y523 HydrophobicContact CE1-CD1 4.43Å; Y519-Y523 HydrophobicContact CE1-CE1 4.25Å; Y519-Y523 HydrophobicContact CG-CD2 4.39Å; Y519-Y523 HydrophobicContact CG-CG 4.31Å; D520-Y523 WeakPolarHBondContact O-CB 3.33Å; D520-Y523 WeakPolarHBondContact O-CD2 3.09Å; D520-Y523 PolarHBondContact O-N 2.93Å; S521-Y523 VanDerWaalsContact C-N 3.3Å; Y523-Y525 HydrophobicContact CD1-CD2 4.15Å; Y523-Y525 AromaticContact CD1-CE2 3.73Å; Y523-Y525 HydrophobicContact CD1-CE2 3.73Å; Y523-Y525 HydrophobicContact CE1-CE2 4.48Å; Y523-Y525 HydrophobicContact CG-CD2 4.45Å; Y523-Y525 HydrophobicContact CG-CE2 4.46Å; Y523-W539 HydrophobicContact CD1-CZ3 4.34Å
524	K	96.9	Very high	94.5	Very high	92 Å²	92	65.1 Å²	65.1	40%	0.4	34%	0.335	S	S	.	.			trans	-115.1	24.9	-176.7	-50.9	-59.3	173.5	-162	0	112.5	S521 K522 W539 E540	S521-K524 PolarHBondContact O-NZ 3.33Å; K522-K524 WeakPolarHBondContact O-CE 3.39Å; K524-W539 HydrophobicContact CB-CD2 3.9Å; K524-W539 HydrophobicContact CB-CE3 4.08Å; K524-W539 HydrophobicContact CB-CG 4.46Å; K524-W539 HydrophobicContact CB-CH2 4.16Å; K524-W539 HydrophobicContact CB-CZ2 3.97Å; K524-W539 HydrophobicContact CB-CZ3 4.21Å; K524-W539 HydrophobicContact CG-CH2 4.18Å; K524-W539 HydrophobicContact CG-CZ2 3.87Å; K524-W539 VanDerWaalsContact N-CZ3 3.3Å; K524-W539 WeakPolarHBondContact O-CA 3.49Å; K524-E540 HydrophobicContact CB-CG 3.56Å; K524-E540 HydrophobicContact CG-CG 3.84Å; K524-E540 PolarHBondContact O-N 2.91Å
525	Y	97.7	Very high	94.8	Very high	27 Å²	27	63.5 Å²	63.5	11%	0.106	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	142.3	176.2	-65.9	-61.6	0	0	0	111.2	C263 P264 Y265 S444 L516 Y519 Y523 L537 A538 W539	C263-Y525 PolarHBondContact SG-OH 3.34Å; P264-Y525 WeakPolarHBondContact CD-OH 3.39Å; P264-Y525 HydrophobicContact CG-CD1 4.1Å; P264-Y525 HydrophobicContact CG-CD2 3.72Å; P264-Y525 HydrophobicContact CG-CE1 3.99Å; P264-Y525 HydrophobicContact CG-CE2 3.59Å; P264-Y525 HydrophobicContact CG-CG 3.98Å; Y265-Y525 HydrophobicContact CE1-CE1 4.04Å; S444-Y525 WeakPolarHBondContact CB-OH 3.37Å; L516-Y525 HydrophobicContact CD2-CG 4.25Å; Y519-Y525 HydrophobicContact CD1-CD2 4.11Å; Y519-Y525 HydrophobicContact CD1-CE2 4.07Å; Y519-Y525 HydrophobicContact CE1-CE2 4.15Å; Y519-Y525 HydrophobicContact CG-CD2 4.32Å; Y523-Y525 HydrophobicContact CD1-CD2 4.15Å; Y523-Y525 AromaticContact CD1-CE2 3.73Å; Y523-Y525 HydrophobicContact CD1-CE2 3.73Å; Y523-Y525 HydrophobicContact CE1-CE2 4.48Å; Y523-Y525 HydrophobicContact CG-CD2 4.45Å; Y523-Y525 HydrophobicContact CG-CE2 4.46Å; Y525-L537 HydrophobicContact CD1-CD1 3.91Å; Y525-L537 HydrophobicContact CD1-CG 4.3Å; Y525-L537 HydrophobicContact CG-CD1 4.3Å; Y525-A538 CarbonylContact C-O 3.49Å; Y525-A538 VanDerWaalsContact CA-O 3.25Å; Y525-A538 WeakPolarHBondContact CA-O 3.44Å; Y525-W539 AromaticContact CD1-CE3 3.85Å; Y525-W539 HydrophobicContact CD1-CE3 3.85Å; Y525-W539 HydrophobicContact CD1-CZ3 4.47Å; Y525-W539 HydrophobicContact CD2-CE3 4.44Å; Y525-W539 HydrophobicContact CD2-CZ3 4.27Å; Y525-W539 AromaticContact CE1-CE3 3.68Å; Y525-W539 HydrophobicContact CE1-CE3 3.68Å; Y525-W539 HydrophobicContact CE1-CZ3 4.21Å; Y525-W539 HydrophobicContact CE2-CE3 4.29Å; Y525-W539 AromaticContact CE2-CZ3 4Å; Y525-W539 HydrophobicContact CE2-CZ3 4Å; Y525-W539 HydrophobicContact CG-CE3 4.22Å; Y525-W539 HydrophobicContact CG-CZ3 4.49Å; Y525-W539 AromaticContact CZ-CE3 3.91Å; Y525-W539 AromaticContact CZ-CZ3 3.96Å
526	S	97	Very high	95.1	Very high	34 Å²	34	63.2 Å²	63.2	24%	0.238	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	160.9	175.9	52.9	0	0	0	0	109.4	A538	S526-A538 PolarHBondContact N-O 3.36Å; S526-A538 PolarHBondContact O-N 2.77Å
527	L	97.4	Very high	95.3	Very high	41 Å²	41	62.1 Å²	62.1	22%	0.215	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.5	171.5	-57.5	-179	0	0	0	110.4	F268 A512 D513 L516 L535 S536 L537	F268-L527 HydrophobicContact CD2-CD2 4.07Å; F268-L527 HydrophobicContact CE2-CD2 3.73Å; A512-L527 HydrophobicContact CB-CD1 3.42Å; A512-L527 VanDerWaalsContact CB-CD1 3.42Å; A512-L527 HydrophobicContact CB-CD2 3.85Å; A512-L527 HydrophobicContact CB-CG 4.27Å; D513-L527 VanDerWaalsContact OD1-CD1 3.27Å; D513-L527 WeakPolarHBondContact OD1-CD1 3.26Å; L516-L527 HydrophobicContact CD1-CD2 4Å; L516-L527 HydrophobicContact CD1-CG 4.14Å; L527-L535 HydrophobicContact CB-CD1 4.15Å; L527-L535 HydrophobicContact CD1-CD1 4.49Å; L527-S536 WeakPolarHBondContact CA-O 3.08Å; L527-L537 HydrophobicContact CD2-CD1 4.46Å
528	V	97.2	Very high	95.6	Very high	36 Å²	36	52.1 Å²	52.1	22%	0.218	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	120	176.4	178.3	0	0	0	0	108.3	L530 S536 A538 P543	V528-L530 HydrophobicContact CG1-CD2 3.86Å; V528-L530 HydrophobicContact CG1-CG 4.39Å; V528-S536 PolarHBondContact N-O 3.36Å; V528-S536 WeakPolarHBondContact O-CB 3.48Å; V528-S536 PolarHBondContact O-N 3.06Å; V528-A538 HydrophobicContact CB-CB 4.39Å; V528-A538 HydrophobicContact CG2-CB 3.58Å; V528-P543 HydrophobicContact CB-CG 4.44Å; V528-P543 HydrophobicContact CG1-CG 4.25Å
529	E	96.7	Very high	96.2	Very high	134 Å²	134	47 Å²	47	63%	0.626	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.7	169.3	-68.2	-178.6	-111.2	0	0	109.6	M509 F534 L535	M509-E529 HydrophobicContact SD-CG 4.34Å; E529-F534 WeakPolarHBondContact CA-O 3.39Å; E529-L535 HydrophobicContact CG-CD1 4.22Å
530	L	96.9	Very high	96.4	Very high	35 Å²	35	50.5 Å²	50.5	18%	0.183	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.9	174.1	-57.4	173.6	0	0	0	109.4	E419 V528 A533 F534 P543 T546	E419-L530 HydrophobicContact CG-CD1 4.14Å; V528-L530 HydrophobicContact CG1-CD2 3.86Å; V528-L530 HydrophobicContact CG1-CG 4.39Å; L530-A533 PolarHBondContact O-N 3.45Å; L530-F534 HydrophobicContact CB-CB 3.92Å; L530-F534 PolarHBondContact N-O 2.97Å; L530-F534 WeakPolarHBondContact O-CB 3.35Å; L530-F534 PolarHBondContact O-N 3.05Å; L530-P543 HydrophobicContact CD1-CB 4.22Å; L530-P543 HydrophobicContact CD1-CG 4.25Å; L530-P543 HydrophobicContact CD2-CG 4.2Å; L530-T546 HydrophobicContact CD1-CG2 4.48Å
531	P	95.2	Very high	96.5	Very high	106 Å²	106	55 Å²	55	69%	0.688	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	148.3	-178	28.8	-35	0	0	0	111.9	F534	P531-F534 VanDerWaalsContact O-CD2 3.3Å; P531-F534 WeakPolarHBondContact O-CD2 3.27Å
532	P	94.3	Very high	96.8	Very high	72 Å²	72	54.1 Å²	54.1	47%	0.468	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86	-24.5	-0.8	33	-34.5	0	0	0	114.2	P501	P501-P532 HydrophobicContact CB-CG 4.13Å; P501-P532 HydrophobicContact CG-CG 3.98Å
533	A	95.4	Very high	96.9	Very high	21 Å²	21	50.5 Å²	50.5	17%	0.174	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-153.5	28	-168.9	0	0	0	0	0	113.3	P501 L530	P501-A533 HydrophobicContact CB-CB 4.14Å; L530-A533 PolarHBondContact O-N 3.45Å
534	F	97.9	Very high	97	Very high	7 Å²	7	48.5 Å²	48.5	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	140.8	-178.7	-65.9	-85.7	0	0	0	110.8	S487 Q491 E529 L530 P531 T546 S548 W550	S487-F534 VanDerWaalsContact O-CZ 3.27Å; S487-F534 WeakPolarHBondContact O-CZ 3.44Å; Q491-F534 HydrophobicContact CB-CE2 4.12Å; Q491-F534 HydrophobicContact CB-CZ 3.93Å; E529-F534 WeakPolarHBondContact CA-O 3.39Å; L530-F534 HydrophobicContact CB-CB 3.92Å; L530-F534 PolarHBondContact N-O 2.97Å; L530-F534 WeakPolarHBondContact O-CB 3.35Å; L530-F534 PolarHBondContact O-N 3.05Å; P531-F534 VanDerWaalsContact O-CD2 3.3Å; P531-F534 WeakPolarHBondContact O-CD2 3.27Å; F534-T546 HydrophobicContact CB-CG2 3.57Å; F534-T546 HydrophobicContact CD1-CG2 3.56Å; F534-T546 HydrophobicContact CG-CG2 3.91Å; F534-S548 WeakPolarHBondContact CE1-OG 3.48Å; F534-W550 AromaticContact CE1-CZ2 3.93Å; F534-W550 HydrophobicContact CE1-CZ2 3.93Å; F534-W550 HydrophobicContact CZ-CH2 4.15Å; F534-W550 AromaticContact CZ-CZ2 3.7Å; F534-W550 HydrophobicContact CZ-CZ2 3.7Å
535	L	98.2	Very high	97.1	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.1	168.8	-176.7	64.8	0	0	0	108.8	F268 T272 L504 M509 A512 L527 E529 T546 V547	F268-L535 HydrophobicContact CE2-CD2 3.95Å; F268-L535 HydrophobicContact CE2-CG 4.08Å; F268-L535 HydrophobicContact CZ-CD2 4.32Å; F268-L535 HydrophobicContact CZ-CG 4.06Å; T272-L535 HydrophobicContact CG2-CD2 4.04Å; L504-L535 HydrophobicContact CD1-CB 3.56Å; M509-L535 HydrophobicContact CG-CD1 4.23Å; M509-L535 HydrophobicContact CG-CD2 4.18Å; A512-L535 HydrophobicContact CB-CD2 4.3Å; L527-L535 HydrophobicContact CB-CD1 4.15Å; L527-L535 HydrophobicContact CD1-CD1 4.49Å; E529-L535 HydrophobicContact CG-CD1 4.22Å; L535-T546 WeakPolarHBondContact O-CA 3.48Å; L535-V547 PolarHBondContact N-O 3.05Å; L535-V547 PolarHBondContact O-N 3.31Å
536	S	98.4	Very high	97.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.5	-178.2	-159.9	0	0	0	0	112	L527 V528 P543 L545 T546	L527-S536 WeakPolarHBondContact CA-O 3.08Å; V528-S536 PolarHBondContact N-O 3.36Å; V528-S536 WeakPolarHBondContact O-CB 3.48Å; V528-S536 PolarHBondContact O-N 3.06Å; S536-P543 WeakPolarHBondContact OG-CB 3.45Å; S536-L545 CarbonylContact C-O 3.52Å; S536-L545 VanDerWaalsContact CA-O 3.32Å; S536-L545 WeakPolarHBondContact CA-O 3.43Å; S536-L545 PolarHBondContact OG-O 3.47Å; S536-T546 WeakPolarHBondContact CB-OG1 3.47Å; S536-T546 PolarHBondContact OG-OG1 3.48Å
537	L	98.3	Very high	97.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.7	164.2	174.6	65.2	0	0	0	108.4	P264 Y265 F268 L516 Y525 L527 L544 L545	P264-L537 HydrophobicContact CB-CD2 4.44Å; P264-L537 HydrophobicContact CG-CD2 4.03Å; Y265-L537 HydrophobicContact CD1-CD2 3.67Å; Y265-L537 HydrophobicContact CE1-CD2 4.15Å; F268-L537 HydrophobicContact CB-CD2 3.99Å; F268-L537 HydrophobicContact CD1-CB 3.48Å; F268-L537 VanDerWaalsContact CD1-CB 3.48Å; F268-L537 HydrophobicContact CD1-CD2 4.15Å; F268-L537 HydrophobicContact CD1-CG 4.43Å; F268-L537 HydrophobicContact CD2-CB 4.24Å; F268-L537 HydrophobicContact CE1-CB 3.6Å; F268-L537 HydrophobicContact CE2-CB 4.34Å; F268-L537 HydrophobicContact CG-CB 3.82Å; F268-L537 HydrophobicContact CG-CD2 4.14Å; F268-L537 HydrophobicContact CG-CG 4.47Å; F268-L537 HydrophobicContact CZ-CB 4.04Å; L516-L537 HydrophobicContact CD1-CD1 4.07Å; L516-L537 HydrophobicContact CD2-CD1 3.95Å; Y525-L537 HydrophobicContact CD1-CD1 3.91Å; Y525-L537 HydrophobicContact CD1-CG 4.3Å; Y525-L537 HydrophobicContact CG-CD1 4.3Å; L527-L537 HydrophobicContact CD2-CD1 4.46Å; L537-L544 PolarHBondContact O-N 3.34Å; L537-L545 PolarHBondContact N-O 3.31Å; L537-L545 PolarHBondContact O-N 2.82Å
538	A	98.3	Very high	97.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	150.2	-175.4	0	0	0	0	0	111.8	Y525 S526 V528 R542	Y525-A538 CarbonylContact C-O 3.49Å; Y525-A538 VanDerWaalsContact CA-O 3.25Å; Y525-A538 WeakPolarHBondContact CA-O 3.44Å; S526-A538 PolarHBondContact N-O 3.36Å; S526-A538 PolarHBondContact O-N 2.77Å; V528-A538 HydrophobicContact CB-CB 4.39Å; V528-A538 HydrophobicContact CG2-CB 3.58Å; A538-R542 CarbonylContact C-O 3.56Å; A538-R542 WeakPolarHBondContact CA-O 3.46Å; A538-R542 VanDerWaalsContact CB-C 3.47Å; A538-R542 VanDerWaalsContact CB-O 3.25Å; A538-R542 WeakPolarHBondContact CB-O 3.5Å
539	W	97.6	Very high	97.3	Very high	7 Å²	7	38.1 Å²	38.1	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.1	167.7	177.9	-88.8	0	0	0	109	P440 E443 V447 Y523 K524 Y525 K541 R542 L544	P440-W539 HydrophobicContact CB-CB 3.98Å; P440-W539 VanDerWaalsContact CB-CD1 3.4Å; P440-W539 HydrophobicContact CB-CG 3.91Å; E443-W539 HydrophobicContact CB-CZ2 4.18Å; E443-W539 PolarHBondContact OE2-NE1 3.35Å; V447-W539 HydrophobicContact CB-CH2 4.09Å; V447-W539 HydrophobicContact CG1-CH2 4.49Å; V447-W539 HydrophobicContact CG2-CH2 3.82Å; V447-W539 HydrophobicContact CG2-CZ2 4.13Å; Y523-W539 HydrophobicContact CD1-CZ3 4.34Å; K524-W539 HydrophobicContact CB-CD2 3.9Å; K524-W539 HydrophobicContact CB-CE3 4.08Å; K524-W539 HydrophobicContact CB-CG 4.46Å; K524-W539 HydrophobicContact CB-CH2 4.16Å; K524-W539 HydrophobicContact CB-CZ2 3.97Å; K524-W539 HydrophobicContact CB-CZ3 4.21Å; K524-W539 HydrophobicContact CG-CH2 4.18Å; K524-W539 HydrophobicContact CG-CZ2 3.87Å; K524-W539 VanDerWaalsContact N-CZ3 3.3Å; K524-W539 WeakPolarHBondContact O-CA 3.49Å; Y525-W539 AromaticContact CD1-CE3 3.85Å; Y525-W539 HydrophobicContact CD1-CE3 3.85Å; Y525-W539 HydrophobicContact CD1-CZ3 4.47Å; Y525-W539 HydrophobicContact CD2-CE3 4.44Å; Y525-W539 HydrophobicContact CD2-CZ3 4.27Å; Y525-W539 AromaticContact CE1-CE3 3.68Å; Y525-W539 HydrophobicContact CE1-CE3 3.68Å; Y525-W539 HydrophobicContact CE1-CZ3 4.21Å; Y525-W539 HydrophobicContact CE2-CE3 4.29Å; Y525-W539 AromaticContact CE2-CZ3 4Å; Y525-W539 HydrophobicContact CE2-CZ3 4Å; Y525-W539 HydrophobicContact CG-CE3 4.22Å; Y525-W539 HydrophobicContact CG-CZ3 4.49Å; Y525-W539 AromaticContact CZ-CE3 3.91Å; Y525-W539 AromaticContact CZ-CZ3 3.96Å; W539-K541 PolarHBondContact O-N 3.14Å; W539-R542 PolarHBondContact N-O 3.18Å; W539-R542 VanDerWaalsContact O-CB 3.29Å; W539-R542 WeakPolarHBondContact O-CB 3.3Å; W539-R542 PolarHBondContact O-N 3.41Å; W539-L544 HydrophobicContact CB-CD1 3.63Å; W539-L544 HydrophobicContact CB-CG 4.37Å
540	E	95.4	Very high	97.4	Very high	118 Å²	118	31.8 Å²	31.8	55%	0.551	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	42.2	-173.4	-65.2	-167.7	148	0	0	112.5	K524 R542	K524-E540 HydrophobicContact CB-CG 3.56Å; K524-E540 HydrophobicContact CG-CG 3.84Å; K524-E540 PolarHBondContact O-N 2.91Å; E540-R542 PolarHBondContact O-N 3.49Å; E540-R542 VanDerWaalsContact O-N 3.13Å
541	K	95.7	Very high	97.4	Very high	174 Å²	174	37 Å²	37	76%	0.757	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	7.6	-175.6	-48.9	-179.8	178.9	-177.4	0	115.2	W539 P543	W539-K541 PolarHBondContact O-N 3.14Å; K541-P543 WeakPolarHBondContact O-CD 3.34Å
542	R	96.5	Very high	97.5	Very high	88 Å²	88	33.5 Å²	33.5	33%	0.332	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	113.8	169.3	178.8	62.1	178.4	-134	-1.6	109.7	P440 A538 W539 E540 L544	P440-R542 HydrophobicContact CG-CG 4.29Å; A538-R542 CarbonylContact C-O 3.56Å; A538-R542 WeakPolarHBondContact CA-O 3.46Å; A538-R542 VanDerWaalsContact CB-C 3.47Å; A538-R542 VanDerWaalsContact CB-O 3.25Å; A538-R542 WeakPolarHBondContact CB-O 3.5Å; W539-R542 PolarHBondContact N-O 3.18Å; W539-R542 VanDerWaalsContact O-CB 3.29Å; W539-R542 WeakPolarHBondContact O-CB 3.3Å; W539-R542 PolarHBondContact O-N 3.41Å; E540-R542 PolarHBondContact O-N 3.49Å; E540-R542 VanDerWaalsContact O-N 3.13Å; R542-L544 HydrophobicContact CG-CD2 4.4Å
543	P	98.2	Very high	97.7	Very high	21 Å²	21	31.5 Å²	31.5	14%	0.136	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	135.7	174.4	-30.7	40.3	0	0	0	112.7	E419 V528 L530 S536 K541	E419-P543 HydrophobicContact CB-CB 4.1Å; E419-P543 HydrophobicContact CG-CB 3.6Å; V528-P543 HydrophobicContact CB-CG 4.44Å; V528-P543 HydrophobicContact CG1-CG 4.25Å; L530-P543 HydrophobicContact CD1-CB 4.22Å; L530-P543 HydrophobicContact CD1-CG 4.25Å; L530-P543 HydrophobicContact CD2-CG 4.2Å; S536-P543 WeakPolarHBondContact OG-CB 3.45Å; K541-P543 WeakPolarHBondContact O-CD 3.34Å
544	L	98.3	Very high	97.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	-45.8	179.6	-58.8	-178	0	0	0	112.8	Y265 E419 Y437 P440 V441 L537 W539 R542	Y265-L544 HydrophobicContact CE1-CB 4.45Å; Y265-L544 HydrophobicContact CE1-CD1 3.93Å; E419-L544 PolarHBondContact N-O 3.03Å; Y437-L544 HydrophobicContact CD2-CD2 4.08Å; Y437-L544 HydrophobicContact CE2-CB 4.31Å; Y437-L544 HydrophobicContact CE2-CD2 4.12Å; Y437-L544 WeakPolarHBondContact CE2-O 3.38Å; P440-L544 HydrophobicContact CB-CD2 4.22Å; P440-L544 HydrophobicContact CG-CD2 3.71Å; V441-L544 HydrophobicContact CG2-CD1 4.21Å; V441-L544 HydrophobicContact CG2-CD2 4.27Å; L537-L544 PolarHBondContact O-N 3.34Å; W539-L544 HydrophobicContact CB-CD1 3.63Å; W539-L544 HydrophobicContact CB-CG 4.37Å; R542-L544 HydrophobicContact CG-CD2 4.4Å
545	L	98.5	Very high	97.8	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	120.2	-179.6	-166.9	160.7	0	0	0	108.9	F268 A269 L385 S536 L537 V547	F268-L545 HydrophobicContact CD1-CD2 3.92Å; F268-L545 HydrophobicContact CE1-CD2 3.9Å; F268-L545 WeakPolarHBondContact CE1-O 3.38Å; A269-L545 HydrophobicContact CB-CD1 4.3Å; A269-L545 HydrophobicContact CB-CD2 3.66Å; L385-L545 HydrophobicContact CD1-CD1 4.17Å; L385-L545 HydrophobicContact CD2-CD1 4.11Å; L385-L545 HydrophobicContact CD2-CG 4.29Å; S536-L545 CarbonylContact C-O 3.52Å; S536-L545 VanDerWaalsContact CA-O 3.32Å; S536-L545 WeakPolarHBondContact CA-O 3.43Å; S536-L545 PolarHBondContact OG-O 3.47Å; L537-L545 PolarHBondContact N-O 3.31Å; L537-L545 PolarHBondContact O-N 2.82Å; L545-V547 HydrophobicContact CD2-CG2 3.99Å
546	T	98.6	Very high	97.8	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.031	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.1	-173.9	-58.1	0	0	0	0	110.8	G416 E417 E419 L530 F534 L535 S536	G416-T546 CarbonylContact C-O 3.55Å; G416-T546 VanDerWaalsContact CA-O 3.32Å; G416-T546 WeakPolarHBondContact CA-O 3.48Å; E417-T546 PolarHBondContact N-O 3.33Å; E417-T546 PolarHBondContact O-N 3.41Å; E419-T546 WeakPolarHBondContact CB-OG1 3.37Å; E419-T546 WeakPolarHBondContact CG-OG1 3.26Å; E419-T546 VanDerWaalsContact OE2-CB 3.29Å; E419-T546 WeakPolarHBondContact OE2-CB 3.44Å; E419-T546 PolarHBondContact OE2-OG1 3.1Å; L530-T546 HydrophobicContact CD1-CG2 4.48Å; F534-T546 HydrophobicContact CB-CG2 3.57Å; F534-T546 HydrophobicContact CD1-CG2 3.56Å; F534-T546 HydrophobicContact CG-CG2 3.91Å; L535-T546 WeakPolarHBondContact O-CA 3.48Å; S536-T546 WeakPolarHBondContact CB-OG1 3.47Å; S536-T546 PolarHBondContact OG-OG1 3.48Å
547	V	98.6	Very high	97.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.2	173.8	-178.5	0	0	0	0	110.3	F268 A269 T272 L415 L535 L545	F268-V547 HydrophobicContact CD1-CG2 4.46Å; F268-V547 HydrophobicContact CE1-CG2 3.82Å; F268-V547 HydrophobicContact CZ-CG2 4.29Å; A269-V547 HydrophobicContact CB-CG2 4.17Å; T272-V547 HydrophobicContact CG2-CB 3.9Å; T272-V547 HydrophobicContact CG2-CG1 3.66Å; T272-V547 HydrophobicContact CG2-CG2 4.46Å; L415-V547 CarbonylContact O-C 3.56Å; L415-V547 VanDerWaalsContact O-CA 3.3Å; L415-V547 WeakPolarHBondContact O-CA 3.46Å; L535-V547 PolarHBondContact N-O 3.05Å; L535-V547 PolarHBondContact O-N 3.31Å; L545-V547 HydrophobicContact CD2-CG2 3.99Å
548	S	98.6	Very high	97.7	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.9	173.9	48.2	0	0	0	0	111.6	T414 L415 F534 W550	T414-S548 WeakPolarHBondContact CA-O 3.17Å; L415-S548 PolarHBondContact N-O 2.95Å; L415-S548 PolarHBondContact O-N 3.07Å; L415-S548 PolarHBondContact O-OG 3.39Å; F534-S548 WeakPolarHBondContact CE1-OG 3.48Å; S548-W550 PolarHBondContact OG-NE1 3.04Å
549	A	98.6	Very high	97.7	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	148.6	172.6	0	0	0	0	0	110.1	A276 V412 V413 V502 L504	A276-A549 HydrophobicContact CB-CB 4Å; V412-A549 HydrophobicContact CG2-CB 3.9Å; V413-A549 CarbonylContact O-C 3.28Å; V413-A549 WeakPolarHBondContact O-CA 3.47Å; V502-A549 HydrophobicContact CB-CB 3.94Å; V502-A549 HydrophobicContact CG1-CB 4.39Å; V502-A549 PolarHBondContact N-O 3.25Å; L504-A549 HydrophobicContact CD2-CB 3.92Å
550	W	98.7	Very high	97.7	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.7	-172.9	-56.3	84.3	0	0	0	110.8	V412 V413 Q491 M494 E495 F499 E500 P501 F534 S548	V412-W550 CarbonylContact C-O 3.5Å; V412-W550 VanDerWaalsContact CA-O 3.29Å; V412-W550 WeakPolarHBondContact CA-O 3.43Å; V413-W550 HydrophobicContact CB-CB 4.23Å; V413-W550 PolarHBondContact N-O 3.18Å; V413-W550 PolarHBondContact O-N 3.36Å; Q491-W550 HydrophobicContact CB-CH2 4Å; Q491-W550 HydrophobicContact CG-CH2 4Å; M494-W550 HydrophobicContact CB-CD2 3.78Å; M494-W550 HydrophobicContact CB-CE3 3.54Å; M494-W550 HydrophobicContact CB-CH2 3.87Å; M494-W550 HydrophobicContact CB-CZ2 4.04Å; M494-W550 HydrophobicContact CB-CZ3 3.58Å; M494-W550 HydrophobicContact CE-CB 3.66Å; M494-W550 HydrophobicContact CE-CD2 3.74Å; M494-W550 HydrophobicContact CE-CE3 4.44Å; M494-W550 HydrophobicContact CE-CG 3.32Å; M494-W550 HydrophobicContact CG-CD2 3.87Å; M494-W550 HydrophobicContact CG-CE3 4.17Å; M494-W550 HydrophobicContact CG-CG 4.44Å; M494-W550 HydrophobicContact CG-CH2 4.28Å; M494-W550 HydrophobicContact CG-CZ2 3.94Å; M494-W550 HydrophobicContact CG-CZ3 4.36Å; E495-W550 HydrophobicContact CG-CZ3 4.28Å; F499-W550 HydrophobicContact CB-CB 4.13Å; F499-W550 HydrophobicContact CB-CE3 4.09Å; F499-W550 HydrophobicContact CD1-CB 4.34Å; F499-W550 HydrophobicContact CG-CB 4.46Å; E500-W550 CarbonylContact O-C 3.16Å; E500-W550 VanDerWaalsContact O-CA 3.28Å; E500-W550 WeakPolarHBondContact O-CA 3.38Å; P501-W550 HydrophobicContact CB-CE3 4.25Å; P501-W550 HydrophobicContact CB-CH2 4.26Å; P501-W550 HydrophobicContact CB-CZ3 3.92Å; P501-W550 HydrophobicContact CG-CZ3 4.38Å; F534-W550 AromaticContact CE1-CZ2 3.93Å; F534-W550 HydrophobicContact CE1-CZ2 3.93Å; F534-W550 HydrophobicContact CZ-CH2 4.15Å; F534-W550 AromaticContact CZ-CZ2 3.7Å; F534-W550 HydrophobicContact CZ-CZ2 3.7Å; S548-W550 PolarHBondContact OG-NE1 3.04Å
551	R	96.9	Very high	97.9	Very high	143 Å²	143	40 Å²	40	54%	0.54	17%	0.168	S	C	.	.			trans	-140.1	0	173.6	65.8	-176.5	-178.6	-169.4	1.1	113.2	K406 F499 E500 V502	K406-R551 VanDerWaalsContact NZ-C 3.31Å; K406-R551 PolarHBondContact NZ-O 3.24Å; K406-R551 PolarHBondContact NZ-OXT 2.81Å; F499-R551 VanDerWaalsContact CA-O 3.3Å; F499-R551 WeakPolarHBondContact CA-O 3.49Å; E500-R551 HydrophobicContact CG-CG 3.7Å; E500-R551 PolarHBondContact N-O 3.47Å; E500-R551 PolarHBondContact O-N 2.86Å; E500-R551 IonicContact OE1-CZ 3.53Å; E500-R551 IonicContact OE1-NE 3.58Å; E500-R551 PolarHBondContact OE1-NE 2.94Å; E500-R551 IonicContact OE1-NH2 2.91Å; E500-R551 PolarHBondContact OE1-NH2 3.37Å; V502-R551 HydrophobicContact CG2-CB 3.93Å; V502-R551 HydrophobicContact CG2-CG 3.69Å

Retrieved 551 of 551 residues in 268.3 ms (Link to these results)

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