A0A077YVN1_TRITR Loading...

Methyltransf 32 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YVN1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 464 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	27.5	Very low	56.7	Low	227 Å²	227	95.3 Å²	95.3	100%	1.118	47%	0.473	S	S	*	.				0	112.6	0	-79.2	176.4	72.8	0	0	107.2	S3	M1-S3 PolarHBondContact O-N 2.84Å
2	E	27.8	Very low	58.8	Low	201 Å²	201	87.8 Å²	87.8	94%	0.939	44%	0.436	S	S	*	.			trans	-59.5	101.8	173.4	-67.6	171	160.5	0	0	107.9
3	S	33.7	Very low	60.3	Low	56 Å²	56	90 Å²	90	39%	0.392	46%	0.456	S	S	.	.			trans	-61.6	144.3	160.1	68.6	0	0	0	0	105.9	M1 T5	M1-S3 PolarHBondContact O-N 2.84Å; S3-T5 PolarHBondContact O-N 3.08Å; S3-T5 PolarHBondContact O-OG1 3.12Å; S3-T5 VanDerWaalsContact OG-CG2 3.22Å; S3-T5 WeakPolarHBondContact OG-CG2 3.36Å; S3-T5 PolarHBondContact OG-OG1 3.15Å
4	Q	34.6	Very low	62	Low	201 Å²	201	89.1 Å²	89.1	94%	0.939	45%	0.453	S	S	*	.	S	Bend	trans	-66.4	35.7	176.4	-68.1	179.8	-14.2	0	0	112.6
5	T	46.4	Very low	63.7	Low	48 Å²	48	87.2 Å²	87.2	29%	0.294	44%	0.442	S	S	.	.	S	Bend	trans	-66.9	129.4	166.7	48.3	0	0	0	0	108.2	S3 E7	S3-T5 PolarHBondContact O-N 3.08Å; S3-T5 PolarHBondContact O-OG1 3.12Å; S3-T5 VanDerWaalsContact OG-CG2 3.22Å; S3-T5 WeakPolarHBondContact OG-CG2 3.36Å; S3-T5 PolarHBondContact OG-OG1 3.15Å; T5-E7 PolarHBondContact O-N 3.13Å; T5-E7 VanDerWaalsContact O-N 3.09Å
6	N	55.5	Low	65.3	Low	57 Å²	57	88.8 Å²	88.8	31%	0.305	45%	0.451	S	S	.	.			trans	-28.6	114.8	169.5	-164.2	-12.4	0	0	0	110.2	S8 L9 T110	N6-S8 PolarHBondContact O-N 3.46Å; N6-L9 HydrophobicContact CB-CD1 4.34Å; N6-L9 HydrophobicContact CB-CG 4.48Å; N6-L9 WeakPolarHBondContact O-CB 3.48Å; N6-L9 PolarHBondContact O-N 3.38Å; N6-T110 HydrophobicContact CB-CG2 3.82Å
7	E	65.9	Low	66.8	Low	142 Å²	142	91.4 Å²	91.4	66%	0.664	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-7.4	-158.7	-58	-176.9	171	0	0	115.7	T5 R101	T5-E7 PolarHBondContact O-N 3.13Å; T5-E7 VanDerWaalsContact O-N 3.09Å; E7-R101 WeakPolarHBondContact O-CD 3.48Å; E7-R101 IonicContact OE2-CZ 2.99Å; E7-R101 IonicContact OE2-NH1 2.9Å; E7-R101 PolarHBondContact OE2-NH1 3.17Å; E7-R101 IonicContact OE2-NH2 3.71Å
8	S	76	Confident	68	Low	6 Å²	6	86.8 Å²	86.8	4%	0.042	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-8.7	175.8	58.7	0	0	0	0	115.1	N6 P104 V106 P434	N6-S8 PolarHBondContact O-N 3.46Å; S8-P104 VanDerWaalsContact CB-O 3.24Å; S8-P104 WeakPolarHBondContact CB-O 3.2Å; S8-P104 PolarHBondContact OG-O 2.82Å; S8-V106 WeakPolarHBondContact OG-CG2 3.42Å; S8-P434 WeakPolarHBondContact O-CD 3.45Å
9	L	84.2	Confident	69.2	Low	18 Å²	18	84.1 Å²	84.1	9%	0.094	42%	0.424	C	S	.	.			trans	-74.8	136.3	167.8	-73.6	178.8	0	0	0	109.9	N6 V106 T110 V111 L431 A433	N6-L9 HydrophobicContact CB-CD1 4.34Å; N6-L9 HydrophobicContact CB-CG 4.48Å; N6-L9 WeakPolarHBondContact O-CB 3.48Å; N6-L9 PolarHBondContact O-N 3.38Å; L9-V106 HydrophobicContact CD1-CG1 4.42Å; L9-V106 HydrophobicContact CD2-CB 4.28Å; L9-V106 HydrophobicContact CD2-CG1 3.83Å; L9-V106 HydrophobicContact CD2-CG2 3.85Å; L9-V106 HydrophobicContact CG-CG1 4.14Å; L9-V106 HydrophobicContact CG-CG2 3.98Å; L9-T110 HydrophobicContact CD1-CG2 3.82Å; L9-V111 HydrophobicContact CD2-CG2 4.44Å; L9-L431 HydrophobicContact CB-CD1 4.17Å; L9-L431 HydrophobicContact CD1-CD1 4.4Å; L9-L431 HydrophobicContact CD2-CD1 3.83Å; L9-L431 HydrophobicContact CD2-CD2 3.95Å; L9-L431 HydrophobicContact CD2-CG 4.03Å; L9-L431 HydrophobicContact CG-CD1 4.36Å; L9-A433 HydrophobicContact CD2-CB 3.48Å; L9-A433 VanDerWaalsContact CD2-CB 3.48Å
10	F	85.9	Confident	70.3	Confident	58 Å²	58	84.2 Å²	84.2	25%	0.254	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.4	171.7	-176.1	-83.2	0	0	0	109.7	I12 L100 L417 L432	F10-I12 HydrophobicContact CE1-CG1 3.78Å; F10-L100 HydrophobicContact CB-CD2 3.8Å; F10-L100 HydrophobicContact CD1-CD2 4.21Å; F10-L100 HydrophobicContact CD2-CD2 3.95Å; F10-L100 HydrophobicContact CG-CD2 3.71Å; F10-L417 HydrophobicContact CD1-CD2 3.81Å; F10-L417 HydrophobicContact CE1-CD2 3.25Å; F10-L417 HydrophobicContact CE2-CD2 4.27Å; F10-L417 HydrophobicContact CZ-CD2 3.52Å; F10-L432 HydrophobicContact CB-CB 4.14Å; F10-L432 HydrophobicContact CD1-CD1 4.11Å; F10-L432 PolarHBondContact N-O 3.27Å; F10-L432 PolarHBondContact O-N 3.3Å
11	E	86	Confident	71.3	Confident	34 Å²	34	82.9 Å²	82.9	16%	0.159	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142.9	172.6	-67.9	-176.1	-145.6	0	0	108.8	V13 L431	E11-V13 PolarHBondContact O-N 3.34Å; E11-L431 HydrophobicContact CG-CD1 3.37Å
12	I	82.2	Confident	74.4	Confident	6 Å²	6	72 Å²	72	3%	0.031	37%	0.367	C	S	.	.			trans	-85.1	102	169.6	-64.1	172.5	0	0	0	107.3	F10 E15 T18 A420 L421 R424	F10-I12 HydrophobicContact CE1-CG1 3.78Å; I12-E15 HydrophobicContact CG2-CG 4.07Å; I12-T18 HydrophobicContact CD1-CG2 4.07Å; I12-T18 HydrophobicContact CG1-CG2 4.17Å; I12-T18 WeakPolarHBondContact CG2-OG1 3.39Å; I12-A420 VanDerWaalsContact CD1-C 3.47Å; I12-A420 HydrophobicContact CD1-CB 3.63Å; I12-L421 HydrophobicContact CD1-CB 4.45Å; I12-R424 HydrophobicContact CB-CG 3.68Å; I12-R424 HydrophobicContact CD1-CB 4.46Å; I12-R424 HydrophobicContact CD1-CG 3.6Å; I12-R424 HydrophobicContact CG1-CG 4.2Å; I12-R424 HydrophobicContact CG2-CG 3.75Å
13	V	77.7	Confident	77.3	Confident	116 Å²	116	65 Å²	65	70%	0.703	33%	0.334	S	S	*	.	S	Bend	trans	-83.4	-42.8	174.1	-177.1	0	0	0	0	110.4	E11	E11-V13 PolarHBondContact O-N 3.34Å
14	D	85	Confident	80	Confident	77 Å²	77	67.3 Å²	67.3	41%	0.412	34%	0.337	S	S	.	.			trans	-126.8	121.5	177.8	-172.8	-30.3	0	0	0	109.8	L16 E17 T18	D14-L16 WeakPolarHBondContact OD1-CA 3.48Å; D14-L16 WeakPolarHBondContact OD1-CB 3.32Å; D14-L16 PolarHBondContact OD1-N 2.95Å; D14-E17 HydrophobicContact CB-CB 3.85Å; D14-E17 PolarHBondContact OD1-N 2.91Å; D14-T18 WeakPolarHBondContact O-CB 3.41Å; D14-T18 PolarHBondContact O-N 2.87Å; D14-T18 VanDerWaalsContact O-N 3.14Å; D14-T18 PolarHBondContact O-OG1 3.15Å
15	E	87.6	Confident	82.8	Confident	61 Å²	61	57.8 Å²	57.8	29%	0.285	29%	0.293	S	S	.	.	H	α-helix	trans	-67.7	-38.7	179.2	-70.4	173.3	-158.5	0	0	111.7	I12 T18 Q19 L421 R424	I12-E15 HydrophobicContact CG2-CG 4.07Å; E15-T18 PolarHBondContact O-N 3.04Å; E15-Q19 WeakPolarHBondContact O-CG 3.44Å; E15-Q19 PolarHBondContact O-N 2.88Å; E15-L421 HydrophobicContact CB-CD1 4.29Å; E15-L421 HydrophobicContact CG-CD1 4.45Å; E15-R424 HydrophobicContact CG-CB 3.98Å; E15-R424 IonicContact OE1-CZ 3.77Å; E15-R424 IonicContact OE1-NE 2.71Å; E15-R424 PolarHBondContact OE1-NE 3.28Å; E15-R424 VanDerWaalsContact OE1-NE 3.16Å; E15-R424 IonicContact OE1-NH2 2.85Å; E15-R424 PolarHBondContact OE1-NH2 2.97Å
16	L	89.5	Confident	84.9	Confident	112 Å²	112	55.5 Å²	55.5	59%	0.586	28%	0.279	S	S	*	.	H	α-helix	trans	-68.4	-42.6	178.9	-177	64.2	0	0	0	111.1	D14 T18 Q19 V20	D14-L16 WeakPolarHBondContact OD1-CA 3.48Å; D14-L16 WeakPolarHBondContact OD1-CB 3.32Å; D14-L16 PolarHBondContact OD1-N 2.95Å; L16-T18 VanDerWaalsContact C-N 3.31Å; L16-T18 PolarHBondContact O-N 3.15Å; L16-Q19 WeakPolarHBondContact O-CB 3.44Å; L16-Q19 PolarHBondContact O-N 3.23Å; L16-V20 WeakPolarHBondContact O-CG2 3.46Å; L16-V20 PolarHBondContact O-N 2.79Å
17	E	89.8	Confident	86.6	Confident	134 Å²	134	56.1 Å²	56.1	63%	0.626	29%	0.288	S	S	*	.	H	α-helix	trans	-60	-44.2	175	-171.2	179.6	-178.1	0	0	110.9	D14 Q19 V20 F21	D14-E17 HydrophobicContact CB-CB 3.85Å; D14-E17 PolarHBondContact OD1-N 2.91Å; E17-Q19 VanDerWaalsContact C-N 3.33Å; E17-Q19 PolarHBondContact O-N 2.99Å; E17-V20 PolarHBondContact O-N 3.41Å; E17-F21 WeakPolarHBondContact O-CB 3.4Å; E17-F21 PolarHBondContact O-N 3.35Å
18	T	89.5	Confident	87.8	Confident	9 Å²	9	50.6 Å²	50.6	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-38.7	177.6	-57.4	0	0	0	0	112	I12 D14 E15 L16 F21 L22	I12-T18 HydrophobicContact CD1-CG2 4.07Å; I12-T18 HydrophobicContact CG1-CG2 4.17Å; I12-T18 WeakPolarHBondContact CG2-OG1 3.39Å; D14-T18 WeakPolarHBondContact O-CB 3.41Å; D14-T18 PolarHBondContact O-N 2.87Å; D14-T18 VanDerWaalsContact O-N 3.14Å; D14-T18 PolarHBondContact O-OG1 3.15Å; E15-T18 PolarHBondContact O-N 3.04Å; L16-T18 VanDerWaalsContact C-N 3.31Å; L16-T18 PolarHBondContact O-N 3.15Å; T18-F21 PolarHBondContact O-N 2.87Å; T18-L22 HydrophobicContact CG2-CD1 4.26Å; T18-L22 WeakPolarHBondContact O-CB 3.41Å; T18-L22 WeakPolarHBondContact O-CG 3.36Å; T18-L22 PolarHBondContact O-N 3.21Å
19	Q	90.6	Very high	88.5	Confident	35 Å²	35	50.3 Å²	50.3	16%	0.164	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-51.1	175.4	-75.1	174.5	28	0	0	111.8	E15 L16 E17 F21 L22 E23 R287 L421	E15-Q19 WeakPolarHBondContact O-CG 3.44Å; E15-Q19 PolarHBondContact O-N 2.88Å; L16-Q19 WeakPolarHBondContact O-CB 3.44Å; L16-Q19 PolarHBondContact O-N 3.23Å; E17-Q19 VanDerWaalsContact C-N 3.33Å; E17-Q19 PolarHBondContact O-N 2.99Å; Q19-F21 VanDerWaalsContact C-N 3.29Å; Q19-F21 PolarHBondContact O-N 3.36Å; Q19-L22 PolarHBondContact O-N 3.13Å; Q19-E23 PolarHBondContact O-N 3.14Å; Q19-R287 HydrophobicContact CB-CG 3.85Å; Q19-R287 HydrophobicContact CG-CB 3.75Å; Q19-R287 HydrophobicContact CG-CG 3.63Å; Q19-L421 HydrophobicContact CG-CD1 4.1Å; Q19-L421 HydrophobicContact CG-CD2 3.58Å; Q19-L421 HydrophobicContact CG-CG 4.48Å
20	V	90.9	Very high	88.8	Confident	86 Å²	86	50.8 Å²	50.8	52%	0.521	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-40.6	178.3	173.3	0	0	0	0	110.9	L16 E17 E23 K24	L16-V20 WeakPolarHBondContact O-CG2 3.46Å; L16-V20 PolarHBondContact O-N 2.79Å; E17-V20 PolarHBondContact O-N 3.41Å; V20-E23 PolarHBondContact O-N 3.24Å; V20-K24 PolarHBondContact O-N 2.78Å; V20-K24 VanDerWaalsContact O-N 3.14Å
21	F	91.9	Very high	89.1	Confident	56 Å²	56	53.8 Å²	53.8	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-50.3	175.4	-179.7	-115.6	0	0	0	111.5	E17 T18 Q19 E23 K24 L25 H98 L417	E17-F21 WeakPolarHBondContact O-CB 3.4Å; E17-F21 PolarHBondContact O-N 3.35Å; T18-F21 PolarHBondContact O-N 2.87Å; Q19-F21 VanDerWaalsContact C-N 3.29Å; Q19-F21 PolarHBondContact O-N 3.36Å; F21-E23 VanDerWaalsContact C-N 3.33Å; F21-E23 PolarHBondContact O-N 3.11Å; F21-K24 WeakPolarHBondContact O-CB 3.29Å; F21-K24 PolarHBondContact O-N 2.88Å; F21-K24 VanDerWaalsContact O-N 3.16Å; F21-L25 HydrophobicContact CD1-CD1 4.21Å; F21-L25 HydrophobicContact CD1-CG 4.45Å; F21-L25 HydrophobicContact CD2-CD2 4.36Å; F21-L25 HydrophobicContact CE1-CD1 3.71Å; F21-L25 HydrophobicContact CE1-CD2 4.42Å; F21-L25 HydrophobicContact CE1-CG 4.25Å; F21-L25 HydrophobicContact CE2-CD2 3.91Å; F21-L25 HydrophobicContact CE2-CG 4.49Å; F21-L25 HydrophobicContact CZ-CD1 3.97Å; F21-L25 HydrophobicContact CZ-CD2 3.94Å; F21-L25 HydrophobicContact CZ-CG 4.28Å; F21-L25 WeakPolarHBondContact O-CG 3.41Å; F21-L25 PolarHBondContact O-N 3.34Å; F21-H98 HydrophobicContact CE2-CB 4.19Å; F21-H98 AromaticContact CE2-CD2 3.64Å; F21-H98 HydrophobicContact CZ-CB 4.14Å; F21-H98 VanDerWaalsContact CZ-O 3.28Å; F21-H98 WeakPolarHBondContact CZ-O 3.32Å; F21-L417 HydrophobicContact CD1-CD1 4.01Å; F21-L417 HydrophobicContact CE1-CD1 3.69Å
22	L	91.1	Very high	89.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-41.7	178	-86.6	170.3	0	0	0	113	T18 Q19 K24 L25 I26 L288 I414 L417 L421	T18-L22 HydrophobicContact CG2-CD1 4.26Å; T18-L22 WeakPolarHBondContact O-CB 3.41Å; T18-L22 WeakPolarHBondContact O-CG 3.36Å; T18-L22 PolarHBondContact O-N 3.21Å; Q19-L22 PolarHBondContact O-N 3.13Å; L22-K24 VanDerWaalsContact C-N 3.35Å; L22-K24 PolarHBondContact O-N 3.41Å; L22-L25 PolarHBondContact O-N 3.42Å; L22-I26 WeakPolarHBondContact O-CG1 3.04Å; L22-I26 PolarHBondContact O-N 3.41Å; L22-L288 HydrophobicContact CB-CD1 3.99Å; L22-L288 HydrophobicContact CD1-CD1 3.51Å; L22-L288 HydrophobicContact CG-CD1 4.26Å; L22-I414 HydrophobicContact CD2-CB 4.44Å; L22-I414 HydrophobicContact CD2-CG1 4.49Å; L22-I414 HydrophobicContact CD2-CG2 4.21Å; L22-L417 HydrophobicContact CD1-CB 3.93Å; L22-L417 HydrophobicContact CD2-CB 3.48Å; L22-L417 VanDerWaalsContact CD2-CB 3.48Å; L22-L417 HydrophobicContact CD2-CD1 4.02Å; L22-L417 HydrophobicContact CD2-CG 4.42Å; L22-L417 HydrophobicContact CG-CB 3.94Å; L22-L421 HydrophobicContact CD1-CB 4.46Å; L22-L421 HydrophobicContact CD1-CD2 4Å
23	E	89.6	Confident	89.9	Confident	53 Å²	53	55.7 Å²	55.7	25%	0.248	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-46.3	174.6	-83.7	162.9	-120.2	0	0	112.6	Q19 V20 F21 L25 I26 S27 R287 L291	Q19-E23 PolarHBondContact O-N 3.14Å; V20-E23 PolarHBondContact O-N 3.24Å; F21-E23 VanDerWaalsContact C-N 3.33Å; F21-E23 PolarHBondContact O-N 3.11Å; E23-L25 VanDerWaalsContact C-N 3.31Å; E23-L25 PolarHBondContact O-N 3.11Å; E23-I26 PolarHBondContact O-N 2.71Å; E23-S27 WeakPolarHBondContact O-CB 3.26Å; E23-S27 PolarHBondContact O-N 3.34Å; E23-R287 IonicContact OE1-CZ 3.01Å; E23-R287 IonicContact OE1-NE 2.68Å; E23-R287 PolarHBondContact OE1-NE 2.9Å; E23-R287 IonicContact OE1-NH2 3.81Å; E23-R287 PolarHBondContact OE1-NH2 3.05Å; E23-R287 IonicContact OE2-CZ 2.8Å; E23-R287 IonicContact OE2-NH2 2.75Å; E23-R287 PolarHBondContact OE2-NH2 3.24Å; E23-L291 HydrophobicContact CG-CD1 3.38Å; E23-L291 HydrophobicContact CG-CD2 4.09Å; E23-L291 HydrophobicContact CG-CG 4.35Å
24	K	90.9	Very high	90.7	Very high	105 Å²	105	53.2 Å²	53.2	46%	0.457	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-43.1	176.1	178.4	178.4	168.7	-171.5	0	110.9	V20 F21 L22 S27 V28 H98	V20-K24 PolarHBondContact O-N 2.78Å; V20-K24 VanDerWaalsContact O-N 3.14Å; F21-K24 WeakPolarHBondContact O-CB 3.29Å; F21-K24 PolarHBondContact O-N 2.88Å; F21-K24 VanDerWaalsContact O-N 3.16Å; L22-K24 VanDerWaalsContact C-N 3.35Å; L22-K24 PolarHBondContact O-N 3.41Å; K24-S27 PolarHBondContact O-N 2.79Å; K24-V28 WeakPolarHBondContact O-CG2 3.42Å; K24-V28 PolarHBondContact O-N 3Å; K24-H98 PolarHBondContact NZ-NE2 3.45Å
25	L	93.1	Very high	91.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.1	-45	178.3	-54.8	-165.3	0	0	0	111.8	F21 L22 E23 S27 V28 T29 F94 H98 L410 I414 L417	F21-L25 HydrophobicContact CD1-CD1 4.21Å; F21-L25 HydrophobicContact CD1-CG 4.45Å; F21-L25 HydrophobicContact CD2-CD2 4.36Å; F21-L25 HydrophobicContact CE1-CD1 3.71Å; F21-L25 HydrophobicContact CE1-CD2 4.42Å; F21-L25 HydrophobicContact CE1-CG 4.25Å; F21-L25 HydrophobicContact CE2-CD2 3.91Å; F21-L25 HydrophobicContact CE2-CG 4.49Å; F21-L25 HydrophobicContact CZ-CD1 3.97Å; F21-L25 HydrophobicContact CZ-CD2 3.94Å; F21-L25 HydrophobicContact CZ-CG 4.28Å; F21-L25 WeakPolarHBondContact O-CG 3.41Å; F21-L25 PolarHBondContact O-N 3.34Å; L22-L25 PolarHBondContact O-N 3.42Å; E23-L25 VanDerWaalsContact C-N 3.31Å; E23-L25 PolarHBondContact O-N 3.11Å; L25-S27 VanDerWaalsContact C-N 3.35Å; L25-S27 PolarHBondContact O-N 3.04Å; L25-V28 PolarHBondContact O-N 2.86Å; L25-T29 WeakPolarHBondContact O-CG2 3.43Å; L25-T29 PolarHBondContact O-N 3.33Å; L25-T29 PolarHBondContact O-OG1 3.36Å; L25-T29 VanDerWaalsContact O-OG1 3.07Å; L25-F94 HydrophobicContact CD2-CE1 4.21Å; L25-F94 HydrophobicContact CD2-CZ 3.92Å; L25-H98 HydrophobicContact CD2-CB 3.77Å; L25-L410 HydrophobicContact CB-CD1 4.33Å; L25-L410 HydrophobicContact CD1-CD1 3.95Å; L25-L410 HydrophobicContact CD2-CD1 4.05Å; L25-L410 HydrophobicContact CG-CD1 4.31Å; L25-I414 HydrophobicContact CB-CD1 3.78Å; L25-I414 HydrophobicContact CB-CG1 3.69Å; L25-I414 HydrophobicContact CD1-CG1 3.94Å; L25-I414 HydrophobicContact CG-CG1 4.48Å; L25-L417 HydrophobicContact CD1-CD1 4.16Å
26	I	90.8	Very high	91.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-46	176.4	-69.9	159.8	0	0	0	110.4	L22 E23 V28 T29 A30 L288 L291 T293 T294 I414	L22-I26 WeakPolarHBondContact O-CG1 3.04Å; L22-I26 PolarHBondContact O-N 3.41Å; E23-I26 PolarHBondContact O-N 2.71Å; I26-V28 VanDerWaalsContact C-N 3.3Å; I26-V28 PolarHBondContact O-N 3.47Å; I26-T29 WeakPolarHBondContact CA-OG1 3.38Å; I26-T29 PolarHBondContact O-N 3.23Å; I26-T29 PolarHBondContact O-OG1 2.79Å; I26-A30 WeakPolarHBondContact O-CB 3.47Å; I26-A30 PolarHBondContact O-N 2.71Å; I26-L288 HydrophobicContact CD1-CD2 3.61Å; I26-L288 HydrophobicContact CD1-CG 3.81Å; I26-L291 HydrophobicContact CD1-CD1 4.12Å; I26-T293 WeakPolarHBondContact CG2-OG1 3.34Å; I26-T294 HydrophobicContact CD1-CG2 3.63Å; I26-T294 HydrophobicContact CG1-CG2 4.49Å; I26-I414 HydrophobicContact CG1-CG2 4.13Å
27	S	89.6	Confident	91.5	Very high	70 Å²	70	44 Å²	44	49%	0.49	22%	0.223	S	C	.	.	H	α-helix	trans	-60	-39.4	178.6	-174.3	0	0	0	0	112.5	E23 K24 L25	E23-S27 WeakPolarHBondContact O-CB 3.26Å; E23-S27 PolarHBondContact O-N 3.34Å; K24-S27 PolarHBondContact O-N 2.79Å; L25-S27 VanDerWaalsContact C-N 3.35Å; L25-S27 PolarHBondContact O-N 3.04Å
28	V	91.2	Very high	91.7	Very high	25 Å²	25	37.7 Å²	37.7	15%	0.152	19%	0.194	C	C	.	.	H	α-helix	trans	-71	-48	177	171.9	0	0	0	0	110.8	K24 L25 I26 A30 Q31 Y32 F94	K24-V28 WeakPolarHBondContact O-CG2 3.42Å; K24-V28 PolarHBondContact O-N 3Å; L25-V28 PolarHBondContact O-N 2.86Å; I26-V28 VanDerWaalsContact C-N 3.3Å; I26-V28 PolarHBondContact O-N 3.47Å; V28-A30 PolarHBondContact O-N 3.23Å; V28-Q31 WeakPolarHBondContact O-CB 3.4Å; V28-Q31 PolarHBondContact O-N 2.91Å; V28-Q31 VanDerWaalsContact O-N 3.1Å; V28-Y32 HydrophobicContact CG1-CD2 4.49Å; V28-Y32 HydrophobicContact CG1-CE2 4.1Å; V28-Y32 VanDerWaalsContact O-CD2 3.26Å; V28-Y32 WeakPolarHBondContact O-CD2 3.34Å; V28-F94 HydrophobicContact CB-CE1 3.92Å; V28-F94 HydrophobicContact CB-CZ 3.96Å; V28-F94 HydrophobicContact CG1-CD1 3.95Å; V28-F94 HydrophobicContact CG1-CE1 3.66Å; V28-F94 HydrophobicContact CG1-CZ 4.1Å; V28-F94 HydrophobicContact CG2-CE1 4.06Å; V28-F94 HydrophobicContact CG2-CE2 4Å; V28-F94 HydrophobicContact CG2-CZ 3.61Å
29	T	91.8	Very high	91.9	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-33.1	178.9	54.1	0	0	0	0	113	L25 I26 Q31 Y32 N33 L36 F297 L410 I414	L25-T29 WeakPolarHBondContact O-CG2 3.43Å; L25-T29 PolarHBondContact O-N 3.33Å; L25-T29 PolarHBondContact O-OG1 3.36Å; L25-T29 VanDerWaalsContact O-OG1 3.07Å; I26-T29 WeakPolarHBondContact CA-OG1 3.38Å; I26-T29 PolarHBondContact O-N 3.23Å; I26-T29 PolarHBondContact O-OG1 2.79Å; T29-Q31 PolarHBondContact O-N 3.03Å; T29-Y32 CarbonylContact O-C 3.5Å; T29-Y32 WeakPolarHBondContact O-CA 3.11Å; T29-Y32 PolarHBondContact O-N 2.85Å; T29-N33 PolarHBondContact O-N 3.49Å; T29-L36 HydrophobicContact CG2-CD1 4.46Å; T29-F297 HydrophobicContact CG2-CE1 4.41Å; T29-F297 HydrophobicContact CG2-CZ 4.17Å; T29-F297 WeakPolarHBondContact OG1-CE1 3.41Å; T29-F297 VanDerWaalsContact OG1-CZ 3.31Å; T29-F297 WeakPolarHBondContact OG1-CZ 3.42Å; T29-L410 HydrophobicContact CG2-CD2 3.48Å; T29-L410 VanDerWaalsContact CG2-CD2 3.48Å; T29-L410 HydrophobicContact CG2-CG 3.83Å; T29-I414 HydrophobicContact CG2-CD1 3.7Å
30	A	90.3	Very high	92	Very high	28 Å²	28	39.7 Å²	39.7	23%	0.231	20%	0.202	C	C	.	.	H	α-helix	trans	-58.9	-33.8	176.1	0	0	0	0	0	113.1	I26 V28 Y32 N33	I26-A30 WeakPolarHBondContact O-CB 3.47Å; I26-A30 PolarHBondContact O-N 2.71Å; V28-A30 PolarHBondContact O-N 3.23Å; A30-Y32 PolarHBondContact O-N 3.23Å; A30-N33 WeakPolarHBondContact O-CB 3.38Å; A30-N33 PolarHBondContact O-N 3.36Å; A30-N33 PolarHBondContact O-ND2 3.15Å; A30-N33 VanDerWaalsContact O-ND2 3.08Å
31	Q	92.1	Very high	92.2	Very high	122 Å²	122	37.4 Å²	37.4	57%	0.57	19%	0.188	S	C	*	.	H	α-helix	trans	-65.6	-22	176	-60.5	175.8	41.2	0	0	112.5	V28 T29	V28-Q31 WeakPolarHBondContact O-CB 3.4Å; V28-Q31 PolarHBondContact O-N 2.91Å; V28-Q31 VanDerWaalsContact O-N 3.1Å; T29-Q31 PolarHBondContact O-N 3.03Å
32	Y	94	Very high	92.4	Very high	34 Å²	34	34.7 Å²	34.7	13%	0.133	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	18.7	-179.4	-57.1	-77.7	0	0	0	112.8	V28 T29 A30 W34 L35 L36 W56 L91 L407	V28-Y32 HydrophobicContact CG1-CD2 4.49Å; V28-Y32 HydrophobicContact CG1-CE2 4.1Å; V28-Y32 VanDerWaalsContact O-CD2 3.26Å; V28-Y32 WeakPolarHBondContact O-CD2 3.34Å; T29-Y32 CarbonylContact O-C 3.5Å; T29-Y32 WeakPolarHBondContact O-CA 3.11Å; T29-Y32 PolarHBondContact O-N 2.85Å; A30-Y32 PolarHBondContact O-N 3.23Å; Y32-W34 PolarHBondContact O-N 3.5Å; Y32-L35 WeakPolarHBondContact O-CA 3.4Å; Y32-L35 WeakPolarHBondContact O-CB 3.44Å; Y32-L35 PolarHBondContact O-N 3.27Å; Y32-L36 PolarHBondContact O-N 3.36Å; Y32-W56 HydrophobicContact CD1-CH2 4.48Å; Y32-W56 AromaticContact CE1-CH2 3.91Å; Y32-W56 HydrophobicContact CE1-CH2 3.91Å; Y32-W56 HydrophobicContact CE1-CZ2 4.43Å; Y32-L91 HydrophobicContact CD1-CD2 4.15Å; Y32-L91 HydrophobicContact CD2-CD1 4.14Å; Y32-L91 HydrophobicContact CE1-CD1 4.45Å; Y32-L91 HydrophobicContact CE1-CD2 3.66Å; Y32-L91 HydrophobicContact CE2-CD1 3.49Å; Y32-L91 VanDerWaalsContact CE2-CD1 3.49Å; Y32-L91 HydrophobicContact CE2-CD2 4.22Å; Y32-L91 HydrophobicContact CE2-CG 4.42Å; Y32-L407 HydrophobicContact CD2-CD2 4.35Å; Y32-L407 HydrophobicContact CG-CD1 4.22Å
33	N	91.5	Very high	92.8	Very high	45 Å²	45	34.7 Å²	34.7	24%	0.241	18%	0.176	C	C	.	.	H	α-helix	trans	-55.3	-36.3	176.8	-81.2	-24.2	0	0	0	113	T29 A30 L35 L36 N37 S296	T29-N33 PolarHBondContact O-N 3.49Å; A30-N33 WeakPolarHBondContact O-CB 3.38Å; A30-N33 PolarHBondContact O-N 3.36Å; A30-N33 PolarHBondContact O-ND2 3.15Å; A30-N33 VanDerWaalsContact O-ND2 3.08Å; N33-L35 PolarHBondContact O-N 3.34Å; N33-L36 PolarHBondContact O-N 2.95Å; N33-N37 WeakPolarHBondContact O-CB 3.35Å; N33-N37 PolarHBondContact O-N 3.04Å; N33-S296 VanDerWaalsContact ND2-CB 3.33Å; N33-S296 WeakPolarHBondContact ND2-CB 3.43Å; N33-S296 WeakPolarHBondContact OD1-CB 3.39Å; N33-S296 PolarHBondContact OD1-OG 3.32Å
34	W	93	Very high	93.2	Very high	65 Å²	65	32.5 Å²	32.5	25%	0.246	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-27.1	176.9	67	-93.6	0	0	0	112.8	Y32 R51 P53 W56 F400	Y32-W34 PolarHBondContact O-N 3.5Å; W34-R51 HydrophobicContact CD2-CB 4.46Å; W34-R51 HydrophobicContact CE3-CB 3.63Å; W34-R51 HydrophobicContact CZ3-CB 3.97Å; W34-P53 HydrophobicContact CZ2-CG 4.12Å; W34-W56 HydrophobicContact CH2-CZ3 4.37Å; W34-W56 HydrophobicContact CZ2-CZ3 4.21Å; W34-F400 AromaticContact CZ3-CE2 3.94Å; W34-F400 HydrophobicContact CZ3-CE2 3.94Å; W34-F400 HydrophobicContact CZ3-CZ 4.09Å
35	L	95	Very high	93.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-95.4	-44.1	-180	-178.4	59.4	0	0	0	111.4	Y32 N33 A38 F400 L403 R404 L407	Y32-L35 WeakPolarHBondContact O-CA 3.4Å; Y32-L35 WeakPolarHBondContact O-CB 3.44Å; Y32-L35 PolarHBondContact O-N 3.27Å; N33-L35 PolarHBondContact O-N 3.34Å; L35-A38 WeakPolarHBondContact O-CB 3.12Å; L35-A38 PolarHBondContact O-N 3.25Å; L35-F400 HydrophobicContact CD1-CD1 4.24Å; L35-F400 HydrophobicContact CD1-CE1 3.66Å; L35-F400 HydrophobicContact CD1-CE2 4.21Å; L35-F400 HydrophobicContact CD1-CZ 3.64Å; L35-L403 HydrophobicContact CD1-CB 4.2Å; L35-L403 HydrophobicContact CD2-CB 3.97Å; L35-R404 HydrophobicContact CD1-CB 3.89Å; L35-R404 HydrophobicContact CG-CB 4.15Å; L35-R404 WeakPolarHBondContact O-CD 3.41Å; L35-L407 HydrophobicContact CD2-CD1 3.81Å; L35-L407 HydrophobicContact CG-CD1 4.28Å
36	L	93.2	Very high	93.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-42.3	179.1	-76.6	175.9	0	0	0	112.7	T29 Y32 N33 A38 F297 A300 A301 L407 V411	T29-L36 HydrophobicContact CG2-CD1 4.46Å; Y32-L36 PolarHBondContact O-N 3.36Å; N33-L36 PolarHBondContact O-N 2.95Å; L36-A38 VanDerWaalsContact C-N 3.29Å; L36-A38 PolarHBondContact O-N 3.2Å; L36-F297 HydrophobicContact CD1-CD1 4.48Å; L36-F297 HydrophobicContact CD1-CE1 4.06Å; L36-A300 CarbonylContact O-C 3.26Å; L36-A301 HydrophobicContact CB-CB 3.93Å; L36-A301 WeakPolarHBondContact O-CA 3.41Å; L36-A301 PolarHBondContact O-N 3.27Å; L36-L407 HydrophobicContact CD2-CB 3.62Å; L36-L407 HydrophobicContact CD2-CD1 3.88Å; L36-L407 HydrophobicContact CD2-CG 4.35Å; L36-L407 HydrophobicContact CG-CB 4.49Å; L36-L407 HydrophobicContact CG-CD1 3.93Å; L36-V411 HydrophobicContact CD1-CG2 4.15Å; L36-V411 HydrophobicContact CD2-CG2 3.71Å
37	N	91.6	Very high	94	Very high	54 Å²	54	34.9 Å²	34.9	29%	0.289	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	7	-178.5	-67.6	-49.1	0	0	0	113.4	N33 S296 G298	N33-N37 WeakPolarHBondContact O-CB 3.35Å; N33-N37 PolarHBondContact O-N 3.04Å; N37-S296 PolarHBondContact ND2-O 3.08Å; N37-G298 WeakPolarHBondContact OD1-CA 3.43Å; N37-G298 PolarHBondContact OD1-N 2.94Å; N37-G298 VanDerWaalsContact OD1-N 3.08Å
38	A	93.7	Very high	94.3	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.017	16%	0.158	C	C	.	.			trans	-78.3	125	178.2	0	0	0	0	0	111.4	L35 L36 L48 F400 R404	L35-A38 WeakPolarHBondContact O-CB 3.12Å; L35-A38 PolarHBondContact O-N 3.25Å; L36-A38 VanDerWaalsContact C-N 3.29Å; L36-A38 PolarHBondContact O-N 3.2Å; A38-L48 HydrophobicContact CB-CD1 3.84Å; A38-L48 HydrophobicContact CB-CD2 4.24Å; A38-F400 HydrophobicContact CB-CE1 3.97Å; A38-F400 HydrophobicContact CB-CZ 4.19Å; A38-R404 PolarHBondContact O-NE 2.97Å; A38-R404 PolarHBondContact O-NH1 3.15Å
39	F	93.6	Very high	94.5	Very high	57 Å²	57	32.5 Å²	32.5	25%	0.25	16%	0.159	C	C	.	.			trans	-83.9	118.2	173.1	-75.3	-96	0	0	0	109.9	V41 D42 Y299 A300 R347	F39-V41 HydrophobicContact CB-CG2 4.43Å; F39-V41 PolarHBondContact O-N 3.21Å; F39-V41 VanDerWaalsContact O-N 3.17Å; F39-D42 HydrophobicContact CB-CB 4.22Å; F39-D42 VanDerWaalsContact CB-OD2 3.25Å; F39-D42 WeakPolarHBondContact CB-OD2 3.39Å; F39-D42 WeakPolarHBondContact O-CA 3.41Å; F39-D42 WeakPolarHBondContact O-CB 3.47Å; F39-D42 PolarHBondContact O-N 2.91Å; F39-Y299 AromaticContact CE1-CD1 3.94Å; F39-Y299 HydrophobicContact CE1-CD1 3.94Å; F39-Y299 HydrophobicContact CE1-CE1 4.42Å; F39-Y299 HydrophobicContact CZ-CD1 4.1Å; F39-A300 HydrophobicContact CD1-CB 4.41Å; F39-A300 HydrophobicContact CD2-CB 4.03Å; F39-A300 HydrophobicContact CE1-CB 4.17Å; F39-A300 HydrophobicContact CE2-CB 3.77Å; F39-A300 HydrophobicContact CG-CB 4.36Å; F39-A300 HydrophobicContact CZ-CB 3.84Å; F39-R347 VanDerWaalsContact CD2-NH1 3.3Å
40	M	93.6	Very high	94.8	Very high	30 Å²	30	37.7 Å²	37.7	15%	0.148	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-61.8	-27.4	-176.5	-70.3	-50.7	-51.3	0	0	114.1	D42 F43 V397 F400 Y401	M40-D42 PolarHBondContact O-N 3.34Å; M40-F43 HydrophobicContact CE-CD2 4.1Å; M40-F43 VanDerWaalsContact O-CB 3.25Å; M40-F43 WeakPolarHBondContact O-CB 3.48Å; M40-F43 PolarHBondContact O-N 3.11Å; M40-V397 HydrophobicContact CE-CG1 4.24Å; M40-F400 HydrophobicContact CE-CB 4.41Å; M40-F400 HydrophobicContact CE-CD1 3.84Å; M40-F400 HydrophobicContact SD-CD1 3.63Å; M40-F400 HydrophobicContact SD-CE1 4.1Å; M40-Y401 HydrophobicContact CG-CD2 3.79Å; M40-Y401 HydrophobicContact SD-CD2 4.28Å
41	V	95.2	Very high	95.1	Very high	37 Å²	37	41.7 Å²	41.7	22%	0.224	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-68.5	-27.5	175.5	-58.4	0	0	0	0	111.7	F39 F43 R331 A332 E335 R347	F39-V41 HydrophobicContact CB-CG2 4.43Å; F39-V41 PolarHBondContact O-N 3.21Å; F39-V41 VanDerWaalsContact O-N 3.17Å; V41-F43 PolarHBondContact O-N 3.37Å; V41-R331 HydrophobicContact CB-CG 4.37Å; V41-R331 HydrophobicContact CG1-CG 3.66Å; V41-A332 WeakPolarHBondContact O-CA 3.34Å; V41-E335 WeakPolarHBondContact O-CB 3.46Å; V41-E335 WeakPolarHBondContact O-CG 3.4Å; V41-R347 HydrophobicContact CG2-CG 3.8Å
42	D	96.4	Very high	95.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-86.7	12.6	179	-59	-32.1	0	0	0	111.4	F39 M40 F44 V45 D46 R347	F39-D42 HydrophobicContact CB-CB 4.22Å; F39-D42 VanDerWaalsContact CB-OD2 3.25Å; F39-D42 WeakPolarHBondContact CB-OD2 3.39Å; F39-D42 WeakPolarHBondContact O-CA 3.41Å; F39-D42 WeakPolarHBondContact O-CB 3.47Å; F39-D42 PolarHBondContact O-N 2.91Å; M40-D42 PolarHBondContact O-N 3.34Å; D42-F44 PolarHBondContact O-N 3.05Å; D42-V45 HydrophobicContact CB-CB 4.45Å; D42-V45 PolarHBondContact O-N 3.3Å; D42-V45 VanDerWaalsContact O-N 3.15Å; D42-D46 PolarHBondContact O-N 2.91Å; D42-R347 IonicContact OD2-CZ 2.83Å; D42-R347 IonicContact OD2-NH1 3.21Å; D42-R347 PolarHBondContact OD2-NH1 3.21Å
43	F	97.6	Very high	95.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-45.9	-171.6	-179.7	-91.3	0	0	0	114.4	M40 V41 E47 L48 Y49 A332 V397 F400	M40-F43 HydrophobicContact CE-CD2 4.1Å; M40-F43 VanDerWaalsContact O-CB 3.25Å; M40-F43 WeakPolarHBondContact O-CB 3.48Å; M40-F43 PolarHBondContact O-N 3.11Å; V41-F43 PolarHBondContact O-N 3.37Å; F43-E47 PolarHBondContact O-N 3.25Å; F43-L48 HydrophobicContact CB-CD1 4.3Å; F43-L48 HydrophobicContact CD2-CB 3.87Å; F43-L48 HydrophobicContact CD2-CD1 4.21Å; F43-L48 HydrophobicContact CE2-CB 4.28Å; F43-L48 PolarHBondContact O-N 2.7Å; F43-Y49 AromaticContact CE1-CD1 3.86Å; F43-Y49 HydrophobicContact CE1-CD1 3.86Å; F43-Y49 AromaticContact CZ-CD1 4Å; F43-Y49 HydrophobicContact CZ-CD1 4Å; F43-Y49 HydrophobicContact CZ-CG 4.42Å; F43-A332 HydrophobicContact CB-CB 4.08Å; F43-V397 HydrophobicContact CD1-CG2 3.66Å; F43-V397 HydrophobicContact CE1-CG2 3.54Å; F43-V397 HydrophobicContact CG-CG2 4.32Å; F43-V397 HydrophobicContact CZ-CG2 4.1Å; F43-F400 HydrophobicContact CD2-CB 4.22Å; F43-F400 HydrophobicContact CD2-CD1 4.19Å; F43-F400 HydrophobicContact CD2-CG 4.06Å; F43-F400 HydrophobicContact CE2-CB 3.55Å; F43-F400 HydrophobicContact CE2-CD1 4.21Å; F43-F400 AromaticContact CE2-CD2 3.87Å; F43-F400 HydrophobicContact CE2-CD2 3.87Å; F43-F400 AromaticContact CE2-CG 3.61Å; F43-F400 HydrophobicContact CE2-CG 3.61Å; F43-F400 HydrophobicContact CZ-CB 4.44Å
44	F	98.1	Very high	95.6	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.026	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-28.2	176.6	-60.5	-64.9	0	0	0	112.9	D42 Y49 A332 A333 W336 W389 M390 Q393 V397	D42-F44 PolarHBondContact O-N 3.05Å; F44-Y49 HydrophobicContact CD1-CE1 4.49Å; F44-A332 HydrophobicContact CD2-CB 3.66Å; F44-A332 HydrophobicContact CE2-CB 3.81Å; F44-A333 HydrophobicContact CD2-CB 4.42Å; F44-A333 HydrophobicContact CE2-CB 4.34Å; F44-W336 HydrophobicContact CB-CB 4.01Å; F44-W336 HydrophobicContact CB-CG 4.26Å; F44-W389 HydrophobicContact CD1-CZ3 4.12Å; F44-W389 HydrophobicContact CE1-CH2 4.5Å; F44-W389 HydrophobicContact CE1-CZ3 4.17Å; F44-M390 HydrophobicContact CB-CE 3.74Å; F44-M390 HydrophobicContact CB-CG 4.5Å; F44-M390 HydrophobicContact CB-SD 3.84Å; F44-M390 HydrophobicContact CD1-CB 4.32Å; F44-M390 HydrophobicContact CD1-CE 4.38Å; F44-M390 HydrophobicContact CD1-CG 3.74Å; F44-M390 HydrophobicContact CD1-SD 4.2Å; F44-M390 HydrophobicContact CD2-CB 4.06Å; F44-M390 HydrophobicContact CD2-CG 3.95Å; F44-M390 HydrophobicContact CD2-SD 3.76Å; F44-M390 HydrophobicContact CE1-CB 3.96Å; F44-M390 HydrophobicContact CE1-CG 3.83Å; F44-M390 HydrophobicContact CE2-CB 3.69Å; F44-M390 HydrophobicContact CE2-CG 4.05Å; F44-M390 HydrophobicContact CE2-SD 4.37Å; F44-M390 HydrophobicContact CG-CB 4.38Å; F44-M390 HydrophobicContact CG-CE 4.07Å; F44-M390 HydrophobicContact CG-CG 3.81Å; F44-M390 HydrophobicContact CG-SD 3.68Å; F44-M390 HydrophobicContact CZ-CB 3.64Å; F44-M390 HydrophobicContact CZ-CG 3.99Å; F44-M390 WeakPolarHBondContact CZ-O 3.31Å; F44-Q393 HydrophobicContact CE1-CB 4.23Å; F44-Q393 HydrophobicContact CE1-CG 4.45Å; F44-Q393 HydrophobicContact CZ-CB 4.21Å; F44-V397 HydrophobicContact CE1-CG2 4.45Å; F44-V397 HydrophobicContact CE2-CG2 4.26Å; F44-V397 HydrophobicContact CZ-CG2 3.73Å
45	V	97.7	Very high	95.7	Very high	20 Å²	20	45.4 Å²	45.4	12%	0.121	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-44.5	177.6	174.5	0	0	0	0	111.3	D42 E335 W336 V339	D42-V45 HydrophobicContact CB-CB 4.45Å; D42-V45 PolarHBondContact O-N 3.3Å; D42-V45 VanDerWaalsContact O-N 3.15Å; V45-E335 HydrophobicContact CG2-CB 4.48Å; V45-E335 HydrophobicContact CG2-CG 4.05Å; V45-W336 HydrophobicContact CG2-CB 4.06Å; V45-V339 HydrophobicContact CG1-CG1 4.19Å; V45-V339 HydrophobicContact CG2-CB 4.3Å
46	D	96.9	Very high	95.7	Very high	45 Å²	45	45.6 Å²	45.6	24%	0.241	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	9.5	-177.5	-73.4	-19.5	0	0	0	112.9	D42 L48 R346	D42-D46 PolarHBondContact O-N 2.91Å; D46-L48 HydrophobicContact CB-CD2 3.77Å; D46-L48 HydrophobicContact CB-CG 4.24Å; D46-L48 PolarHBondContact O-N 3.11Å; D46-L48 VanDerWaalsContact O-N 3.15Å; D46-R346 VanDerWaalsContact CG-NH1 3.34Å; D46-R346 IonicContact OD1-CZ 3.74Å; D46-R346 IonicContact OD1-NH1 2.88Å; D46-R346 PolarHBondContact OD1-NH1 2.66Å; D46-R346 IonicContact OD1-NH2 2.78Å; D46-R346 PolarHBondContact OD1-NH2 3.11Å; D46-R346 IonicContact OD2-NH1 3.2Å; D46-R346 PolarHBondContact OD2-NH1 2.92Å
47	E	97.3	Very high	95.8	Very high	92 Å²	92	49 Å²	49	43%	0.43	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.6	48.6	-177.2	-60.6	-172.6	62.2	0	0	112.3	F43 Y49 L50	F43-E47 PolarHBondContact O-N 3.25Å; E47-Y49 HydrophobicContact CB-CE1 3.91Å; E47-Y49 HydrophobicContact CB-CE2 4.39Å; E47-Y49 HydrophobicContact CG-CE1 4.24Å; E47-Y49 WeakPolarHBondContact CG-OH 3.3Å; E47-Y49 PolarHBondContact O-N 2.94Å; E47-Y49 PolarHBondContact OE1-OH 3.39Å; E47-L50 HydrophobicContact CB-CD1 3.8Å; E47-L50 HydrophobicContact CB-CG 4.09Å; E47-L50 WeakPolarHBondContact O-CB 3.44Å; E47-L50 PolarHBondContact O-N 2.96Å; E47-L50 WeakPolarHBondContact OE1-CD1 3.35Å
48	L	97.2	Very high	95.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-56.5	-27.9	-168.9	-66.9	-175	0	0	0	113.1	A38 F43 D46 L50 R51 F400	A38-L48 HydrophobicContact CB-CD1 3.84Å; A38-L48 HydrophobicContact CB-CD2 4.24Å; F43-L48 HydrophobicContact CB-CD1 4.3Å; F43-L48 HydrophobicContact CD2-CB 3.87Å; F43-L48 HydrophobicContact CD2-CD1 4.21Å; F43-L48 HydrophobicContact CE2-CB 4.28Å; F43-L48 PolarHBondContact O-N 2.7Å; D46-L48 HydrophobicContact CB-CD2 3.77Å; D46-L48 HydrophobicContact CB-CG 4.24Å; D46-L48 PolarHBondContact O-N 3.11Å; D46-L48 VanDerWaalsContact O-N 3.15Å; L48-L50 PolarHBondContact O-N 3.48Å; L48-R51 WeakPolarHBondContact O-CB 3.15Å; L48-R51 PolarHBondContact O-N 3.31Å; L48-F400 HydrophobicContact CB-CE1 4.24Å; L48-F400 HydrophobicContact CB-CE2 3.94Å; L48-F400 HydrophobicContact CB-CZ 3.76Å; L48-F400 HydrophobicContact CD1-CE1 3.97Å; L48-F400 HydrophobicContact CD1-CZ 4.18Å; L48-F400 VanDerWaalsContact O-CE2 3.3Å; L48-F400 WeakPolarHBondContact O-CE2 3.39Å
49	Y	95.3	Very high	95.9	Very high	45 Å²	45	53.2 Å²	53.2	18%	0.176	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-59.3	-28.1	175.3	55	-92.2	0	0	0	113.7	F43 F44 E47 R51 I52 Y60 W389	F43-Y49 AromaticContact CE1-CD1 3.86Å; F43-Y49 HydrophobicContact CE1-CD1 3.86Å; F43-Y49 AromaticContact CZ-CD1 4Å; F43-Y49 HydrophobicContact CZ-CD1 4Å; F43-Y49 HydrophobicContact CZ-CG 4.42Å; F44-Y49 HydrophobicContact CD1-CE1 4.49Å; E47-Y49 HydrophobicContact CB-CE1 3.91Å; E47-Y49 HydrophobicContact CB-CE2 4.39Å; E47-Y49 HydrophobicContact CG-CE1 4.24Å; E47-Y49 WeakPolarHBondContact CG-OH 3.3Å; E47-Y49 PolarHBondContact O-N 2.94Å; E47-Y49 PolarHBondContact OE1-OH 3.39Å; Y49-R51 PolarHBondContact O-N 3.26Å; Y49-I52 WeakPolarHBondContact O-CB 3.49Å; Y49-I52 WeakPolarHBondContact O-CG1 3.42Å; Y49-I52 PolarHBondContact O-N 3.34Å; Y49-Y60 WeakPolarHBondContact CB-OH 3.44Å; Y49-W389 HydrophobicContact CE1-CH2 4.45Å
50	L	96.6	Very high	95.9	Very high	109 Å²	109	51.6 Å²	51.6	57%	0.571	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-69.7	-19.6	175.6	-63	-178.9	0	0	0	112.9	E47 L48 I52	E47-L50 HydrophobicContact CB-CD1 3.8Å; E47-L50 HydrophobicContact CB-CG 4.09Å; E47-L50 WeakPolarHBondContact O-CB 3.44Å; E47-L50 PolarHBondContact O-N 2.96Å; E47-L50 WeakPolarHBondContact OE1-CD1 3.35Å; L48-L50 PolarHBondContact O-N 3.48Å; L50-I52 VanDerWaalsContact C-N 3.3Å
51	R	96.5	Very high	96	Very high	112 Å²	112	56.1 Å²	56.1	42%	0.423	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-81.2	-11.1	178.2	-53.5	-177.8	-172.3	-179.2	2.3	112.8	W34 L48 Y49	W34-R51 HydrophobicContact CD2-CB 4.46Å; W34-R51 HydrophobicContact CE3-CB 3.63Å; W34-R51 HydrophobicContact CZ3-CB 3.97Å; L48-R51 WeakPolarHBondContact O-CB 3.15Å; L48-R51 PolarHBondContact O-N 3.31Å; Y49-R51 PolarHBondContact O-N 3.26Å
52	I	96.3	Very high	95.9	Very high	2 Å²	2	57 Å²	57	1%	0.01	27%	0.273	C	S	.	.	S	Bend	trans	-64.1	127.3	176.9	-62.3	175.9	0	0	0	109	Y49 L50 R54 W56 Q57 Y60 F400	Y49-I52 WeakPolarHBondContact O-CB 3.49Å; Y49-I52 WeakPolarHBondContact O-CG1 3.42Å; Y49-I52 PolarHBondContact O-N 3.34Å; L50-I52 VanDerWaalsContact C-N 3.3Å; I52-R54 PolarHBondContact O-N 2.93Å; I52-W56 HydrophobicContact CG2-CB 3.68Å; I52-W56 HydrophobicContact CG2-CE3 4.36Å; I52-Q57 HydrophobicContact CG2-CG 4.32Å; I52-Q57 PolarHBondContact O-NE2 3.22Å; I52-Y60 HydrophobicContact CD1-CD1 4.16Å; I52-Y60 HydrophobicContact CD1-CD2 3.28Å; I52-Y60 HydrophobicContact CD1-CE1 4.41Å; I52-Y60 HydrophobicContact CD1-CE2 3.56Å; I52-Y60 HydrophobicContact CD1-CG 3.61Å; I52-F400 HydrophobicContact CD1-CD2 3.94Å; I52-F400 HydrophobicContact CG1-CD2 3.89Å; I52-F400 HydrophobicContact CG1-CE2 4.01Å
53	P	96.6	Very high	95.8	Very high	42 Å²	42	57.6 Å²	57.6	27%	0.273	28%	0.276	S	S	.	.			trans	-51	138.9	176.4	-28.4	34.4	0	0	0	112.2	W34 C55 W56 Q57	W34-P53 HydrophobicContact CZ2-CG 4.12Å; P53-C55 PolarHBondContact O-N 3.37Å; P53-C55 VanDerWaalsContact O-N 3.12Å; P53-W56 HydrophobicContact CB-CD2 4.17Å; P53-W56 HydrophobicContact CB-CG 4.22Å; P53-W56 HydrophobicContact CG-CD2 3.95Å; P53-W56 HydrophobicContact CG-CE3 3.98Å; P53-W56 HydrophobicContact CG-CG 4.5Å; P53-W56 HydrophobicContact CG-CH2 4.42Å; P53-W56 HydrophobicContact CG-CZ2 4.4Å; P53-W56 HydrophobicContact CG-CZ3 4.21Å; P53-W56 WeakPolarHBondContact O-CA 3.49Å; P53-W56 WeakPolarHBondContact O-CB 3.37Å; P53-W56 PolarHBondContact O-N 3.26Å; P53-Q57 PolarHBondContact O-N 3.17Å
54	R	95.4	Very high	95.4	Very high	221 Å²	221	61.8 Å²	61.8	83%	0.834	29%	0.292	S	S	*	.	H	α-helix	trans	-52	-40.3	-177.1	-70.6	-175.2	178.7	178.8	-0.5	113.2	I52 W56 Q57	I52-R54 PolarHBondContact O-N 2.93Å; R54-W56 PolarHBondContact O-N 2.8Å; R54-W56 VanDerWaalsContact O-N 3.15Å; R54-Q57 WeakPolarHBondContact O-CB 3.38Å; R54-Q57 PolarHBondContact O-N 3.46Å; R54-Q57 VanDerWaalsContact O-N 3.13Å
55	C	95.3	Very high	94.9	Very high	79 Å²	79	63.3 Å²	63.3	53%	0.534	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-15.5	178.6	58.1	0	0	0	0	113.9	P53 P85	P53-C55 PolarHBondContact O-N 3.37Å; P53-C55 VanDerWaalsContact O-N 3.12Å; C55-P85 WeakPolarHBondContact O-CG 3.42Å
56	W	96.3	Very high	94.5	Very high	4 Å²	4	66.8 Å²	66.8	2%	0.015	32%	0.316	C	S	.	.	H	α-helix	trans	-97.9	-14.4	176.5	-56.6	-1.4	0	0	0	112.8	Y32 W34 I52 P53 R54 Q58 L59 Y60 P85 S87 L88 L91 L403	Y32-W56 HydrophobicContact CD1-CH2 4.48Å; Y32-W56 AromaticContact CE1-CH2 3.91Å; Y32-W56 HydrophobicContact CE1-CH2 3.91Å; Y32-W56 HydrophobicContact CE1-CZ2 4.43Å; W34-W56 HydrophobicContact CH2-CZ3 4.37Å; W34-W56 HydrophobicContact CZ2-CZ3 4.21Å; I52-W56 HydrophobicContact CG2-CB 3.68Å; I52-W56 HydrophobicContact CG2-CE3 4.36Å; P53-W56 HydrophobicContact CB-CD2 4.17Å; P53-W56 HydrophobicContact CB-CG 4.22Å; P53-W56 HydrophobicContact CG-CD2 3.95Å; P53-W56 HydrophobicContact CG-CE3 3.98Å; P53-W56 HydrophobicContact CG-CG 4.5Å; P53-W56 HydrophobicContact CG-CH2 4.42Å; P53-W56 HydrophobicContact CG-CZ2 4.4Å; P53-W56 HydrophobicContact CG-CZ3 4.21Å; P53-W56 WeakPolarHBondContact O-CA 3.49Å; P53-W56 WeakPolarHBondContact O-CB 3.37Å; P53-W56 PolarHBondContact O-N 3.26Å; R54-W56 PolarHBondContact O-N 2.8Å; R54-W56 VanDerWaalsContact O-N 3.15Å; W56-Q58 PolarHBondContact O-N 2.85Å; W56-L59 PolarHBondContact O-N 3.44Å; W56-Y60 PolarHBondContact O-N 3Å; W56-P85 HydrophobicContact CG-CG 4.37Å; W56-S87 PolarHBondContact NE1-OG 3.1Å; W56-L88 HydrophobicContact CD2-CB 4.42Å; W56-L88 HydrophobicContact CD2-CD1 4.45Å; W56-L88 HydrophobicContact CD2-CD2 4.37Å; W56-L88 HydrophobicContact CE3-CD1 4.41Å; W56-L88 HydrophobicContact CH2-CD1 3.95Å; W56-L88 HydrophobicContact CZ2-CB 4.17Å; W56-L88 HydrophobicContact CZ2-CD1 3.97Å; W56-L88 HydrophobicContact CZ3-CD1 4.18Å; W56-L91 HydrophobicContact CH2-CD2 4.1Å; W56-L403 HydrophobicContact CE3-CD1 4.2Å; W56-L403 HydrophobicContact CE3-CD2 4.15Å; W56-L403 HydrophobicContact CZ3-CD1 4.41Å; W56-L403 HydrophobicContact CZ3-CD2 4.05Å
57	Q	94.7	Very high	94.3	Very high	71 Å²	71	64.6 Å²	64.6	33%	0.332	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-38.4	-171.9	-71.6	-174.7	4.1	0	0	113	I52 P53 R54 L59 Y60 M61	I52-Q57 HydrophobicContact CG2-CG 4.32Å; I52-Q57 PolarHBondContact O-NE2 3.22Å; P53-Q57 PolarHBondContact O-N 3.17Å; R54-Q57 WeakPolarHBondContact O-CB 3.38Å; R54-Q57 PolarHBondContact O-N 3.46Å; R54-Q57 VanDerWaalsContact O-N 3.13Å; Q57-L59 VanDerWaalsContact C-N 3.29Å; Q57-L59 PolarHBondContact O-N 3Å; Q57-Y60 WeakPolarHBondContact O-CB 3.33Å; Q57-Y60 PolarHBondContact O-N 3.3Å; Q57-Y60 VanDerWaalsContact O-N 3.15Å; Q57-M61 VanDerWaalsContact O-CG 3.32Å; Q57-M61 WeakPolarHBondContact O-CG 3.49Å; Q57-M61 PolarHBondContact O-N 3.03Å
58	Q	92.3	Very high	94	Very high	137 Å²	137	60.2 Å²	60.2	64%	0.64	28%	0.284	S	S	*	.	H	α-helix	trans	-58.7	-42.9	178.2	-175.1	61.4	20.4	0	0	112	W56 T62	W56-Q58 PolarHBondContact O-N 2.85Å; Q58-T62 PolarHBondContact O-OG1 2.92Å
59	L	94.1	Very high	93.8	Very high	9 Å²	9	62 Å²	62	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-44.3	176.3	178.4	65.3	0	0	0	111	W56 Q57 M61 T62 V63 W84 L88 F399	W56-L59 PolarHBondContact O-N 3.44Å; Q57-L59 VanDerWaalsContact C-N 3.29Å; Q57-L59 PolarHBondContact O-N 3Å; L59-M61 PolarHBondContact O-N 3.31Å; L59-T62 CarbonylContact O-C 3.56Å; L59-T62 PolarHBondContact O-N 3.29Å; L59-V63 WeakPolarHBondContact O-CA 3.39Å; L59-V63 PolarHBondContact O-N 2.95Å; L59-W84 HydrophobicContact CD1-CZ2 4.45Å; L59-W84 HydrophobicContact CD2-CD2 3.84Å; L59-W84 HydrophobicContact CD2-CE3 3.38Å; L59-W84 HydrophobicContact CD2-CH2 3.71Å; L59-W84 HydrophobicContact CD2-CZ2 4.14Å; L59-W84 HydrophobicContact CD2-CZ3 3.32Å; L59-L88 HydrophobicContact CD2-CD2 4.13Å; L59-F399 HydrophobicContact CD2-CE2 4.31Å; L59-F399 HydrophobicContact CD2-CZ 3.8Å; L59-F399 HydrophobicContact CG-CZ 4.09Å
60	Y	95	Very high	93.6	Very high	22 Å²	22	60.9 Å²	60.9	9%	0.086	29%	0.289	C	S	.	.	H	α-helix	trans	-57.5	-47.6	177	165.3	-98.2	0	0	0	112.7	Y49 I52 W56 Q57 T62 V63 Q396 F399	Y49-Y60 WeakPolarHBondContact CB-OH 3.44Å; I52-Y60 HydrophobicContact CD1-CD1 4.16Å; I52-Y60 HydrophobicContact CD1-CD2 3.28Å; I52-Y60 HydrophobicContact CD1-CE1 4.41Å; I52-Y60 HydrophobicContact CD1-CE2 3.56Å; I52-Y60 HydrophobicContact CD1-CG 3.61Å; W56-Y60 PolarHBondContact O-N 3Å; Q57-Y60 WeakPolarHBondContact O-CB 3.33Å; Q57-Y60 PolarHBondContact O-N 3.3Å; Q57-Y60 VanDerWaalsContact O-N 3.15Å; Y60-T62 PolarHBondContact O-N 3.06Å; Y60-V63 WeakPolarHBondContact O-CG1 3.36Å; Y60-V63 PolarHBondContact O-N 2.93Å; Y60-Q396 HydrophobicContact CD2-CB 4.24Å; Y60-Q396 HydrophobicContact CD2-CG 4.27Å; Y60-Q396 HydrophobicContact CE1-CB 4.46Å; Y60-Q396 HydrophobicContact CE1-CG 4.08Å; Y60-Q396 HydrophobicContact CE2-CB 3.41Å; Y60-Q396 VanDerWaalsContact CE2-CB 3.41Å; Y60-Q396 HydrophobicContact CE2-CG 3.76Å; Y60-Q396 WeakPolarHBondContact OH-CB 3.28Å; Y60-F399 AromaticContact CD2-CD1 3.96Å; Y60-F399 HydrophobicContact CD2-CD1 3.96Å
61	M	94.2	Very high	93.5	Very high	126 Å²	126	55.7 Å²	55.7	62%	0.621	26%	0.262	S	S	*	.	H	α-helix	trans	-63.4	-29.4	-176.5	-71.2	-179.2	106.1	0	0	112.8	Q57 L59	Q57-M61 VanDerWaalsContact O-CG 3.32Å; Q57-M61 WeakPolarHBondContact O-CG 3.49Å; Q57-M61 PolarHBondContact O-N 3.03Å; L59-M61 PolarHBondContact O-N 3.31Å
62	T	93.9	Very high	93.3	Very high	56 Å²	56	50.9 Å²	50.9	34%	0.344	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	20.7	-174.1	56.7	0	0	0	0	112.1	Q58 L59 Y60 R82	Q58-T62 PolarHBondContact O-OG1 2.92Å; L59-T62 CarbonylContact O-C 3.56Å; L59-T62 PolarHBondContact O-N 3.29Å; Y60-T62 PolarHBondContact O-N 3.06Å; T62-R82 PolarHBondContact O-NH1 2.94Å; T62-R82 PolarHBondContact OG1-NH2 2.92Å
63	V	93.6	Very high	93	Very high	12 Å²	12	51.6 Å²	51.6	7%	0.073	25%	0.25	C	S	.	.			trans	-63.7	141.3	-170.5	67.5	0	0	0	0	112.8	L59 Y60 D67 I68 P395 Q396 F399	L59-V63 WeakPolarHBondContact O-CA 3.39Å; L59-V63 PolarHBondContact O-N 2.95Å; Y60-V63 WeakPolarHBondContact O-CG1 3.36Å; Y60-V63 PolarHBondContact O-N 2.93Å; V63-D67 HydrophobicContact CG2-CB 4.14Å; V63-I68 HydrophobicContact CG2-CG1 4.17Å; V63-P395 HydrophobicContact CG1-CB 3.9Å; V63-Q396 HydrophobicContact CG1-CG 4.36Å; V63-F399 HydrophobicContact CB-CB 4.33Å; V63-F399 HydrophobicContact CB-CD2 4.47Å; V63-F399 HydrophobicContact CB-CG 4.32Å; V63-F399 HydrophobicContact CG1-CB 4.08Å; V63-F399 HydrophobicContact CG2-CB 3.8Å; V63-F399 HydrophobicContact CG2-CD2 3.46Å; V63-F399 VanDerWaalsContact CG2-CD2 3.46Å; V63-F399 HydrophobicContact CG2-CE2 4.12Å; V63-F399 HydrophobicContact CG2-CG 3.69Å
64	R	90.6	Very high	91.9	Very high	87 Å²	87	54 Å²	54	33%	0.328	27%	0.273	S	S	.	.			trans	-120	163.9	175.7	-50.5	169.3	-61.3	159.6	5.4	110.8	E66 D67 I68 R82	R64-E66 VanDerWaalsContact C-N 3.28Å; R64-E66 HydrophobicContact CB-CG 4.02Å; R64-E66 WeakPolarHBondContact CB-OE1 3.42Å; R64-E66 VanDerWaalsContact CB-OE2 3.24Å; R64-E66 WeakPolarHBondContact CB-OE2 3.5Å; R64-E66 WeakPolarHBondContact CD-OE1 3.19Å; R64-E66 IonicContact CZ-OE1 3.21Å; R64-E66 IonicContact NE-OE1 2.7Å; R64-E66 PolarHBondContact NE-OE1 3.35Å; R64-E66 VanDerWaalsContact NE-OE1 3.09Å; R64-E66 IonicContact NH1-OE1 3.68Å; R64-E66 PolarHBondContact NH1-OE1 3.14Å; R64-E66 IonicContact NH2-OE1 3.64Å; R64-E66 PolarHBondContact O-N 2.9Å; R64-D67 WeakPolarHBondContact CB-OD2 3.37Å; R64-D67 IonicContact CZ-OD1 3.52Å; R64-D67 PolarHBondContact N-OD2 3.33Å; R64-D67 IonicContact NE-OD1 3.16Å; R64-D67 IonicContact NE-OD2 3Å; R64-D67 PolarHBondContact NE-OD2 2.65Å; R64-D67 IonicContact NH2-OD1 2.98Å; R64-D67 PolarHBondContact NH2-OD1 3.1Å; R64-D67 IonicContact NH2-OD2 3.55Å; R64-D67 WeakPolarHBondContact O-CB 3.27Å; R64-D67 PolarHBondContact O-N 3.24Å; R64-I68 PolarHBondContact O-N 3.33Å; R64-R82 VanDerWaalsContact NH2-CD 3.29Å
65	V	88.1	Confident	90.7	Very high	39 Å²	39	45.9 Å²	45.9	24%	0.236	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-40.5	-179.3	164.9	0	0	0	0	111.3	D67 I68 I69 L316 W394	V65-D67 PolarHBondContact O-N 3.37Å; V65-I68 WeakPolarHBondContact O-CB 3.25Å; V65-I68 PolarHBondContact O-N 3.49Å; V65-I68 VanDerWaalsContact O-N 3.16Å; V65-I69 HydrophobicContact CG1-CD1 4.02Å; V65-I69 WeakPolarHBondContact O-CG1 3.48Å; V65-I69 PolarHBondContact O-N 2.75Å; V65-L316 HydrophobicContact CG1-CB 4.2Å; V65-L316 HydrophobicContact CG1-CD2 3.93Å; V65-W394 HydrophobicContact CG2-CH2 3.96Å
66	E	89.3	Confident	89	Confident	92 Å²	92	47.9 Å²	47.9	43%	0.43	26%	0.261	S	S	.	.	H	α-helix	trans	-61	-31.5	175.5	58.6	-91	-148.7	0	0	113.2	R64 I69 F70	R64-E66 VanDerWaalsContact C-N 3.28Å; R64-E66 HydrophobicContact CB-CG 4.02Å; R64-E66 WeakPolarHBondContact CB-OE1 3.42Å; R64-E66 VanDerWaalsContact CB-OE2 3.24Å; R64-E66 WeakPolarHBondContact CB-OE2 3.5Å; R64-E66 WeakPolarHBondContact CD-OE1 3.19Å; R64-E66 IonicContact CZ-OE1 3.21Å; R64-E66 IonicContact NE-OE1 2.7Å; R64-E66 PolarHBondContact NE-OE1 3.35Å; R64-E66 VanDerWaalsContact NE-OE1 3.09Å; R64-E66 IonicContact NH1-OE1 3.68Å; R64-E66 PolarHBondContact NH1-OE1 3.14Å; R64-E66 IonicContact NH2-OE1 3.64Å; R64-E66 PolarHBondContact O-N 2.9Å; E66-I69 PolarHBondContact O-N 3.21Å; E66-F70 WeakPolarHBondContact O-CB 3.25Å; E66-F70 PolarHBondContact O-N 2.76Å
67	D	91.8	Very high	87	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-37	178.4	-56.7	-35.1	0	0	0	110	V63 R64 V65 L71 R82 W84	V63-D67 HydrophobicContact CG2-CB 4.14Å; R64-D67 WeakPolarHBondContact CB-OD2 3.37Å; R64-D67 IonicContact CZ-OD1 3.52Å; R64-D67 PolarHBondContact N-OD2 3.33Å; R64-D67 IonicContact NE-OD1 3.16Å; R64-D67 IonicContact NE-OD2 3Å; R64-D67 PolarHBondContact NE-OD2 2.65Å; R64-D67 IonicContact NH2-OD1 2.98Å; R64-D67 PolarHBondContact NH2-OD1 3.1Å; R64-D67 IonicContact NH2-OD2 3.55Å; R64-D67 WeakPolarHBondContact O-CB 3.27Å; R64-D67 PolarHBondContact O-N 3.24Å; V65-D67 PolarHBondContact O-N 3.37Å; D67-L71 WeakPolarHBondContact O-CB 3.37Å; D67-L71 PolarHBondContact O-N 3.26Å; D67-R82 WeakPolarHBondContact OD1-CD 3.5Å; D67-R82 WeakPolarHBondContact OD2-CD 3.24Å; D67-R82 IonicContact OD2-CZ 2.71Å; D67-R82 IonicContact OD2-NH1 2.95Å; D67-R82 PolarHBondContact OD2-NH1 3.05Å; D67-W84 HydrophobicContact CB-CH2 4.24Å; D67-W84 HydrophobicContact CB-CZ2 3.88Å; D67-W84 VanDerWaalsContact O-CH2 3.3Å; D67-W84 WeakPolarHBondContact O-CH2 3.45Å
68	I	92	Very high	85.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-44.1	174.1	-60.3	170.2	0	0	0	110.9	V63 R64 V65 L71 L72 F312 L316 A398 F399 A402	V63-I68 HydrophobicContact CG2-CG1 4.17Å; R64-I68 PolarHBondContact O-N 3.33Å; V65-I68 WeakPolarHBondContact O-CB 3.25Å; V65-I68 PolarHBondContact O-N 3.49Å; V65-I68 VanDerWaalsContact O-N 3.16Å; I68-L71 PolarHBondContact O-N 3.16Å; I68-L72 HydrophobicContact CG2-CD1 4.19Å; I68-L72 PolarHBondContact O-N 3.33Å; I68-F312 HydrophobicContact CG2-CE1 4.1Å; I68-F312 HydrophobicContact CG2-CZ 4.12Å; I68-L316 HydrophobicContact CB-CD1 4.13Å; I68-L316 HydrophobicContact CD1-CD2 4.4Å; I68-L316 HydrophobicContact CG2-CD1 3.41Å; I68-L316 VanDerWaalsContact CG2-CD1 3.41Å; I68-L316 HydrophobicContact CG2-CD2 4.41Å; I68-A398 HydrophobicContact CD1-CB 3.79Å; I68-F399 HydrophobicContact CD1-CB 4.38Å; I68-F399 HydrophobicContact CG1-CB 4.24Å; I68-F399 HydrophobicContact CG1-CD2 4.01Å; I68-A402 HydrophobicContact CG2-CB 3.54Å
69	I	91.1	Very high	84.5	Confident	36 Å²	36	53.1 Å²	53.1	19%	0.185	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-47.1	177.8	-67.3	168.4	0	0	0	110.2	V65 E66 L71 L72 S73 I313 L316	V65-I69 HydrophobicContact CG1-CD1 4.02Å; V65-I69 WeakPolarHBondContact O-CG1 3.48Å; V65-I69 PolarHBondContact O-N 2.75Å; E66-I69 PolarHBondContact O-N 3.21Å; I69-L71 PolarHBondContact O-N 3.39Å; I69-L72 PolarHBondContact O-N 3.42Å; I69-S73 WeakPolarHBondContact O-CB 3.49Å; I69-S73 PolarHBondContact O-N 3.29Å; I69-S73 PolarHBondContact O-OG 3.18Å; I69-I313 HydrophobicContact CG2-CG2 4.11Å; I69-L316 HydrophobicContact CD1-CB 3.98Å; I69-L316 HydrophobicContact CG1-CB 3.77Å; I69-L316 HydrophobicContact CG1-CD1 4.19Å
70	F	92.7	Very high	83.9	Confident	22 Å²	22	54.4 Å²	54.4	10%	0.096	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-46.3	177.1	169.8	-93.6	0	0	0	112	E66 L72 S73 T78 W84 L89 R92	E66-F70 WeakPolarHBondContact O-CB 3.25Å; E66-F70 PolarHBondContact O-N 2.76Å; F70-L72 VanDerWaalsContact C-N 3.27Å; F70-L72 PolarHBondContact O-N 2.82Å; F70-S73 PolarHBondContact O-N 3.08Å; F70-T78 WeakPolarHBondContact CD2-O 3.41Å; F70-T78 WeakPolarHBondContact CE2-O 3.16Å; F70-W84 HydrophobicContact CB-CZ2 4.45Å; F70-W84 HydrophobicContact CD1-CD2 4.1Å; F70-W84 AromaticContact CD1-CE2 3.42Å; F70-W84 VanDerWaalsContact CD1-CE2 3.42Å; F70-W84 AromaticContact CD1-CH2 3.84Å; F70-W84 HydrophobicContact CD1-CH2 3.84Å; F70-W84 AromaticContact CD1-CZ2 3.3Å; F70-W84 HydrophobicContact CD1-CZ2 3.3Å; F70-W84 HydrophobicContact CD1-CZ3 4.4Å; F70-W84 AromaticContact CD1-NE1 3.73Å; F70-W84 AromaticContact CE1-CD1 3.99Å; F70-W84 AromaticContact CE1-CD2 3.77Å; F70-W84 HydrophobicContact CE1-CD2 3.77Å; F70-W84 AromaticContact CE1-CE2 3.5Å; F70-W84 HydrophobicContact CE1-CE3 4.29Å; F70-W84 HydrophobicContact CE1-CG 4.14Å; F70-W84 HydrophobicContact CE1-CH2 4.41Å; F70-W84 AromaticContact CE1-CZ2 3.88Å; F70-W84 HydrophobicContact CE1-CZ2 3.88Å; F70-W84 AromaticContact CE1-NE1 3.62Å; F70-W84 HydrophobicContact CG-CZ2 4.23Å; F70-L89 HydrophobicContact CE1-CD2 4.11Å; F70-L89 HydrophobicContact CZ-CD2 4.17Å; F70-R92 PolarHBondContact O-NE 3.1Å
71	L	93.5	Very high	83.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-55.3	-44.8	-178.7	-178.9	60	0	0	0	111.9	D67 I68 I69 W84 L88 F399 A402 L403 L406	D67-L71 WeakPolarHBondContact O-CB 3.37Å; D67-L71 PolarHBondContact O-N 3.26Å; I68-L71 PolarHBondContact O-N 3.16Å; I69-L71 PolarHBondContact O-N 3.39Å; L71-W84 HydrophobicContact CB-CH2 3.96Å; L71-W84 HydrophobicContact CB-CZ3 4.26Å; L71-W84 HydrophobicContact CD1-CH2 4.42Å; L71-W84 HydrophobicContact CD1-CZ3 3.86Å; L71-L88 HydrophobicContact CD1-CD1 4.13Å; L71-L88 HydrophobicContact CD1-CD2 4.41Å; L71-L88 HydrophobicContact CD1-CG 4.2Å; L71-F399 HydrophobicContact CD2-CD2 4.38Å; L71-F399 HydrophobicContact CD2-CE2 3.89Å; L71-F399 HydrophobicContact CD2-CZ 4.46Å; L71-A402 HydrophobicContact CD2-CB 4.08Å; L71-L403 HydrophobicContact CD2-CD2 3.81Å; L71-L403 HydrophobicContact CD2-CG 4.22Å; L71-L406 HydrophobicContact CD1-CD2 3.76Å; L71-L406 HydrophobicContact CG-CD2 4.33Å; L71-L406 WeakPolarHBondContact O-CD1 3.33Å
72	L	92.6	Very high	82.8	Confident	11 Å²	11	57 Å²	57	6%	0.058	33%	0.328	C	S	.	.	H	α-helix	trans	-88.9	-15.8	-174	-64.1	177.5	0	0	0	114.3	I68 I69 F70 A74 N309 F312 I313 A402 L406	I68-L72 HydrophobicContact CG2-CD1 4.19Å; I68-L72 PolarHBondContact O-N 3.33Å; I69-L72 PolarHBondContact O-N 3.42Å; F70-L72 VanDerWaalsContact C-N 3.27Å; F70-L72 PolarHBondContact O-N 2.82Å; L72-A74 PolarHBondContact O-N 2.96Å; L72-N309 HydrophobicContact CB-CB 4.4Å; L72-F312 HydrophobicContact CD1-CD1 3.23Å; L72-F312 HydrophobicContact CD1-CE1 3.59Å; L72-F312 HydrophobicContact CD1-CG 4.16Å; L72-I313 HydrophobicContact CB-CD1 3.8Å; L72-I313 HydrophobicContact CB-CG1 3.89Å; L72-I313 HydrophobicContact CD1-CG1 4.48Å; L72-A402 HydrophobicContact CD1-CB 4.02Å; L72-A402 HydrophobicContact CD2-CB 4.35Å; L72-A402 WeakPolarHBondContact CD2-O 3.42Å; L72-A402 HydrophobicContact CG-CB 4.2Å; L72-L406 HydrophobicContact CD2-CB 4.21Å
73	S	89.1	Confident	82.6	Confident	17 Å²	17	61 Å²	61	12%	0.119	35%	0.352	C	S	.	.			trans	-67.9	127.6	-178.3	-69.6	0	0	0	0	110.6	I69 F70 S75 R92	I69-S73 WeakPolarHBondContact O-CB 3.49Å; I69-S73 PolarHBondContact O-N 3.29Å; I69-S73 PolarHBondContact O-OG 3.18Å; F70-S73 PolarHBondContact O-N 3.08Å; S73-S75 PolarHBondContact O-N 3.36Å; S73-R92 PolarHBondContact O-NH2 3.34Å
74	A	75.4	Confident	82.6	Confident	92 Å²	92	61.4 Å²	61.4	76%	0.76	35%	0.352	S	S	*	.			trans	-69.2	-24.7	175.3	0	0	0	0	0	112.7	L72	L72-A74 PolarHBondContact O-N 2.96Å
75	S	69.2	Low	82.8	Confident	51 Å²	51	58.3 Å²	58.3	36%	0.357	34%	0.343	S	S	.	.			trans	-72.1	132.9	-177.1	-175.4	0	0	0	0	111.9	S73 H77 T78 R92	S73-S75 PolarHBondContact O-N 3.36Å; S75-H77 PolarHBondContact O-N 3.2Å; S75-H77 WeakPolarHBondContact OG-CB 3.43Å; S75-H77 PolarHBondContact OG-N 2.73Å; S75-H77 VanDerWaalsContact OG-N 3.07Å; S75-T78 PolarHBondContact O-OG1 2.78Å; S75-T78 VanDerWaalsContact O-OG1 3.1Å; S75-R92 PolarHBondContact O-NH2 2.92Å
76	T	59.5	Low	83.2	Confident	121 Å²	121	63.2 Å²	63.2	74%	0.742	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-16.7	167.4	50.9	0	0	0	0	111.9
77	H	53.9	Low	83.5	Confident	165 Å²	165	61.3 Å²	61.3	76%	0.764	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.3	-178.9	-61.2	-70.1	0	0	0	114.6	S75 S79	S75-H77 PolarHBondContact O-N 3.2Å; S75-H77 WeakPolarHBondContact OG-CB 3.43Å; S75-H77 PolarHBondContact OG-N 2.73Å; S75-H77 VanDerWaalsContact OG-N 3.07Å; H77-S79 PolarHBondContact O-N 3.41Å
78	T	65	Low	83.6	Confident	43 Å²	43	61.4 Å²	61.4	26%	0.264	37%	0.365	S	S	.	.			trans	-69.4	102.6	169.5	52	0	0	0	0	107.5	F70 S75	F70-T78 WeakPolarHBondContact CD2-O 3.41Å; F70-T78 WeakPolarHBondContact CE2-O 3.16Å; S75-T78 PolarHBondContact O-OG1 2.78Å; S75-T78 VanDerWaalsContact O-OG1 3.1Å
79	S	70.8	Confident	83.7	Confident	113 Å²	113	64.2 Å²	64.2	79%	0.79	38%	0.38	S	S	*	.			trans	-77.1	127.7	175.7	55	0	0	0	0	109.9	H77	H77-S79 PolarHBondContact O-N 3.41Å
80	S	80.9	Confident	83.8	Confident	37 Å²	37	65.1 Å²	65.1	26%	0.259	39%	0.392	S	S	.	.			trans	-101.3	137.6	165.2	-171.7	0	0	0	0	109.1	R82 W84	S80-R82 VanDerWaalsContact C-N 3.3Å; S80-R82 PolarHBondContact OG-N 3.06Å; S80-W84 PolarHBondContact OG-NE1 3.3Å
81	T	79.6	Confident	83.9	Confident	134 Å²	134	64.3 Å²	64.3	82%	0.822	39%	0.389	S	S	*	.			trans	-85.7	-4.2	172.7	53.8	0	0	0	0	112.8
82	R	87.2	Confident	83.9	Confident	68 Å²	68	66 Å²	66	26%	0.257	40%	0.395	S	S	.	.	S	Bend	trans	-90.3	151.9	-180	-57.9	-164.1	85.8	164.7	5.6	111.6	T62 R64 D67 S80 W84	T62-R82 PolarHBondContact O-NH1 2.94Å; T62-R82 PolarHBondContact OG1-NH2 2.92Å; R64-R82 VanDerWaalsContact NH2-CD 3.29Å; D67-R82 WeakPolarHBondContact OD1-CD 3.5Å; D67-R82 WeakPolarHBondContact OD2-CD 3.24Å; D67-R82 IonicContact OD2-CZ 2.71Å; D67-R82 IonicContact OD2-NH1 2.95Å; D67-R82 PolarHBondContact OD2-NH1 3.05Å; S80-R82 VanDerWaalsContact C-N 3.3Å; S80-R82 PolarHBondContact OG-N 3.06Å; R82-W84 VanDerWaalsContact O-CD1 3.27Å; R82-W84 PolarHBondContact O-N 3.03Å
83	V	89	Confident	83.9	Confident	141 Å²	141	68.6 Å²	68.6	86%	0.855	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-76.6	117.5	166	-177.9	0	0	0	0	108.5
84	W	93.8	Very high	84.1	Confident	20 Å²	20	69.3 Å²	69.3	8%	0.076	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-96.9	147.1	177.1	-76.3	74.7	0	0	0	111.1	L59 D67 F70 L71 S80 R82 L86 L88 L89 F399	L59-W84 HydrophobicContact CD1-CZ2 4.45Å; L59-W84 HydrophobicContact CD2-CD2 3.84Å; L59-W84 HydrophobicContact CD2-CE3 3.38Å; L59-W84 HydrophobicContact CD2-CH2 3.71Å; L59-W84 HydrophobicContact CD2-CZ2 4.14Å; L59-W84 HydrophobicContact CD2-CZ3 3.32Å; D67-W84 HydrophobicContact CB-CH2 4.24Å; D67-W84 HydrophobicContact CB-CZ2 3.88Å; D67-W84 VanDerWaalsContact O-CH2 3.3Å; D67-W84 WeakPolarHBondContact O-CH2 3.45Å; F70-W84 HydrophobicContact CB-CZ2 4.45Å; F70-W84 HydrophobicContact CD1-CD2 4.1Å; F70-W84 AromaticContact CD1-CE2 3.42Å; F70-W84 VanDerWaalsContact CD1-CE2 3.42Å; F70-W84 AromaticContact CD1-CH2 3.84Å; F70-W84 HydrophobicContact CD1-CH2 3.84Å; F70-W84 AromaticContact CD1-CZ2 3.3Å; F70-W84 HydrophobicContact CD1-CZ2 3.3Å; F70-W84 HydrophobicContact CD1-CZ3 4.4Å; F70-W84 AromaticContact CD1-NE1 3.73Å; F70-W84 AromaticContact CE1-CD1 3.99Å; F70-W84 AromaticContact CE1-CD2 3.77Å; F70-W84 HydrophobicContact CE1-CD2 3.77Å; F70-W84 AromaticContact CE1-CE2 3.5Å; F70-W84 HydrophobicContact CE1-CE3 4.29Å; F70-W84 HydrophobicContact CE1-CG 4.14Å; F70-W84 HydrophobicContact CE1-CH2 4.41Å; F70-W84 AromaticContact CE1-CZ2 3.88Å; F70-W84 HydrophobicContact CE1-CZ2 3.88Å; F70-W84 AromaticContact CE1-NE1 3.62Å; F70-W84 HydrophobicContact CG-CZ2 4.23Å; L71-W84 HydrophobicContact CB-CH2 3.96Å; L71-W84 HydrophobicContact CB-CZ3 4.26Å; L71-W84 HydrophobicContact CD1-CH2 4.42Å; L71-W84 HydrophobicContact CD1-CZ3 3.86Å; S80-W84 PolarHBondContact OG-NE1 3.3Å; R82-W84 VanDerWaalsContact O-CD1 3.27Å; R82-W84 PolarHBondContact O-N 3.03Å; W84-L86 PolarHBondContact O-N 3.35Å; W84-L88 HydrophobicContact CE3-CD2 3.73Å; W84-L88 HydrophobicContact CE3-CG 4.17Å; W84-L88 HydrophobicContact CZ3-CD2 3.64Å; W84-L88 HydrophobicContact CZ3-CG 4.28Å; W84-L89 HydrophobicContact CB-CD1 3.86Å; W84-L89 HydrophobicContact CB-CD2 3.7Å; W84-L89 HydrophobicContact CB-CG 3.63Å; W84-L89 HydrophobicContact CG-CD2 4.06Å; W84-F399 HydrophobicContact CH2-CE2 4.23Å; W84-F399 HydrophobicContact CZ3-CE2 4.42Å
85	P	95.4	Very high	85	Confident	21 Å²	21	65.2 Å²	65.2	14%	0.136	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-60.4	129.6	171.4	-18.6	30.9	0	0	0	110.3	C55 W56 S87 L88 L89	C55-P85 WeakPolarHBondContact O-CG 3.42Å; W56-P85 HydrophobicContact CG-CG 4.37Å; P85-S87 PolarHBondContact O-N 3.38Å; P85-L88 HydrophobicContact CB-CB 4.27Å; P85-L88 PolarHBondContact O-N 3.26Å; P85-L89 PolarHBondContact O-N 3.1Å; P85-L89 VanDerWaalsContact O-N 3.08Å
86	L	94.9	Very high	86	Confident	143 Å²	143	66 Å²	66	75%	0.749	39%	0.386	S	S	*	.	H	α-helix	trans	-56.1	-39.1	-177.7	-179.8	61.2	0	0	0	112.3	W84 L88 L89 A90	W84-L86 PolarHBondContact O-N 3.35Å; L86-L88 VanDerWaalsContact C-N 3.28Å; L86-L88 PolarHBondContact O-N 3.38Å; L86-L89 PolarHBondContact O-N 3.46Å; L86-A90 VanDerWaalsContact O-CB 3.31Å; L86-A90 WeakPolarHBondContact O-CB 3.43Å; L86-A90 PolarHBondContact O-N 3.33Å
87	S	95.5	Very high	87.4	Confident	52 Å²	52	64.7 Å²	64.7	36%	0.364	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-31.6	177.8	56.1	0	0	0	0	113.3	W56 P85 L91	W56-S87 PolarHBondContact NE1-OG 3.1Å; P85-S87 PolarHBondContact O-N 3.38Å; S87-L91 WeakPolarHBondContact O-CB 3.49Å; S87-L91 PolarHBondContact O-N 2.85Å
88	L	94.8	Very high	89.3	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-77.4	-37.9	176.3	-172.8	53	0	0	0	111.4	W56 L59 L71 W84 P85 L86 L91 R92 F399 L403 L406	W56-L88 HydrophobicContact CD2-CB 4.42Å; W56-L88 HydrophobicContact CD2-CD1 4.45Å; W56-L88 HydrophobicContact CD2-CD2 4.37Å; W56-L88 HydrophobicContact CE3-CD1 4.41Å; W56-L88 HydrophobicContact CH2-CD1 3.95Å; W56-L88 HydrophobicContact CZ2-CB 4.17Å; W56-L88 HydrophobicContact CZ2-CD1 3.97Å; W56-L88 HydrophobicContact CZ3-CD1 4.18Å; L59-L88 HydrophobicContact CD2-CD2 4.13Å; L71-L88 HydrophobicContact CD1-CD1 4.13Å; L71-L88 HydrophobicContact CD1-CD2 4.41Å; L71-L88 HydrophobicContact CD1-CG 4.2Å; W84-L88 HydrophobicContact CE3-CD2 3.73Å; W84-L88 HydrophobicContact CE3-CG 4.17Å; W84-L88 HydrophobicContact CZ3-CD2 3.64Å; W84-L88 HydrophobicContact CZ3-CG 4.28Å; P85-L88 HydrophobicContact CB-CB 4.27Å; P85-L88 PolarHBondContact O-N 3.26Å; L86-L88 VanDerWaalsContact C-N 3.28Å; L86-L88 PolarHBondContact O-N 3.38Å; L88-L91 HydrophobicContact CD1-CD2 4.43Å; L88-L91 PolarHBondContact O-N 3.44Å; L88-R92 WeakPolarHBondContact O-CB 3.46Å; L88-R92 PolarHBondContact O-N 2.93Å; L88-F399 HydrophobicContact CD2-CZ 4.38Å; L88-L403 HydrophobicContact CD1-CD2 3.64Å; L88-L403 HydrophobicContact CD2-CD2 3.99Å; L88-L403 HydrophobicContact CG-CD2 4.49Å; L88-L406 HydrophobicContact CD1-CD2 4.45Å
89	L	93.2	Very high	90.6	Very high	59 Å²	59	57.2 Å²	57.2	31%	0.309	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-42.4	171.7	-68.9	178	0	0	0	111.8	F70 W84 P85 L86 R92 S93	F70-L89 HydrophobicContact CE1-CD2 4.11Å; F70-L89 HydrophobicContact CZ-CD2 4.17Å; W84-L89 HydrophobicContact CB-CD1 3.86Å; W84-L89 HydrophobicContact CB-CD2 3.7Å; W84-L89 HydrophobicContact CB-CG 3.63Å; W84-L89 HydrophobicContact CG-CD2 4.06Å; P85-L89 PolarHBondContact O-N 3.1Å; P85-L89 VanDerWaalsContact O-N 3.08Å; L86-L89 PolarHBondContact O-N 3.46Å; L89-R92 PolarHBondContact O-N 2.83Å; L89-S93 WeakPolarHBondContact O-CB 3.35Å; L89-S93 PolarHBondContact O-N 3.48Å
90	A	94.3	Very high	91.7	Very high	55 Å²	55	52.5 Å²	52.5	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-44.2	175.8	0	0	0	0	0	111.1	L86 S93 F94	L86-A90 VanDerWaalsContact O-CB 3.31Å; L86-A90 WeakPolarHBondContact O-CB 3.43Å; L86-A90 PolarHBondContact O-N 3.33Å; A90-S93 PolarHBondContact O-N 3.4Å; A90-F94 VanDerWaalsContact O-CB 3.29Å; A90-F94 WeakPolarHBondContact O-CB 3.45Å; A90-F94 PolarHBondContact O-N 2.95Å
91	L	94.5	Very high	92.2	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-47.5	174.5	179.6	59.4	0	0	0	112	Y32 W56 S87 L88 S93 F94 I95 L406 L407	Y32-L91 HydrophobicContact CD1-CD2 4.15Å; Y32-L91 HydrophobicContact CD2-CD1 4.14Å; Y32-L91 HydrophobicContact CE1-CD1 4.45Å; Y32-L91 HydrophobicContact CE1-CD2 3.66Å; Y32-L91 HydrophobicContact CE2-CD1 3.49Å; Y32-L91 VanDerWaalsContact CE2-CD1 3.49Å; Y32-L91 HydrophobicContact CE2-CD2 4.22Å; Y32-L91 HydrophobicContact CE2-CG 4.42Å; W56-L91 HydrophobicContact CH2-CD2 4.1Å; S87-L91 WeakPolarHBondContact O-CB 3.49Å; S87-L91 PolarHBondContact O-N 2.85Å; L88-L91 HydrophobicContact CD1-CD2 4.43Å; L88-L91 PolarHBondContact O-N 3.44Å; L91-S93 PolarHBondContact O-N 3.28Å; L91-F94 PolarHBondContact O-N 3.18Å; L91-I95 HydrophobicContact CD1-CD1 3.7Å; L91-I95 HydrophobicContact CD1-CG1 4.15Å; L91-I95 HydrophobicContact CG-CD1 3.76Å; L91-I95 WeakPolarHBondContact O-CD1 3.31Å; L91-I95 VanDerWaalsContact O-CG1 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.34Å; L91-I95 PolarHBondContact O-N 2.65Å; L91-L406 HydrophobicContact CD2-CD2 4.32Å; L91-L406 HydrophobicContact CG-CD2 4.35Å; L91-L407 HydrophobicContact CD1-CD2 4.19Å
92	R	93.1	Very high	92.7	Very high	37 Å²	37	51.4 Å²	51.4	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-57.5	-48.4	177.2	178	178.8	173.2	-104.5	-4.4	111.2	F70 S73 S75 L88 L89 I95 S96 L406	F70-R92 PolarHBondContact O-NE 3.1Å; S73-R92 PolarHBondContact O-NH2 3.34Å; S75-R92 PolarHBondContact O-NH2 2.92Å; L88-R92 WeakPolarHBondContact O-CB 3.46Å; L88-R92 PolarHBondContact O-N 2.93Å; L89-R92 PolarHBondContact O-N 2.83Å; R92-I95 PolarHBondContact O-N 3.02Å; R92-S96 PolarHBondContact O-N 2.86Å; R92-S96 PolarHBondContact O-OG 2.91Å; R92-L406 HydrophobicContact CB-CD2 4.47Å; R92-L406 HydrophobicContact CG-CD1 4.43Å
93	S	92.5	Very high	92.6	Very high	65 Å²	65	52.6 Å²	52.6	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-63.6	-41.4	178.5	179.3	0	0	0	0	112.4	L89 A90 L91 S96 T97	L89-S93 WeakPolarHBondContact O-CB 3.35Å; L89-S93 PolarHBondContact O-N 3.48Å; A90-S93 PolarHBondContact O-N 3.4Å; L91-S93 PolarHBondContact O-N 3.28Å; S93-S96 WeakPolarHBondContact CA-OG 3.08Å; S93-S96 PolarHBondContact O-N 3.33Å; S93-S96 PolarHBondContact O-OG 3.07Å; S93-T97 WeakPolarHBondContact O-CB 3.38Å; S93-T97 WeakPolarHBondContact O-CG2 3.38Å; S93-T97 PolarHBondContact O-N 3.33Å; S93-T97 VanDerWaalsContact O-N 3.09Å; S93-T97 PolarHBondContact O-OG1 2.93Å
94	F	94	Very high	92.6	Very high	32 Å²	32	49.2 Å²	49.2	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-50.9	175.4	-179.6	-89.6	0	0	0	110.9	L25 V28 A90 L91 S96 T97 H98 L410	L25-F94 HydrophobicContact CD2-CE1 4.21Å; L25-F94 HydrophobicContact CD2-CZ 3.92Å; V28-F94 HydrophobicContact CB-CE1 3.92Å; V28-F94 HydrophobicContact CB-CZ 3.96Å; V28-F94 HydrophobicContact CG1-CD1 3.95Å; V28-F94 HydrophobicContact CG1-CE1 3.66Å; V28-F94 HydrophobicContact CG1-CZ 4.1Å; V28-F94 HydrophobicContact CG2-CE1 4.06Å; V28-F94 HydrophobicContact CG2-CE2 4Å; V28-F94 HydrophobicContact CG2-CZ 3.61Å; A90-F94 VanDerWaalsContact O-CB 3.29Å; A90-F94 WeakPolarHBondContact O-CB 3.45Å; A90-F94 PolarHBondContact O-N 2.95Å; L91-F94 PolarHBondContact O-N 3.18Å; F94-S96 PolarHBondContact O-N 2.92Å; F94-T97 PolarHBondContact O-N 2.92Å; F94-T97 PolarHBondContact O-OG1 3.45Å; F94-T97 VanDerWaalsContact O-OG1 3.05Å; F94-H98 HydrophobicContact CD1-CB 4.49Å; F94-H98 AromaticContact CD2-CE1 3.71Å; F94-H98 AromaticContact CD2-ND1 3.74Å; F94-H98 AromaticContact CD2-NE2 4Å; F94-H98 HydrophobicContact CE1-CB 4.16Å; F94-H98 AromaticContact CE2-CD2 3.61Å; F94-H98 AromaticContact CE2-CE1 3.78Å; F94-H98 AromaticContact CE2-CG 3.83Å; F94-H98 AromaticContact CE2-ND1 3.9Å; F94-H98 AromaticContact CE2-NE2 3.58Å; F94-H98 HydrophobicContact CZ-CB 4.2Å; F94-H98 AromaticContact CZ-CD2 3.79Å; F94-H98 AromaticContact CZ-CG 3.89Å; F94-H98 VanDerWaalsContact O-CB 3.29Å; F94-H98 WeakPolarHBondContact O-CB 3.46Å; F94-H98 PolarHBondContact O-N 3.03Å; F94-H98 PolarHBondContact O-ND1 3.22Å; F94-L410 HydrophobicContact CD1-CD2 4.33Å; F94-L410 HydrophobicContact CE1-CD1 4.32Å; F94-L410 HydrophobicContact CE1-CD2 3.98Å
95	I	93.2	Very high	92.5	Very high	7 Å²	7	51.3 Å²	51.3	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-43.6	-178.8	-68.7	162.6	0	0	0	111.1	L91 R92 T97 S99 L406 L407 L410	L91-I95 HydrophobicContact CD1-CD1 3.7Å; L91-I95 HydrophobicContact CD1-CG1 4.15Å; L91-I95 HydrophobicContact CG-CD1 3.76Å; L91-I95 WeakPolarHBondContact O-CD1 3.31Å; L91-I95 VanDerWaalsContact O-CG1 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.34Å; L91-I95 PolarHBondContact O-N 2.65Å; R92-I95 PolarHBondContact O-N 3.02Å; I95-T97 VanDerWaalsContact C-N 3.25Å; I95-T97 PolarHBondContact O-N 3.48Å; I95-S99 WeakPolarHBondContact O-CB 3.26Å; I95-S99 PolarHBondContact O-N 3.42Å; I95-S99 PolarHBondContact O-OG 2.98Å; I95-L406 HydrophobicContact CD1-CD1 4.47Å; I95-L406 HydrophobicContact CD1-CD2 4.06Å; I95-L406 HydrophobicContact CD1-CG 3.67Å; I95-L406 WeakPolarHBondContact CG2-O 3.44Å; I95-L407 HydrophobicContact CD1-CD2 3.71Å; I95-L407 HydrophobicContact CD1-CG 4.17Å; I95-L407 HydrophobicContact CG1-CD2 4.42Å; I95-L410 HydrophobicContact CG1-CB 4.46Å; I95-L410 HydrophobicContact CG1-CD2 4.11Å
96	S	89.9	Confident	92.3	Very high	67 Å²	67	50.6 Å²	50.6	47%	0.469	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-29.7	-179.9	62.3	0	0	0	0	113.1	R92 S93 F94	R92-S96 PolarHBondContact O-N 2.86Å; R92-S96 PolarHBondContact O-OG 2.91Å; S93-S96 WeakPolarHBondContact CA-OG 3.08Å; S93-S96 PolarHBondContact O-N 3.33Å; S93-S96 PolarHBondContact O-OG 3.07Å; F94-S96 PolarHBondContact O-N 2.92Å
97	T	90.6	Very high	92.1	Very high	94 Å²	94	46.3 Å²	46.3	58%	0.577	26%	0.262	S	S	*	.	H	α-helix	trans	-92.9	-24.8	-177.4	51.3	0	0	0	0	113.6	S93 F94 I95	S93-T97 WeakPolarHBondContact O-CB 3.38Å; S93-T97 WeakPolarHBondContact O-CG2 3.38Å; S93-T97 PolarHBondContact O-N 3.33Å; S93-T97 VanDerWaalsContact O-N 3.09Å; S93-T97 PolarHBondContact O-OG1 2.93Å; F94-T97 PolarHBondContact O-N 2.92Å; F94-T97 PolarHBondContact O-OG1 3.45Å; F94-T97 VanDerWaalsContact O-OG1 3.05Å; I95-T97 VanDerWaalsContact C-N 3.25Å; I95-T97 PolarHBondContact O-N 3.48Å
98	H	92.7	Very high	91.8	Very high	35 Å²	35	44.6 Å²	44.6	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-110.9	-8.5	-174	-64.9	65.9	0	0	0	114	F21 K24 L25 F94	F21-H98 HydrophobicContact CE2-CB 4.19Å; F21-H98 AromaticContact CE2-CD2 3.64Å; F21-H98 HydrophobicContact CZ-CB 4.14Å; F21-H98 VanDerWaalsContact CZ-O 3.28Å; F21-H98 WeakPolarHBondContact CZ-O 3.32Å; K24-H98 PolarHBondContact NZ-NE2 3.45Å; L25-H98 HydrophobicContact CD2-CB 3.77Å; F94-H98 HydrophobicContact CD1-CB 4.49Å; F94-H98 AromaticContact CD2-CE1 3.71Å; F94-H98 AromaticContact CD2-ND1 3.74Å; F94-H98 AromaticContact CD2-NE2 4Å; F94-H98 HydrophobicContact CE1-CB 4.16Å; F94-H98 AromaticContact CE2-CD2 3.61Å; F94-H98 AromaticContact CE2-CE1 3.78Å; F94-H98 AromaticContact CE2-CG 3.83Å; F94-H98 AromaticContact CE2-ND1 3.9Å; F94-H98 AromaticContact CE2-NE2 3.58Å; F94-H98 HydrophobicContact CZ-CB 4.2Å; F94-H98 AromaticContact CZ-CD2 3.79Å; F94-H98 AromaticContact CZ-CG 3.89Å; F94-H98 VanDerWaalsContact O-CB 3.29Å; F94-H98 WeakPolarHBondContact O-CB 3.46Å; F94-H98 PolarHBondContact O-N 3.03Å; F94-H98 PolarHBondContact O-ND1 3.22Å
99	S	93.2	Very high	91.5	Very high	15 Å²	15	48.7 Å²	48.7	11%	0.105	27%	0.271	C	S	.	.	S	Bend	trans	-81.6	149.8	171.4	-53.1	0	0	0	0	110.3	I95 R101 L410 S413	I95-S99 WeakPolarHBondContact O-CB 3.26Å; I95-S99 PolarHBondContact O-N 3.42Å; I95-S99 PolarHBondContact O-OG 2.98Å; S99-R101 PolarHBondContact O-N 3.33Å; S99-L410 PolarHBondContact OG-N 3.46Å; S99-S413 WeakPolarHBondContact CA-OG 3.42Å
100	L	93.2	Very high	91.2	Very high	15 Å²	15	47.9 Å²	47.9	8%	0.079	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-53.9	131	168.9	-69.5	173.5	0	0	0	109.7	F10 R102 S413 L416 L417 L432 L445	F10-L100 HydrophobicContact CB-CD2 3.8Å; F10-L100 HydrophobicContact CD1-CD2 4.21Å; F10-L100 HydrophobicContact CD2-CD2 3.95Å; F10-L100 HydrophobicContact CG-CD2 3.71Å; L100-R102 PolarHBondContact O-N 2.62Å; L100-S413 PolarHBondContact N-OG 3.1Å; L100-L416 HydrophobicContact CD1-CB 3.79Å; L100-L416 HydrophobicContact CD1-CD1 3.97Å; L100-L417 HydrophobicContact CD1-CG 4.33Å; L100-L417 HydrophobicContact CD2-CD2 4.06Å; L100-L417 HydrophobicContact CD2-CG 4.37Å; L100-L417 HydrophobicContact CG-CG 4.42Å; L100-L432 HydrophobicContact CD1-CD1 3.81Å; L100-L432 HydrophobicContact CD2-CD1 4.27Å; L100-L445 HydrophobicContact CB-CD1 3.86Å; L100-L445 HydrophobicContact CD1-CD1 4.01Å
101	R	90.9	Very high	91	Very high	121 Å²	121	45.3 Å²	45.3	46%	0.457	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-67.7	134.5	-177.9	-66.2	-166.6	-172.6	-176.8	5.1	110.3	E7 S99 P434	E7-R101 WeakPolarHBondContact O-CD 3.48Å; E7-R101 IonicContact OE2-CZ 2.99Å; E7-R101 IonicContact OE2-NH1 2.9Å; E7-R101 PolarHBondContact OE2-NH1 3.17Å; E7-R101 IonicContact OE2-NH2 3.71Å; S99-R101 PolarHBondContact O-N 3.33Å; R101-P434 WeakPolarHBondContact O-CG 3.29Å
102	R	90.1	Very high	90.7	Very high	26 Å²	26	45 Å²	45	10%	0.098	25%	0.246	C	C	.	.			trans	-97.8	-12.6	177.3	-59.7	167.7	69.5	84.9	-3	112	L100 E310 E412 P434 A442 N444	L100-R102 PolarHBondContact O-N 2.62Å; R102-E310 IonicContact CZ-OE1 3.32Å; R102-E310 IonicContact NE-OE1 3.38Å; R102-E310 PolarHBondContact NE-OE1 3.02Å; R102-E310 IonicContact NH2-OE1 2.64Å; R102-E310 IonicContact NH2-OE2 3.72Å; R102-E412 IonicContact NH1-OE2 2.97Å; R102-E412 PolarHBondContact NH1-OE2 3.18Å; R102-P434 WeakPolarHBondContact O-CB 3.34Å; R102-A442 PolarHBondContact NH1-O 3.22Å; R102-A442 PolarHBondContact NH2-O 3.17Å; R102-N444 PolarHBondContact O-ND2 3.31Å
103	H	86.7	Confident	90.4	Very high	94 Å²	94	46.3 Å²	46.3	44%	0.435	26%	0.259	S	S	.	.			trans	-145.5	157.7	178.1	-77.4	-72.4	0	0	0	110.7	P438	H103-P438 WeakPolarHBondContact NE2-CD 3.42Å; H103-P438 WeakPolarHBondContact NE2-CG 3.48Å
104	P	88.5	Confident	90	Very high	70 Å²	70	44.9 Å²	44.9	46%	0.455	25%	0.246	S	C	.	.	S	Bend	cis	-61.9	154.8	-10.2	28.7	-36	0	0	0	111.4	S8	S8-P104 VanDerWaalsContact CB-O 3.24Å; S8-P104 WeakPolarHBondContact CB-O 3.2Å; S8-P104 PolarHBondContact OG-O 2.82Å
105	L	90.9	Very high	89.1	Confident	64 Å²	64	46.2 Å²	46.2	34%	0.335	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-66.3	140.2	174.9	-60.1	-177	0	0	0	109	P434 F436 D437	L105-P434 WeakPolarHBondContact CA-O 3.33Å; L105-P434 HydrophobicContact CD2-CB 4.48Å; L105-F436 WeakPolarHBondContact CD2-O 3.29Å; L105-D437 HydrophobicContact CD1-CB 4.18Å
106	V	91	Very high	88.3	Confident	6 Å²	6	51 Å²	51	4%	0.036	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-89.4	133	177.6	-177.7	0	0	0	0	108.8	S8 L9 T110 V111 P434 L435	S8-V106 WeakPolarHBondContact OG-CG2 3.42Å; L9-V106 HydrophobicContact CD1-CG1 4.42Å; L9-V106 HydrophobicContact CD2-CB 4.28Å; L9-V106 HydrophobicContact CD2-CG1 3.83Å; L9-V106 HydrophobicContact CD2-CG2 3.85Å; L9-V106 HydrophobicContact CG-CG1 4.14Å; L9-V106 HydrophobicContact CG-CG2 3.98Å; V106-T110 VanDerWaalsContact CG1-CB 3.48Å; V106-T110 HydrophobicContact CG1-CG2 3.77Å; V106-V111 HydrophobicContact CG1-CG2 3.67Å; V106-P434 HydrophobicContact CG2-CG 4.08Å; V106-P434 PolarHBondContact N-O 2.98Å; V106-L435 VanDerWaalsContact O-CD2 3.29Å; V106-L435 WeakPolarHBondContact O-CD2 3.41Å
107	S	90.4	Very high	87.6	Confident	52 Å²	52	52.2 Å²	52.2	36%	0.364	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-75.9	155.9	175.7	68.4	0	0	0	0	111.1	D109 T110 V111	S107-D109 PolarHBondContact O-N 3.2Å; S107-T110 WeakPolarHBondContact O-CB 3.39Å; S107-T110 PolarHBondContact O-N 3.44Å; S107-T110 PolarHBondContact OG-N 3.46Å; S107-T110 VanDerWaalsContact OG-N 3.15Å; S107-T110 PolarHBondContact OG-OG1 3.41Å; S107-V111 PolarHBondContact O-N 3.35Å
108	V	90.5	Very high	86.9	Confident	17 Å²	17	54.6 Å²	54.6	10%	0.103	32%	0.32	C	S	.	.	H	α-helix	trans	-56.2	-35.6	170.2	176.3	0	0	0	0	110.8	T110 V111 C112 I141 L145 R148	V108-T110 VanDerWaalsContact C-N 3.28Å; V108-T110 PolarHBondContact O-N 3.06Å; V108-V111 PolarHBondContact O-N 3.48Å; V108-C112 PolarHBondContact O-N 3.08Å; V108-I141 HydrophobicContact CG2-CG2 4.08Å; V108-L145 HydrophobicContact CG1-CB 4.11Å; V108-L145 HydrophobicContact CG1-CD1 4.03Å; V108-L145 HydrophobicContact CG2-CB 4.4Å; V108-R148 HydrophobicContact CG1-CG 4.46Å
109	D	88	Confident	86	Confident	87 Å²	87	57.9 Å²	57.9	47%	0.465	35%	0.347	S	S	.	.	H	α-helix	trans	-62.2	-31.8	175.3	-59.3	-67.3	0	0	0	113.7	S107 P113 R148	S107-D109 PolarHBondContact O-N 3.2Å; D109-P113 VanDerWaalsContact O-CA 3.24Å; D109-P113 WeakPolarHBondContact O-CA 3.31Å; D109-P113 WeakPolarHBondContact O-CD 3.4Å; D109-P113 VanDerWaalsContact O-CG 3.28Å; D109-P113 WeakPolarHBondContact O-CG 3.43Å; D109-R148 IonicContact OD1-CZ 3.7Å; D109-R148 IonicContact OD1-NH1 3.81Å; D109-R148 PolarHBondContact OD1-NH1 3.18Å; D109-R148 IonicContact OD1-NH2 3.79Å; D109-R148 PolarHBondContact OD1-NH2 2.68Å; D109-R148 IonicContact OD2-NH2 3.73Å
110	T	87.8	Confident	85	Confident	42 Å²	42	60.4 Å²	60.4	26%	0.258	36%	0.364	S	S	.	.	H	α-helix	trans	-74.9	-39.8	178.1	-50.5	0	0	0	0	110.7	N6 L9 V106 S107 V108	N6-T110 HydrophobicContact CB-CG2 3.82Å; L9-T110 HydrophobicContact CD1-CG2 3.82Å; V106-T110 VanDerWaalsContact CG1-CB 3.48Å; V106-T110 HydrophobicContact CG1-CG2 3.77Å; S107-T110 WeakPolarHBondContact O-CB 3.39Å; S107-T110 PolarHBondContact O-N 3.44Å; S107-T110 PolarHBondContact OG-N 3.46Å; S107-T110 VanDerWaalsContact OG-N 3.15Å; S107-T110 PolarHBondContact OG-OG1 3.41Å; V108-T110 VanDerWaalsContact C-N 3.28Å; V108-T110 PolarHBondContact O-N 3.06Å
111	V	89.1	Confident	84.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-76.9	-36.3	-178.7	-177.6	0	0	0	0	112.1	L9 V106 S107 V108 L145 F149 L431 A433 L435 W460	L9-V111 HydrophobicContact CD2-CG2 4.44Å; V106-V111 HydrophobicContact CG1-CG2 3.67Å; S107-V111 PolarHBondContact O-N 3.35Å; V108-V111 PolarHBondContact O-N 3.48Å; V111-L145 HydrophobicContact CB-CD1 3.89Å; V111-L145 HydrophobicContact CG1-CD1 3.73Å; V111-L145 HydrophobicContact CG1-CD2 4.16Å; V111-F149 HydrophobicContact CG1-CE2 4.47Å; V111-F149 HydrophobicContact CG1-CZ 4.36Å; V111-L431 HydrophobicContact CB-CD2 4.48Å; V111-L431 HydrophobicContact CG1-CD2 3.71Å; V111-L431 HydrophobicContact CG2-CD2 4.33Å; V111-A433 HydrophobicContact CG2-CB 4.14Å; V111-L435 HydrophobicContact CG2-CD2 4.14Å; V111-W460 WeakPolarHBondContact O-CB 3.27Å
112	C	89.5	Confident	83	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	39%	0.391	C	S	.	.	S	Bend	trans	-145.1	84.6	179.4	-165.8	0	0	0	0	108.8	V108 L145 R148 F149	V108-C112 PolarHBondContact O-N 3.08Å; C112-L145 HydrophobicContact CB-CD1 3.77Å; C112-R148 HydrophobicContact CB-CB 4.19Å; C112-R148 WeakPolarHBondContact O-CD 3.43Å; C112-R148 PolarHBondContact O-NH1 3.26Å; C112-R148 VanDerWaalsContact O-NH1 3.07Å; C112-F149 HydrophobicContact CB-CE2 4.47Å
113	P	86.4	Confident	81.9	Confident	63 Å²	63	62.7 Å²	62.7	41%	0.409	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-60.3	136.8	178	-18.1	28.9	0	0	0	110.8	D109 P459	D109-P113 VanDerWaalsContact O-CA 3.24Å; D109-P113 WeakPolarHBondContact O-CA 3.31Å; D109-P113 WeakPolarHBondContact O-CD 3.4Å; D109-P113 VanDerWaalsContact O-CG 3.28Å; D109-P113 WeakPolarHBondContact O-CG 3.43Å; P113-P459 WeakPolarHBondContact CD-O 3.29Å
114	L	82.7	Confident	80.8	Confident	35 Å²	35	61.2 Å²	61.2	18%	0.183	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-74.9	145.5	172.5	-78.6	169.2	0	0	0	110.4	R148	L114-R148 HydrophobicContact CD2-CG 4.14Å; L114-R148 HydrophobicContact CG-CG 4.49Å
115	P	76.7	Confident	79.3	Confident	61 Å²	61	62.4 Å²	62.4	40%	0.396	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-57.1	148.4	168.4	-22.9	32.4	0	0	0	111.6	G117 R118	P115-G117 PolarHBondContact O-N 3.39Å; P115-R118 PolarHBondContact O-N 3.48Å; P115-R118 VanDerWaalsContact O-N 3.12Å
116	A	75.9	Confident	77.9	Confident	108 Å²	108	65.7 Å²	65.7	89%	0.893	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	133.7	178.3	0	0	0	0	0	111.7	R118	A116-R118 VanDerWaalsContact C-N 3.34Å; A116-R118 PolarHBondContact O-N 2.94Å
117	G	74.4	Confident	76.4	Confident	91 Å²	91	67.6 Å²	67.6	94%	0.938	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	-6.7	-179.8	0	0	0	0	0	115.6	P115	P115-G117 PolarHBondContact O-N 3.39Å
118	R	75.5	Confident	75.2	Confident	145 Å²	145	65.8 Å²	65.8	55%	0.547	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-92.5	136.1	170.9	-68.6	-166	176.9	-178.1	3	111.3	P115 A116 E151	P115-R118 PolarHBondContact O-N 3.48Å; P115-R118 VanDerWaalsContact O-N 3.12Å; A116-R118 VanDerWaalsContact C-N 3.34Å; A116-R118 PolarHBondContact O-N 2.94Å; R118-E151 PolarHBondContact NH1-O 3.39Å
119	S	75.4	Confident	74.2	Confident	104 Å²	104	71.1 Å²	71.1	73%	0.727	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-103.8	150.5	173.3	57.5	0	0	0	0	110.9	K121	S119-K121 PolarHBondContact O-N 3.48Å
120	S	72.1	Confident	73.6	Confident	67 Å²	67	75.6 Å²	75.6	47%	0.469	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-64.4	132.8	174.6	60	0	0	0	0	110.5	G122	S120-G122 PolarHBondContact O-N 2.91Å
121	K	75.2	Confident	73.4	Confident	89 Å²	89	74.6 Å²	74.6	39%	0.387	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-57.9	129.5	172	-66.7	-176.7	179.8	164.4	0	110.7	S119 L123 E151 V178 Y179	S119-K121 PolarHBondContact O-N 3.48Å; K121-L123 PolarHBondContact O-N 2.95Å; K121-E151 WeakPolarHBondContact CE-OE1 3.38Å; K121-E151 IonicContact NZ-OE1 3.38Å; K121-E151 PolarHBondContact NZ-OE1 3.3Å; K121-E151 VanDerWaalsContact NZ-OE1 3.11Å; K121-V178 HydrophobicContact CB-CG1 3.97Å; K121-V178 HydrophobicContact CD-CG1 4.39Å; K121-V178 VanDerWaalsContact CD-O 3.27Å; K121-V178 WeakPolarHBondContact CD-O 3.43Å; K121-Y179 HydrophobicContact CB-CE1 4.3Å; K121-Y179 HydrophobicContact CD-CD1 3.93Å; K121-Y179 HydrophobicContact CD-CE1 4.02Å; K121-Y179 HydrophobicContact CG-CE1 4.42Å
122	G	66.7	Low	73.2	Confident	69 Å²	69	77.8 Å²	77.8	71%	0.711	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-65.6	123.7	177.1	0	0	0	0	0	111.4	S120 S124	S120-G122 PolarHBondContact O-N 2.91Å; G122-S124 PolarHBondContact O-N 2.84Å; G122-S124 VanDerWaalsContact O-N 3.15Å
123	L	67.5	Low	72.9	Confident	53 Å²	53	83.2 Å²	83.2	28%	0.277	51%	0.507	S	S	.	.			trans	-82.8	86	176.5	-72.2	165.7	0	0	0	110.1	K121 I125 R140 L174 V178	K121-L123 PolarHBondContact O-N 2.95Å; L123-I125 PolarHBondContact O-N 2.89Å; L123-R140 HydrophobicContact CD1-CB 4.01Å; L123-R140 HydrophobicContact CD1-CG 4.12Å; L123-L174 HydrophobicContact CD2-CD1 3.77Å; L123-L174 HydrophobicContact CD2-CD2 3.99Å; L123-L174 HydrophobicContact CD2-CG 3.91Å; L123-V178 HydrophobicContact CD2-CB 4.43Å; L123-V178 HydrophobicContact CD2-CG1 4.06Å; L123-V178 HydrophobicContact CD2-CG2 4Å
124	S	62.3	Low	72.8	Confident	62 Å²	62	83 Å²	83	43%	0.434	50%	0.499	S	S	.	.			trans	-61.9	121.9	171.1	176.8	0	0	0	0	110.2	G122 N126 H127	G122-S124 PolarHBondContact O-N 2.84Å; G122-S124 VanDerWaalsContact O-N 3.15Å; S124-N126 PolarHBondContact O-N 3.09Å; S124-H127 PolarHBondContact O-ND1 2.79Å
125	I	57.1	Low	73	Confident	96 Å²	96	85 Å²	85	49%	0.492	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-68	-21	-171.1	-56.2	-179.4	0	0	0	112.2	L123 H127 L128 R140	L123-I125 PolarHBondContact O-N 2.89Å; I125-H127 PolarHBondContact O-N 3.34Å; I125-L128 PolarHBondContact O-N 3.4Å; I125-R140 VanDerWaalsContact CD1-NH2 3.26Å
126	N	61	Low	73.6	Confident	132 Å²	132	83 Å²	83	71%	0.706	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-57.9	-17.4	-175	-62.6	-3.2	0	0	0	112.9	S124 L128	S124-N126 PolarHBondContact O-N 3.09Å; N126-L128 PolarHBondContact O-N 2.95Å
127	H	59.7	Low	74.1	Confident	46 Å²	46	80.6 Å²	80.6	21%	0.213	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-76.6	-12.7	179.6	-60.8	117.4	0	0	0	115	S124 I125 E177 R203	S124-H127 PolarHBondContact O-ND1 2.79Å; I125-H127 PolarHBondContact O-N 3.34Å; H127-E177 WeakPolarHBondContact CB-OE2 3.35Å; H127-E177 IonicContact CD2-OE1 3.89Å; H127-E177 IonicContact CD2-OE2 3.12Å; H127-E177 PolarHBondContact CD2-OE2 3.09Å; H127-E177 IonicContact CG-OE2 3.74Å; H127-R203 PolarHBondContact O-NH1 3.29Å; H127-R203 PolarHBondContact O-NH2 3.35Å
128	L	66.5	Low	74.9	Confident	15 Å²	15	76.5 Å²	76.5	8%	0.079	42%	0.418	C	S	.	.			trans	-127.2	60.2	-169	-67.3	176.2	0	0	0	113.4	I125 N126 V131 M136 I139 H170 L174	I125-L128 PolarHBondContact O-N 3.4Å; N126-L128 PolarHBondContact O-N 2.95Å; L128-V131 HydrophobicContact CB-CG2 4.07Å; L128-V131 HydrophobicContact CD2-CG2 4.39Å; L128-M136 HydrophobicContact CB-CE 3.33Å; L128-M136 HydrophobicContact CB-SD 3.94Å; L128-M136 HydrophobicContact CD1-CE 3.97Å; L128-M136 HydrophobicContact CD1-SD 3.37Å; L128-M136 WeakPolarHBondContact CD1-SD 3.45Å; L128-M136 HydrophobicContact CG-CE 4.3Å; L128-M136 HydrophobicContact CG-SD 4.3Å; L128-M136 WeakPolarHBondContact O-CE 3.4Å; L128-I139 HydrophobicContact CD1-CG2 3.85Å; L128-H170 HydrophobicContact CD2-CB 3.77Å; L128-L174 HydrophobicContact CD1-CD1 4.28Å
129	E	68.5	Low	75.7	Confident	129 Å²	129	69.6 Å²	69.6	60%	0.603	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	144.9	172.6	-63.8	176.9	161.2	0	0	112.2	V131	E129-V131 VanDerWaalsContact C-N 3.26Å; E129-V131 PolarHBondContact O-N 3.04Å
130	H	75.3	Confident	76.4	Confident	181 Å²	181	68.5 Å²	68.5	84%	0.838	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	27.9	175.1	-51.9	-72	0	0	0	116.1
131	V	83	Confident	77.4	Confident	21 Å²	21	67 Å²	67	13%	0.127	36%	0.359	C	S	.	.			trans	-97.4	132.2	173.5	-175.5	0	0	0	0	109.8	L128 E129 K135 M136 I139 H170	L128-V131 HydrophobicContact CB-CG2 4.07Å; L128-V131 HydrophobicContact CD2-CG2 4.39Å; E129-V131 VanDerWaalsContact C-N 3.26Å; E129-V131 PolarHBondContact O-N 3.04Å; V131-K135 HydrophobicContact CG1-CB 3.68Å; V131-K135 HydrophobicContact CG1-CD 4.36Å; V131-K135 HydrophobicContact CG1-CG 3.84Å; V131-M136 HydrophobicContact CB-CE 3.99Å; V131-M136 HydrophobicContact CG1-CB 4.18Å; V131-M136 HydrophobicContact CG1-CE 4.45Å; V131-I139 HydrophobicContact CG1-CD1 4.3Å; V131-H170 WeakPolarHBondContact CG2-CE1 3.05Å; V131-H170 WeakPolarHBondContact CG2-ND1 3.11Å
132	S	85.3	Confident	78.4	Confident	66 Å²	66	62.7 Å²	62.7	46%	0.462	34%	0.34	S	S	.	.			trans	-63.5	150.5	175.8	66.9	0	0	0	0	111.5	K134 K135 M136	S132-K134 PolarHBondContact O-N 3.19Å; S132-K134 VanDerWaalsContact O-N 3.15Å; S132-K135 PolarHBondContact O-N 2.8Å; S132-M136 PolarHBondContact O-N 3.28Å
133	P	82.7	Confident	79.7	Confident	115 Å²	115	59.4 Å²	59.4	75%	0.747	31%	0.306	S	S	*	.	H	α-helix	trans	-53.1	-40.2	-178.9	-29.1	35.3	0	0	0	113.7	M136 H137	P133-M136 WeakPolarHBondContact O-CB 3.38Å; P133-M136 PolarHBondContact O-N 3.33Å; P133-H137 PolarHBondContact O-N 3.29Å
134	K	84.6	Confident	81	Confident	59 Å²	59	57.6 Å²	57.6	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-56.9	-51.7	174.5	172.2	178.2	-178	174.5	0	112.3	S132 M136 H137 Q138 V440	S132-K134 PolarHBondContact O-N 3.19Å; S132-K134 VanDerWaalsContact O-N 3.15Å; K134-M136 VanDerWaalsContact C-N 3.31Å; K134-H137 PolarHBondContact O-N 3.02Å; K134-Q138 WeakPolarHBondContact O-CG 3.44Å; K134-Q138 PolarHBondContact O-N 2.71Å; K134-V440 HydrophobicContact CB-CG1 3.87Å; K134-V440 WeakPolarHBondContact CD-O 3.33Å; K134-V440 WeakPolarHBondContact CE-O 3.43Å; K134-V440 HydrophobicContact CG-CG1 3.88Å; K134-V440 WeakPolarHBondContact CG-O 3.34Å
135	K	87.5	Confident	82.5	Confident	75 Å²	75	54.6 Å²	54.6	33%	0.326	28%	0.277	S	S	.	.	H	α-helix	trans	-70.1	-33.8	-175.7	-173.5	166	-174.3	168.1	0	110.8	V131 S132 Q138 I139	V131-K135 HydrophobicContact CG1-CB 3.68Å; V131-K135 HydrophobicContact CG1-CD 4.36Å; V131-K135 HydrophobicContact CG1-CG 3.84Å; S132-K135 PolarHBondContact O-N 2.8Å; K135-Q138 PolarHBondContact O-N 2.9Å; K135-I139 HydrophobicContact CD-CD1 4.44Å; K135-I139 HydrophobicContact CG-CD1 3.68Å; K135-I139 HydrophobicContact CG-CG1 4.38Å; K135-I139 WeakPolarHBondContact O-CB 3.36Å; K135-I139 WeakPolarHBondContact O-CD1 3.5Å; K135-I139 VanDerWaalsContact O-CG1 3.23Å; K135-I139 WeakPolarHBondContact O-CG1 3.3Å; K135-I139 PolarHBondContact O-N 3.03Å
136	M	88.5	Confident	84.3	Confident	21 Å²	21	50 Å²	50	10%	0.103	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-49.1	173.1	-179.3	70.3	65.4	0	0	112	L128 V131 S132 P133 K134 Q138 I139 R140	L128-M136 HydrophobicContact CB-CE 3.33Å; L128-M136 HydrophobicContact CB-SD 3.94Å; L128-M136 HydrophobicContact CD1-CE 3.97Å; L128-M136 HydrophobicContact CD1-SD 3.37Å; L128-M136 WeakPolarHBondContact CD1-SD 3.45Å; L128-M136 HydrophobicContact CG-CE 4.3Å; L128-M136 HydrophobicContact CG-SD 4.3Å; L128-M136 WeakPolarHBondContact O-CE 3.4Å; V131-M136 HydrophobicContact CB-CE 3.99Å; V131-M136 HydrophobicContact CG1-CB 4.18Å; V131-M136 HydrophobicContact CG1-CE 4.45Å; S132-M136 PolarHBondContact O-N 3.28Å; P133-M136 WeakPolarHBondContact O-CB 3.38Å; P133-M136 PolarHBondContact O-N 3.33Å; K134-M136 VanDerWaalsContact C-N 3.31Å; M136-Q138 VanDerWaalsContact C-N 3.29Å; M136-Q138 PolarHBondContact O-N 3.21Å; M136-I139 PolarHBondContact O-N 3.1Å; M136-R140 WeakPolarHBondContact O-CG 3.44Å; M136-R140 PolarHBondContact O-N 2.92Å; M136-R140 HydrophobicContact SD-CG 4.4Å; M136-R140 PolarHBondContact SD-NE 3.1Å; M136-R140 PolarHBondContact SD-NH2 3.35Å
137	H	87	Confident	85.9	Confident	56 Å²	56	43.8 Å²	43.8	26%	0.259	22%	0.22	S	C	.	.	H	α-helix	trans	-54.2	-46.3	177.9	173.2	80.8	0	0	0	111.7	P133 K134 I141 D437 V440	P133-H137 PolarHBondContact O-N 3.29Å; K134-H137 PolarHBondContact O-N 3.02Å; H137-I141 WeakPolarHBondContact CE1-CD1 3.05Å; H137-I141 WeakPolarHBondContact NE2-CD1 3.44Å; H137-I141 WeakPolarHBondContact O-CG1 3.47Å; H137-I141 PolarHBondContact O-N 3.46Å; H137-D437 PolarHBondContact NE2-N 3.27Å; H137-V440 HydrophobicContact CB-CG1 4.47Å
138	Q	91.9	Very high	87.4	Confident	5 Å²	5	42.1 Å²	42.1	2%	0.023	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-46.5	-179.1	-65.2	168.4	-18.9	0	0	113	K134 K135 M136 R140 I141 L142 L241 H242 F436 C441	K134-Q138 WeakPolarHBondContact O-CG 3.44Å; K134-Q138 PolarHBondContact O-N 2.71Å; K135-Q138 PolarHBondContact O-N 2.9Å; M136-Q138 VanDerWaalsContact C-N 3.29Å; M136-Q138 PolarHBondContact O-N 3.21Å; Q138-R140 VanDerWaalsContact C-N 3.3Å; Q138-R140 PolarHBondContact O-N 2.79Å; Q138-I141 PolarHBondContact O-N 3.47Å; Q138-L142 WeakPolarHBondContact O-CB 3.1Å; Q138-L142 PolarHBondContact O-N 2.83Å; Q138-L241 HydrophobicContact CB-CD1 4.14Å; Q138-L241 HydrophobicContact CB-CD2 3.98Å; Q138-H242 VanDerWaalsContact CD-CE1 3.4Å; Q138-H242 VanDerWaalsContact CD-NE2 3.35Å; Q138-H242 PolarHBondContact NE2-CE1 3.4Å; Q138-H242 PolarHBondContact NE2-NE2 3.31Å; Q138-H242 PolarHBondContact OE1-CE1 3.14Å; Q138-H242 PolarHBondContact OE1-NE2 2.99Å; Q138-F436 HydrophobicContact CB-CE1 4.11Å; Q138-F436 HydrophobicContact CB-CZ 4.17Å; Q138-F436 HydrophobicContact CG-CD1 4.21Å; Q138-F436 HydrophobicContact CG-CD2 4.34Å; Q138-F436 HydrophobicContact CG-CE1 4.24Å; Q138-F436 HydrophobicContact CG-CE2 4.34Å; Q138-F436 HydrophobicContact CG-CG 4.27Å; Q138-F436 HydrophobicContact CG-CZ 4.31Å; Q138-C441 PolarHBondContact NE2-SG 3.38Å
139	I	92.2	Very high	88.6	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-39.4	-179.4	-73.9	166.2	0	0	0	110.9	L128 V131 K135 M136 G143 H170 L171 L174 L241	L128-I139 HydrophobicContact CD1-CG2 3.85Å; V131-I139 HydrophobicContact CG1-CD1 4.3Å; K135-I139 HydrophobicContact CD-CD1 4.44Å; K135-I139 HydrophobicContact CG-CD1 3.68Å; K135-I139 HydrophobicContact CG-CG1 4.38Å; K135-I139 WeakPolarHBondContact O-CB 3.36Å; K135-I139 WeakPolarHBondContact O-CD1 3.5Å; K135-I139 VanDerWaalsContact O-CG1 3.23Å; K135-I139 WeakPolarHBondContact O-CG1 3.3Å; K135-I139 PolarHBondContact O-N 3.03Å; M136-I139 PolarHBondContact O-N 3.1Å; I139-G143 VanDerWaalsContact O-CA 3.28Å; I139-G143 WeakPolarHBondContact O-CA 3.47Å; I139-G143 PolarHBondContact O-N 3.34Å; I139-H170 HydrophobicContact CD1-CB 3.5Å; I139-L171 HydrophobicContact CG1-CB 4.32Å; I139-L171 HydrophobicContact CG2-CD1 4.19Å; I139-L174 HydrophobicContact CG2-CB 4.25Å; I139-L174 HydrophobicContact CG2-CD1 3.49Å; I139-L174 VanDerWaalsContact CG2-CD1 3.49Å; I139-L241 HydrophobicContact CG1-CD2 4.12Å
140	R	90.7	Very high	89.8	Confident	81 Å²	81	36.4 Å²	36.4	31%	0.306	19%	0.185	S	C	.	.	H	α-helix	trans	-64.9	-48.8	178.5	-72.7	-178.8	-177.3	166.9	5	112.1	L123 I125 M136 Q138 S144	L123-R140 HydrophobicContact CD1-CB 4.01Å; L123-R140 HydrophobicContact CD1-CG 4.12Å; I125-R140 VanDerWaalsContact CD1-NH2 3.26Å; M136-R140 WeakPolarHBondContact O-CG 3.44Å; M136-R140 PolarHBondContact O-N 2.92Å; M136-R140 HydrophobicContact SD-CG 4.4Å; M136-R140 PolarHBondContact SD-NE 3.1Å; M136-R140 PolarHBondContact SD-NH2 3.35Å; Q138-R140 VanDerWaalsContact C-N 3.3Å; Q138-R140 PolarHBondContact O-N 2.79Å; R140-S144 WeakPolarHBondContact O-CB 3.39Å; R140-S144 PolarHBondContact O-N 3.12Å
141	I	92.9	Very high	90.4	Very high	34 Å²	34	30.1 Å²	30.1	17%	0.174	16%	0.156	C	C	.	.	H	α-helix	trans	-67.2	-52.1	-176.7	-68.4	167.1	0	0	0	110.2	V108 H137 Q138 S144 L145 L435 F436	V108-I141 HydrophobicContact CG2-CG2 4.08Å; H137-I141 WeakPolarHBondContact CE1-CD1 3.05Å; H137-I141 WeakPolarHBondContact NE2-CD1 3.44Å; H137-I141 WeakPolarHBondContact O-CG1 3.47Å; H137-I141 PolarHBondContact O-N 3.46Å; Q138-I141 PolarHBondContact O-N 3.47Å; I141-S144 PolarHBondContact O-N 3.19Å; I141-L145 WeakPolarHBondContact O-CB 3.49Å; I141-L145 PolarHBondContact O-N 3.49Å; I141-L435 HydrophobicContact CG2-CB 4.05Å; I141-L435 HydrophobicContact CG2-CD1 4.29Å; I141-L435 HydrophobicContact CG2-CD2 4.34Å; I141-L435 HydrophobicContact CG2-CG 4.49Å; I141-F436 HydrophobicContact CB-CD1 4.3Å; I141-F436 HydrophobicContact CB-CE1 3.95Å; I141-F436 HydrophobicContact CD1-CD1 4.04Å; I141-F436 HydrophobicContact CG2-CD1 4.26Å; I141-F436 HydrophobicContact CG2-CE1 3.94Å
142	L	95.1	Very high	90.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.5	-40.8	-179.5	-175	61.6	0	0	0	111.6	Q138 S144 L145 V146 L171 L241 L265 F436 L446	Q138-L142 WeakPolarHBondContact O-CB 3.1Å; Q138-L142 PolarHBondContact O-N 2.83Å; L142-S144 VanDerWaalsContact C-N 3.33Å; L142-S144 PolarHBondContact O-N 2.77Å; L142-L145 PolarHBondContact O-N 2.93Å; L142-V146 HydrophobicContact CD1-CG2 4.34Å; L142-V146 HydrophobicContact CG-CG2 4.34Å; L142-V146 VanDerWaalsContact O-CG2 3.24Å; L142-V146 WeakPolarHBondContact O-CG2 3.43Å; L142-V146 PolarHBondContact O-N 3.34Å; L142-L171 HydrophobicContact CD2-CD2 3.77Å; L142-L171 HydrophobicContact CG-CD2 4.31Å; L142-L241 HydrophobicContact CD2-CB 3.77Å; L142-L241 HydrophobicContact CD2-CD1 3.95Å; L142-L241 HydrophobicContact CD2-CD2 4.41Å; L142-L241 HydrophobicContact CD2-CG 4.23Å; L142-L265 HydrophobicContact CD1-CB 4.21Å; L142-L265 HydrophobicContact CD1-CD1 4.45Å; L142-F436 HydrophobicContact CB-CZ 4.45Å; L142-L446 HydrophobicContact CD1-CD1 4.28Å
143	G	94.9	Very high	90.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-41.9	177	0	0	0	0	0	112.5	I139 G147 L175 Y179	I139-G143 VanDerWaalsContact O-CA 3.28Å; I139-G143 WeakPolarHBondContact O-CA 3.47Å; I139-G143 PolarHBondContact O-N 3.34Å; G143-G147 PolarHBondContact O-N 2.77Å; G143-L175 WeakPolarHBondContact O-CD2 3.23Å; G143-Y179 WeakPolarHBondContact O-CE2 3.43Å
144	S	93.6	Very high	90.9	Very high	14 Å²	14	29.8 Å²	29.8	10%	0.098	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-44.5	174.4	-171.6	0	0	0	0	111.9	R140 I141 L142 G147 R148 Y179	R140-S144 WeakPolarHBondContact O-CB 3.39Å; R140-S144 PolarHBondContact O-N 3.12Å; I141-S144 PolarHBondContact O-N 3.19Å; L142-S144 VanDerWaalsContact C-N 3.33Å; L142-S144 PolarHBondContact O-N 2.77Å; S144-G147 PolarHBondContact O-N 3.02Å; S144-R148 WeakPolarHBondContact O-CG 3.44Å; S144-R148 PolarHBondContact O-N 3.35Å; S144-Y179 WeakPolarHBondContact CA-OH 3.23Å
145	L	94.6	Very high	91.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.7	-47.5	179.4	-177.9	60.7	0	0	0	112.4	V108 V111 C112 I141 L142 G147 R148 F149 L265 L435 L446	V108-L145 HydrophobicContact CG1-CB 4.11Å; V108-L145 HydrophobicContact CG1-CD1 4.03Å; V108-L145 HydrophobicContact CG2-CB 4.4Å; V111-L145 HydrophobicContact CB-CD1 3.89Å; V111-L145 HydrophobicContact CG1-CD1 3.73Å; V111-L145 HydrophobicContact CG1-CD2 4.16Å; C112-L145 HydrophobicContact CB-CD1 3.77Å; I141-L145 WeakPolarHBondContact O-CB 3.49Å; I141-L145 PolarHBondContact O-N 3.49Å; L142-L145 PolarHBondContact O-N 2.93Å; L145-G147 PolarHBondContact O-N 2.82Å; L145-R148 PolarHBondContact O-N 3.32Å; L145-F149 HydrophobicContact CD1-CD2 3.99Å; L145-F149 HydrophobicContact CD1-CE2 3.58Å; L145-F149 HydrophobicContact CD2-CE2 4.23Å; L145-F149 HydrophobicContact CG-CD2 3.94Å; L145-F149 HydrophobicContact CG-CE2 3.69Å; L145-F149 VanDerWaalsContact O-CD2 3.26Å; L145-F149 WeakPolarHBondContact O-CD2 3.35Å; L145-F149 PolarHBondContact O-N 2.99Å; L145-L265 HydrophobicContact CD2-CD2 4.15Å; L145-L435 HydrophobicContact CD2-CD1 3.73Å; L145-L446 HydrophobicContact CD2-CD2 3.45Å; L145-L446 VanDerWaalsContact CD2-CD2 3.45Å
146	V	95.6	Very high	91.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58	-50	175.4	174.7	0	0	0	0	110.2	L142 R148 F149 F150 V161 L175 L181 I239 L265	L142-V146 HydrophobicContact CD1-CG2 4.34Å; L142-V146 HydrophobicContact CG-CG2 4.34Å; L142-V146 VanDerWaalsContact O-CG2 3.24Å; L142-V146 WeakPolarHBondContact O-CG2 3.43Å; L142-V146 PolarHBondContact O-N 3.34Å; V146-R148 VanDerWaalsContact C-N 3.25Å; V146-R148 PolarHBondContact O-N 2.89Å; V146-F149 WeakPolarHBondContact O-CB 3.12Å; V146-F149 PolarHBondContact O-N 2.9Å; V146-F149 VanDerWaalsContact O-N 3.13Å; V146-F150 HydrophobicContact CG1-CD2 4.14Å; V146-F150 HydrophobicContact CG1-CE2 4.13Å; V146-F150 WeakPolarHBondContact O-CD2 3.39Å; V146-F150 PolarHBondContact O-N 3.09Å; V146-F150 VanDerWaalsContact O-N 3.17Å; V146-V161 HydrophobicContact CG1-CG1 4.47Å; V146-V161 HydrophobicContact CG1-CG2 4.04Å; V146-L175 HydrophobicContact CB-CD2 3.67Å; V146-L175 HydrophobicContact CG1-CD1 4.1Å; V146-L175 HydrophobicContact CG1-CD2 3.63Å; V146-L175 HydrophobicContact CG2-CD2 4.44Å; V146-L181 HydrophobicContact CG1-CD1 4.19Å; V146-I239 HydrophobicContact CG2-CD1 4.38Å; V146-I239 HydrophobicContact CG2-CG2 3.94Å; V146-L265 HydrophobicContact CB-CD1 4.36Å; V146-L265 HydrophobicContact CG2-CD1 3.44Å; V146-L265 VanDerWaalsContact CG2-CD1 3.44Å
147	G	93.2	Very high	91.3	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-54	-43.4	178.3	0	0	0	0	0	112.5	G143 S144 L145 F150 E151 Y179	G143-G147 PolarHBondContact O-N 2.77Å; S144-G147 PolarHBondContact O-N 3.02Å; L145-G147 PolarHBondContact O-N 2.82Å; G147-F150 PolarHBondContact O-N 3Å; G147-E151 WeakPolarHBondContact O-CG 3.36Å; G147-E151 PolarHBondContact O-N 3.43Å; G147-Y179 VanDerWaalsContact CA-CD1 3.48Å
148	R	91.2	Very high	91.5	Very high	10 Å²	10	28.5 Å²	28.5	4%	0.038	16%	0.162	C	C	.	.	H	α-helix	trans	-66.6	-40.6	176.8	-71.8	-169.6	-169.9	-154.9	-1.1	113.9	V108 D109 C112 L114 S144 L145 V146 F150 E151 C152	V108-R148 HydrophobicContact CG1-CG 4.46Å; D109-R148 IonicContact OD1-CZ 3.7Å; D109-R148 IonicContact OD1-NH1 3.81Å; D109-R148 PolarHBondContact OD1-NH1 3.18Å; D109-R148 IonicContact OD1-NH2 3.79Å; D109-R148 PolarHBondContact OD1-NH2 2.68Å; D109-R148 IonicContact OD2-NH2 3.73Å; C112-R148 HydrophobicContact CB-CB 4.19Å; C112-R148 WeakPolarHBondContact O-CD 3.43Å; C112-R148 PolarHBondContact O-NH1 3.26Å; C112-R148 VanDerWaalsContact O-NH1 3.07Å; L114-R148 HydrophobicContact CD2-CG 4.14Å; L114-R148 HydrophobicContact CG-CG 4.49Å; S144-R148 WeakPolarHBondContact O-CG 3.44Å; S144-R148 PolarHBondContact O-N 3.35Å; L145-R148 PolarHBondContact O-N 3.32Å; V146-R148 VanDerWaalsContact C-N 3.25Å; V146-R148 PolarHBondContact O-N 2.89Å; R148-F150 PolarHBondContact O-N 2.96Å; R148-E151 PolarHBondContact O-N 2.97Å; R148-C152 WeakPolarHBondContact O-CB 3.49Å; R148-C152 PolarHBondContact O-N 2.97Å; R148-C152 PolarHBondContact O-SG 2.84Å
149	F	93.3	Very high	91.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.7	-42.1	174.1	-88	-71.3	0	0	0	111.3	V111 C112 L145 V146 S153 L156 L263 L265 V448 P459 W460	V111-F149 HydrophobicContact CG1-CE2 4.47Å; V111-F149 HydrophobicContact CG1-CZ 4.36Å; C112-F149 HydrophobicContact CB-CE2 4.47Å; L145-F149 HydrophobicContact CD1-CD2 3.99Å; L145-F149 HydrophobicContact CD1-CE2 3.58Å; L145-F149 HydrophobicContact CD2-CE2 4.23Å; L145-F149 HydrophobicContact CG-CD2 3.94Å; L145-F149 HydrophobicContact CG-CE2 3.69Å; L145-F149 VanDerWaalsContact O-CD2 3.26Å; L145-F149 WeakPolarHBondContact O-CD2 3.35Å; L145-F149 PolarHBondContact O-N 2.99Å; V146-F149 WeakPolarHBondContact O-CB 3.12Å; V146-F149 PolarHBondContact O-N 2.9Å; V146-F149 VanDerWaalsContact O-N 3.13Å; F149-S153 WeakPolarHBondContact O-CB 3.12Å; F149-S153 PolarHBondContact O-N 3.46Å; F149-L156 HydrophobicContact CB-CD1 3.96Å; F149-L263 HydrophobicContact CB-CD2 3.59Å; F149-L263 HydrophobicContact CD1-CD1 4.17Å; F149-L263 HydrophobicContact CD1-CD2 4.07Å; F149-L263 HydrophobicContact CD2-CD1 4.39Å; F149-L263 HydrophobicContact CD2-CD2 3.9Å; F149-L263 HydrophobicContact CE1-CD1 4.14Å; F149-L263 HydrophobicContact CE2-CD1 4.34Å; F149-L263 HydrophobicContact CG-CD1 4.32Å; F149-L263 HydrophobicContact CG-CD2 3.6Å; F149-L263 HydrophobicContact CZ-CD1 4.24Å; F149-L265 HydrophobicContact CD2-CD1 4.23Å; F149-L265 HydrophobicContact CD2-CD2 4.44Å; F149-L265 HydrophobicContact CE2-CD2 3.94Å; F149-V448 HydrophobicContact CZ-CG1 4.12Å; F149-P459 HydrophobicContact CD1-CB 4.37Å; F149-P459 HydrophobicContact CD1-CG 3.88Å; F149-P459 HydrophobicContact CE1-CB 3.96Å; F149-P459 HydrophobicContact CE1-CG 3.7Å; F149-W460 HydrophobicContact CE1-CE3 4.03Å; F149-W460 AromaticContact CE1-CZ3 3.72Å; F149-W460 HydrophobicContact CE1-CZ3 3.72Å; F149-W460 AromaticContact CZ-CE3 3.89Å; F149-W460 HydrophobicContact CZ-CE3 3.89Å; F149-W460 AromaticContact CZ-CZ3 3.67Å; F149-W460 HydrophobicContact CZ-CZ3 3.67Å
150	F	92.5	Very high	91.7	Very high	25 Å²	25	28.7 Å²	28.7	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-69.1	-31.5	175.6	-84	-99.4	0	0	0	113.7	V146 G147 R148 L156 V161 L181 A237	V146-F150 HydrophobicContact CG1-CD2 4.14Å; V146-F150 HydrophobicContact CG1-CE2 4.13Å; V146-F150 WeakPolarHBondContact O-CD2 3.39Å; V146-F150 PolarHBondContact O-N 3.09Å; V146-F150 VanDerWaalsContact O-N 3.17Å; G147-F150 PolarHBondContact O-N 3Å; R148-F150 PolarHBondContact O-N 2.96Å; F150-L156 HydrophobicContact CD1-CB 3.92Å; F150-L156 HydrophobicContact CD2-CD1 4.06Å; F150-L156 HydrophobicContact CE1-CB 4.05Å; F150-L156 HydrophobicContact CE2-CD1 4.14Å; F150-L156 HydrophobicContact CG-CB 4.22Å; F150-L156 HydrophobicContact CG-CD1 4.41Å; F150-L156 HydrophobicContact CZ-CB 4.43Å; F150-L156 HydrophobicContact CZ-CD2 4.47Å; F150-V161 HydrophobicContact CD2-CG2 4.3Å; F150-V161 HydrophobicContact CE1-CG2 4.35Å; F150-V161 HydrophobicContact CE2-CG2 3.41Å; F150-V161 VanDerWaalsContact CE2-CG2 3.41Å; F150-V161 HydrophobicContact CZ-CG2 3.43Å; F150-V161 VanDerWaalsContact CZ-CG2 3.43Å; F150-L181 HydrophobicContact CB-CD1 4.31Å; F150-L181 HydrophobicContact CB-CD2 3.79Å; F150-L181 HydrophobicContact CD1-CD1 4.47Å; F150-L181 HydrophobicContact CD1-CD2 3.62Å; F150-L181 HydrophobicContact CD2-CD1 3.86Å; F150-L181 HydrophobicContact CD2-CD2 4.4Å; F150-L181 HydrophobicContact CE1-CD2 4.3Å; F150-L181 HydrophobicContact CE2-CD1 4.3Å; F150-L181 HydrophobicContact CG-CD1 3.95Å; F150-L181 HydrophobicContact CG-CD2 3.67Å; F150-L181 HydrophobicContact CG-CG 4.49Å; F150-A237 HydrophobicContact CE2-CB 3.55Å; F150-A237 HydrophobicContact CZ-CB 3.7Å
151	E	89.1	Confident	92	Very high	49 Å²	49	24.9 Å²	24.9	23%	0.229	15%	0.151	C	C	.	.	H	α-helix	trans	-77.9	-26.1	178.3	-73.2	173.4	170.9	0	0	113.7	R118 K121 G147 R148	R118-E151 PolarHBondContact NH1-O 3.39Å; K121-E151 WeakPolarHBondContact CE-OE1 3.38Å; K121-E151 IonicContact NZ-OE1 3.38Å; K121-E151 PolarHBondContact NZ-OE1 3.3Å; K121-E151 VanDerWaalsContact NZ-OE1 3.11Å; G147-E151 WeakPolarHBondContact O-CG 3.36Å; G147-E151 PolarHBondContact O-N 3.43Å; R148-E151 PolarHBondContact O-N 2.97Å
152	C	86.3	Confident	92.2	Very high	38 Å²	38	23.2 Å²	23.2	26%	0.257	14%	0.142	S	C	.	.	H	α-helix	trans	-109.1	-21.9	-171.9	-53.5	0	0	0	0	113.7	R148	R148-C152 WeakPolarHBondContact O-CB 3.49Å; R148-C152 PolarHBondContact O-N 2.97Å; R148-C152 PolarHBondContact O-SG 2.84Å
153	S	87.7	Confident	92.3	Very high	7 Å²	7	23.4 Å²	23.4	5%	0.049	14%	0.143	C	C	.	.			trans	-103.4	115.1	-176.6	-175.2	0	0	0	0	112.3	F149 M155 L156 F450	F149-S153 WeakPolarHBondContact O-CB 3.12Å; F149-S153 PolarHBondContact O-N 3.46Å; S153-M155 PolarHBondContact O-N 3.01Å; S153-M155 VanDerWaalsContact O-N 3.13Å; S153-M155 PolarHBondContact OG-N 3.4Å; S153-L156 PolarHBondContact O-N 3.05Å; S153-L156 VanDerWaalsContact O-N 3.11Å; S153-F450 WeakPolarHBondContact OG-CZ 3.31Å
154	N	86.6	Confident	92.4	Very high	149 Å²	149	23.4 Å²	23.4	80%	0.797	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-59.7	-24.1	174.1	-70.1	-17.5	0	0	0	112.7	L156 V157	N154-L156 PolarHBondContact O-N 3.16Å; N154-V157 WeakPolarHBondContact O-CG2 3.41Å; N154-V157 PolarHBondContact O-N 3.35Å
155	M	88.3	Confident	92.4	Very high	30 Å²	30	24.2 Å²	24.2	15%	0.148	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-70.8	-14.3	179.3	-61.3	-171.4	67.1	0	0	113.8	S153 P235 K262 F450 K451 A456	S153-M155 PolarHBondContact O-N 3.01Å; S153-M155 VanDerWaalsContact O-N 3.13Å; S153-M155 PolarHBondContact OG-N 3.4Å; M155-P235 WeakPolarHBondContact O-CB 3.24Å; M155-P235 VanDerWaalsContact O-CG 3.25Å; M155-P235 WeakPolarHBondContact O-CG 3.29Å; M155-K262 HydrophobicContact CB-CG 4.5Å; M155-K262 HydrophobicContact CE-CB 4.4Å; M155-K262 HydrophobicContact CE-CD 3.85Å; M155-K262 HydrophobicContact CE-CG 4.13Å; M155-F450 HydrophobicContact SD-CE1 3.81Å; M155-F450 HydrophobicContact SD-CZ 3.83Å; M155-K451 WeakPolarHBondContact CE-O 3.43Å; M155-A456 HydrophobicContact CG-CB 3.71Å; M155-A456 HydrophobicContact SD-CB 3.33Å; M155-A456 WeakPolarHBondContact SD-CB 3.45Å
156	L	91.8	Very high	92.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-107.9	1.9	-177.7	-64.2	175.9	0	0	0	113	F149 F150 S153 N154 G158 G159 A237 K262 L263	F149-L156 HydrophobicContact CB-CD1 3.96Å; F150-L156 HydrophobicContact CD1-CB 3.92Å; F150-L156 HydrophobicContact CD2-CD1 4.06Å; F150-L156 HydrophobicContact CE1-CB 4.05Å; F150-L156 HydrophobicContact CE2-CD1 4.14Å; F150-L156 HydrophobicContact CG-CB 4.22Å; F150-L156 HydrophobicContact CG-CD1 4.41Å; F150-L156 HydrophobicContact CZ-CB 4.43Å; F150-L156 HydrophobicContact CZ-CD2 4.47Å; S153-L156 PolarHBondContact O-N 3.05Å; S153-L156 VanDerWaalsContact O-N 3.11Å; N154-L156 PolarHBondContact O-N 3.16Å; L156-G158 PolarHBondContact O-N 3.32Å; L156-G159 WeakPolarHBondContact O-CA 3.47Å; L156-G159 PolarHBondContact O-N 3.36Å; L156-A237 HydrophobicContact CD2-CB 4.31Å; L156-K262 HydrophobicContact CD2-CB 4.03Å; L156-L263 HydrophobicContact CD1-CB 4.32Å; L156-L263 HydrophobicContact CD1-CD2 3.85Å; L156-L263 HydrophobicContact CD2-CB 4.29Å
157	V	89.7	Confident	92	Very high	100 Å²	100	25.4 Å²	25.4	61%	0.606	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	128.1	-179.7	174.3	0	0	0	0	110.2	N154 G159	N154-V157 WeakPolarHBondContact O-CG2 3.41Å; N154-V157 PolarHBondContact O-N 3.35Å; V157-G159 PolarHBondContact O-N 2.9Å
158	G	90.2	Very high	91.8	Very high	54 Å²	54	30.3 Å²	30.3	56%	0.557	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	69	5.1	-176.5	0	0	0	0	0	114.7	L156	L156-G158 PolarHBondContact O-N 3.32Å
159	G	93.8	Very high	91.7	Very high	6 Å²	6	29.8 Å²	29.8	6%	0.062	18%	0.184	C	C	.	.			trans	-74.9	172.9	-177.4	0	0	0	0	0	114.5	L156 V157 P235	L156-G159 WeakPolarHBondContact O-CA 3.47Å; L156-G159 PolarHBondContact O-N 3.36Å; V157-G159 PolarHBondContact O-N 2.9Å; G159-P235 CarbonylContact C-O 3.52Å; G159-P235 WeakPolarHBondContact CA-O 3.48Å
160	T	95.5	Very high	91.6	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.9	-178.6	-62.9	0	0	0	0	110	K182 I184 E234 P235 L236 A237	T160-K182 HydrophobicContact CG2-CB 4.18Å; T160-I184 HydrophobicContact CG2-CD1 3.83Å; T160-I184 HydrophobicContact CG2-CG1 3.71Å; T160-E234 PolarHBondContact OG1-OE1 3.02Å; T160-P235 PolarHBondContact N-O 3.39Å; T160-L236 HydrophobicContact CG2-CD2 4.48Å; T160-L236 WeakPolarHBondContact O-CA 3.33Å; T160-A237 PolarHBondContact O-N 3.19Å
161	V	97.2	Very high	91.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132	172.2	-176.4	0	0	0	0	109.5	V146 F150 L175 L181 K182 V183 I184 A237 I239	V146-V161 HydrophobicContact CG1-CG1 4.47Å; V146-V161 HydrophobicContact CG1-CG2 4.04Å; F150-V161 HydrophobicContact CD2-CG2 4.3Å; F150-V161 HydrophobicContact CE1-CG2 4.35Å; F150-V161 HydrophobicContact CE2-CG2 3.41Å; F150-V161 VanDerWaalsContact CE2-CG2 3.41Å; F150-V161 HydrophobicContact CZ-CG2 3.43Å; F150-V161 VanDerWaalsContact CZ-CG2 3.43Å; V161-L175 HydrophobicContact CG1-CD1 3.94Å; V161-L181 HydrophobicContact CG2-CB 4.28Å; V161-L181 HydrophobicContact CG2-CD1 3.85Å; V161-K182 PolarHBondContact N-O 3.48Å; V161-V183 HydrophobicContact CB-CG1 4.32Å; V161-V183 HydrophobicContact CB-CG2 4.32Å; V161-V183 HydrophobicContact CG1-CG1 4.5Å; V161-V183 CarbonylContact O-C 3.4Å; V161-V183 VanDerWaalsContact O-CA 3.3Å; V161-V183 WeakPolarHBondContact O-CA 3.32Å; V161-I184 PolarHBondContact O-N 3.4Å; V161-A237 CarbonylContact C-O 3.58Å; V161-A237 WeakPolarHBondContact CA-O 3.45Å; V161-I239 HydrophobicContact CG1-CD1 3.68Å; V161-I239 HydrophobicContact CG1-CG1 3.97Å; V161-I239 HydrophobicContact CG1-CG2 4.12Å
162	V	97	Very high	91.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	107.4	171.8	-177.9	0	0	0	0	108.5	I184 V186 W226 L227 L230 L236 A237 L238 I239	V162-I184 CarbonylContact C-O 3.55Å; V162-I184 WeakPolarHBondContact CA-O 3.48Å; V162-I184 HydrophobicContact CG2-CB 4.44Å; V162-V186 HydrophobicContact CG1-CG2 4.13Å; V162-W226 HydrophobicContact CG1-CH2 3.85Å; V162-W226 HydrophobicContact CG1-CZ3 3.77Å; V162-L227 HydrophobicContact CB-CD1 4.08Å; V162-L227 HydrophobicContact CG1-CD1 4.03Å; V162-L227 HydrophobicContact CG2-CD1 3.74Å; V162-L230 HydrophobicContact CG1-CD1 4.09Å; V162-L230 HydrophobicContact CG2-CD1 4.4Å; V162-L236 HydrophobicContact CG2-CD2 4.25Å; V162-A237 PolarHBondContact N-O 3.24Å; V162-L238 HydrophobicContact CB-CD1 3.86Å; V162-L238 HydrophobicContact CG1-CD1 3.74Å; V162-I239 PolarHBondContact O-N 3.44Å
163	D	97.2	Very high	92	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	95.1	180	-175.4	10.1	0	0	0	110	S166 S172 V183 I184 V186 I239	D163-S166 WeakPolarHBondContact O-CB 3.41Å; D163-S172 PolarHBondContact OD2-N 3.05Å; D163-S172 PolarHBondContact OD2-OG 3.01Å; D163-V183 HydrophobicContact CB-CG1 4.17Å; D163-I184 PolarHBondContact N-O 3.14Å; D163-V186 PolarHBondContact O-N 3.44Å; D163-I239 HydrophobicContact CB-CD1 4.03Å; D163-I239 HydrophobicContact CB-CG1 3.94Å
164	A	96.3	Very high	92.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.2	-174.9	0	0	0	0	0	112	L221 L238 I239 L251	A164-L221 HydrophobicContact CB-CD1 3.95Å; A164-L238 HydrophobicContact CB-CD1 4.28Å; A164-I239 PolarHBondContact N-O 2.75Å; A164-L251 HydrophobicContact CB-CD1 3.87Å; A164-L251 HydrophobicContact CB-CD2 3.43Å; A164-L251 VanDerWaalsContact CB-CD2 3.43Å; A164-L251 HydrophobicContact CB-CG 4.27Å
165	G	93.8	Very high	92.4	Very high	32 Å²	32	18.5 Å²	18.5	33%	0.33	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	34.8	-167.9	0	0	0	0	0	111.8	G167 V186	G165-G167 PolarHBondContact O-N 2.8Å; G165-V186 WeakPolarHBondContact CA-O 3.3Å; G165-V186 PolarHBondContact N-O 3.2Å
166	S	92	Very high	92.6	Very high	9 Å²	9	19.4 Å²	19.4	6%	0.063	13%	0.126	C	C	.	.			trans	-57.4	-22.2	-175.5	58.5	0	0	0	0	113.9	D163 K168 G169 V186	D163-S166 WeakPolarHBondContact O-CB 3.41Å; S166-K168 PolarHBondContact O-N 3.16Å; S166-G169 PolarHBondContact O-N 3.38Å; S166-V186 PolarHBondContact N-O 3.44Å; S166-V186 PolarHBondContact OG-O 2.72Å
167	G	90	Very high	92.3	Very high	15 Å²	15	21.6 Å²	21.6	16%	0.155	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	-122.3	-175.3	0	0	0	0	0	110.5	G165 G169 D187 V192	G165-G167 PolarHBondContact O-N 2.8Å; G167-G169 PolarHBondContact O-N 3.28Å; G167-G169 VanDerWaalsContact O-N 3.12Å; G167-D187 WeakPolarHBondContact CA-OD2 3.38Å; G167-D187 PolarHBondContact N-OD2 3.31Å; G167-V192 WeakPolarHBondContact O-CG1 3.41Å
168	K	87.8	Confident	92.3	Very high	104 Å²	104	18 Å²	18	45%	0.452	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-0.7	179.2	-63.4	-174.1	-179.1	-177.6	0	114.3	S166 R173 V192 S196	S166-K168 PolarHBondContact O-N 3.16Å; K168-R173 VanDerWaalsContact O-CZ 3.31Å; K168-R173 PolarHBondContact O-NH1 3.48Å; K168-R173 VanDerWaalsContact O-NH1 3.1Å; K168-R173 PolarHBondContact O-NH2 3.31Å; K168-V192 HydrophobicContact CG-CG1 4.32Å; K168-S196 PolarHBondContact O-OG 3.15Å
169	G	89.6	Confident	92.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	21.2	176.2	0	0	0	0	0	116.1	S166 G167 S172 R173	S166-G169 PolarHBondContact O-N 3.38Å; G167-G169 PolarHBondContact O-N 3.28Å; G167-G169 VanDerWaalsContact O-N 3.12Å; G169-S172 WeakPolarHBondContact CA-OG 3.34Å; G169-R173 VanDerWaalsContact C-NH2 3.33Å; G169-R173 WeakPolarHBondContact O-CB 3.4Å; G169-R173 VanDerWaalsContact O-CZ 3.26Å; G169-R173 PolarHBondContact O-N 3.28Å; G169-R173 PolarHBondContact O-NH1 3.38Å; G169-R173 PolarHBondContact O-NH2 2.87Å
170	H	90.3	Very high	92	Very high	15 Å²	15	18.7 Å²	18.7	7%	0.069	12%	0.116	C	C	.	.	H	α-helix	trans	-69.2	-39	-176.3	-69.3	-73	0	0	0	113.5	L128 V131 I139 R173 L174	L128-H170 HydrophobicContact CD2-CB 3.77Å; V131-H170 WeakPolarHBondContact CG2-CE1 3.05Å; V131-H170 WeakPolarHBondContact CG2-ND1 3.11Å; I139-H170 HydrophobicContact CD1-CB 3.5Å; H170-R173 PolarHBondContact ND1-NH2 3.12Å; H170-R173 VanDerWaalsContact ND1-NH2 3.13Å; H170-L174 PolarHBondContact O-N 3.45Å; H170-L174 VanDerWaalsContact O-N 3.12Å
171	L	93.2	Very high	91.9	Very high	6 Å²	6	19.4 Å²	19.4	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-46.9	175.3	179.4	56	0	0	0	109.9	I139 L142 R173 L174 L175 I239 L241	I139-L171 HydrophobicContact CG1-CB 4.32Å; I139-L171 HydrophobicContact CG2-CD1 4.19Å; L142-L171 HydrophobicContact CD2-CD2 3.77Å; L142-L171 HydrophobicContact CG-CD2 4.31Å; L171-R173 VanDerWaalsContact C-N 3.29Å; L171-R173 PolarHBondContact O-N 2.65Å; L171-L174 PolarHBondContact O-N 3.02Å; L171-L175 HydrophobicContact CD1-CD1 4.31Å; L171-L175 HydrophobicContact CD1-CG 4.18Å; L171-L175 HydrophobicContact CG-CD1 4.1Å; L171-L175 HydrophobicContact CG-CG 4.43Å; L171-L175 WeakPolarHBondContact O-CG 3.41Å; L171-L175 PolarHBondContact O-N 3.25Å; L171-I239 HydrophobicContact CD2-CD1 3.63Å; L171-I239 HydrophobicContact CG-CD1 4.12Å; L171-L241 HydrophobicContact CD2-CB 4.25Å; L171-L241 HydrophobicContact CD2-CD2 4.36Å
172	S	93.9	Very high	91.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-52.3	-46.8	175.6	-20.6	0	0	0	0	112	D163 G169 L175 H176	D163-S172 PolarHBondContact OD2-N 3.05Å; D163-S172 PolarHBondContact OD2-OG 3.01Å; G169-S172 WeakPolarHBondContact CA-OG 3.34Å; S172-L175 PolarHBondContact O-N 3.33Å; S172-H176 PolarHBondContact O-N 3.14Å
173	R	90.4	Very high	91.7	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.015	14%	0.144	C	C	.	.	H	α-helix	trans	-61.4	-46.5	174.2	-83.5	-173.6	-71.4	-74.2	-4.6	113.5	K168 G169 H170 L171 L175 H176 E177 S196 D200 I214	K168-R173 VanDerWaalsContact O-CZ 3.31Å; K168-R173 PolarHBondContact O-NH1 3.48Å; K168-R173 VanDerWaalsContact O-NH1 3.1Å; K168-R173 PolarHBondContact O-NH2 3.31Å; G169-R173 VanDerWaalsContact C-NH2 3.33Å; G169-R173 WeakPolarHBondContact O-CB 3.4Å; G169-R173 VanDerWaalsContact O-CZ 3.26Å; G169-R173 PolarHBondContact O-N 3.28Å; G169-R173 PolarHBondContact O-NH1 3.38Å; G169-R173 PolarHBondContact O-NH2 2.87Å; H170-R173 PolarHBondContact ND1-NH2 3.12Å; H170-R173 VanDerWaalsContact ND1-NH2 3.13Å; L171-R173 VanDerWaalsContact C-N 3.29Å; L171-R173 PolarHBondContact O-N 2.65Å; R173-L175 VanDerWaalsContact C-N 3.32Å; R173-L175 PolarHBondContact O-N 3.16Å; R173-H176 PolarHBondContact O-N 3.35Å; R173-E177 WeakPolarHBondContact O-CB 3.34Å; R173-E177 WeakPolarHBondContact O-CG 3.39Å; R173-E177 PolarHBondContact O-N 3.24Å; R173-S196 PolarHBondContact NH1-OG 3.25Å; R173-D200 WeakPolarHBondContact CD-OD1 3.42Å; R173-D200 WeakPolarHBondContact CG-OD1 3.38Å; R173-D200 IonicContact CZ-OD1 3.35Å; R173-D200 IonicContact NE-OD1 2.91Å; R173-D200 IonicContact NH1-OD1 2.89Å; R173-D200 PolarHBondContact NH1-OD1 2.94Å; R173-D200 IonicContact NH1-OD2 3.97Å; R173-I214 HydrophobicContact CB-CD1 4.31Å; R173-I214 HydrophobicContact CG-CD1 3.74Å
174	L	90	Very high	91.6	Very high	5 Å²	5	25.5 Å²	25.5	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-58.7	-47	178.2	177.5	163.4	0	0	0	110.8	L123 L128 I139 H170 L171 H176 E177 V178 Y179	L123-L174 HydrophobicContact CD2-CD1 3.77Å; L123-L174 HydrophobicContact CD2-CD2 3.99Å; L123-L174 HydrophobicContact CD2-CG 3.91Å; L128-L174 HydrophobicContact CD1-CD1 4.28Å; I139-L174 HydrophobicContact CG2-CB 4.25Å; I139-L174 HydrophobicContact CG2-CD1 3.49Å; I139-L174 VanDerWaalsContact CG2-CD1 3.49Å; H170-L174 PolarHBondContact O-N 3.45Å; H170-L174 VanDerWaalsContact O-N 3.12Å; L171-L174 PolarHBondContact O-N 3.02Å; L174-H176 VanDerWaalsContact C-N 3.31Å; L174-H176 PolarHBondContact O-N 3.03Å; L174-E177 PolarHBondContact O-N 3.1Å; L174-V178 HydrophobicContact CG-CG2 4.3Å; L174-V178 VanDerWaalsContact O-CB 3.29Å; L174-V178 WeakPolarHBondContact O-CB 3.37Å; L174-V178 WeakPolarHBondContact O-CG2 3.43Å; L174-V178 PolarHBondContact O-N 3.11Å; L174-Y179 HydrophobicContact CD2-CD2 4.18Å; L174-Y179 HydrophobicContact CD2-CE2 3.96Å
175	L	92.9	Very high	91.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.2	-42.6	-179.8	-68	174.9	0	0	0	111.8	G143 V146 V161 L171 S172 R173 Y179 G180 L181 V183 I239	G143-L175 WeakPolarHBondContact O-CD2 3.23Å; V146-L175 HydrophobicContact CB-CD2 3.67Å; V146-L175 HydrophobicContact CG1-CD1 4.1Å; V146-L175 HydrophobicContact CG1-CD2 3.63Å; V146-L175 HydrophobicContact CG2-CD2 4.44Å; V161-L175 HydrophobicContact CG1-CD1 3.94Å; L171-L175 HydrophobicContact CD1-CD1 4.31Å; L171-L175 HydrophobicContact CD1-CG 4.18Å; L171-L175 HydrophobicContact CG-CD1 4.1Å; L171-L175 HydrophobicContact CG-CG 4.43Å; L171-L175 WeakPolarHBondContact O-CG 3.41Å; L171-L175 PolarHBondContact O-N 3.25Å; S172-L175 PolarHBondContact O-N 3.33Å; R173-L175 VanDerWaalsContact C-N 3.32Å; R173-L175 PolarHBondContact O-N 3.16Å; L175-Y179 CarbonylContact O-C 3.57Å; L175-Y179 WeakPolarHBondContact O-CA 3.43Å; L175-Y179 VanDerWaalsContact O-CB 3.29Å; L175-Y179 WeakPolarHBondContact O-CB 3.38Å; L175-Y179 PolarHBondContact O-N 2.78Å; L175-Y179 VanDerWaalsContact O-N 3.11Å; L175-G180 PolarHBondContact O-N 3.21Å; L175-L181 HydrophobicContact CB-CD1 4.44Å; L175-L181 HydrophobicContact CD2-CD1 4.31Å; L175-L181 PolarHBondContact O-N 3.01Å; L175-V183 HydrophobicContact CB-CG2 3.97Å; L175-I239 HydrophobicContact CD1-CD1 3.69Å
176	H	91	Very high	91.6	Very high	49 Å²	49	24 Å²	24	23%	0.227	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-54.6	175.4	173.3	40.7	0	0	0	112.3	S172 R173 L174 V178 G180 V183 P213 I214	S172-H176 PolarHBondContact O-N 3.14Å; R173-H176 PolarHBondContact O-N 3.35Å; L174-H176 VanDerWaalsContact C-N 3.31Å; L174-H176 PolarHBondContact O-N 3.03Å; H176-V178 PolarHBondContact O-N 3.38Å; H176-G180 WeakPolarHBondContact O-CA 3.39Å; H176-G180 PolarHBondContact O-N 3.22Å; H176-V183 HydrophobicContact CB-CG2 4.47Å; H176-P213 VanDerWaalsContact CE1-CD 3.43Å; H176-P213 WeakPolarHBondContact CE1-CD 3.27Å; H176-P213 WeakPolarHBondContact CE1-CG 3.46Å; H176-P213 WeakPolarHBondContact ND1-CG 3.33Å; H176-P213 VanDerWaalsContact NE2-CD 3.31Å; H176-P213 WeakPolarHBondContact NE2-CD 3.43Å; H176-P213 WeakPolarHBondContact NE2-CG 3.26Å; H176-I214 HydrophobicContact CB-CD1 3.93Å; H176-I214 HydrophobicContact CB-CG1 3.81Å
177	E	87.2	Confident	91.7	Very high	46 Å²	46	24.8 Å²	24.8	22%	0.215	13%	0.134	C	C	.	.	H	α-helix	trans	-68.8	-32.4	-170.8	-68.8	-176.2	135.6	0	0	113.2	H127 R173 L174 R203 K207	H127-E177 WeakPolarHBondContact CB-OE2 3.35Å; H127-E177 IonicContact CD2-OE1 3.89Å; H127-E177 IonicContact CD2-OE2 3.12Å; H127-E177 PolarHBondContact CD2-OE2 3.09Å; H127-E177 IonicContact CG-OE2 3.74Å; R173-E177 WeakPolarHBondContact O-CB 3.34Å; R173-E177 WeakPolarHBondContact O-CG 3.39Å; R173-E177 PolarHBondContact O-N 3.24Å; L174-E177 PolarHBondContact O-N 3.1Å; E177-R203 IonicContact OE1-NH1 3.3Å; E177-R203 PolarHBondContact OE1-NH1 3.33Å; E177-R203 IonicContact OE2-NH1 3.02Å; E177-R203 PolarHBondContact OE2-NH1 3.22Å; E177-K207 IonicContact OE1-NZ 2.89Å; E177-K207 PolarHBondContact OE1-NZ 3.39Å
178	V	88	Confident	91.8	Very high	24 Å²	24	27.6 Å²	27.6	15%	0.145	15%	0.151	C	C	.	.	H	α-helix	trans	-96.7	-40.5	-177	-179.7	0	0	0	0	111.6	K121 L123 L174 H176	K121-V178 HydrophobicContact CB-CG1 3.97Å; K121-V178 HydrophobicContact CD-CG1 4.39Å; K121-V178 VanDerWaalsContact CD-O 3.27Å; K121-V178 WeakPolarHBondContact CD-O 3.43Å; L123-V178 HydrophobicContact CD2-CB 4.43Å; L123-V178 HydrophobicContact CD2-CG1 4.06Å; L123-V178 HydrophobicContact CD2-CG2 4Å; L174-V178 HydrophobicContact CG-CG2 4.3Å; L174-V178 VanDerWaalsContact O-CB 3.29Å; L174-V178 WeakPolarHBondContact O-CB 3.37Å; L174-V178 WeakPolarHBondContact O-CG2 3.43Å; L174-V178 PolarHBondContact O-N 3.11Å; H176-V178 PolarHBondContact O-N 3.38Å
179	Y	89.7	Confident	92	Very high	19 Å²	19	26.1 Å²	26.1	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-105.8	-7.5	-173	-63.3	-83.6	0	0	0	113.7	K121 G143 S144 G147 L174 L175 L181	K121-Y179 HydrophobicContact CB-CE1 4.3Å; K121-Y179 HydrophobicContact CD-CD1 3.93Å; K121-Y179 HydrophobicContact CD-CE1 4.02Å; K121-Y179 HydrophobicContact CG-CE1 4.42Å; G143-Y179 WeakPolarHBondContact O-CE2 3.43Å; S144-Y179 WeakPolarHBondContact CA-OH 3.23Å; G147-Y179 VanDerWaalsContact CA-CD1 3.48Å; L174-Y179 HydrophobicContact CD2-CD2 4.18Å; L174-Y179 HydrophobicContact CD2-CE2 3.96Å; L175-Y179 CarbonylContact O-C 3.57Å; L175-Y179 WeakPolarHBondContact O-CA 3.43Å; L175-Y179 VanDerWaalsContact O-CB 3.29Å; L175-Y179 WeakPolarHBondContact O-CB 3.38Å; L175-Y179 PolarHBondContact O-N 2.78Å; L175-Y179 VanDerWaalsContact O-N 3.11Å; Y179-L181 PolarHBondContact O-N 3.25Å
180	G	89.5	Confident	92.1	Very high	57 Å²	57	30.4 Å²	30.4	59%	0.588	17%	0.171	S	C	*	.			trans	70.1	17.1	180	0	0	0	0	0	113.5	L175 H176	L175-G180 PolarHBondContact O-N 3.21Å; H176-G180 WeakPolarHBondContact O-CA 3.39Å; H176-G180 PolarHBondContact O-N 3.22Å
181	L	92.8	Very high	92.2	Very high	19 Å²	19	32 Å²	32	10%	0.099	19%	0.187	C	C	.	.			trans	-76	145.3	-174.4	-58	-179.1	0	0	0	111.4	V146 F150 V161 L175 Y179 V183	V146-L181 HydrophobicContact CG1-CD1 4.19Å; F150-L181 HydrophobicContact CB-CD1 4.31Å; F150-L181 HydrophobicContact CB-CD2 3.79Å; F150-L181 HydrophobicContact CD1-CD1 4.47Å; F150-L181 HydrophobicContact CD1-CD2 3.62Å; F150-L181 HydrophobicContact CD2-CD1 3.86Å; F150-L181 HydrophobicContact CD2-CD2 4.4Å; F150-L181 HydrophobicContact CE1-CD2 4.3Å; F150-L181 HydrophobicContact CE2-CD1 4.3Å; F150-L181 HydrophobicContact CG-CD1 3.95Å; F150-L181 HydrophobicContact CG-CD2 3.67Å; F150-L181 HydrophobicContact CG-CG 4.49Å; V161-L181 HydrophobicContact CG2-CB 4.28Å; V161-L181 HydrophobicContact CG2-CD1 3.85Å; L175-L181 HydrophobicContact CB-CD1 4.44Å; L175-L181 HydrophobicContact CD2-CD1 4.31Å; L175-L181 PolarHBondContact O-N 3.01Å; Y179-L181 PolarHBondContact O-N 3.25Å; L181-V183 HydrophobicContact CB-CG2 4.37Å
182	K	93.9	Very high	92.1	Very high	119 Å²	119	33 Å²	33	52%	0.517	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.1	165.1	-63.8	179.2	-175.2	172.6	0	108.1	T160 V161	T160-K182 HydrophobicContact CG2-CB 4.18Å; V161-K182 PolarHBondContact N-O 3.48Å
183	V	95.4	Very high	91.9	Very high	1 Å²	1	33 Å²	33	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.5	-176.5	-168.7	0	0	0	0	110.8	V161 D163 L175 H176 L181 P213 I214 V215	V161-V183 HydrophobicContact CB-CG1 4.32Å; V161-V183 HydrophobicContact CB-CG2 4.32Å; V161-V183 HydrophobicContact CG1-CG1 4.5Å; V161-V183 CarbonylContact O-C 3.4Å; V161-V183 VanDerWaalsContact O-CA 3.3Å; V161-V183 WeakPolarHBondContact O-CA 3.32Å; D163-V183 HydrophobicContact CB-CG1 4.17Å; L175-V183 HydrophobicContact CB-CG2 3.97Å; H176-V183 HydrophobicContact CB-CG2 4.47Å; L181-V183 HydrophobicContact CB-CG2 4.37Å; V183-P213 PolarHBondContact N-O 3.33Å; V183-I214 CarbonylContact O-C 3.56Å; V183-I214 VanDerWaalsContact O-CA 3.28Å; V183-I214 WeakPolarHBondContact O-CA 3.4Å; V183-V215 PolarHBondContact O-N 2.91Å
184	I	95.3	Very high	91.9	Very high	12 Å²	12	34.9 Å²	34.9	6%	0.062	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	107.2	168.1	-55.3	177	0	0	0	107.2	T160 V161 V162 D163 V186 V215 L217 L230	T160-I184 HydrophobicContact CG2-CD1 3.83Å; T160-I184 HydrophobicContact CG2-CG1 3.71Å; V161-I184 PolarHBondContact O-N 3.4Å; V162-I184 CarbonylContact C-O 3.55Å; V162-I184 WeakPolarHBondContact CA-O 3.48Å; V162-I184 HydrophobicContact CG2-CB 4.44Å; D163-I184 PolarHBondContact N-O 3.14Å; I184-V186 HydrophobicContact CG2-CG2 3.99Å; I184-V215 CarbonylContact C-O 3.56Å; I184-V215 WeakPolarHBondContact CA-O 3.29Å; I184-V215 HydrophobicContact CG1-CB 4.32Å; I184-L217 HydrophobicContact CG2-CD1 3.48Å; I184-L217 VanDerWaalsContact CG2-CD1 3.48Å; I184-L217 HydrophobicContact CG2-CG 3.96Å; I184-L230 HydrophobicContact CD1-CB 3.88Å; I184-L230 HydrophobicContact CG2-CD1 4.16Å
185	A	95.1	Very high	91.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	113.7	178.5	0	0	0	0	0	109.3	I214 V215 L217	A185-I214 HydrophobicContact CB-CG2 4.13Å; A185-V215 PolarHBondContact N-O 3.29Å; A185-L217 PolarHBondContact O-N 3.48Å
186	V	94.8	Very high	91.6	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.9	-177.6	-170.9	0	0	0	0	109.8	V162 D163 G165 S166 I184 L217 Q219 L221 W226 L230	V162-V186 HydrophobicContact CG1-CG2 4.13Å; D163-V186 PolarHBondContact O-N 3.44Å; G165-V186 WeakPolarHBondContact CA-O 3.3Å; G165-V186 PolarHBondContact N-O 3.2Å; S166-V186 PolarHBondContact N-O 3.44Å; S166-V186 PolarHBondContact OG-O 2.72Å; I184-V186 HydrophobicContact CG2-CG2 3.99Å; V186-L217 WeakPolarHBondContact CA-O 3.45Å; V186-L217 HydrophobicContact CG2-CB 4.39Å; V186-Q219 HydrophobicContact CG1-CB 3.87Å; V186-L221 HydrophobicContact CG1-CD1 4.19Å; V186-L221 HydrophobicContact CG1-CD2 3.96Å; V186-L221 HydrophobicContact CG1-CG 4.22Å; V186-W226 HydrophobicContact CG2-CZ3 4.43Å; V186-L230 HydrophobicContact CG2-CD1 4.37Å
187	D	94.2	Very high	91.4	Very high	24 Å²	24	43.8 Å²	43.8	13%	0.128	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	153	170.6	-161.7	-71	0	0	0	109.8	G167 N189 V193 L217 V218 Q219	G167-D187 WeakPolarHBondContact CA-OD2 3.38Å; G167-D187 PolarHBondContact N-OD2 3.31Å; D187-N189 WeakPolarHBondContact OD1-CB 3.3Å; D187-N189 PolarHBondContact OD1-N 3Å; D187-V193 HydrophobicContact CB-CG2 3.65Å; D187-L217 PolarHBondContact N-O 3.44Å; D187-L217 VanDerWaalsContact N-O 3.14Å; D187-V218 CarbonylContact O-C 3.51Å; D187-V218 VanDerWaalsContact O-CA 3.29Å; D187-V218 WeakPolarHBondContact O-CA 3.43Å; D187-Q219 CarbonylContact C-O 3.44Å; D187-Q219 PolarHBondContact O-N 2.95Å
188	C	92	Very high	91.5	Very high	74 Å²	74	45.2 Å²	45.2	50%	0.5	25%	0.25	S	C	.	.	S	Bend	trans	-85.7	-11.3	178.8	64.3	0	0	0	0	113.5	R220	C188-R220 HydrophobicContact CB-CB 4.13Å; C188-R220 HydrophobicContact CB-CG 4.18Å
189	N	92.7	Very high	91.3	Very high	73 Å²	73	47 Å²	47	39%	0.39	26%	0.258	S	S	.	.			trans	-96.3	100.1	-177.7	-172.7	-37.2	0	0	0	111.3	D187 A191 V192 V193	D187-N189 WeakPolarHBondContact OD1-CB 3.3Å; D187-N189 PolarHBondContact OD1-N 3Å; N189-A191 VanDerWaalsContact C-N 3.3Å; N189-A191 PolarHBondContact O-N 3.26Å; N189-A191 WeakPolarHBondContact OD1-CB 3.18Å; N189-A191 PolarHBondContact OD1-N 3.32Å; N189-A191 VanDerWaalsContact OD1-N 3.13Å; N189-V192 HydrophobicContact CB-CB 4.04Å; N189-V192 HydrophobicContact CB-CG2 4.01Å; N189-V192 VanDerWaalsContact CG-CG2 3.5Å; N189-V192 WeakPolarHBondContact O-CB 3.21Å; N189-V192 PolarHBondContact O-N 3.33Å; N189-V192 PolarHBondContact OD1-N 2.91Å; N189-V192 VanDerWaalsContact OD1-N 3.17Å; N189-V193 WeakPolarHBondContact O-CG2 3.42Å; N189-V193 PolarHBondContact O-N 2.97Å
190	D	92.1	Very high	91.1	Very high	90 Å²	90	46.4 Å²	46.4	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-53.1	-44.4	179.5	179	41.6	0	0	0	113.2	V192 V193 S194 V218	D190-V192 PolarHBondContact O-N 2.64Å; D190-V192 VanDerWaalsContact O-N 3.17Å; D190-V193 PolarHBondContact O-N 2.79Å; D190-S194 VanDerWaalsContact O-CB 3.22Å; D190-S194 WeakPolarHBondContact O-CB 3.37Å; D190-S194 PolarHBondContact O-N 3.05Å; D190-S194 PolarHBondContact O-OG 3.13Å; D190-S194 PolarHBondContact OD1-OG 3.28Å; D190-V218 HydrophobicContact CB-CG1 3.98Å; D190-V218 HydrophobicContact CB-CG2 4.25Å
191	A	93.1	Very high	90.8	Very high	50 Å²	50	48.7 Å²	48.7	41%	0.413	25%	0.254	S	S	.	.	H	α-helix	trans	-63.2	-27.1	179.9	0	0	0	0	0	112.8	N189 R195	N189-A191 VanDerWaalsContact C-N 3.3Å; N189-A191 PolarHBondContact O-N 3.26Å; N189-A191 WeakPolarHBondContact OD1-CB 3.18Å; N189-A191 PolarHBondContact OD1-N 3.32Å; N189-A191 VanDerWaalsContact OD1-N 3.13Å; A191-R195 WeakPolarHBondContact O-CG 3.42Å; A191-R195 PolarHBondContact O-N 2.81Å; A191-R195 PolarHBondContact O-NE 3.23Å
192	V	90	Very high	90.4	Very high	26 Å²	26	54.4 Å²	54.4	16%	0.158	28%	0.278	C	S	.	.	H	α-helix	trans	-81.2	-44.7	176.2	173.8	0	0	0	0	110.8	G167 K168 N189 D190 R195 S196	G167-V192 WeakPolarHBondContact O-CG1 3.41Å; K168-V192 HydrophobicContact CG-CG1 4.32Å; N189-V192 HydrophobicContact CB-CB 4.04Å; N189-V192 HydrophobicContact CB-CG2 4.01Å; N189-V192 VanDerWaalsContact CG-CG2 3.5Å; N189-V192 WeakPolarHBondContact O-CB 3.21Å; N189-V192 PolarHBondContact O-N 3.33Å; N189-V192 PolarHBondContact OD1-N 2.91Å; N189-V192 VanDerWaalsContact OD1-N 3.17Å; D190-V192 PolarHBondContact O-N 2.64Å; D190-V192 VanDerWaalsContact O-N 3.17Å; V192-R195 PolarHBondContact O-N 2.77Å; V192-S196 PolarHBondContact O-N 3.24Å
193	V	89.9	Confident	89.8	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-47.4	177.3	178.5	0	0	0	0	111.1	D187 N189 D190 R195 S196 R197 H216 V218	D187-V193 HydrophobicContact CB-CG2 3.65Å; N189-V193 WeakPolarHBondContact O-CG2 3.42Å; N189-V193 PolarHBondContact O-N 2.97Å; D190-V193 PolarHBondContact O-N 2.79Å; V193-R195 VanDerWaalsContact C-N 3.28Å; V193-R195 PolarHBondContact O-N 3.44Å; V193-S196 WeakPolarHBondContact O-CA 3.27Å; V193-S196 WeakPolarHBondContact O-CB 3.28Å; V193-S196 PolarHBondContact O-N 2.89Å; V193-R197 PolarHBondContact O-N 3.42Å; V193-H216 HydrophobicContact CG1-CB 3.75Å; V193-V218 HydrophobicContact CB-CG2 3.69Å; V193-V218 HydrophobicContact CG1-CG2 3.7Å; V193-V218 HydrophobicContact CG2-CG2 3.93Å
194	S	90.7	Very high	89.1	Confident	42 Å²	42	52 Å²	52	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-58.6	-39.8	177.2	-73	0	0	0	0	111.9	D190 R197 V198	D190-S194 VanDerWaalsContact O-CB 3.22Å; D190-S194 WeakPolarHBondContact O-CB 3.37Å; D190-S194 PolarHBondContact O-N 3.05Å; D190-S194 PolarHBondContact O-OG 3.13Å; D190-S194 PolarHBondContact OD1-OG 3.28Å; S194-R197 PolarHBondContact O-N 2.89Å; S194-V198 WeakPolarHBondContact O-CG2 3.31Å; S194-V198 PolarHBondContact O-N 3.43Å; S194-V198 VanDerWaalsContact O-N 3.14Å
195	R	88.5	Confident	88.3	Confident	145 Å²	145	57.3 Å²	57.3	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-64.4	-38.4	172.1	-84.4	-178.9	-84.3	179.5	-10.1	112.6	A191 V192 V193 V198 I199	A191-R195 WeakPolarHBondContact O-CG 3.42Å; A191-R195 PolarHBondContact O-N 2.81Å; A191-R195 PolarHBondContact O-NE 3.23Å; V192-R195 PolarHBondContact O-N 2.77Å; V193-R195 VanDerWaalsContact C-N 3.28Å; V193-R195 PolarHBondContact O-N 3.44Å; R195-V198 PolarHBondContact O-N 3.35Å; R195-I199 WeakPolarHBondContact O-CG1 3.25Å; R195-I199 PolarHBondContact O-N 2.95Å; R195-I199 VanDerWaalsContact O-N 3.15Å
196	S	87.4	Confident	87.4	Confident	1 Å²	1	66 Å²	66	1%	0.007	34%	0.335	C	S	.	.	H	α-helix	trans	-64.4	-44.2	175.7	-165	0	0	0	0	111.7	K168 R173 V192 V193 V198 I199 D200 H216	K168-S196 PolarHBondContact O-OG 3.15Å; R173-S196 PolarHBondContact NH1-OG 3.25Å; V192-S196 PolarHBondContact O-N 3.24Å; V193-S196 WeakPolarHBondContact O-CA 3.27Å; V193-S196 WeakPolarHBondContact O-CB 3.28Å; V193-S196 PolarHBondContact O-N 2.89Å; S196-V198 VanDerWaalsContact C-N 3.32Å; S196-V198 PolarHBondContact O-N 3.29Å; S196-I199 PolarHBondContact O-N 2.82Å; S196-I199 VanDerWaalsContact O-N 3.15Å; S196-D200 VanDerWaalsContact O-CG 3.25Å; S196-D200 PolarHBondContact O-N 3.37Å; S196-H216 PolarHBondContact OG-CE1 3.25Å
197	R	88.3	Confident	86.4	Confident	96 Å²	96	71.5 Å²	71.5	36%	0.362	36%	0.359	S	S	.	.	H	α-helix	trans	-56.4	-44.7	175.7	-69.2	-180	-175	148.7	-2.7	112	V193 S194 I199 D200 L201 H216	V193-R197 PolarHBondContact O-N 3.42Å; S194-R197 PolarHBondContact O-N 2.89Å; R197-I199 PolarHBondContact O-N 3.29Å; R197-D200 PolarHBondContact O-N 2.81Å; R197-L201 WeakPolarHBondContact O-CB 3.29Å; R197-L201 VanDerWaalsContact O-CG 3.31Å; R197-L201 WeakPolarHBondContact O-CG 3.38Å; R197-L201 PolarHBondContact O-N 3.1Å; R197-H216 HydrophobicContact CG-CB 3.57Å; R197-H216 PolarHBondContact NH2-O 3.39Å
198	V	87.9	Confident	84.8	Confident	75 Å²	75	78 Å²	78	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-62.7	-40.7	177.8	172	0	0	0	0	112	S194 R195 S196 D200 K202	S194-V198 WeakPolarHBondContact O-CG2 3.31Å; S194-V198 PolarHBondContact O-N 3.43Å; S194-V198 VanDerWaalsContact O-N 3.14Å; R195-V198 PolarHBondContact O-N 3.35Å; S196-V198 VanDerWaalsContact C-N 3.32Å; S196-V198 PolarHBondContact O-N 3.29Å; V198-D200 VanDerWaalsContact C-N 3.34Å; V198-K202 HydrophobicContact CG1-CD 4.38Å; V198-K202 WeakPolarHBondContact O-CG 3.41Å; V198-K202 PolarHBondContact O-N 2.86Å; V198-K202 VanDerWaalsContact O-N 3.15Å
199	I	84.7	Confident	83.3	Confident	62 Å²	62	76.9 Å²	76.9	32%	0.318	39%	0.385	S	S	.	.	H	α-helix	trans	-63	-44.6	176.5	-68.5	165.1	0	0	0	110.1	R195 S196 R197 K202 R203	R195-I199 WeakPolarHBondContact O-CG1 3.25Å; R195-I199 PolarHBondContact O-N 2.95Å; R195-I199 VanDerWaalsContact O-N 3.15Å; S196-I199 PolarHBondContact O-N 2.82Å; S196-I199 VanDerWaalsContact O-N 3.15Å; R197-I199 PolarHBondContact O-N 3.29Å; I199-K202 PolarHBondContact O-N 3.18Å; I199-R203 WeakPolarHBondContact O-CG 3.36Å; I199-R203 PolarHBondContact O-N 2.95Å; I199-R203 VanDerWaalsContact O-N 3.14Å
200	D	84.7	Confident	81.6	Confident	7 Å²	7	79.9 Å²	79.9	4%	0.037	41%	0.407	C	S	.	.	H	α-helix	trans	-70.3	-42.3	-175.8	-63.6	-6.3	0	0	0	111	R173 S196 R197 V198 K202 R203 V204 H216	R173-D200 WeakPolarHBondContact CD-OD1 3.42Å; R173-D200 WeakPolarHBondContact CG-OD1 3.38Å; R173-D200 IonicContact CZ-OD1 3.35Å; R173-D200 IonicContact NE-OD1 2.91Å; R173-D200 IonicContact NH1-OD1 2.89Å; R173-D200 PolarHBondContact NH1-OD1 2.94Å; R173-D200 IonicContact NH1-OD2 3.97Å; S196-D200 VanDerWaalsContact O-CG 3.25Å; S196-D200 PolarHBondContact O-N 3.37Å; R197-D200 PolarHBondContact O-N 2.81Å; V198-D200 VanDerWaalsContact C-N 3.34Å; D200-K202 VanDerWaalsContact C-N 3.33Å; D200-K202 PolarHBondContact O-N 2.89Å; D200-R203 WeakPolarHBondContact O-CB 3.28Å; D200-R203 PolarHBondContact O-N 2.7Å; D200-V204 VanDerWaalsContact O-CG2 3.29Å; D200-V204 WeakPolarHBondContact O-CG2 3.19Å; D200-V204 PolarHBondContact O-N 2.92Å; D200-H216 IonicContact OD2-CD2 3.11Å; D200-H216 IonicContact OD2-CE1 3.96Å; D200-H216 PolarHBondContact OD2-CE1 3.47Å; D200-H216 IonicContact OD2-NE2 3Å; D200-H216 PolarHBondContact OD2-NE2 3.36Å
201	L	84.2	Confident	80	Confident	105 Å²	105	81.5 Å²	81.5	55%	0.55	42%	0.416	S	S	.	.	H	α-helix	trans	-56.5	-44.5	172.4	-75.3	169.7	0	0	0	112.2	R197 R203 V204 N205	R197-L201 WeakPolarHBondContact O-CB 3.29Å; R197-L201 VanDerWaalsContact O-CG 3.31Å; R197-L201 WeakPolarHBondContact O-CG 3.38Å; R197-L201 PolarHBondContact O-N 3.1Å; L201-R203 VanDerWaalsContact C-N 3.26Å; L201-R203 PolarHBondContact O-N 3.23Å; L201-V204 PolarHBondContact O-N 3.31Å; L201-N205 VanDerWaalsContact O-CG 3.3Å; L201-N205 PolarHBondContact O-N 3.04Å
202	K	84.1	Confident	78.7	Confident	138 Å²	138	81.8 Å²	81.8	60%	0.6	41%	0.414	S	S	*	.	H	α-helix	trans	-62.8	-32.9	176.5	-74.9	178.4	-179.8	-174.3	0	112.5	V198 I199 D200 K206	V198-K202 HydrophobicContact CG1-CD 4.38Å; V198-K202 WeakPolarHBondContact O-CG 3.41Å; V198-K202 PolarHBondContact O-N 2.86Å; V198-K202 VanDerWaalsContact O-N 3.15Å; I199-K202 PolarHBondContact O-N 3.18Å; D200-K202 VanDerWaalsContact C-N 3.33Å; D200-K202 PolarHBondContact O-N 2.89Å; K202-K206 WeakPolarHBondContact O-CG 3.35Å; K202-K206 PolarHBondContact O-N 3.05Å
203	R	81.4	Confident	77.8	Confident	44 Å²	44	82.3 Å²	82.3	17%	0.166	42%	0.418	C	S	.	.	H	α-helix	trans	-76	-42.4	178.2	-74.5	178.3	171.2	-142.2	0.9	112.2	H127 E177 I199 D200 L201 K206 K207	H127-R203 PolarHBondContact O-NH1 3.29Å; H127-R203 PolarHBondContact O-NH2 3.35Å; E177-R203 IonicContact OE1-NH1 3.3Å; E177-R203 PolarHBondContact OE1-NH1 3.33Å; E177-R203 IonicContact OE2-NH1 3.02Å; E177-R203 PolarHBondContact OE2-NH1 3.22Å; I199-R203 WeakPolarHBondContact O-CG 3.36Å; I199-R203 PolarHBondContact O-N 2.95Å; I199-R203 VanDerWaalsContact O-N 3.14Å; D200-R203 WeakPolarHBondContact O-CB 3.28Å; D200-R203 PolarHBondContact O-N 2.7Å; L201-R203 VanDerWaalsContact C-N 3.26Å; L201-R203 PolarHBondContact O-N 3.23Å; R203-K206 PolarHBondContact O-N 3.09Å; R203-K206 VanDerWaalsContact O-N 3.17Å; R203-K207 PolarHBondContact O-N 3.44Å; R203-K207 VanDerWaalsContact O-N 3.07Å
204	V	80	Confident	77.7	Confident	27 Å²	27	82.8 Å²	82.8	16%	0.164	42%	0.421	C	S	.	.	H	α-helix	trans	-58.4	-48.8	175.9	171.5	0	0	0	0	110.1	D200 L201 K206 K207 L208 S209	D200-V204 VanDerWaalsContact O-CG2 3.29Å; D200-V204 WeakPolarHBondContact O-CG2 3.19Å; D200-V204 PolarHBondContact O-N 2.92Å; L201-V204 PolarHBondContact O-N 3.31Å; V204-K206 PolarHBondContact O-N 3.43Å; V204-K207 PolarHBondContact O-N 3.01Å; V204-L208 PolarHBondContact O-N 3.43Å; V204-L208 VanDerWaalsContact O-N 3.17Å; V204-S209 WeakPolarHBondContact CG1-O 3.4Å
205	N	78.3	Confident	77.5	Confident	123 Å²	123	84.4 Å²	84.4	66%	0.658	43%	0.429	S	S	*	.	H	α-helix	trans	-59.7	-32.4	177	-71.2	-8.4	0	0	0	113.2	L201	L201-N205 VanDerWaalsContact O-CG 3.3Å; L201-N205 PolarHBondContact O-N 3.04Å
206	K	77.6	Confident	77.5	Confident	183 Å²	183	78.2 Å²	78.2	80%	0.796	41%	0.406	S	S	*	.	H	α-helix	trans	-75	-29.7	175.7	-77.3	-179.2	177.4	-171.3	0	113.4	K202 R203 V204	K202-K206 WeakPolarHBondContact O-CG 3.35Å; K202-K206 PolarHBondContact O-N 3.05Å; R203-K206 PolarHBondContact O-N 3.09Å; R203-K206 VanDerWaalsContact O-N 3.17Å; V204-K206 PolarHBondContact O-N 3.43Å
207	K	71.9	Confident	77.4	Confident	116 Å²	116	80.6 Å²	80.6	50%	0.504	42%	0.418	S	S	.	.	H	α-helix	trans	-94.4	-3.3	-175.3	-73.5	-177.6	174.6	176	0	114	E177 R203 V204 S209	E177-K207 IonicContact OE1-NZ 2.89Å; E177-K207 PolarHBondContact OE1-NZ 3.39Å; R203-K207 PolarHBondContact O-N 3.44Å; R203-K207 VanDerWaalsContact O-N 3.07Å; V204-K207 PolarHBondContact O-N 3.01Å; K207-S209 PolarHBondContact O-N 3.28Å; K207-S209 VanDerWaalsContact O-N 3.09Å
208	L	61.2	Low	77.4	Confident	159 Å²	159	79 Å²	79	83%	0.832	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	24.8	-173.1	-92.8	79.3	0	0	0	113.5	V204	V204-L208 PolarHBondContact O-N 3.43Å; V204-L208 VanDerWaalsContact O-N 3.17Å
209	S	60.5	Low	77.4	Confident	51 Å²	51	78.3 Å²	78.3	36%	0.357	41%	0.411	S	S	.	.			trans	-83.8	138.4	175.1	63.3	0	0	0	0	110	V204 K207	V204-S209 WeakPolarHBondContact CG1-O 3.4Å; K207-S209 PolarHBondContact O-N 3.28Å; K207-S209 VanDerWaalsContact O-N 3.09Å
210	T	57.7	Low	77.6	Confident	137 Å²	137	84.2 Å²	84.2	84%	0.84	43%	0.429	S	S	*	.	S	Bend	trans	-82.6	-20.1	-177.2	45.8	0	0	0	0	114.5
211	D	59	Low	77.6	Confident	124 Å²	124	84.8 Å²	84.8	66%	0.663	43%	0.432	S	S	*	.			trans	-120.3	132.7	-178.4	-74.8	-40.7	0	0	0	112.1	P213	D211-P213 VanDerWaalsContact O-CD 3.32Å; D211-P213 WeakPolarHBondContact O-CD 3.11Å
212	S	64.8	Low	77.6	Confident	55 Å²	55	84 Å²	84	39%	0.385	43%	0.432	S	S	.	.			trans	-97.7	101.1	159.2	-164.2	0	0	0	0	107.8	I214	S212-I214 PolarHBondContact O-N 2.99Å; S212-I214 VanDerWaalsContact O-N 3.12Å
213	P	71.6	Confident	77.6	Confident	38 Å²	38	85.5 Å²	85.5	25%	0.247	44%	0.438	C	S	.	.			trans	-79.5	12.4	179.9	34.4	-37.2	0	0	0	112.5	H176 V183 D211	H176-P213 VanDerWaalsContact CE1-CD 3.43Å; H176-P213 WeakPolarHBondContact CE1-CD 3.27Å; H176-P213 WeakPolarHBondContact CE1-CG 3.46Å; H176-P213 WeakPolarHBondContact ND1-CG 3.33Å; H176-P213 VanDerWaalsContact NE2-CD 3.31Å; H176-P213 WeakPolarHBondContact NE2-CD 3.43Å; H176-P213 WeakPolarHBondContact NE2-CG 3.26Å; V183-P213 PolarHBondContact N-O 3.33Å; D211-P213 VanDerWaalsContact O-CD 3.32Å; D211-P213 WeakPolarHBondContact O-CD 3.11Å
214	I	87.2	Confident	77.8	Confident	11 Å²	11	88.6 Å²	88.6	6%	0.056	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	105.9	169.6	-50	174.9	0	0	0	108.2	R173 H176 V183 A185 S212 H216	R173-I214 HydrophobicContact CB-CD1 4.31Å; R173-I214 HydrophobicContact CG-CD1 3.74Å; H176-I214 HydrophobicContact CB-CD1 3.93Å; H176-I214 HydrophobicContact CB-CG1 3.81Å; V183-I214 CarbonylContact O-C 3.56Å; V183-I214 VanDerWaalsContact O-CA 3.28Å; V183-I214 WeakPolarHBondContact O-CA 3.4Å; A185-I214 HydrophobicContact CB-CG2 4.13Å; S212-I214 PolarHBondContact O-N 2.99Å; S212-I214 VanDerWaalsContact O-N 3.12Å; I214-H216 WeakPolarHBondContact CG2-NE2 3.2Å
215	V	87.1	Confident	78	Confident	76 Å²	76	89.1 Å²	89.1	46%	0.461	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120	173.6	-178	0	0	0	0	108.4	V183 I184 A185 L217	V183-V215 PolarHBondContact O-N 2.91Å; I184-V215 CarbonylContact C-O 3.56Å; I184-V215 WeakPolarHBondContact CA-O 3.29Å; I184-V215 HydrophobicContact CG1-CB 4.32Å; A185-V215 PolarHBondContact N-O 3.29Å; V215-L217 HydrophobicContact CG1-CD2 3.97Å; V215-L217 HydrophobicContact CG1-CG 4.13Å
216	H	87.1	Confident	78.5	Confident	15 Å²	15	83.8 Å²	83.8	7%	0.069	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.3	179	-76	-79	0	0	0	110.7	V193 S196 R197 D200 I214	V193-H216 HydrophobicContact CG1-CB 3.75Å; S196-H216 PolarHBondContact OG-CE1 3.25Å; R197-H216 HydrophobicContact CG-CB 3.57Å; R197-H216 PolarHBondContact NH2-O 3.39Å; D200-H216 IonicContact OD2-CD2 3.11Å; D200-H216 IonicContact OD2-CE1 3.96Å; D200-H216 PolarHBondContact OD2-CE1 3.47Å; D200-H216 IonicContact OD2-NE2 3Å; D200-H216 PolarHBondContact OD2-NE2 3.36Å; I214-H216 WeakPolarHBondContact CG2-NE2 3.2Å
217	L	85.9	Confident	79.2	Confident	50 Å²	50	75.1 Å²	75.1	26%	0.262	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129	-179.6	-61.2	-179.5	0	0	0	111.3	I184 A185 V186 D187 V215 Q219 L230	I184-L217 HydrophobicContact CG2-CD1 3.48Å; I184-L217 VanDerWaalsContact CG2-CD1 3.48Å; I184-L217 HydrophobicContact CG2-CG 3.96Å; A185-L217 PolarHBondContact O-N 3.48Å; V186-L217 WeakPolarHBondContact CA-O 3.45Å; V186-L217 HydrophobicContact CG2-CB 4.39Å; D187-L217 PolarHBondContact N-O 3.44Å; D187-L217 VanDerWaalsContact N-O 3.14Å; V215-L217 HydrophobicContact CG1-CD2 3.97Å; V215-L217 HydrophobicContact CG1-CG 4.13Å; L217-Q219 PolarHBondContact O-N 2.65Å; L217-L230 HydrophobicContact CD1-CD1 4.47Å; L217-L230 HydrophobicContact CD1-CD2 3.4Å; L217-L230 VanDerWaalsContact CD1-CD2 3.4Å
218	V	88.4	Confident	79.9	Confident	62 Å²	62	72.2 Å²	72.2	38%	0.376	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	104.3	169.5	-176.4	0	0	0	0	107.3	D187 D190 V193	D187-V218 CarbonylContact O-C 3.51Å; D187-V218 VanDerWaalsContact O-CA 3.29Å; D187-V218 WeakPolarHBondContact O-CA 3.43Å; D190-V218 HydrophobicContact CB-CG1 3.98Å; D190-V218 HydrophobicContact CB-CG2 4.25Å; V193-V218 HydrophobicContact CB-CG2 3.69Å; V193-V218 HydrophobicContact CG1-CG2 3.7Å; V193-V218 HydrophobicContact CG2-CG2 3.93Å
219	Q	88	Confident	81.2	Confident	62 Å²	62	68.9 Å²	68.9	29%	0.29	38%	0.378	S	S	.	.			trans	-148.2	130.5	-179.5	-165.4	172.3	-19.7	0	0	111.1	V186 D187 L217 L221	V186-Q219 HydrophobicContact CG1-CB 3.87Å; D187-Q219 CarbonylContact C-O 3.44Å; D187-Q219 PolarHBondContact O-N 2.95Å; L217-Q219 PolarHBondContact O-N 2.65Å; Q219-L221 HydrophobicContact CB-CD2 4.28Å; Q219-L221 HydrophobicContact CG-CD2 3.98Å
220	R	88.1	Confident	82.4	Confident	185 Å²	185	68 Å²	68	70%	0.698	37%	0.369	S	S	*	.			trans	-84.7	115.8	167.3	-162.2	-172.5	174.5	79.7	-0.9	108.4	C188 T222	C188-R220 HydrophobicContact CB-CB 4.13Å; C188-R220 HydrophobicContact CB-CG 4.18Å; R220-T222 HydrophobicContact CG-CG2 3.9Å; R220-T222 PolarHBondContact O-N 3.43Å
221	L	86.3	Confident	83.4	Confident	20 Å²	20	62.3 Å²	62.3	11%	0.105	34%	0.335	C	S	.	.			trans	-84.3	95.4	-178.4	-54.1	-178.9	0	0	0	109.4	A164 V186 Q219 W226 L247 L251	A164-L221 HydrophobicContact CB-CD1 3.95Å; V186-L221 HydrophobicContact CG1-CD1 4.19Å; V186-L221 HydrophobicContact CG1-CD2 3.96Å; V186-L221 HydrophobicContact CG1-CG 4.22Å; Q219-L221 HydrophobicContact CB-CD2 4.28Å; Q219-L221 HydrophobicContact CG-CD2 3.98Å; L221-W226 HydrophobicContact CD1-CH2 3.73Å; L221-W226 HydrophobicContact CD1-CZ2 3.57Å; L221-W226 HydrophobicContact CD1-CZ3 4.29Å; L221-W226 HydrophobicContact CD2-CD2 3.5Å; L221-W226 HydrophobicContact CD2-CE3 3.73Å; L221-W226 HydrophobicContact CD2-CG 4.01Å; L221-W226 HydrophobicContact CD2-CH2 4.23Å; L221-W226 HydrophobicContact CD2-CZ2 4.04Å; L221-W226 HydrophobicContact CD2-CZ3 4.06Å; L221-W226 HydrophobicContact CG-CZ2 4.29Å; L221-L247 HydrophobicContact CB-CD1 4.12Å; L221-L247 HydrophobicContact CD1-CD1 3.8Å; L221-L247 HydrophobicContact CG-CD1 4.41Å; L221-L251 HydrophobicContact CD1-CD2 4.19Å
222	T	83.3	Confident	84.3	Confident	88 Å²	88	65.9 Å²	65.9	54%	0.54	35%	0.345	S	S	.	.			trans	-129.9	-28.5	179.8	55.4	0	0	0	0	113.9	R220 H250	R220-T222 HydrophobicContact CG-CG2 3.9Å; R220-T222 PolarHBondContact O-N 3.43Å; T222-H250 PolarHBondContact O-CE1 3.06Å
223	K	84.1	Confident	85.3	Confident	170 Å²	170	68 Å²	68	74%	0.739	36%	0.36	S	S	*	.	S	Bend	trans	-99.1	148.5	178.6	-64.9	-174.3	178.9	-176.7	0	109.9	H250	K223-H250 PolarHBondContact O-CE1 3.33Å; K223-H250 PolarHBondContact O-NE2 3.43Å
224	Q	85.4	Confident	86.3	Confident	109 Å²	109	68.4 Å²	68.4	51%	0.509	36%	0.358	S	S	.	.	S	Bend	trans	-76.1	161.4	175.1	-73.6	-178.4	-17	0	0	112.5	E254	Q224-E254 WeakPolarHBondContact CA-OE1 3.19Å; Q224-E254 WeakPolarHBondContact CB-OE1 3.45Å; Q224-E254 WeakPolarHBondContact CG-OE1 3.3Å
225	G	85.3	Confident	86.6	Confident	37 Å²	37	69.5 Å²	69.5	38%	0.381	37%	0.366	S	S	.	.	S	Bend	trans	79.4	14	174.4	0	0	0	0	0	114.3	E254	G225-E254 VanDerWaalsContact N-CD 3.33Å; G225-E254 PolarHBondContact N-OE1 3.28Å; G225-E254 PolarHBondContact N-OE2 3.36Å; G225-E254 VanDerWaalsContact N-OE2 3.08Å
226	W	89.2	Confident	87	Confident	12 Å²	12	65.9 Å²	65.9	5%	0.045	34%	0.344	C	S	.	.	H	α-helix	trans	-75.9	-29.6	177.3	62.5	-83.2	0	0	0	111.5	V162 V186 L221 D228 S229 L230 L238 H250 L251 E254	V162-W226 HydrophobicContact CG1-CH2 3.85Å; V162-W226 HydrophobicContact CG1-CZ3 3.77Å; V186-W226 HydrophobicContact CG2-CZ3 4.43Å; L221-W226 HydrophobicContact CD1-CH2 3.73Å; L221-W226 HydrophobicContact CD1-CZ2 3.57Å; L221-W226 HydrophobicContact CD1-CZ3 4.29Å; L221-W226 HydrophobicContact CD2-CD2 3.5Å; L221-W226 HydrophobicContact CD2-CE3 3.73Å; L221-W226 HydrophobicContact CD2-CG 4.01Å; L221-W226 HydrophobicContact CD2-CH2 4.23Å; L221-W226 HydrophobicContact CD2-CZ2 4.04Å; L221-W226 HydrophobicContact CD2-CZ3 4.06Å; L221-W226 HydrophobicContact CG-CZ2 4.29Å; W226-D228 PolarHBondContact O-N 3.19Å; W226-S229 WeakPolarHBondContact O-CB 3.35Å; W226-S229 PolarHBondContact O-N 3.01Å; W226-S229 PolarHBondContact O-OG 3.17Å; W226-L230 HydrophobicContact CE3-CD1 3.61Å; W226-L230 HydrophobicContact CE3-CG 4.17Å; W226-L230 HydrophobicContact CZ3-CD1 3.45Å; W226-L230 VanDerWaalsContact CZ3-CD1 3.45Å; W226-L230 HydrophobicContact CZ3-CG 4.46Å; W226-L238 HydrophobicContact CH2-CD1 3.84Å; W226-L238 HydrophobicContact CZ2-CD1 4.39Å; W226-H250 AromaticContact CD1-NE2 3.47Å; W226-H250 AromaticContact NE1-CD2 3.29Å; W226-H250 PolarHBondContact NE1-CD2 2.82Å; W226-H250 VanDerWaalsContact NE1-CD2 3.29Å; W226-H250 AromaticContact NE1-NE2 3.18Å; W226-H250 PolarHBondContact NE1-NE2 3.46Å; W226-H250 VanDerWaalsContact NE1-NE2 3.18Å; W226-L251 HydrophobicContact CH2-CD2 4.5Å; W226-L251 HydrophobicContact CZ2-CD2 4.06Å; W226-E254 VanDerWaalsContact CD1-CD 3.49Å; W226-E254 HydrophobicContact CZ2-CG 4.21Å; W226-E254 PolarHBondContact N-OE2 2.87Å; W226-E254 VanDerWaalsContact N-OE2 3.16Å; W226-E254 PolarHBondContact NE1-OE2 2.91Å
227	L	90.8	Very high	87.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-44.4	-173.6	-173.9	59.3	0	0	0	112.5	V162 S229 L230 L236 L238 E254 C261	V162-L227 HydrophobicContact CB-CD1 4.08Å; V162-L227 HydrophobicContact CG1-CD1 4.03Å; V162-L227 HydrophobicContact CG2-CD1 3.74Å; L227-S229 PolarHBondContact O-N 2.71Å; L227-L230 WeakPolarHBondContact O-CB 3.44Å; L227-L230 PolarHBondContact O-N 3.41Å; L227-L236 HydrophobicContact CD1-CD1 3.91Å; L227-L236 HydrophobicContact CD2-CD1 4.44Å; L227-L236 HydrophobicContact CG-CD1 3.72Å; L227-L238 HydrophobicContact CD1-CD1 4.24Å; L227-L238 HydrophobicContact CD2-CD2 4.2Å; L227-E254 PolarHBondContact N-OE2 3.21Å; L227-C261 HydrophobicContact CD2-CB 3.63Å
228	D	87.7	Confident	88.1	Confident	56 Å²	56	62.8 Å²	62.8	30%	0.299	33%	0.328	S	S	.	.	H	α-helix	trans	-69.8	-23.1	-179.7	-66.5	-36.8	0	0	0	112.6	W226 L230 S231 S258 R260	W226-D228 PolarHBondContact O-N 3.19Å; D228-L230 PolarHBondContact O-N 3.46Å; D228-S231 VanDerWaalsContact O-O 3.06Å; D228-S258 WeakPolarHBondContact OD1-CB 3.07Å; D228-S258 PolarHBondContact OD1-OG 3.29Å; D228-R260 PolarHBondContact O-NH1 2.91Å
229	S	88.5	Confident	88.5	Confident	88 Å²	88	59.8 Å²	59.8	62%	0.615	31%	0.31	S	S	*	.	H	α-helix	trans	-71.1	-18.2	176	77.9	0	0	0	0	113.7	W226 L227 S231	W226-S229 WeakPolarHBondContact O-CB 3.35Å; W226-S229 PolarHBondContact O-N 3.01Å; W226-S229 PolarHBondContact O-OG 3.17Å; L227-S229 PolarHBondContact O-N 2.71Å; S229-S231 VanDerWaalsContact C-N 3.28Å; S229-S231 PolarHBondContact O-N 3.11Å
230	L	85.8	Confident	88.9	Confident	33 Å²	33	56.9 Å²	56.9	17%	0.173	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.4	-173.5	-65.2	-171.9	0	0	0	114.2	V162 I184 V186 L217 W226 L227 D228	V162-L230 HydrophobicContact CG1-CD1 4.09Å; V162-L230 HydrophobicContact CG2-CD1 4.4Å; I184-L230 HydrophobicContact CD1-CB 3.88Å; I184-L230 HydrophobicContact CG2-CD1 4.16Å; V186-L230 HydrophobicContact CG2-CD1 4.37Å; L217-L230 HydrophobicContact CD1-CD1 4.47Å; L217-L230 HydrophobicContact CD1-CD2 3.4Å; L217-L230 VanDerWaalsContact CD1-CD2 3.4Å; W226-L230 HydrophobicContact CE3-CD1 3.61Å; W226-L230 HydrophobicContact CE3-CG 4.17Å; W226-L230 HydrophobicContact CZ3-CD1 3.45Å; W226-L230 VanDerWaalsContact CZ3-CD1 3.45Å; W226-L230 HydrophobicContact CZ3-CG 4.46Å; L227-L230 WeakPolarHBondContact O-CB 3.44Å; L227-L230 PolarHBondContact O-N 3.41Å; D228-L230 PolarHBondContact O-N 3.46Å
231	S	78.6	Confident	89.2	Confident	18 Å²	18	49.2 Å²	49.2	13%	0.126	27%	0.27	C	S	.	.			trans	-159.1	164.5	-168.5	49.4	0	0	0	0	111.1	D228 S229 E234 R260	D228-S231 VanDerWaalsContact O-O 3.06Å; S229-S231 VanDerWaalsContact C-N 3.28Å; S229-S231 PolarHBondContact O-N 3.11Å; S231-E234 VanDerWaalsContact CB-CD 3.44Å; S231-E234 WeakPolarHBondContact CB-OE1 3.29Å; S231-E234 WeakPolarHBondContact CB-OE2 3.34Å; S231-R260 VanDerWaalsContact C-NH1 3.31Å; S231-R260 PolarHBondContact O-NH1 3.02Å; S231-R260 PolarHBondContact OG-NH1 3.05Å; S231-R260 VanDerWaalsContact OG-NH1 3.16Å; S231-R260 PolarHBondContact OG-NH2 3.46Å
232	K	77.4	Confident	89.3	Confident	198 Å²	198	50.3 Å²	50.3	86%	0.861	27%	0.274	S	S	*	.	S	Bend	trans	-89.5	-47.4	-168.6	-66.8	-175.8	-179.9	-178.9	0	113.4	E234	K232-E234 PolarHBondContact N-OE2 2.9Å
233	S	85.9	Confident	89.5	Confident	101 Å²	101	46.2 Å²	46.2	71%	0.706	25%	0.249	S	C	*	.	S	Bend	trans	-160.9	-10.3	-176.9	57.3	0	0	0	0	114.8	R260	S233-R260 VanDerWaalsContact C-NH2 3.33Å; S233-R260 VanDerWaalsContact N-NH2 3.17Å
234	E	91.5	Very high	89.7	Confident	46 Å²	46	40.9 Å²	40.9	22%	0.215	23%	0.233	C	C	.	.	S	Bend	trans	-68.3	156.3	-176.4	73.1	-86.5	-156.4	0	0	112.8	T160 S231 K232 R260	T160-E234 PolarHBondContact OG1-OE1 3.02Å; S231-E234 VanDerWaalsContact CB-CD 3.44Å; S231-E234 WeakPolarHBondContact CB-OE1 3.29Å; S231-E234 WeakPolarHBondContact CB-OE2 3.34Å; K232-E234 PolarHBondContact N-OE2 2.9Å; E234-R260 PolarHBondContact O-NE 2.89Å; E234-R260 PolarHBondContact O-NH2 2.66Å; E234-R260 IonicContact OE2-NH2 3.55Å; E234-R260 PolarHBondContact OE2-NH2 2.99Å
235	P	94.4	Very high	89.7	Confident	33 Å²	33	35.7 Å²	35.7	21%	0.214	21%	0.208	C	C	.	.			trans	-61.1	146.9	171.6	-21.2	32.6	0	0	0	112	M155 G159 T160 K262	M155-P235 WeakPolarHBondContact O-CB 3.24Å; M155-P235 VanDerWaalsContact O-CG 3.25Å; M155-P235 WeakPolarHBondContact O-CG 3.29Å; G159-P235 CarbonylContact C-O 3.52Å; G159-P235 WeakPolarHBondContact CA-O 3.48Å; T160-P235 PolarHBondContact N-O 3.39Å; P235-K262 HydrophobicContact CB-CG 4.21Å
236	L	95.9	Very high	90	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	141.9	179.4	-61.2	175.5	0	0	0	111.3	T160 V162 L227 R260 C261 K262	T160-L236 HydrophobicContact CG2-CD2 4.48Å; T160-L236 WeakPolarHBondContact O-CA 3.33Å; V162-L236 HydrophobicContact CG2-CD2 4.25Å; L227-L236 HydrophobicContact CD1-CD1 3.91Å; L227-L236 HydrophobicContact CD2-CD1 4.44Å; L227-L236 HydrophobicContact CG-CD1 3.72Å; L236-R260 HydrophobicContact CD1-CB 4.34Å; L236-R260 HydrophobicContact CG-CB 4.45Å; L236-R260 PolarHBondContact N-O 3.13Å; L236-C261 HydrophobicContact CB-CB 4.43Å; L236-C261 CarbonylContact O-C 3.51Å; L236-C261 WeakPolarHBondContact O-CA 3.25Å; L236-K262 PolarHBondContact O-N 3.19Å
237	A	97.2	Very high	90.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118	164.4	0	0	0	0	0	109	F150 L156 T160 V161 V162 L263	F150-A237 HydrophobicContact CE2-CB 3.55Å; F150-A237 HydrophobicContact CZ-CB 3.7Å; L156-A237 HydrophobicContact CD2-CB 4.31Å; T160-A237 PolarHBondContact O-N 3.19Å; V161-A237 CarbonylContact C-O 3.58Å; V161-A237 WeakPolarHBondContact CA-O 3.45Å; V162-A237 PolarHBondContact N-O 3.24Å; A237-L263 CarbonylContact C-O 3.54Å; A237-L263 WeakPolarHBondContact CA-O 3.22Å; A237-L263 HydrophobicContact CB-CB 4.08Å; A237-L263 HydrophobicContact CB-CD2 4.15Å; A237-L263 HydrophobicContact CB-CG 4.41Å
238	L	97.8	Very high	90.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.7	179.3	-174.2	60.1	0	0	0	110.1	V162 A164 W226 L227 L251 E254 C261 L263 L264 L265	V162-L238 HydrophobicContact CB-CD1 3.86Å; V162-L238 HydrophobicContact CG1-CD1 3.74Å; A164-L238 HydrophobicContact CB-CD1 4.28Å; W226-L238 HydrophobicContact CH2-CD1 3.84Å; W226-L238 HydrophobicContact CZ2-CD1 4.39Å; L227-L238 HydrophobicContact CD1-CD1 4.24Å; L227-L238 HydrophobicContact CD2-CD2 4.2Å; L238-L251 HydrophobicContact CD1-CD2 4.08Å; L238-L251 HydrophobicContact CD2-CB 3.79Å; L238-L251 HydrophobicContact CD2-CD2 3.98Å; L238-L251 HydrophobicContact CD2-CG 4.37Å; L238-L251 WeakPolarHBondContact CD2-O 3.42Å; L238-L251 HydrophobicContact CG-CB 4.35Å; L238-L251 HydrophobicContact CG-CD2 4.23Å; L238-E254 HydrophobicContact CD2-CB 4.38Å; L238-C261 VanDerWaalsContact CB-SG 3.54Å; L238-L263 PolarHBondContact N-O 2.95Å; L238-L264 HydrophobicContact CB-CD1 4.19Å; L238-L264 HydrophobicContact CD2-CD1 4.13Å; L238-L264 HydrophobicContact CG-CD1 4.12Å; L238-L264 CarbonylContact O-C 3.54Å; L238-L264 VanDerWaalsContact O-CA 3.29Å; L238-L264 WeakPolarHBondContact O-CA 3.37Å; L238-L265 PolarHBondContact O-N 3.07Å
239	I	98	Very high	90.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.1	-179.8	73.4	175.2	0	0	0	110.9	V146 V161 V162 D163 A164 L171 L175 L265	V146-I239 HydrophobicContact CG2-CD1 4.38Å; V146-I239 HydrophobicContact CG2-CG2 3.94Å; V161-I239 HydrophobicContact CG1-CD1 3.68Å; V161-I239 HydrophobicContact CG1-CG1 3.97Å; V161-I239 HydrophobicContact CG1-CG2 4.12Å; V162-I239 PolarHBondContact O-N 3.44Å; D163-I239 HydrophobicContact CB-CD1 4.03Å; D163-I239 HydrophobicContact CB-CG1 3.94Å; A164-I239 PolarHBondContact N-O 2.75Å; L171-I239 HydrophobicContact CD2-CD1 3.63Å; L171-I239 HydrophobicContact CG-CD1 4.12Å; L175-I239 HydrophobicContact CD1-CD1 3.69Å; I239-L265 CarbonylContact C-O 3.52Å; I239-L265 VanDerWaalsContact CA-O 3.31Å; I239-L265 WeakPolarHBondContact CA-O 3.41Å; I239-L265 HydrophobicContact CB-CB 4.45Å; I239-L265 HydrophobicContact CG2-CB 4.05Å; I239-L265 HydrophobicContact CG2-CD1 4.07Å
240	G	96.4	Very high	90.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	95.5	178	0	0	0	0	0	111.2	H242 L265 V267	G240-H242 PolarHBondContact O-N 2.96Å; G240-L265 PolarHBondContact N-O 3.45Å; G240-V267 PolarHBondContact O-N 3.41Å
241	L	94.7	Very high	91.4	Very high	25 Å²	25	34.3 Å²	34.3	13%	0.131	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	107	176	-179.1	59.1	0	0	0	110.2	Q138 I139 L142 L171 V267 F436	Q138-L241 HydrophobicContact CB-CD1 4.14Å; Q138-L241 HydrophobicContact CB-CD2 3.98Å; I139-L241 HydrophobicContact CG1-CD2 4.12Å; L142-L241 HydrophobicContact CD2-CB 3.77Å; L142-L241 HydrophobicContact CD2-CD1 3.95Å; L142-L241 HydrophobicContact CD2-CD2 4.41Å; L142-L241 HydrophobicContact CD2-CG 4.23Å; L171-L241 HydrophobicContact CD2-CB 4.25Å; L171-L241 HydrophobicContact CD2-CD2 4.36Å; L241-V267 HydrophobicContact CD1-CB 4.48Å; L241-V267 HydrophobicContact CD1-CG2 4.41Å; L241-F436 HydrophobicContact CD1-CE2 3.94Å; L241-F436 HydrophobicContact CD1-CZ 3.83Å
242	H	88.1	Confident	92.2	Very high	42 Å²	42	33.4 Å²	33.4	19%	0.194	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	65.1	41.7	-173.4	-59.7	-178.1	0	0	0	113.4	Q138 G240 C244 V267 C269 C441	Q138-H242 VanDerWaalsContact CD-CE1 3.4Å; Q138-H242 VanDerWaalsContact CD-NE2 3.35Å; Q138-H242 PolarHBondContact NE2-CE1 3.4Å; Q138-H242 PolarHBondContact NE2-NE2 3.31Å; Q138-H242 PolarHBondContact OE1-CE1 3.14Å; Q138-H242 PolarHBondContact OE1-NE2 2.99Å; G240-H242 PolarHBondContact O-N 2.96Å; H242-C244 PolarHBondContact O-N 2.63Å; H242-V267 CarbonylContact C-O 3.5Å; H242-V267 WeakPolarHBondContact CA-O 3.47Å; H242-V267 PolarHBondContact N-O 3.06Å; H242-C269 HydrophobicContact CB-CB 3.95Å; H242-C269 PolarHBondContact O-SG 2.83Å; H242-C441 PolarHBondContact NE2-SG 3.15Å; H242-C441 VanDerWaalsContact NE2-SG 3.36Å
243	A	86.2	Confident	93.1	Very high	2 Å²	2	27.1 Å²	27.1	2%	0.017	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	113	172	0	0	0	0	0	110.1	L247 S248 L251 V267	A243-L247 HydrophobicContact CB-CB 4.33Å; A243-L247 HydrophobicContact CB-CD2 4.03Å; A243-L247 HydrophobicContact CB-CG 3.94Å; A243-S248 WeakPolarHBondContact O-CB 3.46Å; A243-L251 HydrophobicContact CB-CD1 4.11Å; A243-V267 PolarHBondContact N-O 3.34Å
244	C	88.2	Confident	93.6	Very high	59 Å²	59	22.3 Å²	22.3	40%	0.399	11%	0.112	S	C	.	.			trans	-75.1	128.9	-175	-66.5	0	0	0	0	111.7	H242 H246 L247 C269 C270	H242-C244 PolarHBondContact O-N 2.63Å; C244-H246 PolarHBondContact O-N 3Å; C244-L247 WeakPolarHBondContact O-CB 3.28Å; C244-L247 PolarHBondContact O-N 3.1Å; C244-C269 PolarHBondContact SG-SG 3.32Å; C244-C270 HydrophobicContact CB-CB 4.04Å
245	G	87.2	Confident	93.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	-122.4	169.2	0	0	0	0	0	113.9	L247 S248 C270 L274	G245-L247 PolarHBondContact O-N 2.9Å; G245-L247 VanDerWaalsContact O-N 3.13Å; G245-S248 PolarHBondContact O-N 3.39Å; G245-S248 PolarHBondContact O-OG 3.31Å; G245-C270 VanDerWaalsContact CA-O 3.3Å; G245-C270 WeakPolarHBondContact CA-O 3.33Å; G245-C270 PolarHBondContact N-O 3.3Å; G245-L274 WeakPolarHBondContact O-CD2 3.35Å
246	H	89.8	Confident	93.9	Very high	101 Å²	101	19.8 Å²	19.8	47%	0.468	10%	0.099	S	C	.	.	H	α-helix	trans	-53.3	-28.2	179	-64	-56.6	0	0	0	115.1	C244 S248 E249 H250 H273	C244-H246 PolarHBondContact O-N 3Å; H246-S248 VanDerWaalsContact C-N 3.33Å; H246-S248 PolarHBondContact O-N 3.19Å; H246-E249 IonicContact ND1-OE2 2.66Å; H246-E249 PolarHBondContact O-N 3.2Å; H246-H250 WeakPolarHBondContact O-CB 3.44Å; H246-H250 PolarHBondContact O-N 3.26Å; H246-H273 PolarHBondContact CD2-O 2.83Å; H246-H273 PolarHBondContact CE1-O 2.93Å; H246-H273 PolarHBondContact NE2-O 3.44Å
247	L	92.9	Very high	93.8	Very high	42 Å²	42	23.3 Å²	23.3	22%	0.22	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-47.6	174.6	179.5	61	0	0	0	110	L221 A243 C244 G245 E249 H250 L251	L221-L247 HydrophobicContact CB-CD1 4.12Å; L221-L247 HydrophobicContact CD1-CD1 3.8Å; L221-L247 HydrophobicContact CG-CD1 4.41Å; A243-L247 HydrophobicContact CB-CB 4.33Å; A243-L247 HydrophobicContact CB-CD2 4.03Å; A243-L247 HydrophobicContact CB-CG 3.94Å; C244-L247 WeakPolarHBondContact O-CB 3.28Å; C244-L247 PolarHBondContact O-N 3.1Å; G245-L247 PolarHBondContact O-N 2.9Å; G245-L247 VanDerWaalsContact O-N 3.13Å; L247-E249 VanDerWaalsContact C-N 3.31Å; L247-E249 PolarHBondContact O-N 2.58Å; L247-H250 PolarHBondContact O-N 2.93Å; L247-H250 VanDerWaalsContact O-N 3.1Å; L247-L251 HydrophobicContact CD1-CD2 4.11Å; L247-L251 HydrophobicContact CD1-CG 4.39Å; L247-L251 WeakPolarHBondContact O-CG 3.22Å; L247-L251 PolarHBondContact O-N 2.83Å
248	S	93.7	Very high	93.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.5	-38.4	-180	64.6	0	0	0	0	112.9	A243 G245 H246 I252 R419	A243-S248 WeakPolarHBondContact O-CB 3.46Å; G245-S248 PolarHBondContact O-N 3.39Å; G245-S248 PolarHBondContact O-OG 3.31Å; H246-S248 VanDerWaalsContact C-N 3.33Å; H246-S248 PolarHBondContact O-N 3.19Å; S248-I252 WeakPolarHBondContact O-CD1 3.5Å; S248-I252 VanDerWaalsContact O-CG1 3.3Å; S248-I252 WeakPolarHBondContact O-CG1 3.48Å; S248-I252 PolarHBondContact O-N 3.38Å; S248-R419 PolarHBondContact OG-NH1 3.47Å; S248-R419 PolarHBondContact OG-NH2 3.45Å
249	E	93.7	Very high	93.4	Very high	35 Å²	35	29.2 Å²	29.2	16%	0.164	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-45	172.7	165.3	174.8	-176.6	0	0	111.4	H246 L247 L251 I252 R253 L284	H246-E249 IonicContact ND1-OE2 2.66Å; H246-E249 PolarHBondContact O-N 3.2Å; L247-E249 VanDerWaalsContact C-N 3.31Å; L247-E249 PolarHBondContact O-N 2.58Å; E249-L251 VanDerWaalsContact C-N 3.33Å; E249-L251 PolarHBondContact O-N 3.11Å; E249-I252 WeakPolarHBondContact O-CB 3.17Å; E249-I252 PolarHBondContact O-N 3.32Å; E249-I252 VanDerWaalsContact O-N 3.17Å; E249-R253 HydrophobicContact CG-CG 4.48Å; E249-R253 WeakPolarHBondContact O-CG 3.5Å; E249-R253 PolarHBondContact O-N 3.3Å; E249-R253 IonicContact OE1-CZ 2.96Å; E249-R253 IonicContact OE1-NE 3.16Å; E249-R253 PolarHBondContact OE1-NE 2.84Å; E249-R253 IonicContact OE1-NH2 2.71Å; E249-R253 PolarHBondContact OE1-NH2 3.05Å; E249-L284 HydrophobicContact CG-CD1 4.23Å; E249-L284 HydrophobicContact CG-CD2 3.67Å; E249-L284 VanDerWaalsContact OE1-CD2 3.3Å; E249-L284 WeakPolarHBondContact OE1-CD2 3.16Å
250	H	94	Very high	93.1	Very high	18 Å²	18	31.2 Å²	31.2	8%	0.083	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-41.6	-179.3	-158.8	69	0	0	0	111.7	T222 K223 W226 H246 L247 I252 R253 E254	T222-H250 PolarHBondContact O-CE1 3.06Å; K223-H250 PolarHBondContact O-CE1 3.33Å; K223-H250 PolarHBondContact O-NE2 3.43Å; W226-H250 AromaticContact CD1-NE2 3.47Å; W226-H250 AromaticContact NE1-CD2 3.29Å; W226-H250 PolarHBondContact NE1-CD2 2.82Å; W226-H250 VanDerWaalsContact NE1-CD2 3.29Å; W226-H250 AromaticContact NE1-NE2 3.18Å; W226-H250 PolarHBondContact NE1-NE2 3.46Å; W226-H250 VanDerWaalsContact NE1-NE2 3.18Å; H246-H250 WeakPolarHBondContact O-CB 3.44Å; H246-H250 PolarHBondContact O-N 3.26Å; L247-H250 PolarHBondContact O-N 2.93Å; L247-H250 VanDerWaalsContact O-N 3.1Å; H250-I252 VanDerWaalsContact C-N 3.31Å; H250-I252 PolarHBondContact O-N 3.14Å; H250-R253 PolarHBondContact O-N 3.17Å; H250-E254 WeakPolarHBondContact O-CB 3.5Å; H250-E254 VanDerWaalsContact O-CG 3.24Å; H250-E254 WeakPolarHBondContact O-CG 3.33Å; H250-E254 PolarHBondContact O-N 3.2Å
251	L	97	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-40.8	175.3	-57.8	-172.7	0	0	0	112.2	A164 L221 W226 L238 A243 L247 E249 E254 F255 L264	A164-L251 HydrophobicContact CB-CD1 3.87Å; A164-L251 HydrophobicContact CB-CD2 3.43Å; A164-L251 VanDerWaalsContact CB-CD2 3.43Å; A164-L251 HydrophobicContact CB-CG 4.27Å; L221-L251 HydrophobicContact CD1-CD2 4.19Å; W226-L251 HydrophobicContact CH2-CD2 4.5Å; W226-L251 HydrophobicContact CZ2-CD2 4.06Å; L238-L251 HydrophobicContact CD1-CD2 4.08Å; L238-L251 HydrophobicContact CD2-CB 3.79Å; L238-L251 HydrophobicContact CD2-CD2 3.98Å; L238-L251 HydrophobicContact CD2-CG 4.37Å; L238-L251 WeakPolarHBondContact CD2-O 3.42Å; L238-L251 HydrophobicContact CG-CB 4.35Å; L238-L251 HydrophobicContact CG-CD2 4.23Å; A243-L251 HydrophobicContact CB-CD1 4.11Å; L247-L251 HydrophobicContact CD1-CD2 4.11Å; L247-L251 HydrophobicContact CD1-CG 4.39Å; L247-L251 WeakPolarHBondContact O-CG 3.22Å; L247-L251 PolarHBondContact O-N 2.83Å; E249-L251 VanDerWaalsContact C-N 3.33Å; E249-L251 PolarHBondContact O-N 3.11Å; L251-E254 PolarHBondContact O-N 3.24Å; L251-F255 WeakPolarHBondContact O-CB 3.22Å; L251-F255 PolarHBondContact O-N 2.99Å; L251-L264 HydrophobicContact CB-CD1 4.2Å
252	I	96.9	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-46.1	177.9	-71.2	162.2	0	0	0	110.5	S248 E249 H250 F255 V256 L264 L284 R419 F422 L423 L447	S248-I252 WeakPolarHBondContact O-CD1 3.5Å; S248-I252 VanDerWaalsContact O-CG1 3.3Å; S248-I252 WeakPolarHBondContact O-CG1 3.48Å; S248-I252 PolarHBondContact O-N 3.38Å; E249-I252 WeakPolarHBondContact O-CB 3.17Å; E249-I252 PolarHBondContact O-N 3.32Å; E249-I252 VanDerWaalsContact O-N 3.17Å; H250-I252 VanDerWaalsContact C-N 3.31Å; H250-I252 PolarHBondContact O-N 3.14Å; I252-F255 PolarHBondContact O-N 3.08Å; I252-V256 PolarHBondContact O-N 2.91Å; I252-V256 VanDerWaalsContact O-N 3.13Å; I252-L264 HydrophobicContact CB-CD2 4.46Å; I252-L264 HydrophobicContact CG1-CD2 3.84Å; I252-L284 HydrophobicContact CB-CD1 4.38Å; I252-L284 HydrophobicContact CD1-CD1 4.34Å; I252-L284 HydrophobicContact CG2-CD1 3.89Å; I252-R419 HydrophobicContact CD1-CB 3.85Å; I252-R419 HydrophobicContact CD1-CG 3.69Å; I252-F422 HydrophobicContact CG2-CD1 3.45Å; I252-F422 VanDerWaalsContact CG2-CD1 3.45Å; I252-F422 HydrophobicContact CG2-CE1 3.7Å; I252-L423 HydrophobicContact CG2-CD2 3.84Å; I252-L423 HydrophobicContact CG2-CG 4.27Å; I252-L447 HydrophobicContact CD1-CD2 3.87Å; I252-L447 HydrophobicContact CG1-CD2 4.19Å
253	R	96	Very high	93.5	Very high	65 Å²	65	30.8 Å²	30.8	25%	0.245	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-43.1	177.9	-69	-179.8	-179.1	-77.4	5.1	112	E249 H250 V256 V257	E249-R253 HydrophobicContact CG-CG 4.48Å; E249-R253 WeakPolarHBondContact O-CG 3.5Å; E249-R253 PolarHBondContact O-N 3.3Å; E249-R253 IonicContact OE1-CZ 2.96Å; E249-R253 IonicContact OE1-NE 3.16Å; E249-R253 PolarHBondContact OE1-NE 2.84Å; E249-R253 IonicContact OE1-NH2 2.71Å; E249-R253 PolarHBondContact OE1-NH2 3.05Å; H250-R253 PolarHBondContact O-N 3.17Å; R253-V256 PolarHBondContact O-N 3.06Å; R253-V257 WeakPolarHBondContact O-CG2 3.12Å; R253-V257 PolarHBondContact O-N 2.75Å
254	E	95.8	Very high	94.1	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-40.4	177.7	-74	-67.3	106.7	0	0	113	Q224 G225 W226 L227 L238 H250 L251 V256 V257 S258	Q224-E254 WeakPolarHBondContact CA-OE1 3.19Å; Q224-E254 WeakPolarHBondContact CB-OE1 3.45Å; Q224-E254 WeakPolarHBondContact CG-OE1 3.3Å; G225-E254 VanDerWaalsContact N-CD 3.33Å; G225-E254 PolarHBondContact N-OE1 3.28Å; G225-E254 PolarHBondContact N-OE2 3.36Å; G225-E254 VanDerWaalsContact N-OE2 3.08Å; W226-E254 VanDerWaalsContact CD1-CD 3.49Å; W226-E254 HydrophobicContact CZ2-CG 4.21Å; W226-E254 PolarHBondContact N-OE2 2.87Å; W226-E254 VanDerWaalsContact N-OE2 3.16Å; W226-E254 PolarHBondContact NE1-OE2 2.91Å; L227-E254 PolarHBondContact N-OE2 3.21Å; L238-E254 HydrophobicContact CD2-CB 4.38Å; H250-E254 WeakPolarHBondContact O-CB 3.5Å; H250-E254 VanDerWaalsContact O-CG 3.24Å; H250-E254 WeakPolarHBondContact O-CG 3.33Å; H250-E254 PolarHBondContact O-N 3.2Å; L251-E254 PolarHBondContact O-N 3.24Å; E254-V256 VanDerWaalsContact C-N 3.27Å; E254-V256 PolarHBondContact O-N 3.39Å; E254-V257 PolarHBondContact O-N 2.9Å; E254-S258 WeakPolarHBondContact O-CB 3.46Å; E254-S258 PolarHBondContact O-N 3.24Å
255	F	97.2	Very high	94.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.1	-43.9	173.5	167.2	-101.9	0	0	0	110.9	L251 I252 C261 L264 L423 S428 K451	L251-F255 WeakPolarHBondContact O-CB 3.22Å; L251-F255 PolarHBondContact O-N 2.99Å; I252-F255 PolarHBondContact O-N 3.08Å; F255-C261 HydrophobicContact CD2-CB 4.05Å; F255-L264 HydrophobicContact CB-CB 4.13Å; F255-L264 HydrophobicContact CB-CD1 4.37Å; F255-L264 HydrophobicContact CB-CD2 4.07Å; F255-L264 HydrophobicContact CB-CG 4.43Å; F255-L264 HydrophobicContact CD1-CB 4.11Å; F255-L264 HydrophobicContact CD1-CD2 4.1Å; F255-L264 HydrophobicContact CD2-CB 3.61Å; F255-L264 HydrophobicContact CE1-CB 4.41Å; F255-L264 HydrophobicContact CE2-CB 3.96Å; F255-L264 HydrophobicContact CG-CB 3.67Å; F255-L264 HydrophobicContact CG-CD2 4.09Å; F255-L264 HydrophobicContact CG-CG 4.39Å; F255-L264 HydrophobicContact CZ-CB 4.34Å; F255-L423 HydrophobicContact CD1-CD2 3.47Å; F255-L423 VanDerWaalsContact CD1-CD2 3.47Å; F255-L423 HydrophobicContact CE1-CD2 3.73Å; F255-S428 VanDerWaalsContact CE1-OG 3.27Å; F255-S428 WeakPolarHBondContact CE1-OG 3.47Å; F255-K451 HydrophobicContact CE1-CG 4.27Å; F255-K451 HydrophobicContact CE2-CG 3.96Å; F255-K451 HydrophobicContact CZ-CD 4.45Å; F255-K451 HydrophobicContact CZ-CG 3.6Å; F255-K451 WeakPolarHBondContact O-CE 3.38Å; F255-K451 PolarHBondContact O-NZ 3.41Å
256	V	95.7	Very high	95	Very high	25 Å²	25	28 Å²	28	15%	0.152	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-47.8	176.8	166.2	0	0	0	0	111.4	I252 R253 E254 F422 L423 N426 K451	I252-V256 PolarHBondContact O-N 2.91Å; I252-V256 VanDerWaalsContact O-N 3.13Å; R253-V256 PolarHBondContact O-N 3.06Å; E254-V256 VanDerWaalsContact C-N 3.27Å; E254-V256 PolarHBondContact O-N 3.39Å; V256-F422 HydrophobicContact CB-CE1 4.24Å; V256-F422 HydrophobicContact CG2-CD1 4.23Å; V256-F422 HydrophobicContact CG2-CE1 3.57Å; V256-F422 HydrophobicContact CG2-CZ 4.2Å; V256-L423 HydrophobicContact CG2-CD2 3.79Å; V256-N426 HydrophobicContact CB-CB 4.45Å; V256-N426 HydrophobicContact CG1-CB 3.66Å; V256-N426 HydrophobicContact CG2-CB 3.93Å; V256-K451 PolarHBondContact O-NZ 2.9Å
257	V	94	Very high	95.3	Very high	74 Å²	74	23.2 Å²	23.2	45%	0.448	12%	0.115	S	C	.	.	H	α-helix	trans	-71.7	-38.1	-175.4	173.5	0	0	0	0	113.2	R253 E254 D259	R253-V257 WeakPolarHBondContact O-CG2 3.12Å; R253-V257 PolarHBondContact O-N 2.75Å; E254-V257 PolarHBondContact O-N 2.9Å; V257-D259 PolarHBondContact O-N 3.45Å
258	S	93.8	Very high	95.4	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.007	11%	0.105	C	C	.	.			trans	-80.8	112.5	-177.5	171	0	0	0	0	111	D228 E254 R260 C261 K451	D228-S258 WeakPolarHBondContact OD1-CB 3.07Å; D228-S258 PolarHBondContact OD1-OG 3.29Å; E254-S258 WeakPolarHBondContact O-CB 3.46Å; E254-S258 PolarHBondContact O-N 3.24Å; S258-R260 PolarHBondContact O-N 2.93Å; S258-R260 PolarHBondContact OG-N 3.35Å; S258-C261 PolarHBondContact O-N 2.91Å; S258-C261 PolarHBondContact OG-N 3.13Å; S258-C261 VanDerWaalsContact OG-N 3.16Å; S258-K451 PolarHBondContact O-NZ 3.39Å
259	D	91.4	Very high	95.3	Very high	123 Å²	123	21.6 Å²	21.6	66%	0.658	11%	0.108	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23	172.5	-74.3	-28.7	0	0	0	112.7	V257 K262	V257-D259 PolarHBondContact O-N 3.45Å; D259-K262 WeakPolarHBondContact O-CE 3.29Å; D259-K262 PolarHBondContact O-NZ 3.48Å
260	R	92.5	Very high	95.2	Very high	42 Å²	42	21.2 Å²	21.2	16%	0.158	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-26.8	179.5	-63.1	178.1	60.1	-156.2	-7.1	112.3	D228 S231 S233 E234 L236 S258 K262	D228-R260 PolarHBondContact O-NH1 2.91Å; S231-R260 VanDerWaalsContact C-NH1 3.31Å; S231-R260 PolarHBondContact O-NH1 3.02Å; S231-R260 PolarHBondContact OG-NH1 3.05Å; S231-R260 VanDerWaalsContact OG-NH1 3.16Å; S231-R260 PolarHBondContact OG-NH2 3.46Å; S233-R260 VanDerWaalsContact C-NH2 3.33Å; S233-R260 VanDerWaalsContact N-NH2 3.17Å; E234-R260 PolarHBondContact O-NE 2.89Å; E234-R260 PolarHBondContact O-NH2 2.66Å; E234-R260 IonicContact OE2-NH2 3.55Å; E234-R260 PolarHBondContact OE2-NH2 2.99Å; L236-R260 HydrophobicContact CD1-CB 4.34Å; L236-R260 HydrophobicContact CG-CB 4.45Å; L236-R260 PolarHBondContact N-O 3.13Å; S258-R260 PolarHBondContact O-N 2.93Å; S258-R260 PolarHBondContact OG-N 3.35Å; R260-K262 PolarHBondContact O-N 3.23Å
261	C	95.6	Very high	95.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	105.7	177	-158	0	0	0	0	110.9	L227 L236 L238 F255 S258 K451	L227-C261 HydrophobicContact CD2-CB 3.63Å; L236-C261 HydrophobicContact CB-CB 4.43Å; L236-C261 CarbonylContact O-C 3.51Å; L236-C261 WeakPolarHBondContact O-CA 3.25Å; L238-C261 VanDerWaalsContact CB-SG 3.54Å; F255-C261 HydrophobicContact CD2-CB 4.05Å; S258-C261 PolarHBondContact O-N 2.91Å; S258-C261 PolarHBondContact OG-N 3.13Å; S258-C261 VanDerWaalsContact OG-N 3.16Å; C261-K451 WeakPolarHBondContact O-CD 3.32Å
262	K	95.3	Very high	94.9	Very high	58 Å²	58	21.8 Å²	21.8	25%	0.252	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-22.2	-176.3	-56.2	-48.4	-169.5	179	0	113.1	M155 L156 P235 L236 D259 R260 F450 K451	M155-K262 HydrophobicContact CB-CG 4.5Å; M155-K262 HydrophobicContact CE-CB 4.4Å; M155-K262 HydrophobicContact CE-CD 3.85Å; M155-K262 HydrophobicContact CE-CG 4.13Å; L156-K262 HydrophobicContact CD2-CB 4.03Å; P235-K262 HydrophobicContact CB-CG 4.21Å; L236-K262 PolarHBondContact O-N 3.19Å; D259-K262 WeakPolarHBondContact O-CE 3.29Å; D259-K262 PolarHBondContact O-NZ 3.48Å; R260-K262 PolarHBondContact O-N 3.23Å; K262-F450 WeakPolarHBondContact O-CA 3.16Å; K262-F450 WeakPolarHBondContact O-CD2 3.06Å; K262-K451 PolarHBondContact O-N 3.04Å
263	L	96.9	Very high	94.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.6	-177.6	174.7	66.4	0	0	0	110.8	F149 L156 A237 L238 L265 V448 G449 F450	F149-L263 HydrophobicContact CB-CD2 3.59Å; F149-L263 HydrophobicContact CD1-CD1 4.17Å; F149-L263 HydrophobicContact CD1-CD2 4.07Å; F149-L263 HydrophobicContact CD2-CD1 4.39Å; F149-L263 HydrophobicContact CD2-CD2 3.9Å; F149-L263 HydrophobicContact CE1-CD1 4.14Å; F149-L263 HydrophobicContact CE2-CD1 4.34Å; F149-L263 HydrophobicContact CG-CD1 4.32Å; F149-L263 HydrophobicContact CG-CD2 3.6Å; F149-L263 HydrophobicContact CZ-CD1 4.24Å; L156-L263 HydrophobicContact CD1-CB 4.32Å; L156-L263 HydrophobicContact CD1-CD2 3.85Å; L156-L263 HydrophobicContact CD2-CB 4.29Å; A237-L263 CarbonylContact C-O 3.54Å; A237-L263 WeakPolarHBondContact CA-O 3.22Å; A237-L263 HydrophobicContact CB-CB 4.08Å; A237-L263 HydrophobicContact CB-CD2 4.15Å; A237-L263 HydrophobicContact CB-CG 4.41Å; L238-L263 PolarHBondContact N-O 2.95Å; L263-L265 HydrophobicContact CD1-CD1 4.45Å; L263-L265 HydrophobicContact CD1-CD2 4.23Å; L263-L265 HydrophobicContact CD1-CG 4.04Å; L263-L265 HydrophobicContact CD2-CD1 3.84Å; L263-L265 HydrophobicContact CD2-CG 4.27Å; L263-L265 HydrophobicContact CG-CD1 4.2Å; L263-L265 HydrophobicContact CG-CG 4.08Å; L263-V448 HydrophobicContact CD1-CG1 3.9Å; L263-G449 CarbonylContact C-O 3.34Å; L263-G449 WeakPolarHBondContact CA-O 3.34Å; L263-F450 HydrophobicContact CB-CD2 4.33Å; L263-F450 HydrophobicContact CD1-CD2 3.97Å
264	L	98	Very high	94.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.7	168.2	174.7	68.2	0	0	0	109.3	L238 L251 I252 F255 L423 V448 G449	L238-L264 HydrophobicContact CB-CD1 4.19Å; L238-L264 HydrophobicContact CD2-CD1 4.13Å; L238-L264 HydrophobicContact CG-CD1 4.12Å; L238-L264 CarbonylContact O-C 3.54Å; L238-L264 VanDerWaalsContact O-CA 3.29Å; L238-L264 WeakPolarHBondContact O-CA 3.37Å; L251-L264 HydrophobicContact CB-CD1 4.2Å; I252-L264 HydrophobicContact CB-CD2 4.46Å; I252-L264 HydrophobicContact CG1-CD2 3.84Å; F255-L264 HydrophobicContact CB-CB 4.13Å; F255-L264 HydrophobicContact CB-CD1 4.37Å; F255-L264 HydrophobicContact CB-CD2 4.07Å; F255-L264 HydrophobicContact CB-CG 4.43Å; F255-L264 HydrophobicContact CD1-CB 4.11Å; F255-L264 HydrophobicContact CD1-CD2 4.1Å; F255-L264 HydrophobicContact CD2-CB 3.61Å; F255-L264 HydrophobicContact CE1-CB 4.41Å; F255-L264 HydrophobicContact CE2-CB 3.96Å; F255-L264 HydrophobicContact CG-CB 3.67Å; F255-L264 HydrophobicContact CG-CD2 4.09Å; F255-L264 HydrophobicContact CG-CG 4.39Å; F255-L264 HydrophobicContact CZ-CB 4.34Å; L264-L423 HydrophobicContact CD2-CD1 4.13Å; L264-L423 HydrophobicContact CD2-CD2 4.38Å; L264-V448 CarbonylContact O-C 3.56Å; L264-V448 VanDerWaalsContact O-CA 3.3Å; L264-V448 WeakPolarHBondContact O-CA 3.12Å; L264-G449 PolarHBondContact N-O 3.34Å; L264-G449 PolarHBondContact O-N 3.3Å
265	L	98.1	Very high	93.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	100.9	171.5	-64.8	162.5	0	0	0	109	L142 L145 V146 F149 L238 I239 G240 L263 L446 V448	L142-L265 HydrophobicContact CD1-CB 4.21Å; L142-L265 HydrophobicContact CD1-CD1 4.45Å; L145-L265 HydrophobicContact CD2-CD2 4.15Å; V146-L265 HydrophobicContact CB-CD1 4.36Å; V146-L265 HydrophobicContact CG2-CD1 3.44Å; V146-L265 VanDerWaalsContact CG2-CD1 3.44Å; F149-L265 HydrophobicContact CD2-CD1 4.23Å; F149-L265 HydrophobicContact CD2-CD2 4.44Å; F149-L265 HydrophobicContact CE2-CD2 3.94Å; L238-L265 PolarHBondContact O-N 3.07Å; I239-L265 CarbonylContact C-O 3.52Å; I239-L265 VanDerWaalsContact CA-O 3.31Å; I239-L265 WeakPolarHBondContact CA-O 3.41Å; I239-L265 HydrophobicContact CB-CB 4.45Å; I239-L265 HydrophobicContact CG2-CB 4.05Å; I239-L265 HydrophobicContact CG2-CD1 4.07Å; G240-L265 PolarHBondContact N-O 3.45Å; L263-L265 HydrophobicContact CD1-CD1 4.45Å; L263-L265 HydrophobicContact CD1-CD2 4.23Å; L263-L265 HydrophobicContact CD1-CG 4.04Å; L263-L265 HydrophobicContact CD2-CD1 3.84Å; L263-L265 HydrophobicContact CD2-CG 4.27Å; L263-L265 HydrophobicContact CG-CD1 4.2Å; L263-L265 HydrophobicContact CG-CG 4.08Å; L265-L446 HydrophobicContact CB-CD1 4.13Å; L265-L446 HydrophobicContact CD2-CD1 4.37Å; L265-L446 HydrophobicContact CD2-CD2 3.77Å; L265-L446 HydrophobicContact CD2-CG 4.47Å; L265-V448 HydrophobicContact CD2-CB 4.26Å; L265-V448 HydrophobicContact CD2-CG1 3.77Å; L265-V448 HydrophobicContact CD2-CG2 3.84Å
266	S	97.5	Very high	92.6	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.014	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.2	-171.1	-170.4	0	0	0	0	112.2	L447	S266-L447 PolarHBondContact N-O 3.12Å; S266-L447 PolarHBondContact O-N 3.02Å
267	V	96.3	Very high	91.3	Very high	1 Å²	1	33 Å²	33	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	106.7	172.1	-177.6	0	0	0	0	107.5	G240 L241 H242 A243 F436 L446	G240-V267 PolarHBondContact O-N 3.41Å; L241-V267 HydrophobicContact CD1-CB 4.48Å; L241-V267 HydrophobicContact CD1-CG2 4.41Å; H242-V267 CarbonylContact C-O 3.5Å; H242-V267 WeakPolarHBondContact CA-O 3.47Å; H242-V267 PolarHBondContact N-O 3.06Å; A243-V267 PolarHBondContact N-O 3.34Å; V267-F436 HydrophobicContact CB-CE2 4.5Å; V267-F436 HydrophobicContact CG1-CE2 4.07Å; V267-F436 HydrophobicContact CG2-CE2 3.87Å; V267-F436 HydrophobicContact CG2-CZ 4.37Å; V267-L446 HydrophobicContact CG2-CB 4.3Å; V267-L446 HydrophobicContact CG2-CD1 3.62Å
268	G	93.8	Very high	90.2	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	156.4	174.5	0	0	0	0	0	112	R443	G268-R443 VanDerWaalsContact O-CB 3.3Å; G268-R443 WeakPolarHBondContact O-CB 3.31Å
269	C	91.5	Very high	89.3	Confident	7 Å²	7	41.5 Å²	41.5	5%	0.047	20%	0.204	C	C	.	.			trans	-143.2	-31.1	177.5	77.3	0	0	0	0	118.2	H242 C244 C306 R443	H242-C269 HydrophobicContact CB-CB 3.95Å; H242-C269 PolarHBondContact O-SG 2.83Å; C244-C269 PolarHBondContact SG-SG 3.32Å; C269-C306 PolarHBondContact O-SG 2.84Å; C269-R443 PolarHBondContact O-NE 3.39Å
270	C	93.1	Very high	88.8	Confident	26 Å²	26	37.4 Å²	37.4	18%	0.176	18%	0.183	C	C	.	.			trans	-121.6	75.4	-174.9	-66.4	0	0	0	0	109.6	C244 G245 M272 H273	C244-C270 HydrophobicContact CB-CB 4.04Å; G245-C270 VanDerWaalsContact CA-O 3.3Å; G245-C270 WeakPolarHBondContact CA-O 3.33Å; G245-C270 PolarHBondContact N-O 3.3Å; C270-M272 VanDerWaalsContact C-N 3.26Å; C270-M272 VanDerWaalsContact C-SD 3.5Å; C270-M272 HydrophobicContact CB-CE 3.9Å; C270-M272 HydrophobicContact CB-SD 3.57Å; C270-M272 VanDerWaalsContact CB-SD 3.57Å; C270-M272 PolarHBondContact O-N 3.11Å; C270-H273 PolarHBondContact O-N 3.42Å
271	Y	93.4	Very high	88.5	Confident	1 Å²	1	35.8 Å²	35.8	0%	0.004	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-68.1	-23.5	-174.3	-57.2	-58.7	0	0	0	113.2	H273 L274 A305 C306 E412 I415 R443	Y271-H273 PolarHBondContact O-N 3.46Å; Y271-H273 VanDerWaalsContact O-N 3.15Å; Y271-L274 HydrophobicContact CD1-CD1 3.93Å; Y271-L274 WeakPolarHBondContact O-CB 3.38Å; Y271-L274 WeakPolarHBondContact O-CG 3.3Å; Y271-L274 PolarHBondContact O-N 2.92Å; Y271-A305 HydrophobicContact CD2-CB 3.8Å; Y271-A305 HydrophobicContact CE2-CB 4.43Å; Y271-C306 PolarHBondContact N-SG 3.16Å; Y271-E412 HydrophobicContact CE2-CB 4.37Å; Y271-E412 HydrophobicContact CE2-CG 3.88Å; Y271-E412 WeakPolarHBondContact CE2-OE1 3.35Å; Y271-E412 PolarHBondContact OH-OE1 2.87Å; Y271-I415 HydrophobicContact CD1-CD1 4.12Å; Y271-I415 HydrophobicContact CD1-CG2 3.96Å; Y271-I415 HydrophobicContact CD2-CD1 4.26Å; Y271-I415 HydrophobicContact CE1-CG2 3.98Å; Y271-I415 HydrophobicContact CG-CD1 3.85Å; Y271-R443 HydrophobicContact CE2-CG 4.36Å
272	M	91	Very high	88.2	Confident	30 Å²	30	42.1 Å²	42.1	15%	0.148	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-60.1	-24	174.5	75.4	-62.9	-157.1	0	0	113.4	C270 L274 A275 Y299 L302 D303	C270-M272 VanDerWaalsContact C-N 3.26Å; C270-M272 VanDerWaalsContact C-SD 3.5Å; C270-M272 HydrophobicContact CB-CE 3.9Å; C270-M272 HydrophobicContact CB-SD 3.57Å; C270-M272 VanDerWaalsContact CB-SD 3.57Å; C270-M272 PolarHBondContact O-N 3.11Å; M272-L274 PolarHBondContact O-N 2.95Å; M272-A275 WeakPolarHBondContact O-CB 3.47Å; M272-A275 PolarHBondContact O-N 3.18Å; M272-Y299 HydrophobicContact CB-CD2 3.83Å; M272-Y299 HydrophobicContact CB-CE1 4.29Å; M272-Y299 HydrophobicContact CB-CE2 3.58Å; M272-Y299 HydrophobicContact CB-CG 4.3Å; M272-Y299 HydrophobicContact CG-CD2 4.34Å; M272-Y299 HydrophobicContact CG-CE1 4.5Å; M272-Y299 HydrophobicContact CG-CE2 3.59Å; M272-L302 HydrophobicContact CB-CB 4.45Å; M272-D303 HydrophobicContact CB-CB 4.05Å
273	H	89.3	Confident	88	Confident	95 Å²	95	39.7 Å²	39.7	44%	0.44	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-81.1	10.2	171	-64.5	-50.3	0	0	0	113.5	H246 C270 Y271	H246-H273 PolarHBondContact CD2-O 2.83Å; H246-H273 PolarHBondContact CE1-O 2.93Å; H246-H273 PolarHBondContact NE2-O 3.44Å; C270-H273 PolarHBondContact O-N 3.42Å; Y271-H273 PolarHBondContact O-N 3.46Å; Y271-H273 VanDerWaalsContact O-N 3.15Å
274	L	86.8	Confident	87.8	Confident	6 Å²	6	40 Å²	40	3%	0.031	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-93.7	-13.8	164.5	-58.1	170.3	0	0	0	111.6	G245 Y271 M272 T276 L302 I415	G245-L274 WeakPolarHBondContact O-CD2 3.35Å; Y271-L274 HydrophobicContact CD1-CD1 3.93Å; Y271-L274 WeakPolarHBondContact O-CB 3.38Å; Y271-L274 WeakPolarHBondContact O-CG 3.3Å; Y271-L274 PolarHBondContact O-N 2.92Å; M272-L274 PolarHBondContact O-N 2.95Å; L274-T276 PolarHBondContact O-N 2.82Å; L274-L302 HydrophobicContact CB-CD1 4.3Å; L274-I415 HydrophobicContact CD1-CG2 4.1Å
275	A	82.7	Confident	87.6	Confident	15 Å²	15	40 Å²	40	12%	0.124	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-62.8	129	174.7	0	0	0	0	0	109.1	M272 Y299 L302	M272-A275 WeakPolarHBondContact O-CB 3.47Å; M272-A275 PolarHBondContact O-N 3.18Å; A275-Y299 HydrophobicContact CB-CD2 4.42Å; A275-L302 HydrophobicContact CB-CD1 3.9Å
276	T	77.9	Confident	87.2	Confident	31 Å²	31	47.5 Å²	47.5	19%	0.19	23%	0.225	C	C	.	.			trans	-69.3	176.5	171.7	60.7	0	0	0	0	111.1	L274 H278 Q279 T280 K282	L274-T276 PolarHBondContact O-N 2.82Å; T276-H278 PolarHBondContact O-N 3.04Å; T276-Q279 WeakPolarHBondContact O-CA 3.34Å; T276-Q279 PolarHBondContact O-N 2.85Å; T276-T280 WeakPolarHBondContact CG2-O 3.27Å; T276-T280 PolarHBondContact N-O 2.71Å; T276-T280 PolarHBondContact OG1-O 3.12Å; T276-T280 VanDerWaalsContact OG1-O 3.1Å; T276-T280 PolarHBondContact OG1-OG1 3.48Å; T276-K282 HydrophobicContact CG2-CD 3.86Å; T276-K282 HydrophobicContact CG2-CG 3.93Å
277	E	69.8	Low	86.6	Confident	180 Å²	180	51.3 Å²	51.3	84%	0.841	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-37	173	-64.6	-179.3	174.1	0	0	112.4	Q279	E277-Q279 PolarHBondContact O-N 2.83Å; E277-Q279 VanDerWaalsContact O-N 3.1Å
278	H	69.5	Low	86.2	Confident	154 Å²	154	51.3 Å²	51.3	71%	0.713	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	10.6	173.4	-52.7	-54.7	0	0	0	114.9	T276 T280	T276-H278 PolarHBondContact O-N 3.04Å; H278-T280 VanDerWaalsContact C-N 3.28Å; H278-T280 PolarHBondContact O-N 3.36Å
279	Q	74.3	Confident	85.9	Confident	98 Å²	98	56.3 Å²	56.3	46%	0.458	26%	0.262	S	S	.	.	S	Bend	trans	57.7	37.9	-179.9	-55	-71.4	-49.1	0	0	112.7	T276 E277 G298	T276-Q279 WeakPolarHBondContact O-CA 3.34Å; T276-Q279 PolarHBondContact O-N 2.85Å; E277-Q279 PolarHBondContact O-N 2.83Å; E277-Q279 VanDerWaalsContact O-N 3.1Å; Q279-G298 WeakPolarHBondContact O-CA 3.44Å
280	T	81.5	Confident	85.5	Confident	37 Å²	37	59.6 Å²	59.6	23%	0.227	29%	0.285	C	S	.	.			trans	-126.7	141.8	178.3	54.2	0	0	0	0	110.7	T276 H278 A295	T276-T280 WeakPolarHBondContact CG2-O 3.27Å; T276-T280 PolarHBondContact N-O 2.71Å; T276-T280 PolarHBondContact OG1-O 3.12Å; T276-T280 VanDerWaalsContact OG1-O 3.1Å; T276-T280 PolarHBondContact OG1-OG1 3.48Å; H278-T280 VanDerWaalsContact C-N 3.28Å; H278-T280 PolarHBondContact O-N 3.36Å; T280-A295 WeakPolarHBondContact CG2-O 3.44Å
281	W	87.1	Confident	84.8	Confident	8 Å²	8	59.9 Å²	59.9	3%	0.03	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-73.5	139.7	169.1	-180	41.8	0	0	0	111.3	P283 L288 F297 L302 I414 I415 D418	W281-P283 HydrophobicContact CH2-CB 4.1Å; W281-P283 HydrophobicContact CZ2-CB 4.05Å; W281-P283 HydrophobicContact CZ3-CB 4.5Å; W281-L288 HydrophobicContact CH2-CD2 4.03Å; W281-L288 HydrophobicContact CZ3-CD2 4.37Å; W281-F297 HydrophobicContact CB-CB 4.01Å; W281-F297 HydrophobicContact CD2-CD2 4.36Å; W281-F297 HydrophobicContact CE3-CB 4.41Å; W281-F297 AromaticContact CE3-CD2 3.42Å; W281-F297 HydrophobicContact CE3-CD2 3.42Å; W281-F297 VanDerWaalsContact CE3-CD2 3.42Å; W281-F297 HydrophobicContact CE3-CE2 4.08Å; W281-F297 HydrophobicContact CE3-CG 4.34Å; W281-F297 AromaticContact CZ3-CD2 3.76Å; W281-F297 HydrophobicContact CZ3-CD2 3.76Å; W281-F297 AromaticContact CZ3-CE2 3.93Å; W281-F297 HydrophobicContact CZ3-CE2 3.93Å; W281-F297 PolarHBondContact N-O 3.31Å; W281-L302 HydrophobicContact CB-CD1 4.05Å; W281-L302 HydrophobicContact CB-CD2 4.11Å; W281-L302 HydrophobicContact CB-CG 4.48Å; W281-L302 HydrophobicContact CG-CD2 4.13Å; W281-I414 HydrophobicContact CH2-CG2 3.81Å; W281-I414 HydrophobicContact CZ3-CG2 3.76Å; W281-I415 HydrophobicContact CH2-CG1 4.31Å; W281-I415 HydrophobicContact CZ2-CB 4.38Å; W281-I415 HydrophobicContact CZ2-CG1 4.04Å; W281-D418 HydrophobicContact CH2-CB 3.88Å; W281-D418 HydrophobicContact CZ2-CB 3.95Å
282	K	88	Confident	83.6	Confident	134 Å²	134	69.4 Å²	69.4	58%	0.583	33%	0.326	S	S	*	.			trans	-113	114.5	168.9	-70.7	-173.6	177.2	179.7	0	109.7	T276	T276-K282 HydrophobicContact CG2-CD 3.86Å; T276-K282 HydrophobicContact CG2-CG 3.93Å
283	P	91.5	Very high	82.4	Confident	7 Å²	7	71.3 Å²	71.3	5%	0.045	34%	0.339	C	S	.	.			trans	-68.4	159.1	177.7	26.9	-33.7	0	0	0	112.5	W281 L288 Q289 T294 D418	W281-P283 HydrophobicContact CH2-CB 4.1Å; W281-P283 HydrophobicContact CZ2-CB 4.05Å; W281-P283 HydrophobicContact CZ3-CB 4.5Å; P283-L288 HydrophobicContact CB-CB 3.5Å; P283-L288 VanDerWaalsContact CB-CB 3.5Å; P283-L288 HydrophobicContact CB-CD2 4.16Å; P283-L288 HydrophobicContact CB-CG 4.5Å; P283-L288 HydrophobicContact CG-CB 3.66Å; P283-Q289 HydrophobicContact CG-CG 4.04Å; P283-Q289 VanDerWaalsContact O-CG 3.25Å; P283-Q289 WeakPolarHBondContact O-CG 3.27Å; P283-Q289 PolarHBondContact O-NE2 2.91Å; P283-T294 HydrophobicContact CG-CG2 4.2Å; P283-D418 WeakPolarHBondContact CA-OD2 3.19Å; P283-D418 VanDerWaalsContact CB-OD1 3.29Å; P283-D418 WeakPolarHBondContact CB-OD1 3.27Å
284	L	92.6	Very high	81.1	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.026	32%	0.322	C	S	.	.	S	Bend	trans	-91	-39.7	179.3	-59.8	-172.6	0	0	0	113.1	E249 I252 Q289 D418 R419 F422	E249-L284 HydrophobicContact CG-CD1 4.23Å; E249-L284 HydrophobicContact CG-CD2 3.67Å; E249-L284 VanDerWaalsContact OE1-CD2 3.3Å; E249-L284 WeakPolarHBondContact OE1-CD2 3.16Å; I252-L284 HydrophobicContact CB-CD1 4.38Å; I252-L284 HydrophobicContact CD1-CD1 4.34Å; I252-L284 HydrophobicContact CG2-CD1 3.89Å; L284-Q289 PolarHBondContact O-NE2 2.91Å; L284-D418 PolarHBondContact N-OD1 2.8Å; L284-D418 PolarHBondContact N-OD2 2.62Å; L284-R419 HydrophobicContact CD1-CG 4.16Å; L284-F422 HydrophobicContact CB-CB 3.75Å; L284-F422 HydrophobicContact CB-CD1 4.26Å; L284-F422 HydrophobicContact CB-CD2 3.91Å; L284-F422 HydrophobicContact CB-CG 3.69Å; L284-F422 HydrophobicContact CD1-CD1 4.32Å; L284-F422 WeakPolarHBondContact O-CD2 3.41Å
285	S	93.4	Very high	79.8	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	-66.4	142.7	-176.7	62.1	0	0	0	0	111	R287 L288 Q289 D418 E425	S285-R287 PolarHBondContact O-N 3.4Å; S285-L288 PolarHBondContact O-N 3.42Å; S285-L288 WeakPolarHBondContact OG-CB 3.3Å; S285-L288 WeakPolarHBondContact OG-CD1 3.39Å; S285-L288 PolarHBondContact OG-N 2.88Å; S285-Q289 WeakPolarHBondContact O-CG 3.48Å; S285-Q289 PolarHBondContact O-N 3.35Å; S285-Q289 VanDerWaalsContact O-N 3.13Å; S285-D418 WeakPolarHBondContact CB-OD1 3.3Å; S285-D418 PolarHBondContact N-OD1 2.93Å; S285-D418 PolarHBondContact OG-OD1 3.43Å; S285-E425 WeakPolarHBondContact CA-OE2 3.46Å
286	R	91	Very high	79.2	Confident	159 Å²	159	70.1 Å²	70.1	60%	0.6	34%	0.344	S	S	*	.	H	α-helix	trans	-57.1	-38.8	176.6	-69.9	-173.9	-69.8	-125.4	-4.8	110.4	S290 E425	R286-S290 PolarHBondContact O-N 3Å; R286-E425 PolarHBondContact N-OE1 3.47Å; R286-E425 PolarHBondContact N-OE2 3.12Å; R286-E425 PolarHBondContact NH2-O 3.13Å
287	R	85.4	Confident	79.5	Confident	82 Å²	82	68.7 Å²	68.7	31%	0.309	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-54.9	178.6	-175.7	66.1	174.2	165	-2.1	112.2	Q19 E23 S285 Q289 S290 L421 E425	Q19-R287 HydrophobicContact CB-CG 3.85Å; Q19-R287 HydrophobicContact CG-CB 3.75Å; Q19-R287 HydrophobicContact CG-CG 3.63Å; E23-R287 IonicContact OE1-CZ 3.01Å; E23-R287 IonicContact OE1-NE 2.68Å; E23-R287 PolarHBondContact OE1-NE 2.9Å; E23-R287 IonicContact OE1-NH2 3.81Å; E23-R287 PolarHBondContact OE1-NH2 3.05Å; E23-R287 IonicContact OE2-CZ 2.8Å; E23-R287 IonicContact OE2-NH2 2.75Å; E23-R287 PolarHBondContact OE2-NH2 3.24Å; S285-R287 PolarHBondContact O-N 3.4Å; R287-Q289 VanDerWaalsContact C-N 3.3Å; R287-Q289 PolarHBondContact O-N 2.98Å; R287-S290 WeakPolarHBondContact O-CB 3.47Å; R287-S290 PolarHBondContact O-N 3.16Å; R287-S290 VanDerWaalsContact O-N 3.09Å; R287-S290 PolarHBondContact O-OG 2.83Å; R287-L421 HydrophobicContact CB-CD2 4.09Å; R287-E425 PolarHBondContact N-OE1 3.15Å
288	L	86.5	Confident	80.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.7	-30.5	-174.2	-86.9	79.5	0	0	0	112.3	L22 I26 W281 P283 S285 S290 L291 T294 I414 D418 L421	L22-L288 HydrophobicContact CB-CD1 3.99Å; L22-L288 HydrophobicContact CD1-CD1 3.51Å; L22-L288 HydrophobicContact CG-CD1 4.26Å; I26-L288 HydrophobicContact CD1-CD2 3.61Å; I26-L288 HydrophobicContact CD1-CG 3.81Å; W281-L288 HydrophobicContact CH2-CD2 4.03Å; W281-L288 HydrophobicContact CZ3-CD2 4.37Å; P283-L288 HydrophobicContact CB-CB 3.5Å; P283-L288 VanDerWaalsContact CB-CB 3.5Å; P283-L288 HydrophobicContact CB-CD2 4.16Å; P283-L288 HydrophobicContact CB-CG 4.5Å; P283-L288 HydrophobicContact CG-CB 3.66Å; S285-L288 PolarHBondContact O-N 3.42Å; S285-L288 WeakPolarHBondContact OG-CB 3.3Å; S285-L288 WeakPolarHBondContact OG-CD1 3.39Å; S285-L288 PolarHBondContact OG-N 2.88Å; L288-S290 PolarHBondContact O-N 3.21Å; L288-L291 PolarHBondContact O-N 3.43Å; L288-L291 VanDerWaalsContact O-N 3.1Å; L288-T294 HydrophobicContact CB-CG2 4.07Å; L288-T294 HydrophobicContact CD2-CG2 4.33Å; L288-T294 HydrophobicContact CG-CG2 4.32Å; L288-T294 VanDerWaalsContact O-CG2 3.3Å; L288-T294 WeakPolarHBondContact O-CG2 3.47Å; L288-T294 PolarHBondContact O-OG1 3.12Å; L288-I414 HydrophobicContact CD2-CG2 4.38Å; L288-D418 HydrophobicContact CD2-CB 3.92Å; L288-L421 HydrophobicContact CD1-CD2 4.16Å
289	Q	87.4	Confident	81.3	Confident	108 Å²	108	57 Å²	57	51%	0.505	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-29.3	172.7	-73.2	176.1	21	0	0	112.7	P283 L284 S285 R287 L291	P283-Q289 HydrophobicContact CG-CG 4.04Å; P283-Q289 VanDerWaalsContact O-CG 3.25Å; P283-Q289 WeakPolarHBondContact O-CG 3.27Å; P283-Q289 PolarHBondContact O-NE2 2.91Å; L284-Q289 PolarHBondContact O-NE2 2.91Å; S285-Q289 WeakPolarHBondContact O-CG 3.48Å; S285-Q289 PolarHBondContact O-N 3.35Å; S285-Q289 VanDerWaalsContact O-N 3.13Å; R287-Q289 VanDerWaalsContact C-N 3.3Å; R287-Q289 PolarHBondContact O-N 2.98Å; Q289-L291 VanDerWaalsContact C-N 3.28Å; Q289-L291 PolarHBondContact O-N 2.97Å
290	S	83.6	Confident	82.1	Confident	75 Å²	75	52.5 Å²	52.5	52%	0.524	26%	0.26	S	S	.	.	H	α-helix	trans	-74	-17.5	177.1	77.1	0	0	0	0	113.7	R286 R287 L288	R286-S290 PolarHBondContact O-N 3Å; R287-S290 WeakPolarHBondContact O-CB 3.47Å; R287-S290 PolarHBondContact O-N 3.16Å; R287-S290 VanDerWaalsContact O-N 3.09Å; R287-S290 PolarHBondContact O-OG 2.83Å; L288-S290 PolarHBondContact O-N 3.21Å
291	L	77.9	Confident	82.6	Confident	32 Å²	32	50.7 Å²	50.7	17%	0.168	25%	0.249	C	C	.	.			trans	-92.5	112.4	-176.5	-59.3	172.1	0	0	0	110.7	E23 I26 L288 Q289 T293 T294	E23-L291 HydrophobicContact CG-CD1 3.38Å; E23-L291 HydrophobicContact CG-CD2 4.09Å; E23-L291 HydrophobicContact CG-CG 4.35Å; I26-L291 HydrophobicContact CD1-CD1 4.12Å; L288-L291 PolarHBondContact O-N 3.43Å; L288-L291 VanDerWaalsContact O-N 3.1Å; Q289-L291 VanDerWaalsContact C-N 3.28Å; Q289-L291 PolarHBondContact O-N 2.97Å; L291-T293 PolarHBondContact O-N 3.41Å; L291-T293 VanDerWaalsContact O-N 3.11Å; L291-T294 HydrophobicContact CB-CG2 4.09Å; L291-T294 PolarHBondContact O-N 3.06Å; L291-T294 PolarHBondContact O-OG1 2.78Å
292	K	68.2	Low	83	Confident	201 Å²	201	50.3 Å²	50.3	87%	0.874	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-56.5	-29.2	177.8	-68	-176	179	179.4	0	113.6	T294 A295	K292-T294 PolarHBondContact O-N 3.34Å; K292-A295 PolarHBondContact O-N 3.22Å
293	T	67	Low	83.2	Confident	71 Å²	71	46 Å²	46	44%	0.436	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-67.2	-19.6	-178.2	44.4	0	0	0	0	113.8	I26 L291 A295 S296	I26-T293 WeakPolarHBondContact CG2-OG1 3.34Å; L291-T293 PolarHBondContact O-N 3.41Å; L291-T293 VanDerWaalsContact O-N 3.11Å; T293-A295 PolarHBondContact O-N 2.83Å; T293-S296 WeakPolarHBondContact O-CB 3.49Å; T293-S296 PolarHBondContact O-N 3.18Å; T293-S296 PolarHBondContact O-OG 2.97Å
294	T	61.5	Low	83.2	Confident	11 Å²	11	45.8 Å²	45.8	7%	0.067	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-64.3	-22.5	178.1	56	0	0	0	0	113.8	I26 P283 L288 L291 K292 S296	I26-T294 HydrophobicContact CD1-CG2 3.63Å; I26-T294 HydrophobicContact CG1-CG2 4.49Å; P283-T294 HydrophobicContact CG-CG2 4.2Å; L288-T294 HydrophobicContact CB-CG2 4.07Å; L288-T294 HydrophobicContact CD2-CG2 4.33Å; L288-T294 HydrophobicContact CG-CG2 4.32Å; L288-T294 VanDerWaalsContact O-CG2 3.3Å; L288-T294 WeakPolarHBondContact O-CG2 3.47Å; L288-T294 PolarHBondContact O-OG1 3.12Å; L291-T294 HydrophobicContact CB-CG2 4.09Å; L291-T294 PolarHBondContact O-N 3.06Å; L291-T294 PolarHBondContact O-OG1 2.78Å; K292-T294 PolarHBondContact O-N 3.34Å; T294-S296 PolarHBondContact O-N 3.24Å
295	A	59.2	Low	83.2	Confident	57 Å²	57	45.6 Å²	45.6	47%	0.471	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-65.2	-2.2	174.9	0	0	0	0	0	113.8	T280 K292 T293	T280-A295 WeakPolarHBondContact CG2-O 3.44Å; K292-A295 PolarHBondContact O-N 3.22Å; T293-A295 PolarHBondContact O-N 2.83Å
296	S	69.6	Low	83.1	Confident	22 Å²	22	46.4 Å²	46.4	15%	0.154	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-81.1	-15.6	-176.8	76.8	0	0	0	0	115.4	N33 N37 T293 T294 G298	N33-S296 VanDerWaalsContact ND2-CB 3.33Å; N33-S296 WeakPolarHBondContact ND2-CB 3.43Å; N33-S296 WeakPolarHBondContact OD1-CB 3.39Å; N33-S296 PolarHBondContact OD1-OG 3.32Å; N37-S296 PolarHBondContact ND2-O 3.08Å; T293-S296 WeakPolarHBondContact O-CB 3.49Å; T293-S296 PolarHBondContact O-N 3.18Å; T293-S296 PolarHBondContact O-OG 2.97Å; T294-S296 PolarHBondContact O-N 3.24Å; S296-G298 PolarHBondContact O-N 3.46Å
297	F	84.2	Confident	82.9	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.217	C	C	.	.			trans	-83.8	97.7	178.2	-65.1	-17.2	0	0	0	111	T29 L36 W281 A301 L302 V411 I414	T29-F297 HydrophobicContact CG2-CE1 4.41Å; T29-F297 HydrophobicContact CG2-CZ 4.17Å; T29-F297 WeakPolarHBondContact OG1-CE1 3.41Å; T29-F297 VanDerWaalsContact OG1-CZ 3.31Å; T29-F297 WeakPolarHBondContact OG1-CZ 3.42Å; L36-F297 HydrophobicContact CD1-CD1 4.48Å; L36-F297 HydrophobicContact CD1-CE1 4.06Å; W281-F297 HydrophobicContact CB-CB 4.01Å; W281-F297 HydrophobicContact CD2-CD2 4.36Å; W281-F297 HydrophobicContact CE3-CB 4.41Å; W281-F297 AromaticContact CE3-CD2 3.42Å; W281-F297 HydrophobicContact CE3-CD2 3.42Å; W281-F297 VanDerWaalsContact CE3-CD2 3.42Å; W281-F297 HydrophobicContact CE3-CE2 4.08Å; W281-F297 HydrophobicContact CE3-CG 4.34Å; W281-F297 AromaticContact CZ3-CD2 3.76Å; W281-F297 HydrophobicContact CZ3-CD2 3.76Å; W281-F297 AromaticContact CZ3-CE2 3.93Å; W281-F297 HydrophobicContact CZ3-CE2 3.93Å; W281-F297 PolarHBondContact N-O 3.31Å; F297-A301 HydrophobicContact CB-CB 4.18Å; F297-A301 HydrophobicContact CD1-CB 4.21Å; F297-A301 HydrophobicContact CG-CB 4.44Å; F297-L302 HydrophobicContact CB-CD2 4.25Å; F297-L302 HydrophobicContact CB-CG 4.43Å; F297-V411 HydrophobicContact CD2-CG1 4.28Å; F297-V411 HydrophobicContact CE2-CG1 4.28Å; F297-I414 HydrophobicContact CE2-CB 4.26Å; F297-I414 HydrophobicContact CE2-CD1 3.98Å; F297-I414 HydrophobicContact CE2-CG2 3.86Å; F297-I414 HydrophobicContact CZ-CD1 3.67Å
298	G	86.9	Confident	83	Confident	10 Å²	10	37.9 Å²	37.9	10%	0.103	21%	0.205	C	C	.	.			trans	-81.6	179.9	172.3	0	0	0	0	0	113.7	N37 Q279 S296 A300 A301 L302	N37-G298 WeakPolarHBondContact OD1-CA 3.43Å; N37-G298 PolarHBondContact OD1-N 2.94Å; N37-G298 VanDerWaalsContact OD1-N 3.08Å; Q279-G298 WeakPolarHBondContact O-CA 3.44Å; S296-G298 PolarHBondContact O-N 3.46Å; G298-A300 PolarHBondContact O-N 3.13Å; G298-A301 WeakPolarHBondContact O-CB 3.46Å; G298-A301 PolarHBondContact O-N 3.28Å; G298-L302 WeakPolarHBondContact O-CG 3.44Å; G298-L302 PolarHBondContact O-N 3.44Å
299	Y	91	Very high	83.2	Confident	80 Å²	80	38.6 Å²	38.6	31%	0.314	21%	0.209	S	C	.	.	H	α-helix	trans	-52.3	-41.6	178.8	178.1	-81.3	0	0	0	112.8	F39 M272 A275 L302 D303	F39-Y299 AromaticContact CE1-CD1 3.94Å; F39-Y299 HydrophobicContact CE1-CD1 3.94Å; F39-Y299 HydrophobicContact CE1-CE1 4.42Å; F39-Y299 HydrophobicContact CZ-CD1 4.1Å; M272-Y299 HydrophobicContact CB-CD2 3.83Å; M272-Y299 HydrophobicContact CB-CE1 4.29Å; M272-Y299 HydrophobicContact CB-CE2 3.58Å; M272-Y299 HydrophobicContact CB-CG 4.3Å; M272-Y299 HydrophobicContact CG-CD2 4.34Å; M272-Y299 HydrophobicContact CG-CE1 4.5Å; M272-Y299 HydrophobicContact CG-CE2 3.59Å; A275-Y299 HydrophobicContact CB-CD2 4.42Å; Y299-L302 PolarHBondContact O-N 3.43Å; Y299-D303 HydrophobicContact CE1-CB 4.42Å; Y299-D303 VanDerWaalsContact O-CB 3.28Å; Y299-D303 WeakPolarHBondContact O-CB 3.5Å; Y299-D303 PolarHBondContact O-N 3.34Å
300	A	91.3	Very high	83.4	Confident	2 Å²	2	35.3 Å²	35.3	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-38.6	178.2	0	0	0	0	0	112.8	L36 F39 G298 D303 C304 R404	L36-A300 CarbonylContact O-C 3.26Å; F39-A300 HydrophobicContact CD1-CB 4.41Å; F39-A300 HydrophobicContact CD2-CB 4.03Å; F39-A300 HydrophobicContact CE1-CB 4.17Å; F39-A300 HydrophobicContact CE2-CB 3.77Å; F39-A300 HydrophobicContact CG-CB 4.36Å; F39-A300 HydrophobicContact CZ-CB 3.84Å; G298-A300 PolarHBondContact O-N 3.13Å; A300-D303 PolarHBondContact O-N 3.17Å; A300-C304 WeakPolarHBondContact O-CB 3.5Å; A300-C304 PolarHBondContact O-N 3.46Å; A300-R404 PolarHBondContact O-NH2 3.41Å
301	A	92.4	Very high	83.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-44	175.8	0	0	0	0	0	111.1	L36 F297 G298 C304 A305	L36-A301 HydrophobicContact CB-CB 3.93Å; L36-A301 WeakPolarHBondContact O-CA 3.41Å; L36-A301 PolarHBondContact O-N 3.27Å; F297-A301 HydrophobicContact CB-CB 4.18Å; F297-A301 HydrophobicContact CD1-CB 4.21Å; F297-A301 HydrophobicContact CG-CB 4.44Å; G298-A301 WeakPolarHBondContact O-CB 3.46Å; G298-A301 PolarHBondContact O-N 3.28Å; A301-C304 WeakPolarHBondContact O-CB 3.33Å; A301-C304 PolarHBondContact O-N 3.05Å; A301-A305 PolarHBondContact O-N 3.01Å
302	L	93.6	Very high	84.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-36.8	178.2	-63.6	174	0	0	0	112.7	M272 L274 A275 W281 F297 G298 Y299 C304 A305 C306 I415	M272-L302 HydrophobicContact CB-CB 4.45Å; L274-L302 HydrophobicContact CB-CD1 4.3Å; A275-L302 HydrophobicContact CB-CD1 3.9Å; W281-L302 HydrophobicContact CB-CD1 4.05Å; W281-L302 HydrophobicContact CB-CD2 4.11Å; W281-L302 HydrophobicContact CB-CG 4.48Å; W281-L302 HydrophobicContact CG-CD2 4.13Å; F297-L302 HydrophobicContact CB-CD2 4.25Å; F297-L302 HydrophobicContact CB-CG 4.43Å; G298-L302 WeakPolarHBondContact O-CG 3.44Å; G298-L302 PolarHBondContact O-N 3.44Å; Y299-L302 PolarHBondContact O-N 3.43Å; L302-C304 VanDerWaalsContact C-N 3.3Å; L302-A305 PolarHBondContact O-N 2.89Å; L302-C306 PolarHBondContact O-SG 3.36Å; L302-I415 HydrophobicContact CD2-CD1 3.68Å; L302-I415 HydrophobicContact CD2-CG1 4.42Å
303	D	92.9	Very high	85.2	Confident	44 Å²	44	27.3 Å²	27.3	24%	0.235	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-43.5	170.3	175.5	74	0	0	0	110.1	M272 Y299 A300 A305 C306 H307 R404	M272-D303 HydrophobicContact CB-CB 4.05Å; Y299-D303 HydrophobicContact CE1-CB 4.42Å; Y299-D303 VanDerWaalsContact O-CB 3.28Å; Y299-D303 WeakPolarHBondContact O-CB 3.5Å; Y299-D303 PolarHBondContact O-N 3.34Å; A300-D303 PolarHBondContact O-N 3.17Å; D303-A305 VanDerWaalsContact C-N 3.25Å; D303-A305 PolarHBondContact O-N 2.97Å; D303-C306 VanDerWaalsContact O-CB 3.27Å; D303-C306 WeakPolarHBondContact O-CB 3.46Å; D303-C306 PolarHBondContact O-N 3.1Å; D303-H307 PolarHBondContact O-CD2 3.08Å; D303-H307 PolarHBondContact O-NE2 3.18Å; D303-H307 IonicContact OD2-CD2 3.2Å; D303-H307 IonicContact OD2-CE1 4Å; D303-H307 IonicContact OD2-NE2 3.02Å; D303-H307 PolarHBondContact OD2-NE2 3.29Å; D303-R404 IonicContact OD2-NH2 2.65Å
304	C	91.9	Very high	86.2	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-54.9	-41	178.4	-168.4	0	0	0	0	112.2	A300 A301 L302 C306 H307 R404 A408	A300-C304 WeakPolarHBondContact O-CB 3.5Å; A300-C304 PolarHBondContact O-N 3.46Å; A301-C304 WeakPolarHBondContact O-CB 3.33Å; A301-C304 PolarHBondContact O-N 3.05Å; L302-C304 VanDerWaalsContact C-N 3.3Å; C304-C306 PolarHBondContact O-N 2.86Å; C304-C306 VanDerWaalsContact O-N 3.08Å; C304-H307 PolarHBondContact O-CD2 3.25Å; C304-H307 VanDerWaalsContact O-CD2 3.3Å; C304-H307 PolarHBondContact O-N 3.45Å; C304-H307 VanDerWaalsContact O-N 3.17Å; C304-R404 HydrophobicContact CB-CG 4.49Å; C304-R404 PolarHBondContact SG-O 3Å; C304-R404 VanDerWaalsContact SG-O 3.33Å; C304-A408 WeakPolarHBondContact O-CB 3.49Å
305	A	92.7	Very high	87.4	Confident	1 Å²	1	31 Å²	31	1%	0.008	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-14.3	177.3	0	0	0	0	0	114.1	Y271 A301 L302 D303 V411 E412 I415	Y271-A305 HydrophobicContact CD2-CB 3.8Å; Y271-A305 HydrophobicContact CE2-CB 4.43Å; A301-A305 PolarHBondContact O-N 3.01Å; L302-A305 PolarHBondContact O-N 2.89Å; D303-A305 VanDerWaalsContact C-N 3.25Å; D303-A305 PolarHBondContact O-N 2.97Å; A305-V411 HydrophobicContact CB-CB 3.98Å; A305-V411 HydrophobicContact CB-CG1 3.79Å; A305-E412 HydrophobicContact CB-CB 4.22Å; A305-I415 HydrophobicContact CB-CD1 4.38Å
306	C	91.5	Very high	88.7	Confident	17 Å²	17	28.6 Å²	28.6	12%	0.115	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-9.1	179.8	-57.3	0	0	0	0	113.9	C269 Y271 L302 D303 C304 R443	C269-C306 PolarHBondContact O-SG 2.84Å; Y271-C306 PolarHBondContact N-SG 3.16Å; L302-C306 PolarHBondContact O-SG 3.36Å; D303-C306 VanDerWaalsContact O-CB 3.27Å; D303-C306 WeakPolarHBondContact O-CB 3.46Å; D303-C306 PolarHBondContact O-N 3.1Å; C304-C306 PolarHBondContact O-N 2.86Å; C304-C306 VanDerWaalsContact O-N 3.08Å; C306-R443 PolarHBondContact O-NH1 2.96Å
307	H	86.4	Confident	89.3	Confident	54 Å²	54	32.1 Å²	32.1	25%	0.25	16%	0.163	C	C	.	.			trans	-80	158.4	-179	-64.4	-101.9	0	0	0	110.9	D303 C304 Y401	D303-H307 PolarHBondContact O-CD2 3.08Å; D303-H307 PolarHBondContact O-NE2 3.18Å; D303-H307 IonicContact OD2-CD2 3.2Å; D303-H307 IonicContact OD2-CE1 4Å; D303-H307 IonicContact OD2-NE2 3.02Å; D303-H307 PolarHBondContact OD2-NE2 3.29Å; C304-H307 PolarHBondContact O-CD2 3.25Å; C304-H307 VanDerWaalsContact O-CD2 3.3Å; C304-H307 PolarHBondContact O-N 3.45Å; C304-H307 VanDerWaalsContact O-N 3.17Å; H307-Y401 AromaticContact ND1-CE2 3.89Å; H307-Y401 AromaticContact ND1-CZ 3.72Å; H307-Y401 PolarHBondContact ND1-OH 2.84Å
308	S	86.6	Confident	89.2	Confident	9 Å²	9	34.4 Å²	34.4	6%	0.063	18%	0.175	C	C	.	.			trans	-122.4	119.9	177.1	153.4	0	0	0	0	109.9	E310 R311 F312 A442	S308-E310 VanDerWaalsContact C-N 3.26Å; S308-E310 WeakPolarHBondContact CB-OE2 3.47Å; S308-E310 PolarHBondContact O-N 2.86Å; S308-E310 PolarHBondContact OG-N 2.95Å; S308-E310 PolarHBondContact OG-OE2 3.19Å; S308-R311 PolarHBondContact O-N 3.22Å; S308-R311 WeakPolarHBondContact OG-CG 3.3Å; S308-R311 PolarHBondContact OG-N 2.7Å; S308-R311 VanDerWaalsContact OG-N 3.12Å; S308-F312 PolarHBondContact O-N 2.99Å; S308-F312 VanDerWaalsContact O-N 3.13Å; S308-A442 VanDerWaalsContact CB-CB 3.44Å
309	N	92	Very high	88.4	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.08	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-36.8	176.1	-69.1	-11.8	0	0	0	110.5	L72 R311 F312 I313 S405	L72-N309 HydrophobicContact CB-CB 4.4Å; N309-R311 PolarHBondContact O-N 2.72Å; N309-F312 PolarHBondContact O-N 3.05Å; N309-F312 VanDerWaalsContact O-N 3.11Å; N309-I313 WeakPolarHBondContact O-CB 3.42Å; N309-I313 VanDerWaalsContact O-CG1 3.27Å; N309-I313 WeakPolarHBondContact O-CG1 3.39Å; N309-I313 PolarHBondContact O-N 2.68Å; N309-S405 PolarHBondContact ND2-O 3.29Å; N309-S405 WeakPolarHBondContact OD1-CB 3.35Å; N309-S405 PolarHBondContact OD1-O 2.97Å; N309-S405 VanDerWaalsContact OD1-O 3.1Å
310	E	90.9	Very high	87.4	Confident	39 Å²	39	40.4 Å²	40.4	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-44.3	179.4	-51.6	85.9	167.9	0	0	111.2	R102 S308 F312 S314 P438 L439	R102-E310 IonicContact CZ-OE1 3.32Å; R102-E310 IonicContact NE-OE1 3.38Å; R102-E310 PolarHBondContact NE-OE1 3.02Å; R102-E310 IonicContact NH2-OE1 2.64Å; R102-E310 IonicContact NH2-OE2 3.72Å; S308-E310 VanDerWaalsContact C-N 3.26Å; S308-E310 WeakPolarHBondContact CB-OE2 3.47Å; S308-E310 PolarHBondContact O-N 2.86Å; S308-E310 PolarHBondContact OG-N 2.95Å; S308-E310 PolarHBondContact OG-OE2 3.19Å; E310-F312 VanDerWaalsContact C-N 3.33Å; E310-S314 WeakPolarHBondContact O-CB 3.42Å; E310-S314 PolarHBondContact O-N 2.72Å; E310-P438 HydrophobicContact CG-CB 4.15Å; E310-P438 HydrophobicContact CG-CG 4Å; E310-P438 WeakPolarHBondContact OE1-CB 3.46Å; E310-L439 HydrophobicContact CB-CD2 3.55Å; E310-L439 HydrophobicContact CB-CG 4.04Å; E310-L439 WeakPolarHBondContact O-CD2 3.3Å
311	R	88.6	Confident	86.3	Confident	99 Å²	99	44.6 Å²	44.6	37%	0.374	24%	0.24	S	C	.	.	H	α-helix	trans	-67	-36.2	174.8	-72.6	178.3	172.1	-147.2	-12.7	112.5	S308 N309 K315 L439 V440	S308-R311 PolarHBondContact O-N 3.22Å; S308-R311 WeakPolarHBondContact OG-CG 3.3Å; S308-R311 PolarHBondContact OG-N 2.7Å; S308-R311 VanDerWaalsContact OG-N 3.12Å; N309-R311 PolarHBondContact O-N 2.72Å; R311-K315 WeakPolarHBondContact O-CG 3.34Å; R311-K315 PolarHBondContact O-N 3.49Å; R311-K315 VanDerWaalsContact O-N 3.15Å; R311-L439 PolarHBondContact NE-O 3.15Å; R311-L439 PolarHBondContact NH2-O 3.17Å; R311-L439 VanDerWaalsContact NH2-O 3.1Å; R311-V440 PolarHBondContact NH2-O 3.11Å
312	F	89.6	Confident	84.9	Confident	9 Å²	9	46.1 Å²	46.1	4%	0.039	25%	0.251	C	S	.	.	H	α-helix	trans	-69.4	-45.9	-179.9	-174	-155.1	0	0	0	110.9	I68 L72 S308 N309 E310 S314 K315 L316 L325 Y401 A402	I68-F312 HydrophobicContact CG2-CE1 4.1Å; I68-F312 HydrophobicContact CG2-CZ 4.12Å; L72-F312 HydrophobicContact CD1-CD1 3.23Å; L72-F312 HydrophobicContact CD1-CE1 3.59Å; L72-F312 HydrophobicContact CD1-CG 4.16Å; S308-F312 PolarHBondContact O-N 2.99Å; S308-F312 VanDerWaalsContact O-N 3.13Å; N309-F312 PolarHBondContact O-N 3.05Å; N309-F312 VanDerWaalsContact O-N 3.11Å; E310-F312 VanDerWaalsContact C-N 3.33Å; F312-S314 PolarHBondContact O-N 3.03Å; F312-K315 WeakPolarHBondContact O-CB 3.5Å; F312-K315 PolarHBondContact O-N 3.3Å; F312-L316 HydrophobicContact CD2-CD1 3.97Å; F312-L316 HydrophobicContact CD2-CG 4.28Å; F312-L316 HydrophobicContact CE1-CD1 4.35Å; F312-L316 HydrophobicContact CE2-CD1 3.77Å; F312-L316 HydrophobicContact CE2-CD2 4.43Å; F312-L316 HydrophobicContact CE2-CG 4.03Å; F312-L316 HydrophobicContact CG-CD1 4.33Å; F312-L316 HydrophobicContact CZ-CD1 3.96Å; F312-L316 PolarHBondContact O-N 2.88Å; F312-L316 VanDerWaalsContact O-N 3.11Å; F312-L325 HydrophobicContact CD2-CD2 4.2Å; F312-L325 HydrophobicContact CE2-CD1 3.64Å; F312-L325 HydrophobicContact CE2-CD2 3.56Å; F312-L325 HydrophobicContact CE2-CG 4.26Å; F312-L325 HydrophobicContact CZ-CD1 4.29Å; F312-Y401 AromaticContact CD1-CD1 3.86Å; F312-Y401 HydrophobicContact CD1-CD1 3.86Å; F312-Y401 AromaticContact CD1-CE1 3.56Å; F312-Y401 HydrophobicContact CD1-CE1 3.56Å; F312-Y401 HydrophobicContact CD2-CE1 4.19Å; F312-Y401 AromaticContact CE1-CD1 3.3Å; F312-Y401 HydrophobicContact CE1-CD1 3.3Å; F312-Y401 AromaticContact CE1-CE1 3.53Å; F312-Y401 HydrophobicContact CE1-CE1 3.53Å; F312-Y401 HydrophobicContact CE1-CG 4.49Å; F312-Y401 HydrophobicContact CE2-CD1 4.12Å; F312-Y401 HydrophobicContact CE2-CE1 4.14Å; F312-Y401 AromaticContact CG-CE1 3.94Å; F312-Y401 HydrophobicContact CG-CE1 3.94Å; F312-Y401 AromaticContact CZ-CD1 3.47Å; F312-Y401 HydrophobicContact CZ-CD1 3.47Å; F312-Y401 VanDerWaalsContact CZ-CD1 3.47Å; F312-Y401 AromaticContact CZ-CE1 3.85Å; F312-Y401 HydrophobicContact CZ-CE1 3.85Å; F312-A402 HydrophobicContact CE1-CB 3.88Å
313	I	90	Very high	83.6	Confident	32 Å²	32	48.6 Å²	48.6	16%	0.164	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-48.6	171.5	-66.7	163.6	0	0	0	110.5	I69 L72 N309 K315 L316 T317	I69-I313 HydrophobicContact CG2-CG2 4.11Å; L72-I313 HydrophobicContact CB-CD1 3.8Å; L72-I313 HydrophobicContact CB-CG1 3.89Å; L72-I313 HydrophobicContact CD1-CG1 4.48Å; N309-I313 WeakPolarHBondContact O-CB 3.42Å; N309-I313 VanDerWaalsContact O-CG1 3.27Å; N309-I313 WeakPolarHBondContact O-CG1 3.39Å; N309-I313 PolarHBondContact O-N 2.68Å; I313-K315 PolarHBondContact O-N 3.26Å; I313-L316 WeakPolarHBondContact O-CA 3.24Å; I313-L316 WeakPolarHBondContact O-CB 3.41Å; I313-L316 PolarHBondContact O-N 3.01Å; I313-T317 PolarHBondContact O-N 2.96Å; I313-T317 PolarHBondContact O-OG1 2.81Å; I313-T317 VanDerWaalsContact O-OG1 3.06Å
314	S	87.7	Confident	82.8	Confident	61 Å²	61	47.8 Å²	47.8	43%	0.427	27%	0.265	S	S	.	.	H	α-helix	trans	-56.4	-35.6	178.6	175.7	0	0	0	0	113.3	E310 F312 D318	E310-S314 WeakPolarHBondContact O-CB 3.42Å; E310-S314 PolarHBondContact O-N 2.72Å; F312-S314 PolarHBondContact O-N 3.03Å; S314-D318 PolarHBondContact O-N 2.93Å
315	K	86.1	Confident	82.3	Confident	99 Å²	99	47.8 Å²	47.8	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-72.2	-33.8	174.4	-72.4	177.1	-179.7	-177.4	0	113.2	R311 F312 I313 K321 S322	R311-K315 WeakPolarHBondContact O-CG 3.34Å; R311-K315 PolarHBondContact O-N 3.49Å; R311-K315 VanDerWaalsContact O-N 3.15Å; F312-K315 WeakPolarHBondContact O-CB 3.5Å; F312-K315 PolarHBondContact O-N 3.3Å; I313-K315 PolarHBondContact O-N 3.26Å; K315-K321 CarbonylContact O-C 3.46Å; K315-K321 WeakPolarHBondContact O-CB 3.4Å; K315-S322 PolarHBondContact O-N 2.97Å
316	L	86.1	Confident	82	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-73.5	-38.8	179.5	-76	158.4	0	0	0	111.9	V65 I68 I69 F312 I313 D318 L325	V65-L316 HydrophobicContact CG1-CB 4.2Å; V65-L316 HydrophobicContact CG1-CD2 3.93Å; I68-L316 HydrophobicContact CB-CD1 4.13Å; I68-L316 HydrophobicContact CD1-CD2 4.4Å; I68-L316 HydrophobicContact CG2-CD1 3.41Å; I68-L316 VanDerWaalsContact CG2-CD1 3.41Å; I68-L316 HydrophobicContact CG2-CD2 4.41Å; I69-L316 HydrophobicContact CD1-CB 3.98Å; I69-L316 HydrophobicContact CG1-CB 3.77Å; I69-L316 HydrophobicContact CG1-CD1 4.19Å; F312-L316 HydrophobicContact CD2-CD1 3.97Å; F312-L316 HydrophobicContact CD2-CG 4.28Å; F312-L316 HydrophobicContact CE1-CD1 4.35Å; F312-L316 HydrophobicContact CE2-CD1 3.77Å; F312-L316 HydrophobicContact CE2-CD2 4.43Å; F312-L316 HydrophobicContact CE2-CG 4.03Å; F312-L316 HydrophobicContact CG-CD1 4.33Å; F312-L316 HydrophobicContact CZ-CD1 3.96Å; F312-L316 PolarHBondContact O-N 2.88Å; F312-L316 VanDerWaalsContact O-N 3.11Å; I313-L316 WeakPolarHBondContact O-CA 3.24Å; I313-L316 WeakPolarHBondContact O-CB 3.41Å; I313-L316 PolarHBondContact O-N 3.01Å; L316-D318 VanDerWaalsContact C-N 3.34Å; L316-L325 HydrophobicContact CD2-CD1 3.17Å; L316-L325 HydrophobicContact CG-CD1 3.85Å
317	T	84	Confident	81.9	Confident	95 Å²	95	50 Å²	50	58%	0.583	28%	0.278	S	S	*	.	H	α-helix	trans	-72.8	-27.1	-179.4	-49.4	0	0	0	0	112.8	I313 A319	I313-T317 PolarHBondContact O-N 2.96Å; I313-T317 PolarHBondContact O-OG1 2.81Å; I313-T317 VanDerWaalsContact O-OG1 3.06Å; T317-A319 PolarHBondContact O-N 3.04Å
318	D	82.2	Confident	82.1	Confident	49 Å²	49	50.6 Å²	50.6	26%	0.262	28%	0.281	S	S	.	.			trans	-81.2	107.9	176.3	-177.3	-15.8	0	0	0	109.8	S314 L316 N320 K321 S322	S314-D318 PolarHBondContact O-N 2.93Å; L316-D318 VanDerWaalsContact C-N 3.34Å; D318-N320 PolarHBondContact O-N 2.85Å; D318-N320 VanDerWaalsContact O-N 3.12Å; D318-N320 WeakPolarHBondContact OD1-CB 3.22Å; D318-N320 PolarHBondContact OD1-N 3.36Å; D318-K321 HydrophobicContact CB-CB 4Å; D318-K321 HydrophobicContact CB-CD 4.05Å; D318-K321 HydrophobicContact CB-CG 4.11Å; D318-K321 CarbonylContact O-C 3.54Å; D318-K321 WeakPolarHBondContact O-CA 3.38Å; D318-K321 PolarHBondContact O-N 3.41Å; D318-K321 WeakPolarHBondContact OD2-CD 3.35Å; D318-K321 WeakPolarHBondContact OD2-CE 3.39Å; D318-K321 WeakPolarHBondContact OD2-CG 3.32Å; D318-K321 IonicContact OD2-NZ 3.11Å; D318-K321 PolarHBondContact OD2-NZ 3.48Å; D318-S322 PolarHBondContact O-N 2.79Å
319	A	69.4	Low	82.5	Confident	81 Å²	81	50.1 Å²	50.1	67%	0.669	28%	0.278	S	S	*	.	H	α-helix	trans	-52.8	-35.7	-178.9	0	0	0	0	0	112.5	T317 K321 S322	T317-A319 PolarHBondContact O-N 3.04Å; A319-K321 VanDerWaalsContact C-N 3.25Å; A319-K321 PolarHBondContact O-N 3.09Å; A319-S322 PolarHBondContact O-OG 3.1Å
320	N	68.9	Low	82.6	Confident	135 Å²	135	50.8 Å²	50.8	72%	0.722	28%	0.279	S	S	*	.	H	α-helix	trans	-74.3	-14.4	178.5	-64.5	-36.9	0	0	0	113.3	D318	D318-N320 PolarHBondContact O-N 2.85Å; D318-N320 VanDerWaalsContact O-N 3.12Å; D318-N320 WeakPolarHBondContact OD1-CB 3.22Å; D318-N320 PolarHBondContact OD1-N 3.36Å
321	K	68.8	Low	82.9	Confident	91 Å²	91	51 Å²	51	40%	0.396	28%	0.279	S	S	.	.	H	α-helix	trans	-111.5	-14.2	179.4	-63.6	-179.1	-175.1	125.5	0	113.6	K315 D318 A319 S323 S324	K315-K321 CarbonylContact O-C 3.46Å; K315-K321 WeakPolarHBondContact O-CB 3.4Å; D318-K321 HydrophobicContact CB-CB 4Å; D318-K321 HydrophobicContact CB-CD 4.05Å; D318-K321 HydrophobicContact CB-CG 4.11Å; D318-K321 CarbonylContact O-C 3.54Å; D318-K321 WeakPolarHBondContact O-CA 3.38Å; D318-K321 PolarHBondContact O-N 3.41Å; D318-K321 WeakPolarHBondContact OD2-CD 3.35Å; D318-K321 WeakPolarHBondContact OD2-CE 3.39Å; D318-K321 WeakPolarHBondContact OD2-CG 3.32Å; D318-K321 IonicContact OD2-NZ 3.11Å; D318-K321 PolarHBondContact OD2-NZ 3.48Å; A319-K321 VanDerWaalsContact C-N 3.25Å; A319-K321 PolarHBondContact O-N 3.09Å; K321-S323 PolarHBondContact O-N 2.83Å; K321-S324 WeakPolarHBondContact O-CA 2.95Å; K321-S324 WeakPolarHBondContact O-CB 3.38Å; K321-S324 PolarHBondContact O-N 3.38Å; K321-S324 PolarHBondContact O-OG 2.79Å
322	S	62.4	Low	83.3	Confident	32 Å²	32	46.3 Å²	46.3	22%	0.224	26%	0.261	C	S	.	.	H	α-helix	trans	-55.8	-39.7	179.2	65.6	0	0	0	0	112.3	K315 D318 A319 S324 L325	K315-S322 PolarHBondContact O-N 2.97Å; D318-S322 PolarHBondContact O-N 2.79Å; A319-S322 PolarHBondContact O-OG 3.1Å; S322-S324 PolarHBondContact O-N 2.8Å; S322-S324 VanDerWaalsContact O-N 3.11Å; S322-L325 PolarHBondContact O-N 2.91Å
323	S	67.8	Low	83.7	Confident	52 Å²	52	45.9 Å²	45.9	36%	0.364	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-61.6	-16.5	173.4	61.2	0	0	0	0	114	K321 L325 V326	K321-S323 PolarHBondContact O-N 2.83Å; S323-L325 PolarHBondContact O-N 2.89Å; S323-V326 VanDerWaalsContact O-CB 3.29Å; S323-V326 WeakPolarHBondContact O-CB 3.24Å; S323-V326 VanDerWaalsContact O-CG2 3.3Å; S323-V326 WeakPolarHBondContact O-CG2 3.45Å; S323-V326 PolarHBondContact O-N 2.87Å
324	S	75.2	Confident	84	Confident	26 Å²	26	44.4 Å²	44.4	18%	0.182	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-65.3	-18.1	175.8	74.6	0	0	0	0	113.6	K321 S322 V326 V327	K321-S324 WeakPolarHBondContact O-CA 2.95Å; K321-S324 WeakPolarHBondContact O-CB 3.38Å; K321-S324 PolarHBondContact O-N 3.38Å; K321-S324 PolarHBondContact O-OG 2.79Å; S322-S324 PolarHBondContact O-N 2.8Å; S322-S324 VanDerWaalsContact O-N 3.11Å; S324-V326 VanDerWaalsContact C-N 3.31Å; S324-V327 VanDerWaalsContact O-CB 3.28Å; S324-V327 WeakPolarHBondContact O-CB 3.18Å; S324-V327 VanDerWaalsContact O-CG2 3.27Å; S324-V327 WeakPolarHBondContact O-CG2 3.46Å; S324-V327 PolarHBondContact O-N 3.41Å
325	L	82.2	Confident	84.5	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-79	-16.9	178.5	-58	-178.1	0	0	0	113.4	F312 L316 S322 S323 V327 H328 W394 A398	F312-L325 HydrophobicContact CD2-CD2 4.2Å; F312-L325 HydrophobicContact CE2-CD1 3.64Å; F312-L325 HydrophobicContact CE2-CD2 3.56Å; F312-L325 HydrophobicContact CE2-CG 4.26Å; F312-L325 HydrophobicContact CZ-CD1 4.29Å; L316-L325 HydrophobicContact CD2-CD1 3.17Å; L316-L325 HydrophobicContact CG-CD1 3.85Å; S322-L325 PolarHBondContact O-N 2.91Å; S323-L325 PolarHBondContact O-N 2.89Å; L325-V327 PolarHBondContact O-N 3Å; L325-V327 VanDerWaalsContact O-N 3.14Å; L325-H328 WeakPolarHBondContact O-CB 3.2Å; L325-H328 PolarHBondContact O-N 2.95Å; L325-W394 HydrophobicContact CB-CE3 4.01Å; L325-W394 HydrophobicContact CB-CZ3 4.11Å; L325-W394 HydrophobicContact CD1-CZ3 4.46Å; L325-A398 HydrophobicContact CB-CB 4.41Å; L325-A398 HydrophobicContact CD1-CB 4.1Å
326	V	85.7	Confident	85.1	Confident	31 Å²	31	38.7 Å²	38.7	19%	0.188	22%	0.218	C	C	.	.	H	α-helix	trans	-54.5	-31.3	168.1	179.6	0	0	0	0	110.4	S323 S324 H328 S329 Y330 W394	S323-V326 VanDerWaalsContact O-CB 3.29Å; S323-V326 WeakPolarHBondContact O-CB 3.24Å; S323-V326 VanDerWaalsContact O-CG2 3.3Å; S323-V326 WeakPolarHBondContact O-CG2 3.45Å; S323-V326 PolarHBondContact O-N 2.87Å; S324-V326 VanDerWaalsContact C-N 3.31Å; V326-H328 VanDerWaalsContact C-N 3.26Å; V326-H328 PolarHBondContact O-N 2.9Å; V326-S329 WeakPolarHBondContact O-CA 3.15Å; V326-S329 WeakPolarHBondContact O-CB 3.21Å; V326-S329 PolarHBondContact O-N 3Å; V326-Y330 HydrophobicContact CG1-CD1 3.71Å; V326-Y330 HydrophobicContact CG1-CE1 3.3Å; V326-Y330 WeakPolarHBondContact O-CD1 3.4Å; V326-Y330 PolarHBondContact O-N 2.76Å; V326-W394 HydrophobicContact CG2-CB 4.37Å; V326-W394 HydrophobicContact CG2-CD2 3.99Å; V326-W394 HydrophobicContact CG2-CG 3.82Å
327	V	89.7	Confident	85.6	Confident	34 Å²	34	38.5 Å²	38.5	21%	0.206	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-31.2	177.7	-177.3	0	0	0	0	112.8	S324 L325 S329 Y330 R331 A356 R357 Y364	S324-V327 VanDerWaalsContact O-CB 3.28Å; S324-V327 WeakPolarHBondContact O-CB 3.18Å; S324-V327 VanDerWaalsContact O-CG2 3.27Å; S324-V327 WeakPolarHBondContact O-CG2 3.46Å; S324-V327 PolarHBondContact O-N 3.41Å; L325-V327 PolarHBondContact O-N 3Å; L325-V327 VanDerWaalsContact O-N 3.14Å; V327-S329 VanDerWaalsContact C-N 3.28Å; V327-S329 PolarHBondContact O-N 2.79Å; V327-Y330 PolarHBondContact O-N 2.82Å; V327-R331 PolarHBondContact O-N 3.25Å; V327-A356 HydrophobicContact CB-CB 4.42Å; V327-A356 HydrophobicContact CG1-CB 3.83Å; V327-A356 HydrophobicContact CG2-CB 3.66Å; V327-R357 HydrophobicContact CG2-CB 4.26Å; V327-Y364 HydrophobicContact CG1-CE2 4.36Å
328	H	90.4	Very high	86.2	Confident	65 Å²	65	34 Å²	34	30%	0.301	19%	0.189	S	C	.	.	H	α-helix	trans	-65.1	-37.4	174	-66.7	173.1	0	0	0	111.1	L325 V326 R331 A332 V397	L325-H328 WeakPolarHBondContact O-CB 3.2Å; L325-H328 PolarHBondContact O-N 2.95Å; V326-H328 VanDerWaalsContact C-N 3.26Å; V326-H328 PolarHBondContact O-N 2.9Å; H328-R331 PolarHBondContact O-N 3.12Å; H328-A332 WeakPolarHBondContact O-CB 3.33Å; H328-A332 PolarHBondContact O-N 3.41Å; H328-V397 HydrophobicContact CB-CG1 3.98Å
329	S	94.5	Very high	86.9	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-72.9	-37.6	176.1	-53.2	0	0	0	0	111.7	V326 V327 R331 A332 A333 W394	V326-S329 WeakPolarHBondContact O-CA 3.15Å; V326-S329 WeakPolarHBondContact O-CB 3.21Å; V326-S329 PolarHBondContact O-N 3Å; V327-S329 VanDerWaalsContact C-N 3.28Å; V327-S329 PolarHBondContact O-N 2.79Å; S329-R331 VanDerWaalsContact C-N 3.34Å; S329-R331 PolarHBondContact O-N 2.92Å; S329-A332 PolarHBondContact O-N 3.36Å; S329-A333 WeakPolarHBondContact O-CB 3.36Å; S329-A333 PolarHBondContact O-N 2.87Å; S329-W394 WeakPolarHBondContact OG-CA 3.26Å; S329-W394 WeakPolarHBondContact OG-CB 3.5Å
330	Y	95.6	Very high	88.1	Confident	28 Å²	28	32.1 Å²	32.1	11%	0.11	17%	0.173	C	C	.	.	H	α-helix	trans	-57.8	-49.2	172	-75.8	14.4	0	0	0	110.5	V326 V327 A332 A333 L334 L359 F361 Y364 L391	V326-Y330 HydrophobicContact CG1-CD1 3.71Å; V326-Y330 HydrophobicContact CG1-CE1 3.3Å; V326-Y330 WeakPolarHBondContact O-CD1 3.4Å; V326-Y330 PolarHBondContact O-N 2.76Å; V327-Y330 PolarHBondContact O-N 2.82Å; Y330-A332 VanDerWaalsContact C-N 3.34Å; Y330-A332 PolarHBondContact O-N 3.25Å; Y330-A333 PolarHBondContact O-N 3.31Å; Y330-L334 VanDerWaalsContact O-CB 3.23Å; Y330-L334 WeakPolarHBondContact O-CB 3.31Å; Y330-L334 PolarHBondContact O-N 2.84Å; Y330-L359 WeakPolarHBondContact CE2-O 3.46Å; Y330-L359 PolarHBondContact OH-O 3.43Å; Y330-F361 HydrophobicContact CD1-CB 4.41Å; Y330-F361 HydrophobicContact CD1-CD2 4.03Å; Y330-F361 HydrophobicContact CD2-CD2 4.44Å; Y330-F361 HydrophobicContact CE1-CB 4.07Å; Y330-F361 HydrophobicContact CE2-CB 4.43Å; Y330-F361 AromaticContact CG-CD2 3.96Å; Y330-F361 HydrophobicContact CG-CD2 3.96Å; Y330-Y364 AromaticContact CD2-CD1 3.84Å; Y330-Y364 HydrophobicContact CD2-CD1 3.84Å; Y330-Y364 HydrophobicContact CD2-CD2 4.17Å; Y330-Y364 AromaticContact CD2-CG 3.6Å; Y330-Y364 HydrophobicContact CD2-CG 3.6Å; Y330-Y364 HydrophobicContact CE2-CG 4.45Å; Y330-Y364 HydrophobicContact CG-CD1 4.18Å; Y330-Y364 HydrophobicContact CG-CG 4.37Å; Y330-L391 HydrophobicContact CD1-CD2 3.45Å; Y330-L391 VanDerWaalsContact CD1-CD2 3.45Å; Y330-L391 HydrophobicContact CE1-CD2 3.76Å; Y330-L391 HydrophobicContact CG-CD2 4.48Å
331	R	95.6	Very high	89.3	Confident	45 Å²	45	32.2 Å²	32.2	17%	0.17	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-40.8	-179.6	-178.2	62	-169.8	88.6	-3.9	112.1	V41 V327 H328 S329 E335 Y364	V41-R331 HydrophobicContact CB-CG 4.37Å; V41-R331 HydrophobicContact CG1-CG 3.66Å; V327-R331 PolarHBondContact O-N 3.25Å; H328-R331 PolarHBondContact O-N 3.12Å; S329-R331 VanDerWaalsContact C-N 3.34Å; S329-R331 PolarHBondContact O-N 2.92Å; R331-E335 IonicContact CZ-OE2 3.78Å; R331-E335 IonicContact NH1-OE2 2.78Å; R331-E335 PolarHBondContact NH1-OE2 3.49Å; R331-E335 IonicContact NH2-OE2 3.55Å; R331-E335 PolarHBondContact NH2-OE2 2.62Å; R331-E335 PolarHBondContact O-N 3.23Å; R331-Y364 WeakPolarHBondContact CD-OH 3.47Å
332	A	97.4	Very high	90.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-40.6	179.6	0	0	0	0	0	112.9	V41 F43 F44 H328 S329 Y330 L334 E335 W336	V41-A332 WeakPolarHBondContact O-CA 3.34Å; F43-A332 HydrophobicContact CB-CB 4.08Å; F44-A332 HydrophobicContact CD2-CB 3.66Å; F44-A332 HydrophobicContact CE2-CB 3.81Å; H328-A332 WeakPolarHBondContact O-CB 3.33Å; H328-A332 PolarHBondContact O-N 3.41Å; S329-A332 PolarHBondContact O-N 3.36Å; Y330-A332 VanDerWaalsContact C-N 3.34Å; Y330-A332 PolarHBondContact O-N 3.25Å; A332-L334 VanDerWaalsContact C-N 3.34Å; A332-E335 WeakPolarHBondContact O-CB 3.39Å; A332-E335 PolarHBondContact O-N 3.24Å; A332-W336 PolarHBondContact O-N 3.19Å
333	A	97.5	Very high	91.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-39.6	176.2	0	0	0	0	0	111	F44 S329 Y330 W336 L337 F361 M390 L391	F44-A333 HydrophobicContact CD2-CB 4.42Å; F44-A333 HydrophobicContact CE2-CB 4.34Å; S329-A333 WeakPolarHBondContact O-CB 3.36Å; S329-A333 PolarHBondContact O-N 2.87Å; Y330-A333 PolarHBondContact O-N 3.31Å; A333-W336 PolarHBondContact O-N 2.93Å; A333-L337 WeakPolarHBondContact O-CB 3.27Å; A333-L337 PolarHBondContact O-N 3.02Å; A333-F361 HydrophobicContact CB-CE2 4.08Å; A333-F361 HydrophobicContact CB-CZ 4.34Å; A333-M390 HydrophobicContact CB-CB 4.03Å; A333-M390 HydrophobicContact CB-SD 4.18Å; A333-L391 HydrophobicContact CB-CD2 4.09Å
334	L	97.2	Very high	93.1	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-38.5	173.9	-177.8	58.1	0	0	0	112	Y330 A332 L337 L338 L350 F361 Y364 A365 A368 T369	Y330-L334 VanDerWaalsContact O-CB 3.23Å; Y330-L334 WeakPolarHBondContact O-CB 3.31Å; Y330-L334 PolarHBondContact O-N 2.84Å; A332-L334 VanDerWaalsContact C-N 3.34Å; L334-L337 HydrophobicContact CD1-CD2 4.4Å; L334-L337 PolarHBondContact O-N 2.98Å; L334-L338 HydrophobicContact CD1-CD1 4.34Å; L334-L338 HydrophobicContact CD1-CG 4.2Å; L334-L338 HydrophobicContact CG-CD1 4.11Å; L334-L338 HydrophobicContact CG-CG 4.42Å; L334-L338 WeakPolarHBondContact O-CB 3.3Å; L334-L338 VanDerWaalsContact O-CG 3.24Å; L334-L338 WeakPolarHBondContact O-CG 3.32Å; L334-L338 PolarHBondContact O-N 3.33Å; L334-L350 HydrophobicContact CD2-CD1 3.54Å; L334-L350 HydrophobicContact CG-CD1 4.11Å; L334-F361 HydrophobicContact CB-CE2 4.12Å; L334-F361 HydrophobicContact CB-CZ 4.26Å; L334-Y364 HydrophobicContact CD2-CD1 4.43Å; L334-Y364 HydrophobicContact CD2-CE1 3.83Å; L334-A365 HydrophobicContact CD1-CB 3.96Å; L334-A365 HydrophobicContact CD2-CB 4.41Å; L334-A368 HydrophobicContact CD2-CB 3.78Å; L334-T369 HydrophobicContact CD1-CG2 3.99Å; L334-T369 HydrophobicContact CD2-CG2 4.11Å; L334-T369 HydrophobicContact CG-CG2 4.46Å
335	E	97.9	Very high	94	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.1	-47.1	172.9	-167.9	60.8	-146.7	0	0	111.3	V41 V45 R331 A332 L337 L338 V339 R346 R347	V41-E335 WeakPolarHBondContact O-CB 3.46Å; V41-E335 WeakPolarHBondContact O-CG 3.4Å; V45-E335 HydrophobicContact CG2-CB 4.48Å; V45-E335 HydrophobicContact CG2-CG 4.05Å; R331-E335 IonicContact CZ-OE2 3.78Å; R331-E335 IonicContact NH1-OE2 2.78Å; R331-E335 PolarHBondContact NH1-OE2 3.49Å; R331-E335 IonicContact NH2-OE2 3.55Å; R331-E335 PolarHBondContact NH2-OE2 2.62Å; R331-E335 PolarHBondContact O-N 3.23Å; A332-E335 WeakPolarHBondContact O-CB 3.39Å; A332-E335 PolarHBondContact O-N 3.24Å; E335-L337 VanDerWaalsContact C-N 3.31Å; E335-L337 PolarHBondContact O-N 3.27Å; E335-L338 PolarHBondContact O-N 3.16Å; E335-V339 HydrophobicContact CG-CG2 4.41Å; E335-V339 WeakPolarHBondContact O-CB 3.11Å; E335-V339 WeakPolarHBondContact O-CG2 3.11Å; E335-V339 PolarHBondContact O-N 2.84Å; E335-V339 WeakPolarHBondContact OE1-CG2 3.33Å; E335-R346 WeakPolarHBondContact OE1-CA 3.48Å; E335-R347 WeakPolarHBondContact OE1-CA 3.47Å; E335-R347 PolarHBondContact OE1-N 2.87Å
336	W	98.1	Very high	94.6	Very high	39 Å²	39	43.6 Å²	43.6	15%	0.148	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-43.2	176.3	179	91.6	0	0	0	112.3	F44 V45 A332 A333 C340 R341 T386 V387 M390	F44-W336 HydrophobicContact CB-CB 4.01Å; F44-W336 HydrophobicContact CB-CG 4.26Å; V45-W336 HydrophobicContact CG2-CB 4.06Å; A332-W336 PolarHBondContact O-N 3.19Å; A333-W336 PolarHBondContact O-N 2.93Å; W336-C340 VanDerWaalsContact CD1-SG 3.58Å; W336-C340 HydrophobicContact CD2-CB 4.31Å; W336-C340 HydrophobicContact CG-CB 4.42Å; W336-C340 HydrophobicContact CZ2-CB 4.46Å; W336-C340 WeakPolarHBondContact O-CA 3.36Å; W336-C340 WeakPolarHBondContact O-CB 3.33Å; W336-C340 PolarHBondContact O-N 3.49Å; W336-R341 HydrophobicContact CE3-CG 4.46Å; W336-R341 HydrophobicContact CH2-CG 3.97Å; W336-R341 HydrophobicContact CZ3-CG 3.78Å; W336-T386 HydrophobicContact CH2-CG2 3.75Å; W336-T386 HydrophobicContact CZ2-CG2 3.9Å; W336-T386 HydrophobicContact CZ3-CG2 4.31Å; W336-V387 HydrophobicContact CZ3-CG2 4.28Å; W336-M390 HydrophobicContact CB-CE 4.12Å; W336-M390 HydrophobicContact CB-SD 4.08Å; W336-M390 HydrophobicContact CD2-CE 3.28Å; W336-M390 HydrophobicContact CD2-SD 3.95Å; W336-M390 VanDerWaalsContact CE2-CE 3.46Å; W336-M390 HydrophobicContact CE3-CE 3.79Å; W336-M390 HydrophobicContact CE3-SD 4.01Å; W336-M390 HydrophobicContact CG-CE 3.41Å; W336-M390 VanDerWaalsContact CG-CE 3.41Å; W336-M390 HydrophobicContact CG-SD 3.97Å; W336-M390 HydrophobicContact CZ2-CE 4.09Å; W336-M390 HydrophobicContact CZ3-CE 4.37Å
337	L	96.6	Very high	94.8	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	24%	0.235	C	C	.	.	I	π-helix	trans	-60.6	-51.9	176.5	-167.5	102.4	0	0	0	111.4	A333 L334 E335 V339 R341 L342 L381 V387	A333-L337 WeakPolarHBondContact O-CB 3.27Å; A333-L337 PolarHBondContact O-N 3.02Å; L334-L337 HydrophobicContact CD1-CD2 4.4Å; L334-L337 PolarHBondContact O-N 2.98Å; E335-L337 VanDerWaalsContact C-N 3.31Å; E335-L337 PolarHBondContact O-N 3.27Å; L337-V339 PolarHBondContact O-N 3.17Å; L337-R341 HydrophobicContact CD1-CG 4.42Å; L337-R341 HydrophobicContact CG-CB 4.43Å; L337-R341 WeakPolarHBondContact O-CA 3.44Å; L337-R341 VanDerWaalsContact O-CB 3.26Å; L337-R341 WeakPolarHBondContact O-CB 3.48Å; L337-R341 PolarHBondContact O-N 2.69Å; L337-L342 HydrophobicContact CD2-CD1 3.79Å; L337-L342 HydrophobicContact CG-CD1 4.4Å; L337-L342 PolarHBondContact O-N 3.09Å; L337-L381 HydrophobicContact CD1-CB 4.19Å; L337-L381 HydrophobicContact CD1-CD2 3.91Å; L337-L381 HydrophobicContact CD1-CG 4.43Å; L337-L381 HydrophobicContact CD2-CD1 3.7Å; L337-L381 HydrophobicContact CD2-CD2 4.36Å; L337-L381 HydrophobicContact CD2-CG 4.44Å; L337-V387 HydrophobicContact CD1-CG2 4.02Å
338	L	96.5	Very high	94.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	23%	0.233	C	C	.	.	I	π-helix	trans	-59.2	-47	-178.7	-70.7	172.3	0	0	0	111.2	L334 E335 L342 C343 F344 L350 T369 L372 L374	L334-L338 HydrophobicContact CD1-CD1 4.34Å; L334-L338 HydrophobicContact CD1-CG 4.2Å; L334-L338 HydrophobicContact CG-CD1 4.11Å; L334-L338 HydrophobicContact CG-CG 4.42Å; L334-L338 WeakPolarHBondContact O-CB 3.3Å; L334-L338 VanDerWaalsContact O-CG 3.24Å; L334-L338 WeakPolarHBondContact O-CG 3.32Å; L334-L338 PolarHBondContact O-N 3.33Å; E335-L338 PolarHBondContact O-N 3.16Å; L338-L342 HydrophobicContact CD2-CD1 4.06Å; L338-L342 CarbonylContact O-C 3.55Å; L338-L342 VanDerWaalsContact O-C 3.26Å; L338-L342 WeakPolarHBondContact O-CA 3.38Å; L338-L342 WeakPolarHBondContact O-CB 3.46Å; L338-L342 PolarHBondContact O-N 3.19Å; L338-C343 PolarHBondContact O-N 2.84Å; L338-C343 VanDerWaalsContact O-N 3.11Å; L338-F344 HydrophobicContact CB-CB 4.09Å; L338-F344 HydrophobicContact CB-CG 4.45Å; L338-F344 HydrophobicContact CD2-CD2 4.34Å; L338-F344 HydrophobicContact CD2-CG 4.41Å; L338-F344 WeakPolarHBondContact O-CB 3.03Å; L338-F344 PolarHBondContact O-N 3.13Å; L338-L350 HydrophobicContact CD1-CD1 4.19Å; L338-L350 HydrophobicContact CD1-CD2 3.88Å; L338-T369 HydrophobicContact CD1-CG2 4.48Å; L338-T369 HydrophobicContact CD2-CG2 4.31Å; L338-L372 HydrophobicContact CD1-CD1 4.27Å; L338-L372 HydrophobicContact CD2-CD1 3.99Å; L338-L374 HydrophobicContact CD2-CD1 3.74Å
339	V	97	Very high	95	Very high	26 Å²	26	54.2 Å²	54.2	16%	0.158	26%	0.257	C	S	.	.	I	π-helix	trans	-77.1	-52.5	-175.3	176.3	0	0	0	0	111.8	V45 E335 L337 C343 R346	V45-V339 HydrophobicContact CG1-CG1 4.19Å; V45-V339 HydrophobicContact CG2-CB 4.3Å; E335-V339 HydrophobicContact CG-CG2 4.41Å; E335-V339 WeakPolarHBondContact O-CB 3.11Å; E335-V339 WeakPolarHBondContact O-CG2 3.11Å; E335-V339 PolarHBondContact O-N 2.84Å; E335-V339 WeakPolarHBondContact OE1-CG2 3.33Å; L337-V339 PolarHBondContact O-N 3.17Å; V339-C343 WeakPolarHBondContact O-CA 2.97Å; V339-C343 PolarHBondContact O-N 3.25Å; V339-R346 HydrophobicContact CG1-CG 4.08Å; V339-R346 HydrophobicContact CG2-CB 4.4Å; V339-R346 HydrophobicContact CG2-CG 3.95Å
340	C	95.6	Very high	95	Very high	63 Å²	63	55.5 Å²	55.5	43%	0.426	26%	0.263	S	S	.	.	I	π-helix	trans	-89.3	-27.6	-167.6	-54.6	0	0	0	0	113.3	W336	W336-C340 VanDerWaalsContact CD1-SG 3.58Å; W336-C340 HydrophobicContact CD2-CB 4.31Å; W336-C340 HydrophobicContact CG-CB 4.42Å; W336-C340 HydrophobicContact CZ2-CB 4.46Å; W336-C340 WeakPolarHBondContact O-CA 3.36Å; W336-C340 WeakPolarHBondContact O-CB 3.33Å; W336-C340 PolarHBondContact O-N 3.49Å
341	R	92.9	Very high	94.9	Very high	137 Å²	137	60.1 Å²	60.1	52%	0.517	28%	0.282	S	S	.	.	I	π-helix	trans	-99.8	-37.2	177.4	-64.8	-67.9	-153.5	161.7	6.1	112.6	W336 L337 D384	W336-R341 HydrophobicContact CE3-CG 4.46Å; W336-R341 HydrophobicContact CH2-CG 3.97Å; W336-R341 HydrophobicContact CZ3-CG 3.78Å; L337-R341 HydrophobicContact CD1-CG 4.42Å; L337-R341 HydrophobicContact CG-CB 4.43Å; L337-R341 WeakPolarHBondContact O-CA 3.44Å; L337-R341 VanDerWaalsContact O-CB 3.26Å; L337-R341 WeakPolarHBondContact O-CB 3.48Å; L337-R341 PolarHBondContact O-N 2.69Å; R341-D384 IonicContact CZ-OD2 3.65Å; R341-D384 IonicContact NH2-OD2 3.54Å; R341-D384 PolarHBondContact NH2-OD2 2.9Å
342	L	92.3	Very high	94.8	Very high	49 Å²	49	63.8 Å²	63.8	26%	0.257	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	3.3	-172.1	-56.6	171.4	0	0	0	113.8	L337 L338 F344 L374 L376	L337-L342 HydrophobicContact CD2-CD1 3.79Å; L337-L342 HydrophobicContact CG-CD1 4.4Å; L337-L342 PolarHBondContact O-N 3.09Å; L338-L342 HydrophobicContact CD2-CD1 4.06Å; L338-L342 CarbonylContact O-C 3.55Å; L338-L342 VanDerWaalsContact O-C 3.26Å; L338-L342 WeakPolarHBondContact O-CA 3.38Å; L338-L342 WeakPolarHBondContact O-CB 3.46Å; L338-L342 PolarHBondContact O-N 3.19Å; L342-F344 HydrophobicContact CB-CD2 3.81Å; L342-F344 HydrophobicContact CB-CE2 4.13Å; L342-F344 WeakPolarHBondContact O-CD2 3.29Å; L342-F344 PolarHBondContact O-N 2.75Å; L342-L374 HydrophobicContact CD1-CD1 4.49Å; L342-L376 HydrophobicContact CD1-CD1 3.51Å; L342-L376 HydrophobicContact CD1-CD2 4.48Å; L342-L376 HydrophobicContact CD2-CD1 4.48Å; L342-L376 HydrophobicContact CD2-CD2 3.97Å
343	C	92.7	Very high	94.5	Very high	116 Å²	116	65.1 Å²	65.1	78%	0.784	32%	0.319	S	S	*	.			trans	57.5	29.6	176.1	-57.3	0	0	0	0	114.9	L338 V339	L338-C343 PolarHBondContact O-N 2.84Å; L338-C343 VanDerWaalsContact O-N 3.11Å; V339-C343 WeakPolarHBondContact O-CA 2.97Å; V339-C343 PolarHBondContact O-N 3.25Å
344	F	94.1	Very high	94.1	Very high	63 Å²	63	76.2 Å²	76.2	28%	0.276	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-74.5	155	172.9	-84.2	-110.1	0	0	0	111.8	L338 L342 L372 L374	L338-F344 HydrophobicContact CB-CB 4.09Å; L338-F344 HydrophobicContact CB-CG 4.45Å; L338-F344 HydrophobicContact CD2-CD2 4.34Å; L338-F344 HydrophobicContact CD2-CG 4.41Å; L338-F344 WeakPolarHBondContact O-CB 3.03Å; L338-F344 PolarHBondContact O-N 3.13Å; L342-F344 HydrophobicContact CB-CD2 3.81Å; L342-F344 HydrophobicContact CB-CE2 4.13Å; L342-F344 WeakPolarHBondContact O-CD2 3.29Å; L342-F344 PolarHBondContact O-N 2.75Å; F344-L372 HydrophobicContact CD1-CD1 4.28Å; F344-L372 HydrophobicContact CE1-CB 4.31Å; F344-L372 HydrophobicContact CE1-CD1 3.95Å; F344-L372 HydrophobicContact CE1-CD2 4.22Å; F344-L372 HydrophobicContact CE1-CG 4.39Å; F344-L374 HydrophobicContact CE2-CD2 3.73Å; F344-L374 HydrophobicContact CZ-CD1 4.39Å; F344-L374 HydrophobicContact CZ-CD2 3.55Å; F344-L374 HydrophobicContact CZ-CG 4.3Å
345	S	94.7	Very high	93.6	Very high	97 Å²	97	81.4 Å²	81.4	68%	0.678	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-60.1	139.3	165.3	-61	0	0	0	0	110.9	S348	S345-S348 PolarHBondContact O-N 3Å; S345-S348 PolarHBondContact O-OG 2.99Å
346	R	93.9	Very high	93.2	Very high	117 Å²	117	81.7 Å²	81.7	44%	0.442	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	143.9	175.2	-65.3	-177.2	175.9	-149.4	-4	111.4	D46 E335 V339 S348	D46-R346 VanDerWaalsContact CG-NH1 3.34Å; D46-R346 IonicContact OD1-CZ 3.74Å; D46-R346 IonicContact OD1-NH1 2.88Å; D46-R346 PolarHBondContact OD1-NH1 2.66Å; D46-R346 IonicContact OD1-NH2 2.78Å; D46-R346 PolarHBondContact OD1-NH2 3.11Å; D46-R346 IonicContact OD2-NH1 3.2Å; D46-R346 PolarHBondContact OD2-NH1 2.92Å; E335-R346 WeakPolarHBondContact OE1-CA 3.48Å; V339-R346 HydrophobicContact CG1-CG 4.08Å; V339-R346 HydrophobicContact CG2-CB 4.4Å; V339-R346 HydrophobicContact CG2-CG 3.95Å; R346-S348 PolarHBondContact O-N 3.16Å
347	R	91.5	Very high	92.6	Very high	118 Å²	118	84.4 Å²	84.4	45%	0.445	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	37.8	176.1	-56.5	174.9	-71	-128.3	7.2	112.2	F39 V41 D42 E335 R349	F39-R347 VanDerWaalsContact CD2-NH1 3.3Å; V41-R347 HydrophobicContact CG2-CG 3.8Å; D42-R347 IonicContact OD2-CZ 2.83Å; D42-R347 IonicContact OD2-NH1 3.21Å; D42-R347 PolarHBondContact OD2-NH1 3.21Å; E335-R347 WeakPolarHBondContact OE1-CA 3.47Å; E335-R347 PolarHBondContact OE1-N 2.87Å; R347-R349 PolarHBondContact O-N 3.29Å
348	S	91.2	Very high	92.2	Very high	22 Å²	22	89.6 Å²	89.6	15%	0.154	43%	0.425	C	S	.	.			trans	-50.7	138.8	171.5	-75.5	0	0	0	0	110.3	S345 R346 L350	S345-S348 PolarHBondContact O-N 3Å; S345-S348 PolarHBondContact O-OG 2.99Å; R346-S348 PolarHBondContact O-N 3.16Å; S348-L350 PolarHBondContact O-N 2.79Å
349	R	92.7	Very high	92	Very high	214 Å²	214	90.8 Å²	90.8	81%	0.808	43%	0.432	S	S	*	.			trans	-67.7	118.4	-178.4	-175.4	178.8	-177.8	-177.8	0.1	109	R347 N371	R347-R349 PolarHBondContact O-N 3.29Å; R349-N371 PolarHBondContact O-ND2 3.42Å
350	L	93.8	Very high	91.9	Very high	26 Å²	26	91.4 Å²	91.4	14%	0.136	44%	0.437	C	S	.	.			trans	-108.4	156.2	175.7	-57.4	-173.3	0	0	0	110.5	L334 L338 S348 A368 T369 L372	L334-L350 HydrophobicContact CD2-CD1 3.54Å; L334-L350 HydrophobicContact CG-CD1 4.11Å; L338-L350 HydrophobicContact CD1-CD1 4.19Å; L338-L350 HydrophobicContact CD1-CD2 3.88Å; S348-L350 PolarHBondContact O-N 2.79Å; L350-A368 WeakPolarHBondContact CA-O 3.46Å; L350-A368 HydrophobicContact CB-CB 4.39Å; L350-A368 WeakPolarHBondContact CB-O 3.22Å; L350-A368 HydrophobicContact CD1-CB 4.36Å; L350-T369 HydrophobicContact CD2-CG2 4.2Å; L350-L372 HydrophobicContact CD2-CD1 3.76Å; L350-L372 HydrophobicContact CD2-CG 4.44Å
351	Y	94.7	Very high	91.9	Very high	125 Å²	125	88.5 Å²	88.5	49%	0.49	42%	0.417	S	S	.	.			trans	-73.6	143.1	172.8	-74.7	-35.2	0	0	0	112.2	V353 A368 R370 N371	Y351-V353 PolarHBondContact O-N 3.34Å; Y351-A368 PolarHBondContact N-O 3.14Å; Y351-R370 HydrophobicContact CD2-CB 4Å; Y351-R370 HydrophobicContact CE2-CB 4.09Å; Y351-N371 HydrophobicContact CD2-CB 4.17Å; Y351-N371 HydrophobicContact CE1-CB 4.08Å; Y351-N371 HydrophobicContact CE2-CB 3.61Å
352	P	91.9	Very high	92.1	Very high	122 Å²	122	82.3 Å²	82.3	79%	0.792	40%	0.395	S	S	*	.			trans	-69.2	123.8	172.4	28.6	-32.7	0	0	0	110.1
353	V	92.5	Very high	92.3	Very high	28 Å²	28	84.1 Å²	84.1	17%	0.17	40%	0.402	C	S	.	.			trans	-94.7	114.9	178.4	-174.4	0	0	0	0	109.6	Y351 A356 L359 Y364 K367 A368	Y351-V353 PolarHBondContact O-N 3.34Å; V353-A356 HydrophobicContact CB-CB 4.21Å; V353-A356 HydrophobicContact CG1-CB 4.13Å; V353-L359 HydrophobicContact CG1-CD1 3.57Å; V353-Y364 HydrophobicContact CB-CD2 3.77Å; V353-Y364 HydrophobicContact CB-CE2 3.88Å; V353-Y364 HydrophobicContact CG1-CD2 3.98Å; V353-Y364 HydrophobicContact CG2-CD2 3.79Å; V353-Y364 HydrophobicContact CG2-CE2 3.8Å; V353-K367 HydrophobicContact CG1-CB 4.06Å; V353-K367 HydrophobicContact CG1-CD 4.05Å; V353-K367 HydrophobicContact CG2-CB 3.84Å; V353-A368 HydrophobicContact CG2-CB 3.77Å
354	R	88.9	Confident	92.5	Very high	233 Å²	233	79.3 Å²	79.3	88%	0.879	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	139.1	174.8	-66.5	-174.8	-178.2	-177.1	2	109.7	A356	R354-A356 PolarHBondContact O-N 3.15Å; R354-A356 VanDerWaalsContact O-N 3.13Å
355	E	86.8	Confident	92.6	Very high	111 Å²	111	76.4 Å²	76.4	52%	0.519	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	34.2	177.2	-53.5	-154.1	-114.9	0	0	114.5	R357 L358	E355-R357 PolarHBondContact O-N 3.2Å; E355-R357 IonicContact OE2-CZ 3.6Å; E355-R357 IonicContact OE2-NH1 3.26Å; E355-R357 PolarHBondContact OE2-NH1 2.86Å; E355-R357 IonicContact OE2-NH2 3.98Å; E355-R357 PolarHBondContact OE2-NH2 2.79Å; E355-L358 HydrophobicContact CB-CD1 4.07Å; E355-L358 HydrophobicContact CB-CG 4.35Å; E355-L358 WeakPolarHBondContact O-CB 3.11Å; E355-L358 PolarHBondContact O-N 2.87Å; E355-L358 WeakPolarHBondContact OE2-CD1 3.49Å
356	A	88.9	Confident	92.7	Very high	6 Å²	6	76.2 Å²	76.2	5%	0.05	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-50.4	-26.5	-179.7	0	0	0	0	0	114.7	V327 V353 R354 L358 L359 Y364	V327-A356 HydrophobicContact CB-CB 4.42Å; V327-A356 HydrophobicContact CG1-CB 3.83Å; V327-A356 HydrophobicContact CG2-CB 3.66Å; V353-A356 HydrophobicContact CB-CB 4.21Å; V353-A356 HydrophobicContact CG1-CB 4.13Å; R354-A356 PolarHBondContact O-N 3.15Å; R354-A356 VanDerWaalsContact O-N 3.13Å; A356-L358 PolarHBondContact O-N 2.9Å; A356-L359 PolarHBondContact O-N 2.68Å; A356-Y364 HydrophobicContact CB-CD2 3.6Å; A356-Y364 HydrophobicContact CB-CE2 3.93Å
357	R	85.9	Confident	92.8	Very high	95 Å²	95	73.9 Å²	73.9	36%	0.358	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-63.1	-21.8	175.7	76.8	-174.5	-175.8	-67.1	-10.3	114.3	V327 E355	V327-R357 HydrophobicContact CG2-CB 4.26Å; E355-R357 PolarHBondContact O-N 3.2Å; E355-R357 IonicContact OE2-CZ 3.6Å; E355-R357 IonicContact OE2-NH1 3.26Å; E355-R357 PolarHBondContact OE2-NH1 2.86Å; E355-R357 IonicContact OE2-NH2 3.98Å; E355-R357 PolarHBondContact OE2-NH2 2.79Å
358	L	88.9	Confident	93.1	Very high	113 Å²	113	68.2 Å²	68.2	59%	0.592	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-93.9	1.6	-179	-57.5	-178.1	0	0	0	112.2	E355 A356	E355-L358 HydrophobicContact CB-CD1 4.07Å; E355-L358 HydrophobicContact CB-CG 4.35Å; E355-L358 WeakPolarHBondContact O-CB 3.11Å; E355-L358 PolarHBondContact O-N 2.87Å; E355-L358 WeakPolarHBondContact OE2-CD1 3.49Å; A356-L358 PolarHBondContact O-N 2.9Å
359	L	92.3	Very high	93.3	Very high	26 Å²	26	67.2 Å²	67.2	14%	0.136	31%	0.309	C	S	.	.	S	Bend	trans	-109.7	152.3	-173.8	-57.8	-178.3	0	0	0	110.9	Y330 V353 A356 E363 K367	Y330-L359 WeakPolarHBondContact CE2-O 3.46Å; Y330-L359 PolarHBondContact OH-O 3.43Å; V353-L359 HydrophobicContact CG1-CD1 3.57Å; A356-L359 PolarHBondContact O-N 2.68Å; L359-E363 VanDerWaalsContact CA-OE2 3.31Å; L359-E363 WeakPolarHBondContact CA-OE2 3.41Å; L359-E363 HydrophobicContact CB-CB 4.04Å; L359-E363 HydrophobicContact CD2-CB 4.43Å; L359-K367 HydrophobicContact CD1-CD 3.76Å
360	S	94.4	Very high	93.4	Very high	39 Å²	39	64 Å²	64	27%	0.273	30%	0.296	S	S	.	.			trans	-65.1	167.3	162.4	94.5	0	0	0	0	110.5	A362 E363 Y364 E382	S360-A362 VanDerWaalsContact C-N 3.33Å; S360-A362 PolarHBondContact OG-N 3.34Å; S360-E363 PolarHBondContact N-OE2 2.87Å; S360-E363 PolarHBondContact OG-N 2.85Å; S360-Y364 WeakPolarHBondContact O-CB 3.1Å; S360-Y364 PolarHBondContact O-N 2.87Å; S360-E382 WeakPolarHBondContact CB-OE2 3.38Å; S360-E382 PolarHBondContact OG-OE2 3.15Å
361	F	95.9	Very high	93.4	Very high	1 Å²	1	65 Å²	65	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-39.8	175.1	172.4	-102.3	0	0	0	111.3	Y330 A333 L334 Y364 A365 E382 V387 L391	Y330-F361 HydrophobicContact CD1-CB 4.41Å; Y330-F361 HydrophobicContact CD1-CD2 4.03Å; Y330-F361 HydrophobicContact CD2-CD2 4.44Å; Y330-F361 HydrophobicContact CE1-CB 4.07Å; Y330-F361 HydrophobicContact CE2-CB 4.43Å; Y330-F361 AromaticContact CG-CD2 3.96Å; Y330-F361 HydrophobicContact CG-CD2 3.96Å; A333-F361 HydrophobicContact CB-CE2 4.08Å; A333-F361 HydrophobicContact CB-CZ 4.34Å; L334-F361 HydrophobicContact CB-CE2 4.12Å; L334-F361 HydrophobicContact CB-CZ 4.26Å; F361-Y364 HydrophobicContact CD2-CD1 4.47Å; F361-Y364 PolarHBondContact O-N 3.16Å; F361-A365 HydrophobicContact CE1-CB 4.43Å; F361-A365 HydrophobicContact CZ-CB 4.37Å; F361-A365 VanDerWaalsContact O-CB 3.23Å; F361-A365 WeakPolarHBondContact O-CB 3.01Å; F361-A365 PolarHBondContact O-N 3.05Å; F361-E382 HydrophobicContact CB-CG 4.05Å; F361-E382 HydrophobicContact CD1-CB 3.96Å; F361-E382 HydrophobicContact CD1-CG 4.25Å; F361-E382 PolarHBondContact N-OE1 3.38Å; F361-E382 VanDerWaalsContact N-OE1 3.09Å; F361-V387 HydrophobicContact CD1-CG1 3.84Å; F361-V387 HydrophobicContact CE1-CG1 3.58Å; F361-V387 HydrophobicContact CZ-CG1 4.13Å; F361-L391 HydrophobicContact CB-CD1 3.57Å; F361-L391 HydrophobicContact CB-CD2 4.16Å; F361-L391 HydrophobicContact CD1-CD1 4.22Å; F361-L391 HydrophobicContact CD2-CD1 4.36Å; F361-L391 HydrophobicContact CD2-CD2 3.62Å; F361-L391 HydrophobicContact CE2-CD2 4.2Å; F361-L391 HydrophobicContact CG-CD1 3.8Å; F361-L391 HydrophobicContact CG-CD2 3.94Å; F361-L391 HydrophobicContact CG-CG 4.47Å
362	A	97	Very high	93.4	Very high	7 Å²	7	60.9 Å²	60.9	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-49.3	177	0	0	0	0	0	112.1	S360 Y364 A365 E366 Y378 E382	S360-A362 VanDerWaalsContact C-N 3.33Å; S360-A362 PolarHBondContact OG-N 3.34Å; A362-Y364 VanDerWaalsContact C-N 3.35Å; A362-Y364 PolarHBondContact O-N 2.59Å; A362-A365 PolarHBondContact O-N 2.89Å; A362-E366 WeakPolarHBondContact O-CB 3.2Å; A362-E366 PolarHBondContact O-N 2.9Å; A362-Y378 WeakPolarHBondContact CB-O 3.29Å; A362-E382 HydrophobicContact CB-CB 4.14Å; A362-E382 WeakPolarHBondContact CB-OE2 3.43Å; A362-E382 PolarHBondContact N-OE2 3.25Å
363	E	96.3	Very high	93.2	Very high	87 Å²	87	62.2 Å²	62.2	41%	0.407	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-39.3	178.6	-66.3	178.7	127.4	0	0	112.4	L359 S360 K367	L359-E363 VanDerWaalsContact CA-OE2 3.31Å; L359-E363 WeakPolarHBondContact CA-OE2 3.41Å; L359-E363 HydrophobicContact CB-CB 4.04Å; L359-E363 HydrophobicContact CD2-CB 4.43Å; S360-E363 PolarHBondContact N-OE2 2.87Å; S360-E363 PolarHBondContact OG-N 2.85Å; E363-K367 WeakPolarHBondContact O-CB 3.43Å; E363-K367 VanDerWaalsContact O-CG 3.27Å; E363-K367 WeakPolarHBondContact O-CG 3.05Å; E363-K367 PolarHBondContact O-N 3.43Å
364	Y	96.3	Very high	93.1	Very high	15 Å²	15	62.7 Å²	62.7	6%	0.059	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-49.6	173.8	166.4	-94.9	0	0	0	111	V327 Y330 R331 L334 V353 A356 S360 F361 A362 K367 A368	V327-Y364 HydrophobicContact CG1-CE2 4.36Å; Y330-Y364 AromaticContact CD2-CD1 3.84Å; Y330-Y364 HydrophobicContact CD2-CD1 3.84Å; Y330-Y364 HydrophobicContact CD2-CD2 4.17Å; Y330-Y364 AromaticContact CD2-CG 3.6Å; Y330-Y364 HydrophobicContact CD2-CG 3.6Å; Y330-Y364 HydrophobicContact CE2-CG 4.45Å; Y330-Y364 HydrophobicContact CG-CD1 4.18Å; Y330-Y364 HydrophobicContact CG-CG 4.37Å; R331-Y364 WeakPolarHBondContact CD-OH 3.47Å; L334-Y364 HydrophobicContact CD2-CD1 4.43Å; L334-Y364 HydrophobicContact CD2-CE1 3.83Å; V353-Y364 HydrophobicContact CB-CD2 3.77Å; V353-Y364 HydrophobicContact CB-CE2 3.88Å; V353-Y364 HydrophobicContact CG1-CD2 3.98Å; V353-Y364 HydrophobicContact CG2-CD2 3.79Å; V353-Y364 HydrophobicContact CG2-CE2 3.8Å; A356-Y364 HydrophobicContact CB-CD2 3.6Å; A356-Y364 HydrophobicContact CB-CE2 3.93Å; S360-Y364 WeakPolarHBondContact O-CB 3.1Å; S360-Y364 PolarHBondContact O-N 2.87Å; F361-Y364 HydrophobicContact CD2-CD1 4.47Å; F361-Y364 PolarHBondContact O-N 3.16Å; A362-Y364 VanDerWaalsContact C-N 3.35Å; A362-Y364 PolarHBondContact O-N 2.59Å; Y364-K367 PolarHBondContact O-N 3.22Å; Y364-A368 HydrophobicContact CE1-CB 4.34Å; Y364-A368 VanDerWaalsContact O-CB 3.26Å; Y364-A368 WeakPolarHBondContact O-CB 3.43Å; Y364-A368 PolarHBondContact O-N 3.34Å
365	A	96.9	Very high	93.2	Very high	2 Å²	2	59.6 Å²	59.6	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-60.6	-50.3	-177	0	0	0	0	0	110.4	L334 F361 A362 K367 A368 T369 Y378	L334-A365 HydrophobicContact CD1-CB 3.96Å; L334-A365 HydrophobicContact CD2-CB 4.41Å; F361-A365 HydrophobicContact CE1-CB 4.43Å; F361-A365 HydrophobicContact CZ-CB 4.37Å; F361-A365 VanDerWaalsContact O-CB 3.23Å; F361-A365 WeakPolarHBondContact O-CB 3.01Å; F361-A365 PolarHBondContact O-N 3.05Å; A362-A365 PolarHBondContact O-N 2.89Å; A365-K367 VanDerWaalsContact C-N 3.33Å; A365-K367 PolarHBondContact O-N 2.97Å; A365-A368 PolarHBondContact O-N 3.19Å; A365-A368 VanDerWaalsContact O-N 3.12Å; A365-T369 WeakPolarHBondContact O-CG2 3.3Å; A365-T369 PolarHBondContact O-N 2.85Å; A365-T369 PolarHBondContact O-OG1 3.31Å; A365-Y378 HydrophobicContact CB-CD1 3.64Å; A365-Y378 HydrophobicContact CB-CE1 4.03Å
366	E	96.7	Very high	93.4	Very high	94 Å²	94	56.6 Å²	56.6	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-54	-47.8	176.2	-174.2	-166.6	-167.1	0	0	111.7	A362 T369 R370 Y378	A362-E366 WeakPolarHBondContact O-CB 3.2Å; A362-E366 PolarHBondContact O-N 2.9Å; E366-T369 PolarHBondContact O-OG1 3.38Å; E366-R370 WeakPolarHBondContact O-CG 3.5Å; E366-R370 PolarHBondContact O-N 3.06Å; E366-Y378 HydrophobicContact CB-CD1 4.41Å; E366-Y378 HydrophobicContact CB-CD2 3.75Å; E366-Y378 HydrophobicContact CB-CE2 3.88Å; E366-Y378 HydrophobicContact CB-CG 4.04Å; E366-Y378 HydrophobicContact CG-CD2 3.98Å; E366-Y378 HydrophobicContact CG-CE2 3.87Å
367	K	96.2	Very high	93.6	Very high	67 Å²	67	60.6 Å²	60.6	29%	0.291	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-38.7	178.7	-73.6	172.4	-170.2	170.9	0	112.5	V353 L359 E363 Y364 A365	V353-K367 HydrophobicContact CG1-CB 4.06Å; V353-K367 HydrophobicContact CG1-CD 4.05Å; V353-K367 HydrophobicContact CG2-CB 3.84Å; L359-K367 HydrophobicContact CD1-CD 3.76Å; E363-K367 WeakPolarHBondContact O-CB 3.43Å; E363-K367 VanDerWaalsContact O-CG 3.27Å; E363-K367 WeakPolarHBondContact O-CG 3.05Å; E363-K367 PolarHBondContact O-N 3.43Å; Y364-K367 PolarHBondContact O-N 3.22Å; A365-K367 VanDerWaalsContact C-N 3.33Å; A365-K367 PolarHBondContact O-N 2.97Å
368	A	96.2	Very high	94.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-71.1	-33.7	-178	0	0	0	0	0	112.3	L334 L350 Y351 V353 Y364 A365 N371	L334-A368 HydrophobicContact CD2-CB 3.78Å; L350-A368 WeakPolarHBondContact CA-O 3.46Å; L350-A368 HydrophobicContact CB-CB 4.39Å; L350-A368 WeakPolarHBondContact CB-O 3.22Å; L350-A368 HydrophobicContact CD1-CB 4.36Å; Y351-A368 PolarHBondContact N-O 3.14Å; V353-A368 HydrophobicContact CG2-CB 3.77Å; Y364-A368 HydrophobicContact CE1-CB 4.34Å; Y364-A368 VanDerWaalsContact O-CB 3.26Å; Y364-A368 WeakPolarHBondContact O-CB 3.43Å; Y364-A368 PolarHBondContact O-N 3.34Å; A365-A368 PolarHBondContact O-N 3.19Å; A365-A368 VanDerWaalsContact O-N 3.12Å; A368-N371 PolarHBondContact O-OD1 3.24Å
369	T	96.5	Very high	94.4	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	28%	0.282	C	S	.	.	S	Bend	trans	-98.6	6.3	-174.5	58	0	0	0	0	114.4	L334 L338 L350 A365 E366 N371 L372 L374 Y378	L334-T369 HydrophobicContact CD1-CG2 3.99Å; L334-T369 HydrophobicContact CD2-CG2 4.11Å; L334-T369 HydrophobicContact CG-CG2 4.46Å; L338-T369 HydrophobicContact CD1-CG2 4.48Å; L338-T369 HydrophobicContact CD2-CG2 4.31Å; L350-T369 HydrophobicContact CD2-CG2 4.2Å; A365-T369 WeakPolarHBondContact O-CG2 3.3Å; A365-T369 PolarHBondContact O-N 2.85Å; A365-T369 PolarHBondContact O-OG1 3.31Å; E366-T369 PolarHBondContact O-OG1 3.38Å; T369-N371 PolarHBondContact O-N 2.8Å; T369-L372 HydrophobicContact CG2-CD1 4.18Å; T369-L372 WeakPolarHBondContact O-CB 3.35Å; T369-L372 PolarHBondContact O-N 3.03Å; T369-L374 HydrophobicContact CG2-CD1 4.23Å; T369-Y378 PolarHBondContact OG1-OH 3.39Å
370	R	94.4	Very high	94.5	Very high	145 Å²	145	60.3 Å²	60.3	55%	0.547	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-53.3	-31.3	-177.9	-65.1	-175	175.9	161.3	-7.1	114.3	Y351 E366 L372	Y351-R370 HydrophobicContact CD2-CB 4Å; Y351-R370 HydrophobicContact CE2-CB 4.09Å; E366-R370 WeakPolarHBondContact O-CG 3.5Å; E366-R370 PolarHBondContact O-N 3.06Å; R370-L372 PolarHBondContact O-N 3.22Å
371	N	94.6	Very high	94.5	Very high	49 Å²	49	60 Å²	60	26%	0.262	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-75.9	-9.9	177.4	64.1	-58.1	0	0	0	114.5	R349 Y351 A368 T369	R349-N371 PolarHBondContact O-ND2 3.42Å; Y351-N371 HydrophobicContact CD2-CB 4.17Å; Y351-N371 HydrophobicContact CE1-CB 4.08Å; Y351-N371 HydrophobicContact CE2-CB 3.61Å; A368-N371 PolarHBondContact O-OD1 3.24Å; T369-N371 PolarHBondContact O-N 2.8Å
372	L	94	Very high	94.5	Very high	38 Å²	38	62.1 Å²	62.1	20%	0.199	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-93.6	-4.6	179.9	-54.6	-176.8	0	0	0	112.3	L338 F344 L350 T369 R370 L374	L338-L372 HydrophobicContact CD1-CD1 4.27Å; L338-L372 HydrophobicContact CD2-CD1 3.99Å; F344-L372 HydrophobicContact CD1-CD1 4.28Å; F344-L372 HydrophobicContact CE1-CB 4.31Å; F344-L372 HydrophobicContact CE1-CD1 3.95Å; F344-L372 HydrophobicContact CE1-CD2 4.22Å; F344-L372 HydrophobicContact CE1-CG 4.39Å; L350-L372 HydrophobicContact CD2-CD1 3.76Å; L350-L372 HydrophobicContact CD2-CG 4.44Å; T369-L372 HydrophobicContact CG2-CD1 4.18Å; T369-L372 WeakPolarHBondContact O-CB 3.35Å; T369-L372 PolarHBondContact O-N 3.03Å; R370-L372 PolarHBondContact O-N 3.22Å; L372-L374 HydrophobicContact CB-CD1 3.96Å; L372-L374 HydrophobicContact CB-CG 3.78Å; L372-L374 HydrophobicContact CD1-CD1 4.03Å; L372-L374 PolarHBondContact O-N 3.17Å; L372-L374 VanDerWaalsContact O-N 3.16Å
373	N	88.3	Confident	94.4	Very high	150 Å²	150	65.7 Å²	65.7	80%	0.802	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	40.1	179.8	-61	-37.2	0	0	0	113.3
374	L	90.2	Very high	94.3	Very high	37 Å²	37	63.5 Å²	63.5	19%	0.194	32%	0.319	C	S	.	.			trans	-78.7	123.3	-179.1	-70.4	175.3	0	0	0	110.7	L338 L342 F344 T369 L372 L376	L338-L374 HydrophobicContact CD2-CD1 3.74Å; L342-L374 HydrophobicContact CD1-CD1 4.49Å; F344-L374 HydrophobicContact CE2-CD2 3.73Å; F344-L374 HydrophobicContact CZ-CD1 4.39Å; F344-L374 HydrophobicContact CZ-CD2 3.55Å; F344-L374 HydrophobicContact CZ-CG 4.3Å; T369-L374 HydrophobicContact CG2-CD1 4.23Å; L372-L374 HydrophobicContact CB-CD1 3.96Å; L372-L374 HydrophobicContact CB-CG 3.78Å; L372-L374 HydrophobicContact CD1-CD1 4.03Å; L372-L374 PolarHBondContact O-N 3.17Å; L372-L374 VanDerWaalsContact O-N 3.16Å; L374-L376 HydrophobicContact CB-CD1 3.75Å; L374-L376 HydrophobicContact CB-CG 3.96Å; L374-L376 HydrophobicContact CD1-CD1 3.77Å; L374-L376 HydrophobicContact CD2-CD1 4.34Å; L374-L376 HydrophobicContact CG-CD1 4.17Å; L374-L376 PolarHBondContact O-N 3.49Å
375	N	89.7	Confident	94.3	Very high	168 Å²	168	69.6 Å²	69.6	90%	0.898	35%	0.352	S	S	*	.			trans	-91.5	84.6	169.6	-171.1	18.6	0	0	0	109.5
376	L	91.2	Very high	94.3	Very high	48 Å²	48	72 Å²	72	25%	0.251	37%	0.366	S	S	.	.			trans	-127.1	146.3	-174.7	-63.4	171.2	0	0	0	111.1	L342 L374 Y378 L381	L342-L376 HydrophobicContact CD1-CD1 3.51Å; L342-L376 HydrophobicContact CD1-CD2 4.48Å; L342-L376 HydrophobicContact CD2-CD1 4.48Å; L342-L376 HydrophobicContact CD2-CD2 3.97Å; L374-L376 HydrophobicContact CB-CD1 3.75Å; L374-L376 HydrophobicContact CB-CG 3.96Å; L374-L376 HydrophobicContact CD1-CD1 3.77Å; L374-L376 HydrophobicContact CD2-CD1 4.34Å; L374-L376 HydrophobicContact CG-CD1 4.17Å; L374-L376 PolarHBondContact O-N 3.49Å; L376-Y378 HydrophobicContact CB-CE1 4.44Å; L376-Y378 HydrophobicContact CB-CE2 4.23Å; L376-Y378 HydrophobicContact CD1-CE1 4.4Å; L376-Y378 WeakPolarHBondContact O-CD2 3.39Å; L376-Y378 PolarHBondContact O-N 2.83Å; L376-L381 HydrophobicContact CB-CD1 3.97Å; L376-L381 HydrophobicContact CD1-CD1 4.05Å; L376-L381 HydrophobicContact CG-CD1 4.47Å
377	N	94.6	Very high	94.3	Very high	90 Å²	90	67.5 Å²	67.5	48%	0.481	35%	0.345	S	S	.	.			trans	-82.5	89	167.5	-174	-10.6	0	0	0	110	S379 E380 L381	N377-S379 PolarHBondContact O-N 3.19Å; N377-S379 PolarHBondContact OD1-N 3.15Å; N377-E380 HydrophobicContact CB-CB 3.94Å; N377-E380 PolarHBondContact ND2-OE2 2.91Å; N377-E380 WeakPolarHBondContact O-CB 3.35Å; N377-E380 PolarHBondContact O-N 3.25Å; N377-E380 VanDerWaalsContact O-N 3.1Å; N377-E380 PolarHBondContact OD1-N 2.87Å; N377-L381 WeakPolarHBondContact O-CG 3.31Å; N377-L381 PolarHBondContact O-N 3.29Å; N377-L381 VanDerWaalsContact O-N 3.14Å
378	Y	94.9	Very high	94.3	Very high	28 Å²	28	70.2 Å²	70.2	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-60.8	-30.5	-177	-66.2	-81.8	0	0	0	113.8	A362 A365 E366 T369 L376 L381 E382	A362-Y378 WeakPolarHBondContact CB-O 3.29Å; A365-Y378 HydrophobicContact CB-CD1 3.64Å; A365-Y378 HydrophobicContact CB-CE1 4.03Å; E366-Y378 HydrophobicContact CB-CD1 4.41Å; E366-Y378 HydrophobicContact CB-CD2 3.75Å; E366-Y378 HydrophobicContact CB-CE2 3.88Å; E366-Y378 HydrophobicContact CB-CG 4.04Å; E366-Y378 HydrophobicContact CG-CD2 3.98Å; E366-Y378 HydrophobicContact CG-CE2 3.87Å; T369-Y378 PolarHBondContact OG1-OH 3.39Å; L376-Y378 HydrophobicContact CB-CE1 4.44Å; L376-Y378 HydrophobicContact CB-CE2 4.23Å; L376-Y378 HydrophobicContact CD1-CE1 4.4Å; L376-Y378 WeakPolarHBondContact O-CD2 3.39Å; L376-Y378 PolarHBondContact O-N 2.83Å; Y378-L381 HydrophobicContact CD1-CD1 4.25Å; Y378-L381 PolarHBondContact O-N 3.3Å; Y378-E382 PolarHBondContact O-N 3Å
379	S	95.1	Very high	94.3	Very high	69 Å²	69	75.3 Å²	75.3	48%	0.483	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-37.1	175.8	-58.9	0	0	0	0	112	N377 N383	N377-S379 PolarHBondContact O-N 3.19Å; N377-S379 PolarHBondContact OD1-N 3.15Å; S379-N383 VanDerWaalsContact O-CG 3.3Å; S379-N383 PolarHBondContact O-N 3.05Å; S379-N383 PolarHBondContact O-ND2 3.12Å
380	E	95.2	Very high	94.4	Very high	132 Å²	132	75.5 Å²	75.5	62%	0.617	37%	0.374	S	S	*	.	H	α-helix	trans	-66	-43.3	173.3	-174.6	-178.6	168.1	0	0	111	N377 E382 N383 D384	N377-E380 HydrophobicContact CB-CB 3.94Å; N377-E380 PolarHBondContact ND2-OE2 2.91Å; N377-E380 WeakPolarHBondContact O-CB 3.35Å; N377-E380 PolarHBondContact O-N 3.25Å; N377-E380 VanDerWaalsContact O-N 3.1Å; N377-E380 PolarHBondContact OD1-N 2.87Å; E380-E382 PolarHBondContact O-N 3.32Å; E380-N383 CarbonylContact O-C 3.55Å; E380-N383 WeakPolarHBondContact O-CA 3.44Å; E380-N383 PolarHBondContact O-N 3.26Å; E380-D384 PolarHBondContact O-N 3.24Å; E380-D384 VanDerWaalsContact O-N 3.11Å
381	L	93.9	Very high	94.4	Very high	33 Å²	33	69.7 Å²	69.7	17%	0.173	35%	0.353	C	S	.	.	H	α-helix	trans	-63.2	-39	176.8	-59.1	170.5	0	0	0	112.4	L337 L376 N377 Y378 N383 D384 V387	L337-L381 HydrophobicContact CD1-CB 4.19Å; L337-L381 HydrophobicContact CD1-CD2 3.91Å; L337-L381 HydrophobicContact CD1-CG 4.43Å; L337-L381 HydrophobicContact CD2-CD1 3.7Å; L337-L381 HydrophobicContact CD2-CD2 4.36Å; L337-L381 HydrophobicContact CD2-CG 4.44Å; L376-L381 HydrophobicContact CB-CD1 3.97Å; L376-L381 HydrophobicContact CD1-CD1 4.05Å; L376-L381 HydrophobicContact CG-CD1 4.47Å; N377-L381 WeakPolarHBondContact O-CG 3.31Å; N377-L381 PolarHBondContact O-N 3.29Å; N377-L381 VanDerWaalsContact O-N 3.14Å; Y378-L381 HydrophobicContact CD1-CD1 4.25Å; Y378-L381 PolarHBondContact O-N 3.3Å; L381-N383 PolarHBondContact O-N 3.23Å; L381-D384 WeakPolarHBondContact O-CB 3.17Å; L381-D384 PolarHBondContact O-N 2.96Å; L381-V387 WeakPolarHBondContact O-CB 3.48Å; L381-V387 WeakPolarHBondContact O-CG2 3.41Å
382	E	95.4	Very high	94.3	Very high	44 Å²	44	75 Å²	75	21%	0.206	37%	0.374	C	S	.	.	H	α-helix	trans	-63.8	-27.8	173.1	-179.6	163.8	-161.7	0	0	112.3	S360 F361 A362 Y378 E380 R388	S360-E382 WeakPolarHBondContact CB-OE2 3.38Å; S360-E382 PolarHBondContact OG-OE2 3.15Å; F361-E382 HydrophobicContact CB-CG 4.05Å; F361-E382 HydrophobicContact CD1-CB 3.96Å; F361-E382 HydrophobicContact CD1-CG 4.25Å; F361-E382 PolarHBondContact N-OE1 3.38Å; F361-E382 VanDerWaalsContact N-OE1 3.09Å; A362-E382 HydrophobicContact CB-CB 4.14Å; A362-E382 WeakPolarHBondContact CB-OE2 3.43Å; A362-E382 PolarHBondContact N-OE2 3.25Å; Y378-E382 PolarHBondContact O-N 3Å; E380-E382 PolarHBondContact O-N 3.32Å; E382-R388 WeakPolarHBondContact O-CG 3.34Å
383	N	94.9	Very high	94.3	Very high	83 Å²	83	74.9 Å²	74.9	44%	0.444	37%	0.372	S	S	.	.	H	α-helix	trans	-89	-9.8	180	-71.7	-42.8	0	0	0	114.4	S379 E380 L381 L385 R388	S379-N383 VanDerWaalsContact O-CG 3.3Å; S379-N383 PolarHBondContact O-N 3.05Å; S379-N383 PolarHBondContact O-ND2 3.12Å; E380-N383 CarbonylContact O-C 3.55Å; E380-N383 WeakPolarHBondContact O-CA 3.44Å; E380-N383 PolarHBondContact O-N 3.26Å; L381-N383 PolarHBondContact O-N 3.23Å; N383-L385 PolarHBondContact O-N 2.82Å; N383-R388 PolarHBondContact OD1-NE 3.34Å; N383-R388 PolarHBondContact OD1-NH2 3.04Å
384	D	95.4	Very high	94.6	Very high	41 Å²	41	70.6 Å²	70.6	22%	0.219	35%	0.345	C	S	.	.	S	Bend	trans	-53.7	130.4	170	177.6	-74	0	0	0	110	R341 E380 L381 T386 V387 R388	R341-D384 IonicContact CZ-OD2 3.65Å; R341-D384 IonicContact NH2-OD2 3.54Å; R341-D384 PolarHBondContact NH2-OD2 2.9Å; E380-D384 PolarHBondContact O-N 3.24Å; E380-D384 VanDerWaalsContact O-N 3.11Å; L381-D384 WeakPolarHBondContact O-CB 3.17Å; L381-D384 PolarHBondContact O-N 2.96Å; D384-T386 PolarHBondContact O-N 3.45Å; D384-T386 VanDerWaalsContact OD1-CA 3.29Å; D384-T386 WeakPolarHBondContact OD1-CA 3.43Å; D384-T386 WeakPolarHBondContact OD1-CB 3.47Å; D384-T386 PolarHBondContact OD1-N 2.96Å; D384-T386 PolarHBondContact OD1-OG1 3.4Å; D384-T386 VanDerWaalsContact OD1-OG1 3.08Å; D384-V387 HydrophobicContact CB-CB 4.16Å; D384-V387 HydrophobicContact CB-CG2 3.97Å; D384-V387 PolarHBondContact O-N 3.41Å; D384-V387 VanDerWaalsContact O-N 3.14Å; D384-V387 PolarHBondContact OD1-N 3.05Å; D384-V387 VanDerWaalsContact OD1-N 3.13Å; D384-R388 WeakPolarHBondContact O-CG 3.32Å; D384-R388 PolarHBondContact O-N 3.06Å
385	L	96.1	Very high	94.6	Very high	143 Å²	143	70 Å²	70	75%	0.749	34%	0.344	S	S	*	.	H	α-helix	trans	-59.5	-35.4	-174.8	-68.6	175.6	0	0	0	112.5	N383 W389	N383-L385 PolarHBondContact O-N 2.82Å; L385-W389 WeakPolarHBondContact O-CB 3.48Å; L385-W389 PolarHBondContact O-N 3.23Å
386	T	96.8	Very high	94.9	Very high	51 Å²	51	63.2 Å²	63.2	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-68.1	-46.7	177.8	-38.7	0	0	0	0	110	W336 D384 W389 M390	W336-T386 HydrophobicContact CH2-CG2 3.75Å; W336-T386 HydrophobicContact CZ2-CG2 3.9Å; W336-T386 HydrophobicContact CZ3-CG2 4.31Å; D384-T386 PolarHBondContact O-N 3.45Å; D384-T386 VanDerWaalsContact OD1-CA 3.29Å; D384-T386 WeakPolarHBondContact OD1-CA 3.43Å; D384-T386 WeakPolarHBondContact OD1-CB 3.47Å; D384-T386 PolarHBondContact OD1-N 2.96Å; D384-T386 PolarHBondContact OD1-OG1 3.4Å; D384-T386 VanDerWaalsContact OD1-OG1 3.08Å; T386-W389 WeakPolarHBondContact O-CB 3.29Å; T386-W389 PolarHBondContact O-N 3.01Å; T386-M390 HydrophobicContact CG2-CE 3.73Å; T386-M390 VanDerWaalsContact O-CG 3.32Å; T386-M390 WeakPolarHBondContact O-CG 3.21Å; T386-M390 PolarHBondContact O-N 3.39Å
387	V	96.7	Very high	95.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-49.4	177.1	175.6	0	0	0	0	110.1	W336 L337 F361 L381 D384 W389 M390 L391	W336-V387 HydrophobicContact CZ3-CG2 4.28Å; L337-V387 HydrophobicContact CD1-CG2 4.02Å; F361-V387 HydrophobicContact CD1-CG1 3.84Å; F361-V387 HydrophobicContact CE1-CG1 3.58Å; F361-V387 HydrophobicContact CZ-CG1 4.13Å; L381-V387 WeakPolarHBondContact O-CB 3.48Å; L381-V387 WeakPolarHBondContact O-CG2 3.41Å; D384-V387 HydrophobicContact CB-CB 4.16Å; D384-V387 HydrophobicContact CB-CG2 3.97Å; D384-V387 PolarHBondContact O-N 3.41Å; D384-V387 VanDerWaalsContact O-N 3.14Å; D384-V387 PolarHBondContact OD1-N 3.05Å; D384-V387 VanDerWaalsContact OD1-N 3.13Å; V387-W389 VanDerWaalsContact C-N 3.25Å; V387-W389 PolarHBondContact O-N 3.34Å; V387-M390 WeakPolarHBondContact O-CB 3.48Å; V387-M390 PolarHBondContact O-N 3.39Å; V387-L391 HydrophobicContact CG1-CD1 3.98Å; V387-L391 HydrophobicContact CG1-CG 4.18Å; V387-L391 VanDerWaalsContact O-CG 3.27Å; V387-L391 WeakPolarHBondContact O-CG 3.22Å; V387-L391 PolarHBondContact O-N 3.21Å
388	R	96.5	Very high	95	Very high	124 Å²	124	56.7 Å²	56.7	47%	0.468	27%	0.272	S	S	.	.	H	α-helix	trans	-56.1	-40.3	176.1	-73.9	-175.3	156.3	-162.6	-2.9	112.7	E382 N383 D384 K392	E382-R388 WeakPolarHBondContact O-CG 3.34Å; N383-R388 PolarHBondContact OD1-NE 3.34Å; N383-R388 PolarHBondContact OD1-NH2 3.04Å; D384-R388 WeakPolarHBondContact O-CG 3.32Å; D384-R388 PolarHBondContact O-N 3.06Å; R388-K392 WeakPolarHBondContact O-CG 3.42Å; R388-K392 PolarHBondContact O-N 2.86Å
389	W	96.7	Very high	95	Very high	107 Å²	107	55.3 Å²	55.3	41%	0.405	27%	0.266	S	S	.	.	H	α-helix	trans	-63	-49.2	174.1	170.7	84.9	0	0	0	111.4	F44 Y49 L385 T386 V387 L391 K392 Q393	F44-W389 HydrophobicContact CD1-CZ3 4.12Å; F44-W389 HydrophobicContact CE1-CH2 4.5Å; F44-W389 HydrophobicContact CE1-CZ3 4.17Å; Y49-W389 HydrophobicContact CE1-CH2 4.45Å; L385-W389 WeakPolarHBondContact O-CB 3.48Å; L385-W389 PolarHBondContact O-N 3.23Å; T386-W389 WeakPolarHBondContact O-CB 3.29Å; T386-W389 PolarHBondContact O-N 3.01Å; V387-W389 VanDerWaalsContact C-N 3.25Å; V387-W389 PolarHBondContact O-N 3.34Å; W389-L391 VanDerWaalsContact C-N 3.33Å; W389-L391 PolarHBondContact O-N 3.45Å; W389-K392 WeakPolarHBondContact O-CB 3.46Å; W389-K392 PolarHBondContact O-N 3Å; W389-K392 VanDerWaalsContact O-N 3.11Å; W389-Q393 HydrophobicContact CD2-CG 4.24Å; W389-Q393 HydrophobicContact CH2-CG 4.28Å; W389-Q393 HydrophobicContact CZ2-CG 3.89Å; W389-Q393 WeakPolarHBondContact O-CG 3.5Å; W389-Q393 PolarHBondContact O-N 3.01Å
390	M	97.3	Very high	95.1	Very high	5 Å²	5	52 Å²	52	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-44.3	178.4	-71	-179.4	-177.5	0	0	112.2	F44 A333 W336 T386 V387 K392 Q393	F44-M390 HydrophobicContact CB-CE 3.74Å; F44-M390 HydrophobicContact CB-CG 4.5Å; F44-M390 HydrophobicContact CB-SD 3.84Å; F44-M390 HydrophobicContact CD1-CB 4.32Å; F44-M390 HydrophobicContact CD1-CE 4.38Å; F44-M390 HydrophobicContact CD1-CG 3.74Å; F44-M390 HydrophobicContact CD1-SD 4.2Å; F44-M390 HydrophobicContact CD2-CB 4.06Å; F44-M390 HydrophobicContact CD2-CG 3.95Å; F44-M390 HydrophobicContact CD2-SD 3.76Å; F44-M390 HydrophobicContact CE1-CB 3.96Å; F44-M390 HydrophobicContact CE1-CG 3.83Å; F44-M390 HydrophobicContact CE2-CB 3.69Å; F44-M390 HydrophobicContact CE2-CG 4.05Å; F44-M390 HydrophobicContact CE2-SD 4.37Å; F44-M390 HydrophobicContact CG-CB 4.38Å; F44-M390 HydrophobicContact CG-CE 4.07Å; F44-M390 HydrophobicContact CG-CG 3.81Å; F44-M390 HydrophobicContact CG-SD 3.68Å; F44-M390 HydrophobicContact CZ-CB 3.64Å; F44-M390 HydrophobicContact CZ-CG 3.99Å; F44-M390 WeakPolarHBondContact CZ-O 3.31Å; A333-M390 HydrophobicContact CB-CB 4.03Å; A333-M390 HydrophobicContact CB-SD 4.18Å; W336-M390 HydrophobicContact CB-CE 4.12Å; W336-M390 HydrophobicContact CB-SD 4.08Å; W336-M390 HydrophobicContact CD2-CE 3.28Å; W336-M390 HydrophobicContact CD2-SD 3.95Å; W336-M390 VanDerWaalsContact CE2-CE 3.46Å; W336-M390 HydrophobicContact CE3-CE 3.79Å; W336-M390 HydrophobicContact CE3-SD 4.01Å; W336-M390 HydrophobicContact CG-CE 3.41Å; W336-M390 VanDerWaalsContact CG-CE 3.41Å; W336-M390 HydrophobicContact CG-SD 3.97Å; W336-M390 HydrophobicContact CZ2-CE 4.09Å; W336-M390 HydrophobicContact CZ3-CE 4.37Å; T386-M390 HydrophobicContact CG2-CE 3.73Å; T386-M390 VanDerWaalsContact O-CG 3.32Å; T386-M390 WeakPolarHBondContact O-CG 3.21Å; T386-M390 PolarHBondContact O-N 3.39Å; V387-M390 WeakPolarHBondContact O-CB 3.48Å; V387-M390 PolarHBondContact O-N 3.39Å; M390-K392 VanDerWaalsContact C-N 3.27Å; M390-K392 PolarHBondContact O-N 2.93Å; M390-Q393 WeakPolarHBondContact O-CB 3.33Å; M390-Q393 PolarHBondContact O-N 2.78Å
391	L	94.7	Very high	95.1	Very high	23 Å²	23	47 Å²	47	12%	0.12	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-32.3	179.4	-62.4	177.9	0	0	0	112.6	Y330 A333 F361 V387 W389 Q393	Y330-L391 HydrophobicContact CD1-CD2 3.45Å; Y330-L391 VanDerWaalsContact CD1-CD2 3.45Å; Y330-L391 HydrophobicContact CE1-CD2 3.76Å; Y330-L391 HydrophobicContact CG-CD2 4.48Å; A333-L391 HydrophobicContact CB-CD2 4.09Å; F361-L391 HydrophobicContact CB-CD1 3.57Å; F361-L391 HydrophobicContact CB-CD2 4.16Å; F361-L391 HydrophobicContact CD1-CD1 4.22Å; F361-L391 HydrophobicContact CD2-CD1 4.36Å; F361-L391 HydrophobicContact CD2-CD2 3.62Å; F361-L391 HydrophobicContact CE2-CD2 4.2Å; F361-L391 HydrophobicContact CG-CD1 3.8Å; F361-L391 HydrophobicContact CG-CD2 3.94Å; F361-L391 HydrophobicContact CG-CG 4.47Å; V387-L391 HydrophobicContact CG1-CD1 3.98Å; V387-L391 HydrophobicContact CG1-CG 4.18Å; V387-L391 VanDerWaalsContact O-CG 3.27Å; V387-L391 WeakPolarHBondContact O-CG 3.22Å; V387-L391 PolarHBondContact O-N 3.21Å; W389-L391 VanDerWaalsContact C-N 3.33Å; W389-L391 PolarHBondContact O-N 3.45Å; L391-Q393 VanDerWaalsContact C-N 3.3Å; L391-Q393 PolarHBondContact O-N 2.78Å
392	K	93.5	Very high	95.1	Very high	160 Å²	160	45.5 Å²	45.5	70%	0.696	21%	0.211	S	C	*	.	H	α-helix	trans	-72.8	-19.9	174.5	-72	177.8	179.5	-177.3	0	113.3	R388 W389 M390 W394	R388-K392 WeakPolarHBondContact O-CG 3.42Å; R388-K392 PolarHBondContact O-N 2.86Å; W389-K392 WeakPolarHBondContact O-CB 3.46Å; W389-K392 PolarHBondContact O-N 3Å; W389-K392 VanDerWaalsContact O-N 3.11Å; M390-K392 VanDerWaalsContact C-N 3.27Å; M390-K392 PolarHBondContact O-N 2.93Å; K392-W394 PolarHBondContact O-N 2.91Å
393	Q	94.4	Very high	95.2	Very high	36 Å²	36	43.4 Å²	43.4	17%	0.168	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	15.8	178.8	-58.4	-49.1	-55.6	0	0	113.8	F44 W389 M390 L391 P395 Q396 V397	F44-Q393 HydrophobicContact CE1-CB 4.23Å; F44-Q393 HydrophobicContact CE1-CG 4.45Å; F44-Q393 HydrophobicContact CZ-CB 4.21Å; W389-Q393 HydrophobicContact CD2-CG 4.24Å; W389-Q393 HydrophobicContact CH2-CG 4.28Å; W389-Q393 HydrophobicContact CZ2-CG 3.89Å; W389-Q393 WeakPolarHBondContact O-CG 3.5Å; W389-Q393 PolarHBondContact O-N 3.01Å; M390-Q393 WeakPolarHBondContact O-CB 3.33Å; M390-Q393 PolarHBondContact O-N 2.78Å; L391-Q393 VanDerWaalsContact C-N 3.3Å; L391-Q393 PolarHBondContact O-N 2.78Å; Q393-P395 VanDerWaalsContact C-CD 3.43Å; Q393-Q396 HydrophobicContact CB-CB 4.42Å; Q393-Q396 WeakPolarHBondContact O-CB 3.24Å; Q393-Q396 PolarHBondContact O-N 3.47Å; Q393-Q396 VanDerWaalsContact O-N 3.1Å; Q393-Q396 PolarHBondContact O-OE1 3.12Å; Q393-V397 WeakPolarHBondContact O-CG2 3.5Å; Q393-V397 PolarHBondContact O-N 2.87Å
394	W	92.7	Very high	95.2	Very high	61 Å²	61	40 Å²	40	23%	0.231	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-35.3	-175.2	80.8	-95.8	0	0	0	115.7	V65 L325 V326 S329 K392 Q396 V397 A398	V65-W394 HydrophobicContact CG2-CH2 3.96Å; L325-W394 HydrophobicContact CB-CE3 4.01Å; L325-W394 HydrophobicContact CB-CZ3 4.11Å; L325-W394 HydrophobicContact CD1-CZ3 4.46Å; V326-W394 HydrophobicContact CG2-CB 4.37Å; V326-W394 HydrophobicContact CG2-CD2 3.99Å; V326-W394 HydrophobicContact CG2-CG 3.82Å; S329-W394 WeakPolarHBondContact OG-CA 3.26Å; S329-W394 WeakPolarHBondContact OG-CB 3.5Å; K392-W394 PolarHBondContact O-N 2.91Å; W394-Q396 VanDerWaalsContact C-N 3.29Å; W394-Q396 PolarHBondContact O-N 3.48Å; W394-V397 PolarHBondContact O-N 2.63Å; W394-A398 WeakPolarHBondContact O-CB 3.48Å; W394-A398 PolarHBondContact O-N 3.35Å
395	P	92.2	Very high	95.2	Very high	25 Å²	25	38 Å²	38	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-40.2	174.6	-22.4	35.5	0	0	0	111.5	V63 Q393 A398 F399	V63-P395 HydrophobicContact CG1-CB 3.9Å; Q393-P395 VanDerWaalsContact C-CD 3.43Å; P395-A398 PolarHBondContact O-N 2.96Å; P395-F399 WeakPolarHBondContact O-CB 3.4Å; P395-F399 PolarHBondContact O-N 3.32Å
396	Q	95.1	Very high	95.1	Very high	24 Å²	24	31.6 Å²	31.6	11%	0.112	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-43.3	178	-72.7	81.8	0.8	0	0	112	Y60 V63 Q393 W394 A398 F399 F400	Y60-Q396 HydrophobicContact CD2-CB 4.24Å; Y60-Q396 HydrophobicContact CD2-CG 4.27Å; Y60-Q396 HydrophobicContact CE1-CB 4.46Å; Y60-Q396 HydrophobicContact CE1-CG 4.08Å; Y60-Q396 HydrophobicContact CE2-CB 3.41Å; Y60-Q396 VanDerWaalsContact CE2-CB 3.41Å; Y60-Q396 HydrophobicContact CE2-CG 3.76Å; Y60-Q396 WeakPolarHBondContact OH-CB 3.28Å; V63-Q396 HydrophobicContact CG1-CG 4.36Å; Q393-Q396 HydrophobicContact CB-CB 4.42Å; Q393-Q396 WeakPolarHBondContact O-CB 3.24Å; Q393-Q396 PolarHBondContact O-N 3.47Å; Q393-Q396 VanDerWaalsContact O-N 3.1Å; Q393-Q396 PolarHBondContact O-OE1 3.12Å; W394-Q396 VanDerWaalsContact C-N 3.29Å; W394-Q396 PolarHBondContact O-N 3.48Å; Q396-A398 VanDerWaalsContact C-N 3.34Å; Q396-F399 PolarHBondContact O-N 2.81Å; Q396-F400 PolarHBondContact O-N 3.18Å
397	V	95.3	Very high	95	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-45	173.7	175.7	0	0	0	0	110.2	M40 F43 F44 H328 Q393 W394 F399 F400 Y401	M40-V397 HydrophobicContact CE-CG1 4.24Å; F43-V397 HydrophobicContact CD1-CG2 3.66Å; F43-V397 HydrophobicContact CE1-CG2 3.54Å; F43-V397 HydrophobicContact CG-CG2 4.32Å; F43-V397 HydrophobicContact CZ-CG2 4.1Å; F44-V397 HydrophobicContact CE1-CG2 4.45Å; F44-V397 HydrophobicContact CE2-CG2 4.26Å; F44-V397 HydrophobicContact CZ-CG2 3.73Å; H328-V397 HydrophobicContact CB-CG1 3.98Å; Q393-V397 WeakPolarHBondContact O-CG2 3.5Å; Q393-V397 PolarHBondContact O-N 2.87Å; W394-V397 PolarHBondContact O-N 2.63Å; V397-F399 VanDerWaalsContact C-N 3.34Å; V397-F399 PolarHBondContact O-N 2.7Å; V397-F400 PolarHBondContact O-N 3.3Å; V397-Y401 PolarHBondContact O-N 2.87Å
398	A	93.2	Very high	94.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.6	-38.7	177.6	0	0	0	0	0	112.2	I68 L325 W394 P395 Q396 Y401 A402	I68-A398 HydrophobicContact CD1-CB 3.79Å; L325-A398 HydrophobicContact CB-CB 4.41Å; L325-A398 HydrophobicContact CD1-CB 4.1Å; W394-A398 WeakPolarHBondContact O-CB 3.48Å; W394-A398 PolarHBondContact O-N 3.35Å; P395-A398 PolarHBondContact O-N 2.96Å; Q396-A398 VanDerWaalsContact C-N 3.34Å; A398-Y401 PolarHBondContact O-N 3.13Å; A398-A402 WeakPolarHBondContact O-CB 3.23Å; A398-A402 PolarHBondContact O-N 2.67Å
399	F	94.7	Very high	94.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.1	-41.8	175.7	-175.8	-106.1	0	0	0	112.8	L59 Y60 V63 I68 L71 W84 L88 P395 Q396 V397 Y401 A402 L403	L59-F399 HydrophobicContact CD2-CE2 4.31Å; L59-F399 HydrophobicContact CD2-CZ 3.8Å; L59-F399 HydrophobicContact CG-CZ 4.09Å; Y60-F399 AromaticContact CD2-CD1 3.96Å; Y60-F399 HydrophobicContact CD2-CD1 3.96Å; V63-F399 HydrophobicContact CB-CB 4.33Å; V63-F399 HydrophobicContact CB-CD2 4.47Å; V63-F399 HydrophobicContact CB-CG 4.32Å; V63-F399 HydrophobicContact CG1-CB 4.08Å; V63-F399 HydrophobicContact CG2-CB 3.8Å; V63-F399 HydrophobicContact CG2-CD2 3.46Å; V63-F399 VanDerWaalsContact CG2-CD2 3.46Å; V63-F399 HydrophobicContact CG2-CE2 4.12Å; V63-F399 HydrophobicContact CG2-CG 3.69Å; I68-F399 HydrophobicContact CD1-CB 4.38Å; I68-F399 HydrophobicContact CG1-CB 4.24Å; I68-F399 HydrophobicContact CG1-CD2 4.01Å; L71-F399 HydrophobicContact CD2-CD2 4.38Å; L71-F399 HydrophobicContact CD2-CE2 3.89Å; L71-F399 HydrophobicContact CD2-CZ 4.46Å; W84-F399 HydrophobicContact CH2-CE2 4.23Å; W84-F399 HydrophobicContact CZ3-CE2 4.42Å; L88-F399 HydrophobicContact CD2-CZ 4.38Å; P395-F399 WeakPolarHBondContact O-CB 3.4Å; P395-F399 PolarHBondContact O-N 3.32Å; Q396-F399 PolarHBondContact O-N 2.81Å; V397-F399 VanDerWaalsContact C-N 3.34Å; V397-F399 PolarHBondContact O-N 2.7Å; F399-Y401 VanDerWaalsContact C-N 3.31Å; F399-Y401 PolarHBondContact O-N 2.76Å; F399-A402 CarbonylContact O-C 3.57Å; F399-A402 WeakPolarHBondContact O-CA 3.36Å; F399-A402 WeakPolarHBondContact O-CB 3.48Å; F399-A402 PolarHBondContact O-N 3.2Å; F399-A402 VanDerWaalsContact O-N 3.1Å; F399-L403 HydrophobicContact CD1-CD1 3.91Å; F399-L403 HydrophobicContact CD1-CG 4.21Å; F399-L403 HydrophobicContact CE1-CD1 3.63Å; F399-L403 HydrophobicContact CE1-CD2 4.23Å; F399-L403 HydrophobicContact CE1-CG 3.94Å; F399-L403 HydrophobicContact CZ-CD1 4.35Å; F399-L403 HydrophobicContact CZ-CD2 4.13Å; F399-L403 HydrophobicContact CZ-CG 4.22Å; F399-L403 WeakPolarHBondContact O-CG 3.21Å; F399-L403 PolarHBondContact O-N 3.16Å
400	F	96.4	Very high	94.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-42.8	174.3	-169.8	-78.2	0	0	0	111.2	W34 L35 A38 M40 F43 L48 I52 Q396 V397 A402 L403 R404	W34-F400 AromaticContact CZ3-CE2 3.94Å; W34-F400 HydrophobicContact CZ3-CE2 3.94Å; W34-F400 HydrophobicContact CZ3-CZ 4.09Å; L35-F400 HydrophobicContact CD1-CD1 4.24Å; L35-F400 HydrophobicContact CD1-CE1 3.66Å; L35-F400 HydrophobicContact CD1-CE2 4.21Å; L35-F400 HydrophobicContact CD1-CZ 3.64Å; A38-F400 HydrophobicContact CB-CE1 3.97Å; A38-F400 HydrophobicContact CB-CZ 4.19Å; M40-F400 HydrophobicContact CE-CB 4.41Å; M40-F400 HydrophobicContact CE-CD1 3.84Å; M40-F400 HydrophobicContact SD-CD1 3.63Å; M40-F400 HydrophobicContact SD-CE1 4.1Å; F43-F400 HydrophobicContact CD2-CB 4.22Å; F43-F400 HydrophobicContact CD2-CD1 4.19Å; F43-F400 HydrophobicContact CD2-CG 4.06Å; F43-F400 HydrophobicContact CE2-CB 3.55Å; F43-F400 HydrophobicContact CE2-CD1 4.21Å; F43-F400 AromaticContact CE2-CD2 3.87Å; F43-F400 HydrophobicContact CE2-CD2 3.87Å; F43-F400 AromaticContact CE2-CG 3.61Å; F43-F400 HydrophobicContact CE2-CG 3.61Å; F43-F400 HydrophobicContact CZ-CB 4.44Å; L48-F400 HydrophobicContact CB-CE1 4.24Å; L48-F400 HydrophobicContact CB-CE2 3.94Å; L48-F400 HydrophobicContact CB-CZ 3.76Å; L48-F400 HydrophobicContact CD1-CE1 3.97Å; L48-F400 HydrophobicContact CD1-CZ 4.18Å; L48-F400 VanDerWaalsContact O-CE2 3.3Å; L48-F400 WeakPolarHBondContact O-CE2 3.39Å; I52-F400 HydrophobicContact CD1-CD2 3.94Å; I52-F400 HydrophobicContact CG1-CD2 3.89Å; I52-F400 HydrophobicContact CG1-CE2 4.01Å; Q396-F400 PolarHBondContact O-N 3.18Å; V397-F400 PolarHBondContact O-N 3.3Å; F400-A402 VanDerWaalsContact C-N 3.28Å; F400-A402 PolarHBondContact O-N 2.97Å; F400-L403 PolarHBondContact O-N 3.05Å; F400-R404 PolarHBondContact O-N 3.38Å
401	Y	95	Very high	94.5	Very high	27 Å²	27	19 Å²	19	11%	0.106	9%	0.088	C	C	.	.	H	α-helix	trans	-59	-41.5	172.1	175.2	-109.8	0	0	0	111.4	M40 H307 F312 V397 A398 F399 R404 S405	M40-Y401 HydrophobicContact CG-CD2 3.79Å; M40-Y401 HydrophobicContact SD-CD2 4.28Å; H307-Y401 AromaticContact ND1-CE2 3.89Å; H307-Y401 AromaticContact ND1-CZ 3.72Å; H307-Y401 PolarHBondContact ND1-OH 2.84Å; F312-Y401 AromaticContact CD1-CD1 3.86Å; F312-Y401 HydrophobicContact CD1-CD1 3.86Å; F312-Y401 AromaticContact CD1-CE1 3.56Å; F312-Y401 HydrophobicContact CD1-CE1 3.56Å; F312-Y401 HydrophobicContact CD2-CE1 4.19Å; F312-Y401 AromaticContact CE1-CD1 3.3Å; F312-Y401 HydrophobicContact CE1-CD1 3.3Å; F312-Y401 AromaticContact CE1-CE1 3.53Å; F312-Y401 HydrophobicContact CE1-CE1 3.53Å; F312-Y401 HydrophobicContact CE1-CG 4.49Å; F312-Y401 HydrophobicContact CE2-CD1 4.12Å; F312-Y401 HydrophobicContact CE2-CE1 4.14Å; F312-Y401 AromaticContact CG-CE1 3.94Å; F312-Y401 HydrophobicContact CG-CE1 3.94Å; F312-Y401 AromaticContact CZ-CD1 3.47Å; F312-Y401 HydrophobicContact CZ-CD1 3.47Å; F312-Y401 VanDerWaalsContact CZ-CD1 3.47Å; F312-Y401 AromaticContact CZ-CE1 3.85Å; F312-Y401 HydrophobicContact CZ-CE1 3.85Å; V397-Y401 PolarHBondContact O-N 2.87Å; A398-Y401 PolarHBondContact O-N 3.13Å; F399-Y401 VanDerWaalsContact C-N 3.31Å; F399-Y401 PolarHBondContact O-N 2.76Å; Y401-R404 PolarHBondContact O-N 3Å; Y401-S405 WeakPolarHBondContact O-CB 3.38Å; Y401-S405 PolarHBondContact O-N 3.36Å; Y401-S405 PolarHBondContact O-OG 3.1Å
402	A	94.9	Very high	94.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.5	-42.5	175.7	0	0	0	0	0	113.2	I68 L71 L72 F312 A398 F399 F400 R404 S405 L406	I68-A402 HydrophobicContact CG2-CB 3.54Å; L71-A402 HydrophobicContact CD2-CB 4.08Å; L72-A402 HydrophobicContact CD1-CB 4.02Å; L72-A402 HydrophobicContact CD2-CB 4.35Å; L72-A402 WeakPolarHBondContact CD2-O 3.42Å; L72-A402 HydrophobicContact CG-CB 4.2Å; F312-A402 HydrophobicContact CE1-CB 3.88Å; A398-A402 WeakPolarHBondContact O-CB 3.23Å; A398-A402 PolarHBondContact O-N 2.67Å; F399-A402 CarbonylContact O-C 3.57Å; F399-A402 WeakPolarHBondContact O-CA 3.36Å; F399-A402 WeakPolarHBondContact O-CB 3.48Å; F399-A402 PolarHBondContact O-N 3.2Å; F399-A402 VanDerWaalsContact O-N 3.1Å; F400-A402 VanDerWaalsContact C-N 3.28Å; F400-A402 PolarHBondContact O-N 2.97Å; A402-R404 VanDerWaalsContact C-N 3.26Å; A402-R404 PolarHBondContact O-N 2.8Å; A402-S405 PolarHBondContact O-N 2.64Å; A402-L406 WeakPolarHBondContact O-CB 3.01Å; A402-L406 PolarHBondContact O-N 2.85Å
403	L	95.8	Very high	94.5	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-56.9	-43.7	173	-72.2	172	0	0	0	110.7	L35 W56 L71 L88 F399 F400 L406	L35-L403 HydrophobicContact CD1-CB 4.2Å; L35-L403 HydrophobicContact CD2-CB 3.97Å; W56-L403 HydrophobicContact CE3-CD1 4.2Å; W56-L403 HydrophobicContact CE3-CD2 4.15Å; W56-L403 HydrophobicContact CZ3-CD1 4.41Å; W56-L403 HydrophobicContact CZ3-CD2 4.05Å; L71-L403 HydrophobicContact CD2-CD2 3.81Å; L71-L403 HydrophobicContact CD2-CG 4.22Å; L88-L403 HydrophobicContact CD1-CD2 3.64Å; L88-L403 HydrophobicContact CD2-CD2 3.99Å; L88-L403 HydrophobicContact CG-CD2 4.49Å; F399-L403 HydrophobicContact CD1-CD1 3.91Å; F399-L403 HydrophobicContact CD1-CG 4.21Å; F399-L403 HydrophobicContact CE1-CD1 3.63Å; F399-L403 HydrophobicContact CE1-CD2 4.23Å; F399-L403 HydrophobicContact CE1-CG 3.94Å; F399-L403 HydrophobicContact CZ-CD1 4.35Å; F399-L403 HydrophobicContact CZ-CD2 4.13Å; F399-L403 HydrophobicContact CZ-CG 4.22Å; F399-L403 WeakPolarHBondContact O-CG 3.21Å; F399-L403 PolarHBondContact O-N 3.16Å; F400-L403 PolarHBondContact O-N 3.05Å; L403-L406 WeakPolarHBondContact O-CB 3.4Å
404	R	95.7	Very high	94.5	Very high	10 Å²	10	8.9 Å²	8.9	4%	0.038	4%	0.042	C	C	.	.	H	α-helix	trans	-65.7	-48.9	176.2	-178.3	175.4	165	-147.6	-17.2	111.3	L35 A38 A300 D303 C304 F400 Y401 A402 L406 L407	L35-R404 HydrophobicContact CD1-CB 3.89Å; L35-R404 HydrophobicContact CG-CB 4.15Å; L35-R404 WeakPolarHBondContact O-CD 3.41Å; A38-R404 PolarHBondContact O-NE 2.97Å; A38-R404 PolarHBondContact O-NH1 3.15Å; A300-R404 PolarHBondContact O-NH2 3.41Å; D303-R404 IonicContact OD2-NH2 2.65Å; C304-R404 HydrophobicContact CB-CG 4.49Å; C304-R404 PolarHBondContact SG-O 3Å; C304-R404 VanDerWaalsContact SG-O 3.33Å; F400-R404 PolarHBondContact O-N 3.38Å; Y401-R404 PolarHBondContact O-N 3Å; A402-R404 VanDerWaalsContact C-N 3.26Å; A402-R404 PolarHBondContact O-N 2.8Å; R404-L406 VanDerWaalsContact C-N 3.25Å; R404-L406 PolarHBondContact O-N 2.75Å; R404-L407 PolarHBondContact O-N 2.93Å; R404-L407 VanDerWaalsContact O-N 3.11Å
405	S	94.6	Very high	94.6	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-64.6	-25.2	179.1	-68	0	0	0	0	113.8	N309 Y401 A402 L407 A408	N309-S405 PolarHBondContact ND2-O 3.29Å; N309-S405 WeakPolarHBondContact OD1-CB 3.35Å; N309-S405 PolarHBondContact OD1-O 2.97Å; N309-S405 VanDerWaalsContact OD1-O 3.1Å; Y401-S405 WeakPolarHBondContact O-CB 3.38Å; Y401-S405 PolarHBondContact O-N 3.36Å; Y401-S405 PolarHBondContact O-OG 3.1Å; A402-S405 PolarHBondContact O-N 2.64Å; S405-L407 PolarHBondContact O-N 3.33Å; S405-A408 VanDerWaalsContact O-CB 3.22Å; S405-A408 WeakPolarHBondContact O-CB 3.48Å; S405-A408 PolarHBondContact O-N 3.14Å
406	L	95.1	Very high	94.8	Very high	9 Å²	9	4.9 Å²	4.9	5%	0.047	2%	0.024	C	C	.	.	H	α-helix	trans	-55.1	-38.4	171.9	-177.9	65.9	0	0	0	110.9	L71 L72 L88 L91 R92 I95 A402 L403 R404 A408 P409	L71-L406 HydrophobicContact CD1-CD2 3.76Å; L71-L406 HydrophobicContact CG-CD2 4.33Å; L71-L406 WeakPolarHBondContact O-CD1 3.33Å; L72-L406 HydrophobicContact CD2-CB 4.21Å; L88-L406 HydrophobicContact CD1-CD2 4.45Å; L91-L406 HydrophobicContact CD2-CD2 4.32Å; L91-L406 HydrophobicContact CG-CD2 4.35Å; R92-L406 HydrophobicContact CB-CD2 4.47Å; R92-L406 HydrophobicContact CG-CD1 4.43Å; I95-L406 HydrophobicContact CD1-CD1 4.47Å; I95-L406 HydrophobicContact CD1-CD2 4.06Å; I95-L406 HydrophobicContact CD1-CG 3.67Å; I95-L406 WeakPolarHBondContact CG2-O 3.44Å; A402-L406 WeakPolarHBondContact O-CB 3.01Å; A402-L406 PolarHBondContact O-N 2.85Å; L403-L406 WeakPolarHBondContact O-CB 3.4Å; R404-L406 VanDerWaalsContact C-N 3.25Å; R404-L406 PolarHBondContact O-N 2.75Å; L406-A408 VanDerWaalsContact C-N 3.34Å; L406-P409 WeakPolarHBondContact O-CD 3.3Å
407	L	94.7	Very high	94.8	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.019	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.2	179.6	-68.3	158.4	0	0	0	113.8	Y32 L35 L36 L91 I95 R404 S405 L410 V411	Y32-L407 HydrophobicContact CD2-CD2 4.35Å; Y32-L407 HydrophobicContact CG-CD1 4.22Å; L35-L407 HydrophobicContact CD2-CD1 3.81Å; L35-L407 HydrophobicContact CG-CD1 4.28Å; L36-L407 HydrophobicContact CD2-CB 3.62Å; L36-L407 HydrophobicContact CD2-CD1 3.88Å; L36-L407 HydrophobicContact CD2-CG 4.35Å; L36-L407 HydrophobicContact CG-CB 4.49Å; L36-L407 HydrophobicContact CG-CD1 3.93Å; L91-L407 HydrophobicContact CD1-CD2 4.19Å; I95-L407 HydrophobicContact CD1-CD2 3.71Å; I95-L407 HydrophobicContact CD1-CG 4.17Å; I95-L407 HydrophobicContact CG1-CD2 4.42Å; R404-L407 PolarHBondContact O-N 2.93Å; R404-L407 VanDerWaalsContact O-N 3.11Å; S405-L407 PolarHBondContact O-N 3.33Å; L407-L410 HydrophobicContact CD2-CD2 4.36Å; L407-L410 WeakPolarHBondContact O-CB 3.47Å; L407-L410 PolarHBondContact O-N 3.45Å; L407-L410 VanDerWaalsContact O-N 3.1Å; L407-V411 PolarHBondContact O-N 2.71Å; L407-V411 VanDerWaalsContact O-N 3.12Å
408	A	94.4	Very high	94.7	Very high	2 Å²	2	3.8 Å²	3.8	2%	0.017	2%	0.019	C	C	.	.	H	α-helix	trans	-55.9	-46.6	-175.4	0	0	0	0	0	113.8	C304 S405 L406 L410 V411 E412	C304-A408 WeakPolarHBondContact O-CB 3.49Å; S405-A408 VanDerWaalsContact O-CB 3.22Å; S405-A408 WeakPolarHBondContact O-CB 3.48Å; S405-A408 PolarHBondContact O-N 3.14Å; L406-A408 VanDerWaalsContact C-N 3.34Å; A408-L410 PolarHBondContact O-N 3.15Å; A408-V411 PolarHBondContact O-N 2.64Å; A408-E412 PolarHBondContact O-N 3.4Å
409	P	93.7	Very high	94.8	Very high	20 Å²	20	4 Å²	4	13%	0.13	2%	0.02	C	C	.	.	H	α-helix	trans	-61.8	-34.1	178.1	-22.4	35.3	0	0	0	112.6	L406 S413	L406-P409 WeakPolarHBondContact O-CD 3.3Å; P409-S413 VanDerWaalsContact O-CB 3.3Å; P409-S413 WeakPolarHBondContact O-CB 3.28Å; P409-S413 PolarHBondContact O-N 3.07Å; P409-S413 PolarHBondContact O-OG 3.32Å
410	L	93.5	Very high	94.9	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-69.2	-43.3	-179.9	-173.6	62.6	0	0	0	111	L25 T29 F94 I95 S99 L407 A408 S413 I414	L25-L410 HydrophobicContact CB-CD1 4.33Å; L25-L410 HydrophobicContact CD1-CD1 3.95Å; L25-L410 HydrophobicContact CD2-CD1 4.05Å; L25-L410 HydrophobicContact CG-CD1 4.31Å; T29-L410 HydrophobicContact CG2-CD2 3.48Å; T29-L410 VanDerWaalsContact CG2-CD2 3.48Å; T29-L410 HydrophobicContact CG2-CG 3.83Å; F94-L410 HydrophobicContact CD1-CD2 4.33Å; F94-L410 HydrophobicContact CE1-CD1 4.32Å; F94-L410 HydrophobicContact CE1-CD2 3.98Å; I95-L410 HydrophobicContact CG1-CB 4.46Å; I95-L410 HydrophobicContact CG1-CD2 4.11Å; S99-L410 PolarHBondContact OG-N 3.46Å; L407-L410 HydrophobicContact CD2-CD2 4.36Å; L407-L410 WeakPolarHBondContact O-CB 3.47Å; L407-L410 PolarHBondContact O-N 3.45Å; L407-L410 VanDerWaalsContact O-N 3.1Å; A408-L410 PolarHBondContact O-N 3.15Å; L410-S413 WeakPolarHBondContact O-CB 3.4Å; L410-S413 PolarHBondContact O-N 3.44Å; L410-I414 HydrophobicContact CG-CD1 4.45Å; L410-I414 WeakPolarHBondContact O-CG1 3.39Å; L410-I414 PolarHBondContact O-N 3.29Å
411	V	94.2	Very high	94.8	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-65.9	-43.9	176.1	-177.6	0	0	0	0	111.2	L36 F297 A305 L407 A408 S413 I414 I415	L36-V411 HydrophobicContact CD1-CG2 4.15Å; L36-V411 HydrophobicContact CD2-CG2 3.71Å; F297-V411 HydrophobicContact CD2-CG1 4.28Å; F297-V411 HydrophobicContact CE2-CG1 4.28Å; A305-V411 HydrophobicContact CB-CB 3.98Å; A305-V411 HydrophobicContact CB-CG1 3.79Å; L407-V411 PolarHBondContact O-N 2.71Å; L407-V411 VanDerWaalsContact O-N 3.12Å; A408-V411 PolarHBondContact O-N 2.64Å; V411-S413 VanDerWaalsContact C-N 3.27Å; V411-S413 PolarHBondContact O-N 2.93Å; V411-I414 PolarHBondContact O-N 3.17Å; V411-I415 HydrophobicContact CG1-CD1 4.18Å; V411-I415 WeakPolarHBondContact O-CG1 3.48Å; V411-I415 PolarHBondContact O-N 3.13Å; V411-I415 VanDerWaalsContact O-N 3.14Å
412	E	95	Very high	94.8	Very high	4 Å²	4	3.8 Å²	3.8	2%	0.019	2%	0.02	C	C	.	.	H	α-helix	trans	-58.8	-41.3	174.1	178.1	165.4	-137.7	0	0	111.2	R102 Y271 A305 A408 I415 L416	R102-E412 IonicContact NH1-OE2 2.97Å; R102-E412 PolarHBondContact NH1-OE2 3.18Å; Y271-E412 HydrophobicContact CE2-CB 4.37Å; Y271-E412 HydrophobicContact CE2-CG 3.88Å; Y271-E412 WeakPolarHBondContact CE2-OE1 3.35Å; Y271-E412 PolarHBondContact OH-OE1 2.87Å; A305-E412 HydrophobicContact CB-CB 4.22Å; A408-E412 PolarHBondContact O-N 3.4Å; E412-I415 PolarHBondContact O-N 3Å; E412-L416 HydrophobicContact CG-CD1 3.86Å; E412-L416 HydrophobicContact CG-CG 4.42Å; E412-L416 WeakPolarHBondContact O-CG 3.09Å; E412-L416 PolarHBondContact O-N 3.06Å
413	S	94.4	Very high	94.9	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.014	2%	0.02	C	C	.	.	H	α-helix	trans	-62.3	-46	177.8	-59.2	0	0	0	0	112.1	S99 L100 P409 L410 V411 I415 L416 L417	S99-S413 WeakPolarHBondContact CA-OG 3.42Å; L100-S413 PolarHBondContact N-OG 3.1Å; P409-S413 VanDerWaalsContact O-CB 3.3Å; P409-S413 WeakPolarHBondContact O-CB 3.28Å; P409-S413 PolarHBondContact O-N 3.07Å; P409-S413 PolarHBondContact O-OG 3.32Å; L410-S413 WeakPolarHBondContact O-CB 3.4Å; L410-S413 PolarHBondContact O-N 3.44Å; V411-S413 VanDerWaalsContact C-N 3.27Å; V411-S413 PolarHBondContact O-N 2.93Å; S413-I415 VanDerWaalsContact C-N 3.3Å; S413-I415 PolarHBondContact O-N 2.9Å; S413-L416 PolarHBondContact O-N 3.27Å; S413-L417 VanDerWaalsContact O-CB 3.22Å; S413-L417 WeakPolarHBondContact O-CB 3.28Å; S413-L417 WeakPolarHBondContact O-CG 3.24Å; S413-L417 PolarHBondContact O-N 2.98Å
414	I	94.2	Very high	94.8	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-59.3	-43.3	177.7	-67.7	164	0	0	0	110.9	L22 L25 I26 T29 W281 L288 F297 L410 V411 D418	L22-I414 HydrophobicContact CD2-CB 4.44Å; L22-I414 HydrophobicContact CD2-CG1 4.49Å; L22-I414 HydrophobicContact CD2-CG2 4.21Å; L25-I414 HydrophobicContact CB-CD1 3.78Å; L25-I414 HydrophobicContact CB-CG1 3.69Å; L25-I414 HydrophobicContact CD1-CG1 3.94Å; L25-I414 HydrophobicContact CG-CG1 4.48Å; I26-I414 HydrophobicContact CG1-CG2 4.13Å; T29-I414 HydrophobicContact CG2-CD1 3.7Å; W281-I414 HydrophobicContact CH2-CG2 3.81Å; W281-I414 HydrophobicContact CZ3-CG2 3.76Å; L288-I414 HydrophobicContact CD2-CG2 4.38Å; F297-I414 HydrophobicContact CE2-CB 4.26Å; F297-I414 HydrophobicContact CE2-CD1 3.98Å; F297-I414 HydrophobicContact CE2-CG2 3.86Å; F297-I414 HydrophobicContact CZ-CD1 3.67Å; L410-I414 HydrophobicContact CG-CD1 4.45Å; L410-I414 WeakPolarHBondContact O-CG1 3.39Å; L410-I414 PolarHBondContact O-N 3.29Å; V411-I414 PolarHBondContact O-N 3.17Å; I414-D418 VanDerWaalsContact O-CB 3.29Å; I414-D418 WeakPolarHBondContact O-CB 3.36Å; I414-D418 PolarHBondContact O-N 3.01Å
415	I	94.2	Very high	94.7	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-63.8	-44.2	178.2	-64.6	165	0	0	0	111.2	Y271 L274 W281 L302 A305 V411 E412 S413 R419	Y271-I415 HydrophobicContact CD1-CD1 4.12Å; Y271-I415 HydrophobicContact CD1-CG2 3.96Å; Y271-I415 HydrophobicContact CD2-CD1 4.26Å; Y271-I415 HydrophobicContact CE1-CG2 3.98Å; Y271-I415 HydrophobicContact CG-CD1 3.85Å; L274-I415 HydrophobicContact CD1-CG2 4.1Å; W281-I415 HydrophobicContact CH2-CG1 4.31Å; W281-I415 HydrophobicContact CZ2-CB 4.38Å; W281-I415 HydrophobicContact CZ2-CG1 4.04Å; L302-I415 HydrophobicContact CD2-CD1 3.68Å; L302-I415 HydrophobicContact CD2-CG1 4.42Å; A305-I415 HydrophobicContact CB-CD1 4.38Å; V411-I415 HydrophobicContact CG1-CD1 4.18Å; V411-I415 WeakPolarHBondContact O-CG1 3.48Å; V411-I415 PolarHBondContact O-N 3.13Å; V411-I415 VanDerWaalsContact O-N 3.14Å; E412-I415 PolarHBondContact O-N 3Å; S413-I415 VanDerWaalsContact C-N 3.3Å; S413-I415 PolarHBondContact O-N 2.9Å; I415-R419 VanDerWaalsContact O-CD 3.27Å; I415-R419 WeakPolarHBondContact O-CD 3.41Å; I415-R419 WeakPolarHBondContact O-CG 3.45Å; I415-R419 PolarHBondContact O-N 3.46Å
416	L	95.4	Very high	94.7	Very high	3 Å²	3	9.4 Å²	9.4	2%	0.016	5%	0.047	C	C	.	.	H	α-helix	trans	-71	-39.3	-178.9	-72.4	172.7	0	0	0	112.5	L100 E412 S413 R419 A420 L432 L445	L100-L416 HydrophobicContact CD1-CB 3.79Å; L100-L416 HydrophobicContact CD1-CD1 3.97Å; E412-L416 HydrophobicContact CG-CD1 3.86Å; E412-L416 HydrophobicContact CG-CG 4.42Å; E412-L416 WeakPolarHBondContact O-CG 3.09Å; E412-L416 PolarHBondContact O-N 3.06Å; S413-L416 PolarHBondContact O-N 3.27Å; L416-R419 PolarHBondContact O-N 3.26Å; L416-A420 WeakPolarHBondContact O-CB 3.33Å; L416-A420 PolarHBondContact O-N 3.29Å; L416-L432 HydrophobicContact CB-CD1 4.27Å; L416-L432 HydrophobicContact CB-CD2 3.99Å; L416-L432 HydrophobicContact CD1-CD2 4.41Å; L416-L432 HydrophobicContact CD2-CD2 4.21Å; L416-L432 HydrophobicContact CG-CD2 4.44Å; L416-L445 HydrophobicContact CD1-CB 3.63Å; L416-L445 HydrophobicContact CD1-CD1 3.43Å; L416-L445 VanDerWaalsContact CD1-CD1 3.43Å; L416-L445 HydrophobicContact CD1-CG 4.16Å
417	L	95.1	Very high	94.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-68.2	-38.1	176.7	-72.7	170.8	0	0	0	111.8	F10 F21 L22 L25 L100 S413 R419 A420 L421 L432	F10-L417 HydrophobicContact CD1-CD2 3.81Å; F10-L417 HydrophobicContact CE1-CD2 3.25Å; F10-L417 HydrophobicContact CE2-CD2 4.27Å; F10-L417 HydrophobicContact CZ-CD2 3.52Å; F21-L417 HydrophobicContact CD1-CD1 4.01Å; F21-L417 HydrophobicContact CE1-CD1 3.69Å; L22-L417 HydrophobicContact CD1-CB 3.93Å; L22-L417 HydrophobicContact CD2-CB 3.48Å; L22-L417 VanDerWaalsContact CD2-CB 3.48Å; L22-L417 HydrophobicContact CD2-CD1 4.02Å; L22-L417 HydrophobicContact CD2-CG 4.42Å; L22-L417 HydrophobicContact CG-CB 3.94Å; L25-L417 HydrophobicContact CD1-CD1 4.16Å; L100-L417 HydrophobicContact CD1-CG 4.33Å; L100-L417 HydrophobicContact CD2-CD2 4.06Å; L100-L417 HydrophobicContact CD2-CG 4.37Å; L100-L417 HydrophobicContact CG-CG 4.42Å; S413-L417 VanDerWaalsContact O-CB 3.22Å; S413-L417 WeakPolarHBondContact O-CB 3.28Å; S413-L417 WeakPolarHBondContact O-CG 3.24Å; S413-L417 PolarHBondContact O-N 2.98Å; L417-R419 VanDerWaalsContact C-N 3.33Å; L417-R419 PolarHBondContact O-N 3.04Å; L417-A420 PolarHBondContact O-N 3.49Å; L417-L421 VanDerWaalsContact O-CB 3.25Å; L417-L421 WeakPolarHBondContact O-CB 3.1Å; L417-L421 PolarHBondContact O-N 3.36Å; L417-L432 HydrophobicContact CD2-CD1 4.18Å
418	D	94.4	Very high	94.4	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-57.2	-46.6	170.9	172.2	58.6	0	0	0	112	W281 P283 L284 S285 L288 I414 L421 F422	W281-D418 HydrophobicContact CH2-CB 3.88Å; W281-D418 HydrophobicContact CZ2-CB 3.95Å; P283-D418 WeakPolarHBondContact CA-OD2 3.19Å; P283-D418 VanDerWaalsContact CB-OD1 3.29Å; P283-D418 WeakPolarHBondContact CB-OD1 3.27Å; L284-D418 PolarHBondContact N-OD1 2.8Å; L284-D418 PolarHBondContact N-OD2 2.62Å; S285-D418 WeakPolarHBondContact CB-OD1 3.3Å; S285-D418 PolarHBondContact N-OD1 2.93Å; S285-D418 PolarHBondContact OG-OD1 3.43Å; L288-D418 HydrophobicContact CD2-CB 3.92Å; I414-D418 VanDerWaalsContact O-CB 3.29Å; I414-D418 WeakPolarHBondContact O-CB 3.36Å; I414-D418 PolarHBondContact O-N 3.01Å; D418-L421 PolarHBondContact O-N 3.11Å; D418-F422 WeakPolarHBondContact O-CB 3.41Å; D418-F422 PolarHBondContact O-N 3.13Å
419	R	95.4	Very high	94.4	Very high	6 Å²	6	13.8 Å²	13.8	2%	0.023	8%	0.084	C	C	.	.	H	α-helix	trans	-65.9	-42.4	178.2	-67.8	163.4	179.2	-150.5	-9.9	111.7	S248 I252 L284 I415 L416 L417 F422 L423 L447	S248-R419 PolarHBondContact OG-NH1 3.47Å; S248-R419 PolarHBondContact OG-NH2 3.45Å; I252-R419 HydrophobicContact CD1-CB 3.85Å; I252-R419 HydrophobicContact CD1-CG 3.69Å; L284-R419 HydrophobicContact CD1-CG 4.16Å; I415-R419 VanDerWaalsContact O-CD 3.27Å; I415-R419 WeakPolarHBondContact O-CD 3.41Å; I415-R419 WeakPolarHBondContact O-CG 3.45Å; I415-R419 PolarHBondContact O-N 3.46Å; L416-R419 PolarHBondContact O-N 3.26Å; L417-R419 VanDerWaalsContact C-N 3.33Å; L417-R419 PolarHBondContact O-N 3.04Å; R419-F422 PolarHBondContact O-N 3.11Å; R419-L423 WeakPolarHBondContact O-CG 3.2Å; R419-L423 PolarHBondContact O-N 3.33Å; R419-L423 VanDerWaalsContact O-N 3.12Å; R419-L447 HydrophobicContact CB-CD2 3.85Å
420	A	96	Very high	94.4	Very high	1 Å²	1	13 Å²	13	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-62.8	-44.3	176.9	0	0	0	0	0	111.1	I12 L416 L417 L423 R424 V430 L432 L447	I12-A420 VanDerWaalsContact CD1-C 3.47Å; I12-A420 HydrophobicContact CD1-CB 3.63Å; L416-A420 WeakPolarHBondContact O-CB 3.33Å; L416-A420 PolarHBondContact O-N 3.29Å; L417-A420 PolarHBondContact O-N 3.49Å; A420-L423 WeakPolarHBondContact O-CB 3.36Å; A420-L423 PolarHBondContact O-N 3.31Å; A420-R424 PolarHBondContact O-N 2.92Å; A420-V430 HydrophobicContact CB-CG1 3.6Å; A420-L432 HydrophobicContact CB-CD1 3.93Å; A420-L447 HydrophobicContact CB-CD1 4.02Å
421	L	95.1	Very high	94.4	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.6	-42.2	176.1	-178	63.2	0	0	0	111.6	I12 E15 Q19 L22 R287 L288 L417 D418 L423 R424 E425	I12-L421 HydrophobicContact CD1-CB 4.45Å; E15-L421 HydrophobicContact CB-CD1 4.29Å; E15-L421 HydrophobicContact CG-CD1 4.45Å; Q19-L421 HydrophobicContact CG-CD1 4.1Å; Q19-L421 HydrophobicContact CG-CD2 3.58Å; Q19-L421 HydrophobicContact CG-CG 4.48Å; L22-L421 HydrophobicContact CD1-CB 4.46Å; L22-L421 HydrophobicContact CD1-CD2 4Å; R287-L421 HydrophobicContact CB-CD2 4.09Å; L288-L421 HydrophobicContact CD1-CD2 4.16Å; L417-L421 VanDerWaalsContact O-CB 3.25Å; L417-L421 WeakPolarHBondContact O-CB 3.1Å; L417-L421 PolarHBondContact O-N 3.36Å; D418-L421 PolarHBondContact O-N 3.11Å; L421-L423 VanDerWaalsContact C-N 3.29Å; L421-L423 PolarHBondContact O-N 2.94Å; L421-R424 WeakPolarHBondContact O-CB 3.39Å; L421-R424 PolarHBondContact O-N 3.44Å; L421-E425 HydrophobicContact CD1-CG 4.36Å; L421-E425 HydrophobicContact CG-CG 4.29Å; L421-E425 WeakPolarHBondContact O-CB 3.43Å; L421-E425 VanDerWaalsContact O-CG 3.3Å; L421-E425 WeakPolarHBondContact O-CG 3.37Å; L421-E425 PolarHBondContact O-N 3.44Å
422	F	95.6	Very high	94.5	Very high	21 Å²	21	13 Å²	13	9%	0.092	8%	0.079	C	C	.	.	H	α-helix	trans	-57.9	-40.6	174.5	174.6	-101.3	0	0	0	112.5	I252 V256 L284 D418 R419 N426	I252-F422 HydrophobicContact CG2-CD1 3.45Å; I252-F422 VanDerWaalsContact CG2-CD1 3.45Å; I252-F422 HydrophobicContact CG2-CE1 3.7Å; V256-F422 HydrophobicContact CB-CE1 4.24Å; V256-F422 HydrophobicContact CG2-CD1 4.23Å; V256-F422 HydrophobicContact CG2-CE1 3.57Å; V256-F422 HydrophobicContact CG2-CZ 4.2Å; L284-F422 HydrophobicContact CB-CB 3.75Å; L284-F422 HydrophobicContact CB-CD1 4.26Å; L284-F422 HydrophobicContact CB-CD2 3.91Å; L284-F422 HydrophobicContact CB-CG 3.69Å; L284-F422 HydrophobicContact CD1-CD1 4.32Å; L284-F422 WeakPolarHBondContact O-CD2 3.41Å; D418-F422 WeakPolarHBondContact O-CB 3.41Å; D418-F422 PolarHBondContact O-N 3.13Å; R419-F422 PolarHBondContact O-N 3.11Å; F422-N426 PolarHBondContact O-N 3.42Å; F422-N426 PolarHBondContact O-ND2 3.37Å
423	L	95.9	Very high	94.5	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.7	-42.8	176	-70.2	-179.7	0	0	0	112	I252 F255 V256 L264 R419 A420 L421 N426 G427 S428 V430 L447	I252-L423 HydrophobicContact CG2-CD2 3.84Å; I252-L423 HydrophobicContact CG2-CG 4.27Å; F255-L423 HydrophobicContact CD1-CD2 3.47Å; F255-L423 VanDerWaalsContact CD1-CD2 3.47Å; F255-L423 HydrophobicContact CE1-CD2 3.73Å; V256-L423 HydrophobicContact CG2-CD2 3.79Å; L264-L423 HydrophobicContact CD2-CD1 4.13Å; L264-L423 HydrophobicContact CD2-CD2 4.38Å; R419-L423 WeakPolarHBondContact O-CG 3.2Å; R419-L423 PolarHBondContact O-N 3.33Å; R419-L423 VanDerWaalsContact O-N 3.12Å; A420-L423 WeakPolarHBondContact O-CB 3.36Å; A420-L423 PolarHBondContact O-N 3.31Å; L421-L423 VanDerWaalsContact C-N 3.29Å; L421-L423 PolarHBondContact O-N 2.94Å; L423-N426 CarbonylContact O-C 3.58Å; L423-N426 PolarHBondContact O-N 3.07Å; L423-G427 PolarHBondContact O-N 3.12Å; L423-S428 WeakPolarHBondContact O-CB 3.5Å; L423-S428 PolarHBondContact O-N 3.43Å; L423-V430 HydrophobicContact CB-CG2 3.44Å; L423-V430 VanDerWaalsContact CB-CG2 3.44Å; L423-V430 HydrophobicContact CD1-CG2 4.12Å; L423-V430 HydrophobicContact CG-CG2 4.44Å; L423-L447 HydrophobicContact CD1-CD1 4.18Å; L423-L447 HydrophobicContact CD1-CD2 3.98Å; L423-L447 HydrophobicContact CD1-CG 4.13Å
424	R	93.8	Very high	94.5	Very high	42 Å²	42	12.8 Å²	12.8	16%	0.158	8%	0.077	C	C	.	.	H	α-helix	trans	-61.7	-46.6	175.4	-76.8	-63.9	-41.6	171.9	3.9	112.6	I12 E15 A420 L421 N426 G427 S428 E429 V430	I12-R424 HydrophobicContact CB-CG 3.68Å; I12-R424 HydrophobicContact CD1-CB 4.46Å; I12-R424 HydrophobicContact CD1-CG 3.6Å; I12-R424 HydrophobicContact CG1-CG 4.2Å; I12-R424 HydrophobicContact CG2-CG 3.75Å; E15-R424 HydrophobicContact CG-CB 3.98Å; E15-R424 IonicContact OE1-CZ 3.77Å; E15-R424 IonicContact OE1-NE 2.71Å; E15-R424 PolarHBondContact OE1-NE 3.28Å; E15-R424 VanDerWaalsContact OE1-NE 3.16Å; E15-R424 IonicContact OE1-NH2 2.85Å; E15-R424 PolarHBondContact OE1-NH2 2.97Å; A420-R424 PolarHBondContact O-N 2.92Å; L421-R424 WeakPolarHBondContact O-CB 3.39Å; L421-R424 PolarHBondContact O-N 3.44Å; R424-N426 PolarHBondContact O-N 3.31Å; R424-G427 PolarHBondContact O-N 3.07Å; R424-S428 VanDerWaalsContact CD-O 3.3Å; R424-S428 WeakPolarHBondContact CD-O 3.45Å; R424-E429 IonicContact NH1-OE1 3.09Å; R424-E429 PolarHBondContact NH1-OE1 2.94Å; R424-E429 IonicContact NH1-OE2 2.64Å; R424-E429 PolarHBondContact NH1-OE2 3.32Å; R424-V430 HydrophobicContact CG-CB 4.28Å; R424-V430 HydrophobicContact CG-CG2 3.84Å
425	E	93.4	Very high	94.4	Very high	21 Å²	21	13 Å²	13	10%	0.098	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.7	175.8	-78.7	177.3	169.3	0	0	113.5	S285 R286 R287 L421	S285-E425 WeakPolarHBondContact CA-OE2 3.46Å; R286-E425 PolarHBondContact N-OE1 3.47Å; R286-E425 PolarHBondContact N-OE2 3.12Å; R286-E425 PolarHBondContact NH2-O 3.13Å; R287-E425 PolarHBondContact N-OE1 3.15Å; L421-E425 HydrophobicContact CD1-CG 4.36Å; L421-E425 HydrophobicContact CG-CG 4.29Å; L421-E425 WeakPolarHBondContact O-CB 3.43Å; L421-E425 VanDerWaalsContact O-CG 3.3Å; L421-E425 WeakPolarHBondContact O-CG 3.37Å; L421-E425 PolarHBondContact O-N 3.44Å
426	N	94	Very high	94.3	Very high	66 Å²	66	13 Å²	13	35%	0.353	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	23.7	176.5	-68.9	-84	0	0	0	112.7	V256 F422 L423 R424 S428	V256-N426 HydrophobicContact CB-CB 4.45Å; V256-N426 HydrophobicContact CG1-CB 3.66Å; V256-N426 HydrophobicContact CG2-CB 3.93Å; F422-N426 PolarHBondContact O-N 3.42Å; F422-N426 PolarHBondContact O-ND2 3.37Å; L423-N426 CarbonylContact O-C 3.58Å; L423-N426 PolarHBondContact O-N 3.07Å; R424-N426 PolarHBondContact O-N 3.31Å; N426-S428 PolarHBondContact O-N 3.47Å
427	G	92.1	Very high	94.1	Very high	65 Å²	65	15 Å²	15	67%	0.67	9%	0.089	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.9	13.3	168.7	0	0	0	0	0	115.7	L423 R424	L423-G427 PolarHBondContact O-N 3.12Å; R424-G427 PolarHBondContact O-N 3.07Å
428	S	93	Very high	93.9	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.089	C	C	.	.			trans	-91.7	147.6	176.9	-56.6	0	0	0	0	111.4	F255 L423 R424 N426	F255-S428 VanDerWaalsContact CE1-OG 3.27Å; F255-S428 WeakPolarHBondContact CE1-OG 3.47Å; L423-S428 WeakPolarHBondContact O-CB 3.5Å; L423-S428 PolarHBondContact O-N 3.43Å; R424-S428 VanDerWaalsContact CD-O 3.3Å; R424-S428 WeakPolarHBondContact CD-O 3.45Å; N426-S428 PolarHBondContact O-N 3.47Å
429	E	92.9	Very high	93.6	Very high	37 Å²	37	18.9 Å²	18.9	17%	0.173	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	141.3	167.8	-69.7	-67.6	166.3	0	0	110.2	R424 G449 F450 A452 V458 W460 K461	R424-E429 IonicContact NH1-OE1 3.09Å; R424-E429 PolarHBondContact NH1-OE1 2.94Å; R424-E429 IonicContact NH1-OE2 2.64Å; R424-E429 PolarHBondContact NH1-OE2 3.32Å; E429-G449 CarbonylContact O-C 3.4Å; E429-G449 WeakPolarHBondContact O-CA 3.15Å; E429-F450 HydrophobicContact CB-CB 4.49Å; E429-F450 WeakPolarHBondContact CB-O 3.25Å; E429-F450 PolarHBondContact N-O 3.18Å; E429-F450 PolarHBondContact O-N 3.05Å; E429-A452 HydrophobicContact CG-CB 4.26Å; E429-V458 HydrophobicContact CB-CG1 4.43Å; E429-V458 HydrophobicContact CB-CG2 4.01Å; E429-V458 HydrophobicContact CG-CG2 3.73Å; E429-W460 HydrophobicContact CB-CZ2 4.3Å; E429-K461 IonicContact OE1-NZ 2.65Å; E429-K461 PolarHBondContact OE1-NZ 3.17Å; E429-K461 VanDerWaalsContact OE1-NZ 3.16Å; E429-K461 WeakPolarHBondContact OE2-CE 3.38Å; E429-K461 IonicContact OE2-NZ 3.03Å; E429-K461 PolarHBondContact OE2-NZ 3.17Å
430	V	93.8	Very high	93.2	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.018	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.8	-168	-175.2	0	0	0	0	111.7	A420 L423 R424 L447 V448	A420-V430 HydrophobicContact CB-CG1 3.6Å; L423-V430 HydrophobicContact CB-CG2 3.44Å; L423-V430 VanDerWaalsContact CB-CG2 3.44Å; L423-V430 HydrophobicContact CD1-CG2 4.12Å; L423-V430 HydrophobicContact CG-CG2 4.44Å; R424-V430 HydrophobicContact CG-CB 4.28Å; R424-V430 HydrophobicContact CG-CG2 3.84Å; V430-L447 HydrophobicContact CG1-CD1 3.65Å; V430-V448 VanDerWaalsContact CA-O 3.31Å; V430-V448 WeakPolarHBondContact CA-O 3.33Å
431	L	94.3	Very high	92.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.9	173.6	-174.4	73.7	0	0	0	109.9	L9 E11 V111 A433 V448 W460	L9-L431 HydrophobicContact CB-CD1 4.17Å; L9-L431 HydrophobicContact CD1-CD1 4.4Å; L9-L431 HydrophobicContact CD2-CD1 3.83Å; L9-L431 HydrophobicContact CD2-CD2 3.95Å; L9-L431 HydrophobicContact CD2-CG 4.03Å; L9-L431 HydrophobicContact CG-CD1 4.36Å; E11-L431 HydrophobicContact CG-CD1 3.37Å; V111-L431 HydrophobicContact CB-CD2 4.48Å; V111-L431 HydrophobicContact CG1-CD2 3.71Å; V111-L431 HydrophobicContact CG2-CD2 4.33Å; L431-A433 HydrophobicContact CD2-CB 4.44Å; L431-V448 HydrophobicContact CB-CB 4.04Å; L431-V448 HydrophobicContact CB-CG2 4.21Å; L431-V448 HydrophobicContact CD2-CG2 4.39Å; L431-V448 PolarHBondContact N-O 2.89Å; L431-V448 PolarHBondContact O-N 2.8Å; L431-W460 HydrophobicContact CB-CD2 4.25Å; L431-W460 HydrophobicContact CB-CH2 4.47Å; L431-W460 HydrophobicContact CB-CZ2 3.89Å; L431-W460 HydrophobicContact CD1-CG 4.45Å; L431-W460 HydrophobicContact CD2-CB 4.23Å; L431-W460 HydrophobicContact CD2-CD2 3.97Å; L431-W460 HydrophobicContact CD2-CE3 4.4Å; L431-W460 HydrophobicContact CD2-CG 3.92Å
432	L	95.8	Very high	92.5	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.9	166.3	-76.7	161.9	0	0	0	108.8	F10 L100 L416 L417 A420 L446 L447	F10-L432 HydrophobicContact CB-CB 4.14Å; F10-L432 HydrophobicContact CD1-CD1 4.11Å; F10-L432 PolarHBondContact N-O 3.27Å; F10-L432 PolarHBondContact O-N 3.3Å; L100-L432 HydrophobicContact CD1-CD1 3.81Å; L100-L432 HydrophobicContact CD2-CD1 4.27Å; L416-L432 HydrophobicContact CB-CD1 4.27Å; L416-L432 HydrophobicContact CB-CD2 3.99Å; L416-L432 HydrophobicContact CD1-CD2 4.41Å; L416-L432 HydrophobicContact CD2-CD2 4.21Å; L416-L432 HydrophobicContact CG-CD2 4.44Å; L417-L432 HydrophobicContact CD2-CD1 4.18Å; A420-L432 HydrophobicContact CB-CD1 3.93Å; L432-L446 WeakPolarHBondContact CA-O 3.33Å; L432-L447 HydrophobicContact CD2-CB 4Å; L432-L447 HydrophobicContact CD2-CD1 3.78Å; L432-L447 HydrophobicContact CG-CD1 4.08Å
433	A	94.7	Very high	92.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	126.6	-173.4	0	0	0	0	0	112.3	L9 V111 L431 L435 L445 L446	L9-A433 HydrophobicContact CD2-CB 3.48Å; L9-A433 VanDerWaalsContact CD2-CB 3.48Å; V111-A433 HydrophobicContact CG2-CB 4.14Å; L431-A433 HydrophobicContact CD2-CB 4.44Å; A433-L435 HydrophobicContact CB-CG 4.34Å; A433-L435 PolarHBondContact O-N 3.18Å; A433-L435 VanDerWaalsContact O-N 3.11Å; A433-L445 WeakPolarHBondContact O-CA 3.44Å; A433-L446 PolarHBondContact N-O 2.77Å; A433-L446 PolarHBondContact O-N 2.85Å
434	P	94.7	Very high	92.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	98.1	171.9	28.9	-31.9	0	0	0	110.1	S8 R101 R102 L105 V106 N444 L445	S8-P434 WeakPolarHBondContact O-CD 3.45Å; R101-P434 WeakPolarHBondContact O-CG 3.29Å; R102-P434 WeakPolarHBondContact O-CB 3.34Å; L105-P434 WeakPolarHBondContact CA-O 3.33Å; L105-P434 HydrophobicContact CD2-CB 4.48Å; V106-P434 HydrophobicContact CG2-CG 4.08Å; V106-P434 PolarHBondContact N-O 2.98Å; P434-N444 WeakPolarHBondContact CA-O 3.4Å; P434-L445 HydrophobicContact CB-CD2 3.89Å; P434-L445 HydrophobicContact CG-CD2 4.41Å
435	L	92.7	Very high	92.2	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	12%	0.119	C	C	.	.			trans	-97.2	-31.8	-175.2	-78.1	-177.3	0	0	0	113.8	V106 V111 I141 L145 A433 N444 L446	V106-L435 VanDerWaalsContact O-CD2 3.29Å; V106-L435 WeakPolarHBondContact O-CD2 3.41Å; V111-L435 HydrophobicContact CG2-CD2 4.14Å; I141-L435 HydrophobicContact CG2-CB 4.05Å; I141-L435 HydrophobicContact CG2-CD1 4.29Å; I141-L435 HydrophobicContact CG2-CD2 4.34Å; I141-L435 HydrophobicContact CG2-CG 4.49Å; L145-L435 HydrophobicContact CD2-CD1 3.73Å; A433-L435 HydrophobicContact CB-CG 4.34Å; A433-L435 PolarHBondContact O-N 3.18Å; A433-L435 VanDerWaalsContact O-N 3.11Å; L435-N444 PolarHBondContact N-O 3.12Å; L435-L446 HydrophobicContact CD1-CB 3.76Å; L435-L446 HydrophobicContact CD1-CD2 3.27Å; L435-L446 HydrophobicContact CD1-CG 4.11Å; L435-L446 HydrophobicContact CG-CB 4.28Å; L435-L446 HydrophobicContact CG-CD2 4.41Å
436	F	92.8	Very high	92.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	-100.7	150.3	-175.2	-51.2	-45.5	0	0	0	111.6	L105 Q138 I141 L142 L241 V267 P438 C441 N444	L105-F436 WeakPolarHBondContact CD2-O 3.29Å; Q138-F436 HydrophobicContact CB-CE1 4.11Å; Q138-F436 HydrophobicContact CB-CZ 4.17Å; Q138-F436 HydrophobicContact CG-CD1 4.21Å; Q138-F436 HydrophobicContact CG-CD2 4.34Å; Q138-F436 HydrophobicContact CG-CE1 4.24Å; Q138-F436 HydrophobicContact CG-CE2 4.34Å; Q138-F436 HydrophobicContact CG-CG 4.27Å; Q138-F436 HydrophobicContact CG-CZ 4.31Å; I141-F436 HydrophobicContact CB-CD1 4.3Å; I141-F436 HydrophobicContact CB-CE1 3.95Å; I141-F436 HydrophobicContact CD1-CD1 4.04Å; I141-F436 HydrophobicContact CG2-CD1 4.26Å; I141-F436 HydrophobicContact CG2-CE1 3.94Å; L142-F436 HydrophobicContact CB-CZ 4.45Å; L241-F436 HydrophobicContact CD1-CE2 3.94Å; L241-F436 HydrophobicContact CD1-CZ 3.83Å; V267-F436 HydrophobicContact CB-CE2 4.5Å; V267-F436 HydrophobicContact CG1-CE2 4.07Å; V267-F436 HydrophobicContact CG2-CE2 3.87Å; V267-F436 HydrophobicContact CG2-CZ 4.37Å; F436-P438 WeakPolarHBondContact O-CD 3.49Å; F436-C441 HydrophobicContact CB-CB 3.87Å; F436-C441 HydrophobicContact CD2-CB 4.39Å; F436-C441 HydrophobicContact CG-CB 4.44Å; F436-N444 HydrophobicContact CB-CB 3.9Å; F436-N444 PolarHBondContact N-O 2.89Å; F436-N444 WeakPolarHBondContact O-CB 3.47Å; F436-N444 PolarHBondContact O-ND2 3.26Å
437	D	90.3	Very high	92.5	Very high	46 Å²	46	16 Å²	16	25%	0.246	10%	0.098	C	C	.	.			trans	-64.5	120.2	168.6	177.3	-11.6	0	0	0	109.5	L105 H137 L439 V440 C441	L105-D437 HydrophobicContact CD1-CB 4.18Å; H137-D437 PolarHBondContact NE2-N 3.27Å; D437-L439 VanDerWaalsContact C-N 3.26Å; D437-L439 PolarHBondContact O-N 2.89Å; D437-L439 WeakPolarHBondContact OD1-CB 3.35Å; D437-L439 PolarHBondContact OD1-N 3.46Å; D437-V440 HydrophobicContact CB-CB 4.21Å; D437-V440 HydrophobicContact CB-CG2 4.09Å; D437-V440 CarbonylContact O-C 3.33Å; D437-V440 PolarHBondContact O-N 3.44Å; D437-C441 PolarHBondContact O-N 3.14Å
438	P	90.3	Very high	92.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.6	-178.3	26.3	-33.9	0	0	0	114.3	H103 E310 F436 V440 C441 A442	H103-P438 WeakPolarHBondContact NE2-CD 3.42Å; H103-P438 WeakPolarHBondContact NE2-CG 3.48Å; E310-P438 HydrophobicContact CG-CB 4.15Å; E310-P438 HydrophobicContact CG-CG 4Å; E310-P438 WeakPolarHBondContact OE1-CB 3.46Å; F436-P438 WeakPolarHBondContact O-CD 3.49Å; P438-V440 VanDerWaalsContact C-N 3.3Å; P438-V440 PolarHBondContact O-N 3.23Å; P438-C441 WeakPolarHBondContact CA-O 3.15Å; P438-C441 CarbonylContact O-C 3.57Å; P438-A442 PolarHBondContact O-N 3.38Å
439	L	88.3	Confident	92.9	Very high	83 Å²	83	13 Å²	13	44%	0.435	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-40.3	171.2	-70	168.8	0	0	0	110.5	E310 R311 D437	E310-L439 HydrophobicContact CB-CD2 3.55Å; E310-L439 HydrophobicContact CB-CG 4.04Å; E310-L439 WeakPolarHBondContact O-CD2 3.3Å; R311-L439 PolarHBondContact NE-O 3.15Å; R311-L439 PolarHBondContact NH2-O 3.17Å; R311-L439 VanDerWaalsContact NH2-O 3.1Å; D437-L439 VanDerWaalsContact C-N 3.26Å; D437-L439 PolarHBondContact O-N 2.89Å; D437-L439 WeakPolarHBondContact OD1-CB 3.35Å; D437-L439 PolarHBondContact OD1-N 3.46Å
440	V	87.7	Confident	93	Very high	44 Å²	44	11.2 Å²	11.2	27%	0.267	6%	0.058	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-41.6	178.4	-178.9	0	0	0	0	111.1	K134 H137 R311 D437 P438	K134-V440 HydrophobicContact CB-CG1 3.87Å; K134-V440 WeakPolarHBondContact CD-O 3.33Å; K134-V440 WeakPolarHBondContact CE-O 3.43Å; K134-V440 HydrophobicContact CG-CG1 3.88Å; K134-V440 WeakPolarHBondContact CG-O 3.34Å; H137-V440 HydrophobicContact CB-CG1 4.47Å; R311-V440 PolarHBondContact NH2-O 3.11Å; D437-V440 HydrophobicContact CB-CB 4.21Å; D437-V440 HydrophobicContact CB-CG2 4.09Å; D437-V440 CarbonylContact O-C 3.33Å; D437-V440 PolarHBondContact O-N 3.44Å; P438-V440 VanDerWaalsContact C-N 3.3Å; P438-V440 PolarHBondContact O-N 3.23Å
441	C	88.5	Confident	92.9	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.063	C	C	.	.			trans	-135.4	97.9	-179.4	-172	0	0	0	0	112.4	Q138 H242 F436 D437 P438 R443 N444	Q138-C441 PolarHBondContact NE2-SG 3.38Å; H242-C441 PolarHBondContact NE2-SG 3.15Å; H242-C441 VanDerWaalsContact NE2-SG 3.36Å; F436-C441 HydrophobicContact CB-CB 3.87Å; F436-C441 HydrophobicContact CD2-CB 4.39Å; F436-C441 HydrophobicContact CG-CB 4.44Å; D437-C441 PolarHBondContact O-N 3.14Å; P438-C441 WeakPolarHBondContact CA-O 3.15Å; P438-C441 CarbonylContact O-C 3.57Å; C441-R443 CarbonylContact O-C 3.47Å; C441-R443 PolarHBondContact O-N 3.24Å; C441-R443 PolarHBondContact SG-O 3.37Å; C441-N444 PolarHBondContact O-N 2.97Å
442	A	88.3	Confident	91.9	Very high	2 Å²	2	14.4 Å²	14.4	2%	0.017	8%	0.08	C	C	.	.	S	Bend	trans	-48	-28.9	176.3	0	0	0	0	0	115.3	R102 S308 P438	R102-A442 PolarHBondContact NH1-O 3.22Å; R102-A442 PolarHBondContact NH2-O 3.17Å; S308-A442 VanDerWaalsContact CB-CB 3.44Å; P438-A442 PolarHBondContact O-N 3.38Å
443	R	91.8	Very high	90.6	Very high	43 Å²	43	16.1 Å²	16.1	16%	0.162	9%	0.092	C	C	.	.			trans	-105	87.3	174.8	-69.1	78.5	52.7	172	13.4	108.2	G268 C269 Y271 C306 C441	G268-R443 VanDerWaalsContact O-CB 3.3Å; G268-R443 WeakPolarHBondContact O-CB 3.31Å; C269-R443 PolarHBondContact O-NE 3.39Å; Y271-R443 HydrophobicContact CE2-CG 4.36Å; C306-R443 PolarHBondContact O-NH1 2.96Å; C441-R443 CarbonylContact O-C 3.47Å; C441-R443 PolarHBondContact O-N 3.24Å; C441-R443 PolarHBondContact SG-O 3.37Å
444	N	93	Very high	88.8	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.138	C	C	.	.			trans	-100.3	-7.1	-170.4	69.5	-36.6	0	0	0	115.2	R102 P434 L435 F436 C441	R102-N444 PolarHBondContact O-ND2 3.31Å; P434-N444 WeakPolarHBondContact CA-O 3.4Å; L435-N444 PolarHBondContact N-O 3.12Å; F436-N444 HydrophobicContact CB-CB 3.9Å; F436-N444 PolarHBondContact N-O 2.89Å; F436-N444 WeakPolarHBondContact O-CB 3.47Å; F436-N444 PolarHBondContact O-ND2 3.26Å; C441-N444 PolarHBondContact O-N 2.97Å
445	L	94.6	Very high	86.9	Confident	6 Å²	6	29.6 Å²	29.6	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.4	179.4	-66.9	164.1	0	0	0	110.2	L100 L416 A433 P434	L100-L445 HydrophobicContact CB-CD1 3.86Å; L100-L445 HydrophobicContact CD1-CD1 4.01Å; L416-L445 HydrophobicContact CD1-CB 3.63Å; L416-L445 HydrophobicContact CD1-CD1 3.43Å; L416-L445 VanDerWaalsContact CD1-CD1 3.43Å; L416-L445 HydrophobicContact CD1-CG 4.16Å; A433-L445 WeakPolarHBondContact O-CA 3.44Å; P434-L445 HydrophobicContact CB-CD2 3.89Å; P434-L445 HydrophobicContact CG-CD2 4.41Å
446	L	96.2	Very high	85.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.5	169.5	172.4	70.6	0	0	0	109.1	L142 L145 L265 V267 L432 A433 L435 V448	L142-L446 HydrophobicContact CD1-CD1 4.28Å; L145-L446 HydrophobicContact CD2-CD2 3.45Å; L145-L446 VanDerWaalsContact CD2-CD2 3.45Å; L265-L446 HydrophobicContact CB-CD1 4.13Å; L265-L446 HydrophobicContact CD2-CD1 4.37Å; L265-L446 HydrophobicContact CD2-CD2 3.77Å; L265-L446 HydrophobicContact CD2-CG 4.47Å; V267-L446 HydrophobicContact CG2-CB 4.3Å; V267-L446 HydrophobicContact CG2-CD1 3.62Å; L432-L446 WeakPolarHBondContact CA-O 3.33Å; A433-L446 PolarHBondContact N-O 2.77Å; A433-L446 PolarHBondContact O-N 2.85Å; L435-L446 HydrophobicContact CD1-CB 3.76Å; L435-L446 HydrophobicContact CD1-CD2 3.27Å; L435-L446 HydrophobicContact CD1-CG 4.11Å; L435-L446 HydrophobicContact CG-CB 4.28Å; L435-L446 HydrophobicContact CG-CD2 4.41Å; L446-V448 HydrophobicContact CD2-CG2 3.64Å; L446-V448 HydrophobicContact CG-CG2 3.9Å
447	L	97.2	Very high	84.1	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.7	163.4	178	67.4	0	0	0	109.1	I252 S266 R419 A420 L423 V430 L432	I252-L447 HydrophobicContact CD1-CD2 3.87Å; I252-L447 HydrophobicContact CG1-CD2 4.19Å; S266-L447 PolarHBondContact N-O 3.12Å; S266-L447 PolarHBondContact O-N 3.02Å; R419-L447 HydrophobicContact CB-CD2 3.85Å; A420-L447 HydrophobicContact CB-CD1 4.02Å; L423-L447 HydrophobicContact CD1-CD1 4.18Å; L423-L447 HydrophobicContact CD1-CD2 3.98Å; L423-L447 HydrophobicContact CD1-CG 4.13Å; V430-L447 HydrophobicContact CG1-CD1 3.65Å; L432-L447 HydrophobicContact CD2-CB 4Å; L432-L447 HydrophobicContact CD2-CD1 3.78Å; L432-L447 HydrophobicContact CG-CD1 4.08Å
448	V	96.8	Very high	83.3	Confident	0 Å²	0	33 Å²	33	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.6	171.6	-166.1	0	0	0	0	108.6	F149 L263 L264 L265 V430 L431 L446 W460	F149-V448 HydrophobicContact CZ-CG1 4.12Å; L263-V448 HydrophobicContact CD1-CG1 3.9Å; L264-V448 CarbonylContact O-C 3.56Å; L264-V448 VanDerWaalsContact O-CA 3.3Å; L264-V448 WeakPolarHBondContact O-CA 3.12Å; L265-V448 HydrophobicContact CD2-CB 4.26Å; L265-V448 HydrophobicContact CD2-CG1 3.77Å; L265-V448 HydrophobicContact CD2-CG2 3.84Å; V430-V448 VanDerWaalsContact CA-O 3.31Å; V430-V448 WeakPolarHBondContact CA-O 3.33Å; L431-V448 HydrophobicContact CB-CB 4.04Å; L431-V448 HydrophobicContact CB-CG2 4.21Å; L431-V448 HydrophobicContact CD2-CG2 4.39Å; L431-V448 PolarHBondContact N-O 2.89Å; L431-V448 PolarHBondContact O-N 2.8Å; L446-V448 HydrophobicContact CD2-CG2 3.64Å; L446-V448 HydrophobicContact CG-CG2 3.9Å; V448-W460 HydrophobicContact CB-CH2 4.21Å; V448-W460 HydrophobicContact CB-CZ3 4.41Å; V448-W460 HydrophobicContact CG1-CH2 3.58Å; V448-W460 HydrophobicContact CG1-CZ3 3.56Å
449	G	96.1	Very high	82.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.2	166.5	0	0	0	0	0	109.3	L263 L264 E429	L263-G449 CarbonylContact C-O 3.34Å; L263-G449 WeakPolarHBondContact CA-O 3.34Å; L264-G449 PolarHBondContact N-O 3.34Å; L264-G449 PolarHBondContact O-N 3.3Å; E429-G449 CarbonylContact O-C 3.4Å; E429-G449 WeakPolarHBondContact O-CA 3.15Å
450	F	94.1	Very high	82	Confident	0 Å²	0	31 Å²	31	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	121.9	178.5	-168.3	-94.5	0	0	0	110.2	S153 M155 K262 L263 E429 A452 V458 W460	S153-F450 WeakPolarHBondContact OG-CZ 3.31Å; M155-F450 HydrophobicContact SD-CE1 3.81Å; M155-F450 HydrophobicContact SD-CZ 3.83Å; K262-F450 WeakPolarHBondContact O-CA 3.16Å; K262-F450 WeakPolarHBondContact O-CD2 3.06Å; L263-F450 HydrophobicContact CB-CD2 4.33Å; L263-F450 HydrophobicContact CD1-CD2 3.97Å; E429-F450 HydrophobicContact CB-CB 4.49Å; E429-F450 WeakPolarHBondContact CB-O 3.25Å; E429-F450 PolarHBondContact N-O 3.18Å; E429-F450 PolarHBondContact O-N 3.05Å; F450-A452 HydrophobicContact CD1-CB 4.42Å; F450-A452 PolarHBondContact O-N 3.37Å; F450-V458 HydrophobicContact CD1-CG2 4.4Å; F450-W460 HydrophobicContact CB-CH2 3.53Å; F450-W460 HydrophobicContact CB-CZ2 4.41Å; F450-W460 HydrophobicContact CB-CZ3 4.14Å; F450-W460 HydrophobicContact CG-CH2 4.37Å
451	K	92.3	Very high	81.2	Confident	27 Å²	27	32.3 Å²	32.3	12%	0.117	20%	0.198	C	C	.	.			trans	-83.8	95	174.7	-67.5	-170.5	178.6	179.3	0	108.1	M155 F255 V256 S258 C261 K262	M155-K451 WeakPolarHBondContact CE-O 3.43Å; F255-K451 HydrophobicContact CE1-CG 4.27Å; F255-K451 HydrophobicContact CE2-CG 3.96Å; F255-K451 HydrophobicContact CZ-CD 4.45Å; F255-K451 HydrophobicContact CZ-CG 3.6Å; F255-K451 WeakPolarHBondContact O-CE 3.38Å; F255-K451 PolarHBondContact O-NZ 3.41Å; V256-K451 PolarHBondContact O-NZ 2.9Å; S258-K451 PolarHBondContact O-NZ 3.39Å; C261-K451 WeakPolarHBondContact O-CD 3.32Å; K262-K451 PolarHBondContact O-N 3.04Å
452	A	74.3	Confident	79.6	Confident	44 Å²	44	42 Å²	42	36%	0.364	23%	0.234	S	C	.	.			trans	-66	145	175.6	0	0	0	0	0	110.7	E429 F450 V458	E429-A452 HydrophobicContact CG-CB 4.26Å; F450-A452 HydrophobicContact CD1-CB 4.42Å; F450-A452 PolarHBondContact O-N 3.37Å; A452-V458 HydrophobicContact CB-CG2 4.17Å
453	S	68.6	Low	77.7	Confident	38 Å²	38	47.5 Å²	47.5	27%	0.266	27%	0.27	S	S	.	.			trans	-94.6	163.5	160.7	87	0	0	0	0	109	T455 A456	S453-T455 PolarHBondContact O-N 3.37Å; S453-T455 PolarHBondContact OG-N 3.49Å; S453-T455 PolarHBondContact OG-OG1 3.04Å; S453-T455 VanDerWaalsContact OG-OG1 3.06Å; S453-A456 PolarHBondContact O-N 3.12Å; S453-A456 VanDerWaalsContact O-N 3.12Å; S453-A456 WeakPolarHBondContact OG-CB 2.94Å; S453-A456 PolarHBondContact OG-N 3.33Å
454	P	56.8	Low	75.2	Confident	147 Å²	147	57.6 Å²	57.6	96%	0.955	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-21.6	175.9	-24	32.8	0	0	0	114.3
455	T	54.5	Low	74.3	Confident	135 Å²	135	60.5 Å²	60.5	83%	0.828	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-5	-175.5	54.7	0	0	0	0	113.9	S453	S453-T455 PolarHBondContact O-N 3.37Å; S453-T455 PolarHBondContact OG-N 3.49Å; S453-T455 PolarHBondContact OG-OG1 3.04Å; S453-T455 VanDerWaalsContact OG-OG1 3.06Å
456	A	61.7	Low	73.2	Confident	27 Å²	27	63.3 Å²	63.3	22%	0.223	35%	0.35	C	S	.	.			trans	-104.3	124.4	-174.3	0	0	0	0	0	111.5	M155 S453	M155-A456 HydrophobicContact CG-CB 3.71Å; M155-A456 HydrophobicContact SD-CB 3.33Å; M155-A456 WeakPolarHBondContact SD-CB 3.45Å; S453-A456 PolarHBondContact O-N 3.12Å; S453-A456 VanDerWaalsContact O-N 3.12Å; S453-A456 WeakPolarHBondContact OG-CB 2.94Å; S453-A456 PolarHBondContact OG-N 3.33Å
457	C	64.9	Low	72	Confident	87 Å²	87	66.8 Å²	66.8	59%	0.588	37%	0.369	S	S	*	.			trans	-72.8	136.4	173.9	-164.8	0	0	0	0	110.5	P459	C457-P459 WeakPolarHBondContact O-CD 3.16Å
458	V	74	Confident	70.5	Confident	9 Å²	9	70.6 Å²	70.6	6%	0.055	39%	0.39	C	S	.	.			trans	-73	121.7	171.7	178.6	0	0	0	0	108	E429 F450 A452 W460 K461	E429-V458 HydrophobicContact CB-CG1 4.43Å; E429-V458 HydrophobicContact CB-CG2 4.01Å; E429-V458 HydrophobicContact CG-CG2 3.73Å; F450-V458 HydrophobicContact CD1-CG2 4.4Å; A452-V458 HydrophobicContact CB-CG2 4.17Å; V458-W460 VanDerWaalsContact C-N 3.26Å; V458-W460 HydrophobicContact CG1-CD2 3.44Å; V458-W460 VanDerWaalsContact CG1-CD2 3.44Å; V458-W460 HydrophobicContact CG1-CE3 3.81Å; V458-W460 HydrophobicContact CG1-CG 4.05Å; V458-W460 HydrophobicContact CG1-CH2 3.79Å; V458-W460 HydrophobicContact CG1-CZ2 3.39Å; V458-W460 HydrophobicContact CG1-CZ3 3.96Å; V458-W460 PolarHBondContact O-N 3.07Å; V458-K461 HydrophobicContact CB-CB 4.01Å; V458-K461 HydrophobicContact CB-CD 4.06Å; V458-K461 HydrophobicContact CB-CG 3.87Å; V458-K461 HydrophobicContact CG1-CB 4.44Å; V458-K461 HydrophobicContact CG1-CD 4.37Å; V458-K461 HydrophobicContact CG1-CG 3.94Å; V458-K461 HydrophobicContact CG2-CD 4.22Å; V458-K461 PolarHBondContact O-N 3.03Å
459	P	72.7	Confident	68.8	Low	27 Å²	27	75.1 Å²	75.1	18%	0.175	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.4	-167.3	-31.2	38.6	0	0	0	116.5	P113 F149 C457	P113-P459 WeakPolarHBondContact CD-O 3.29Å; F149-P459 HydrophobicContact CD1-CB 4.37Å; F149-P459 HydrophobicContact CD1-CG 3.88Å; F149-P459 HydrophobicContact CE1-CB 3.96Å; F149-P459 HydrophobicContact CE1-CG 3.7Å; C457-P459 WeakPolarHBondContact O-CD 3.16Å
460	W	77.4	Confident	67	Low	13 Å²	13	80.1 Å²	80.1	5%	0.049	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-19.6	175.9	56.6	90.8	0	0	0	113.8	V111 F149 E429 L431 V448 F450 V458 R462	V111-W460 WeakPolarHBondContact O-CB 3.27Å; F149-W460 HydrophobicContact CE1-CE3 4.03Å; F149-W460 AromaticContact CE1-CZ3 3.72Å; F149-W460 HydrophobicContact CE1-CZ3 3.72Å; F149-W460 AromaticContact CZ-CE3 3.89Å; F149-W460 HydrophobicContact CZ-CE3 3.89Å; F149-W460 AromaticContact CZ-CZ3 3.67Å; F149-W460 HydrophobicContact CZ-CZ3 3.67Å; E429-W460 HydrophobicContact CB-CZ2 4.3Å; L431-W460 HydrophobicContact CB-CD2 4.25Å; L431-W460 HydrophobicContact CB-CH2 4.47Å; L431-W460 HydrophobicContact CB-CZ2 3.89Å; L431-W460 HydrophobicContact CD1-CG 4.45Å; L431-W460 HydrophobicContact CD2-CB 4.23Å; L431-W460 HydrophobicContact CD2-CD2 3.97Å; L431-W460 HydrophobicContact CD2-CE3 4.4Å; L431-W460 HydrophobicContact CD2-CG 3.92Å; V448-W460 HydrophobicContact CB-CH2 4.21Å; V448-W460 HydrophobicContact CB-CZ3 4.41Å; V448-W460 HydrophobicContact CG1-CH2 3.58Å; V448-W460 HydrophobicContact CG1-CZ3 3.56Å; F450-W460 HydrophobicContact CB-CH2 3.53Å; F450-W460 HydrophobicContact CB-CZ2 4.41Å; F450-W460 HydrophobicContact CB-CZ3 4.14Å; F450-W460 HydrophobicContact CG-CH2 4.37Å; V458-W460 VanDerWaalsContact C-N 3.26Å; V458-W460 HydrophobicContact CG1-CD2 3.44Å; V458-W460 VanDerWaalsContact CG1-CD2 3.44Å; V458-W460 HydrophobicContact CG1-CE3 3.81Å; V458-W460 HydrophobicContact CG1-CG 4.05Å; V458-W460 HydrophobicContact CG1-CH2 3.79Å; V458-W460 HydrophobicContact CG1-CZ2 3.39Å; V458-W460 HydrophobicContact CG1-CZ3 3.96Å; V458-W460 PolarHBondContact O-N 3.07Å; W460-R462 PolarHBondContact O-N 3.22Å
461	K	70.9	Confident	65.1	Low	71 Å²	71	85.8 Å²	85.8	31%	0.309	47%	0.474	S	S	.	.	S	Bend	trans	-78.7	114.5	175.8	-66.2	-167.7	179.3	-174.4	0	108	E429 V458	E429-K461 IonicContact OE1-NZ 2.65Å; E429-K461 PolarHBondContact OE1-NZ 3.17Å; E429-K461 VanDerWaalsContact OE1-NZ 3.16Å; E429-K461 WeakPolarHBondContact OE2-CE 3.38Å; E429-K461 IonicContact OE2-NZ 3.03Å; E429-K461 PolarHBondContact OE2-NZ 3.17Å; V458-K461 HydrophobicContact CB-CB 4.01Å; V458-K461 HydrophobicContact CB-CD 4.06Å; V458-K461 HydrophobicContact CB-CG 3.87Å; V458-K461 HydrophobicContact CG1-CB 4.44Å; V458-K461 HydrophobicContact CG1-CD 4.37Å; V458-K461 HydrophobicContact CG1-CG 3.94Å; V458-K461 HydrophobicContact CG2-CD 4.22Å; V458-K461 PolarHBondContact O-N 3.03Å
462	R	55.5	Low	63	Low	205 Å²	205	90.3 Å²	90.3	77%	0.774	50%	0.502	S	S	*	.			trans	-66.8	141.8	170.5	-63.2	-172.6	-175.4	-174.6	2.7	108.5	W460 H464	W460-R462 PolarHBondContact O-N 3.22Å; R462-H464 PolarHBondContact O-N 3.09Å
463	P	48.6	Very low	62.1	Low	117 Å²	117	94.2 Å²	94.2	76%	0.76	51%	0.513	S	S	*	.			trans	-55.6	128.8	165.1	22.9	-29.3	0	0	0	108.1
464	H	39.3	Very low	61.5	Low	254 Å²	254	99.3 Å²	99.3	100%	1.176	54%	0.536	S	S	*	.			trans	-63.4	0	177.8	-78.8	-63.7	0	0	0	111.9	R462	R462-H464 PolarHBondContact O-N 3.09Å

Retrieved 464 of 464 residues in 126.9 ms (Link to these results)

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