A0A077Z3Y2_TRITR Loading...

dolichyl-phosphate-mannose--protein mannosyltransferase

Transfers mannosyl residues to the hydroxyl group of serine or threonine residues.

AlphaFold DB , UniProt , Accession A0A077Z3Y2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 588 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	81.4	Confident	88.3	Confident	178 Å²	178	121.4 Å²	121.4	88%	0.877	59%	0.586	S	S	*	*				0	-73	0	-68.3	-175.7	179.5	0	0	112	Y3 M4 F5	M1-Y3 VanDerWaalsContact C-N 3.29Å; M1-Y3 PolarHBondContact O-N 2.97Å; M1-Y3 VanDerWaalsContact O-N 3.17Å; M1-M4 WeakPolarHBondContact O-CB 3.36Å; M1-M4 PolarHBondContact O-N 2.83Å; M1-F5 VanDerWaalsContact O-CD2 3.28Å; M1-F5 WeakPolarHBondContact O-CD2 3.35Å; M1-F5 PolarHBondContact O-N 3.48Å
2	N	87.2	Confident	88.6	Confident	23 Å²	23	116.3 Å²	116.3	12%	0.123	56%	0.56	C	S	.	*	H	α-helix	trans	-48.5	-47.4	-179.2	-72.3	86.7	0	0	0	114	M4 F5 N6 H12 Y13 R72	N2-M4 VanDerWaalsContact C-N 3.27Å; N2-M4 PolarHBondContact O-N 3.34Å; N2-F5 PolarHBondContact O-N 2.93Å; N2-F5 VanDerWaalsContact O-N 3.08Å; N2-N6 PolarHBondContact O-N 3.33Å; N2-N6 VanDerWaalsContact O-N 3.12Å; N2-H12 VanDerWaalsContact ND2-C 3.34Å; N2-H12 PolarHBondContact ND2-O 3.11Å; N2-Y13 HydrophobicContact CB-CD1 3.75Å; N2-Y13 HydrophobicContact CB-CD2 4.29Å; N2-Y13 HydrophobicContact CB-CE1 3.36Å; N2-Y13 HydrophobicContact CB-CE2 3.96Å; N2-Y13 HydrophobicContact CB-CG 4.19Å; N2-Y13 VanDerWaalsContact CB-CZ 3.48Å; N2-R72 PolarHBondContact OD1-NH1 3.05Å
3	Y	88.9	Confident	89	Confident	142 Å²	142	109.5 Å²	109.5	56%	0.557	53%	0.526	S	S	*	.	H	α-helix	trans	-60.2	-34.1	178	-174.8	-96.4	0	0	0	113.6	M1 F5 E7 L8 Y13	M1-Y3 VanDerWaalsContact C-N 3.29Å; M1-Y3 PolarHBondContact O-N 2.97Å; M1-Y3 VanDerWaalsContact O-N 3.17Å; Y3-F5 VanDerWaalsContact C-N 3.31Å; Y3-F5 PolarHBondContact O-N 3.42Å; Y3-E7 WeakPolarHBondContact CA-O 3.21Å; Y3-E7 WeakPolarHBondContact CD2-O 3.36Å; Y3-E7 HydrophobicContact CE2-CB 4.29Å; Y3-E7 WeakPolarHBondContact O-CA 3.45Å; Y3-E7 PolarHBondContact O-N 3.09Å; Y3-L8 HydrophobicContact CD2-CD2 4.14Å; Y3-L8 HydrophobicContact CE2-CD2 4.02Å; Y3-L8 HydrophobicContact CE2-CG 4.33Å; Y3-Y13 WeakPolarHBondContact CA-OH 3.46Å; Y3-Y13 WeakPolarHBondContact CB-OH 3.49Å; Y3-Y13 PolarHBondContact N-OH 2.9Å
4	M	88.8	Confident	89.3	Confident	160 Å²	160	106.1 Å²	106.1	79%	0.788	51%	0.509	S	S	*	.	H	α-helix	trans	-70.9	-29.1	176.8	-65.3	172.2	65.4	0	0	112.4	M1 N2	M1-M4 WeakPolarHBondContact O-CB 3.36Å; M1-M4 PolarHBondContact O-N 2.83Å; N2-M4 VanDerWaalsContact C-N 3.27Å; N2-M4 PolarHBondContact O-N 3.34Å
5	F	85.5	Confident	89.6	Confident	156 Å²	156	101.5 Å²	101.5	68%	0.684	49%	0.492	S	S	*	.	H	α-helix	trans	-83	-44.3	-177.3	-76.3	-71.6	0	0	0	112.5	M1 N2 Y3	M1-F5 VanDerWaalsContact O-CD2 3.28Å; M1-F5 WeakPolarHBondContact O-CD2 3.35Å; M1-F5 PolarHBondContact O-N 3.48Å; N2-F5 PolarHBondContact O-N 2.93Å; N2-F5 VanDerWaalsContact O-N 3.08Å; Y3-F5 VanDerWaalsContact C-N 3.31Å; Y3-F5 PolarHBondContact O-N 3.42Å
6	N	87.3	Confident	90	Very high	60 Å²	60	98.3 Å²	98.3	32%	0.321	48%	0.48	S	S	.	.	H	α-helix	trans	-149.2	32.3	-175.4	-79.5	-43.5	0	0	0	113.3	N2 L8 Q9 H12	N2-N6 PolarHBondContact O-N 3.33Å; N2-N6 VanDerWaalsContact O-N 3.12Å; N6-L8 PolarHBondContact O-N 2.72Å; N6-Q9 HydrophobicContact CB-CB 4.12Å; N6-Q9 HydrophobicContact CB-CG 4.35Å; N6-Q9 WeakPolarHBondContact O-CB 3.35Å; N6-Q9 WeakPolarHBondContact O-CG 3.42Å; N6-Q9 PolarHBondContact O-N 2.82Å; N6-H12 PolarHBondContact ND2-CD2 2.93Å; N6-H12 PolarHBondContact ND2-CE1 3.33Å; N6-H12 PolarHBondContact ND2-NE2 3.5Å
7	E	91	Very high	90.4	Very high	132 Å²	132	92.5 Å²	92.5	62%	0.617	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	-111.7	175.4	-58.8	-178.3	174.1	0	0	112.9	Y3 Y13	Y3-E7 WeakPolarHBondContact CA-O 3.21Å; Y3-E7 WeakPolarHBondContact CD2-O 3.36Å; Y3-E7 HydrophobicContact CE2-CB 4.29Å; Y3-E7 WeakPolarHBondContact O-CA 3.45Å; Y3-E7 PolarHBondContact O-N 3.09Å; E7-Y13 WeakPolarHBondContact O-CE2 3.43Å; E7-Y13 PolarHBondContact O-OH 2.99Å
8	L	90	Very high	90.7	Very high	142 Å²	142	91.2 Å²	91.2	74%	0.743	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	11.3	-176.1	-59.4	179.1	0	0	0	113.5	Y3 N6 P10	Y3-L8 HydrophobicContact CD2-CD2 4.14Å; Y3-L8 HydrophobicContact CE2-CD2 4.02Å; Y3-L8 HydrophobicContact CE2-CG 4.33Å; N6-L8 PolarHBondContact O-N 2.72Å; L8-P10 WeakPolarHBondContact O-CD 3.12Å
9	Q	90.5	Very high	91.1	Very high	106 Å²	106	92.9 Å²	92.9	50%	0.495	46%	0.46	S	S	.	.			trans	-68	118	177.4	-67.7	-171.4	-2.4	0	0	111.1	N6 F11 Y13	N6-Q9 HydrophobicContact CB-CB 4.12Å; N6-Q9 HydrophobicContact CB-CG 4.35Å; N6-Q9 WeakPolarHBondContact O-CB 3.35Å; N6-Q9 WeakPolarHBondContact O-CG 3.42Å; N6-Q9 PolarHBondContact O-N 2.82Å; Q9-F11 VanDerWaalsContact C-N 3.33Å; Q9-F11 PolarHBondContact O-N 3.44Å; Q9-Y13 VanDerWaalsContact O-CD2 3.26Å; Q9-Y13 WeakPolarHBondContact O-CD2 3.32Å
10	P	90	Very high	91.4	Very high	95 Å²	95	89.8 Å²	89.8	62%	0.617	45%	0.445	S	S	*	.	H	α-helix	trans	-68.8	-28.3	-169	25.2	-34.2	0	0	0	113.9	L8 H12 Y13 H14	L8-P10 WeakPolarHBondContact O-CD 3.12Å; P10-H12 PolarHBondContact O-N 3.33Å; P10-Y13 WeakPolarHBondContact O-CB 3.24Å; P10-Y13 PolarHBondContact O-N 2.98Å; P10-H14 PolarHBondContact O-N 3.19Å; P10-H14 VanDerWaalsContact O-N 3.1Å
11	F	91.1	Very high	91.7	Very high	141 Å²	141	86.8 Å²	86.8	62%	0.618	43%	0.43	S	S	*	.	H	α-helix	trans	-50.5	-51.2	-175.6	177.9	-101.7	0	0	0	112.6	Q9 Y13 H14 S15	Q9-F11 VanDerWaalsContact C-N 3.33Å; Q9-F11 PolarHBondContact O-N 3.44Å; F11-Y13 VanDerWaalsContact C-N 3.31Å; F11-Y13 PolarHBondContact O-N 3.12Å; F11-H14 PolarHBondContact O-N 3.07Å; F11-S15 PolarHBondContact O-N 3.31Å; F11-S15 PolarHBondContact O-OG 2.94Å
12	H	91.2	Very high	92.5	Very high	61 Å²	61	80 Å²	80	28%	0.282	41%	0.405	S	S	.	.	H	α-helix	trans	-67.1	-31.7	-177.7	-61.9	-78.5	0	0	0	113.1	N2 N6 P10 H14 V16	N2-H12 VanDerWaalsContact ND2-C 3.34Å; N2-H12 PolarHBondContact ND2-O 3.11Å; N6-H12 PolarHBondContact ND2-CD2 2.93Å; N6-H12 PolarHBondContact ND2-CE1 3.33Å; N6-H12 PolarHBondContact ND2-NE2 3.5Å; P10-H12 PolarHBondContact O-N 3.33Å; H12-H14 VanDerWaalsContact C-N 3.35Å; H12-V16 WeakPolarHBondContact O-CG2 2.92Å; H12-V16 PolarHBondContact O-N 3.48Å
13	Y	93.5	Very high	93	Very high	28 Å²	28	82.8 Å²	82.8	11%	0.11	42%	0.419	C	S	.	.	H	α-helix	trans	-67.1	-42.4	176.4	-68.5	-97.3	0	0	0	110.8	N2 Y3 E7 Q9 P10 F11 N17 I69 R72	N2-Y13 HydrophobicContact CB-CD1 3.75Å; N2-Y13 HydrophobicContact CB-CD2 4.29Å; N2-Y13 HydrophobicContact CB-CE1 3.36Å; N2-Y13 HydrophobicContact CB-CE2 3.96Å; N2-Y13 HydrophobicContact CB-CG 4.19Å; N2-Y13 VanDerWaalsContact CB-CZ 3.48Å; Y3-Y13 WeakPolarHBondContact CA-OH 3.46Å; Y3-Y13 WeakPolarHBondContact CB-OH 3.49Å; Y3-Y13 PolarHBondContact N-OH 2.9Å; E7-Y13 WeakPolarHBondContact O-CE2 3.43Å; E7-Y13 PolarHBondContact O-OH 2.99Å; Q9-Y13 VanDerWaalsContact O-CD2 3.26Å; Q9-Y13 WeakPolarHBondContact O-CD2 3.32Å; P10-Y13 WeakPolarHBondContact O-CB 3.24Å; P10-Y13 PolarHBondContact O-N 2.98Å; F11-Y13 VanDerWaalsContact C-N 3.31Å; F11-Y13 PolarHBondContact O-N 3.12Å; Y13-N17 PolarHBondContact O-N 2.89Å; Y13-N17 PolarHBondContact O-OD1 2.99Å; Y13-I69 HydrophobicContact CD1-CD1 4.07Å; Y13-I69 HydrophobicContact CD1-CG1 4.33Å; Y13-I69 HydrophobicContact CD1-CG2 4.03Å; Y13-I69 HydrophobicContact CD2-CD1 4.39Å; Y13-I69 HydrophobicContact CG-CD1 3.92Å; Y13-I69 HydrophobicContact CG-CG1 4.24Å; Y13-R72 PolarHBondContact O-NH2 3.38Å; Y13-R72 VanDerWaalsContact O-NH2 3.09Å
14	H	94.1	Very high	93.5	Very high	62 Å²	62	76 Å²	76	29%	0.287	39%	0.393	S	S	.	.	H	α-helix	trans	-67.7	-45.5	176.7	-174.9	59.4	0	0	0	112	P10 F11 H12 V16 N17 V18 V66	P10-H14 PolarHBondContact O-N 3.19Å; P10-H14 VanDerWaalsContact O-N 3.1Å; F11-H14 PolarHBondContact O-N 3.07Å; H12-H14 VanDerWaalsContact C-N 3.35Å; H14-V16 VanDerWaalsContact C-N 3.28Å; H14-V16 PolarHBondContact O-N 3.27Å; H14-N17 WeakPolarHBondContact O-CA 3.25Å; H14-N17 WeakPolarHBondContact O-CB 3.09Å; H14-N17 PolarHBondContact O-N 2.99Å; H14-V18 WeakPolarHBondContact O-CG2 3.32Å; H14-V18 PolarHBondContact O-N 3.16Å; H14-V66 PolarHBondContact ND1-O 3.11Å
15	S	94.1	Very high	93.9	Very high	37 Å²	37	69.5 Å²	69.5	26%	0.259	36%	0.362	S	S	.	.	H	α-helix	trans	-56.4	-41.5	177.8	-53.4	0	0	0	0	112.5	F11 V18 L19	F11-S15 PolarHBondContact O-N 3.31Å; F11-S15 PolarHBondContact O-OG 2.94Å; S15-V18 PolarHBondContact O-N 3.33Å; S15-L19 WeakPolarHBondContact O-CG 3.38Å; S15-L19 PolarHBondContact O-N 3.2Å
16	V	95.4	Very high	94.5	Very high	50 Å²	50	67 Å²	67	30%	0.303	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-43	175.4	170.4	0	0	0	0	111.2	H12 H14 V18 L19 L20	H12-V16 WeakPolarHBondContact O-CG2 2.92Å; H12-V16 PolarHBondContact O-N 3.48Å; H14-V16 VanDerWaalsContact C-N 3.28Å; H14-V16 PolarHBondContact O-N 3.27Å; V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 3.21Å; V16-L19 PolarHBondContact O-N 3.33Å; V16-L20 HydrophobicContact CG1-CD1 4.02Å; V16-L20 HydrophobicContact CG1-CG 4.39Å; V16-L20 VanDerWaalsContact O-CG 3.3Å; V16-L20 WeakPolarHBondContact O-CG 3.38Å; V16-L20 PolarHBondContact O-N 3.43Å
17	N	96.4	Very high	94.9	Very high	0 Å²	0	66 Å²	66	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-63.8	-39.2	177.5	-70.9	1.8	0	0	0	111.9	Y13 H14 L20 H21 V66 S68 R72 I75	Y13-N17 PolarHBondContact O-N 2.89Å; Y13-N17 PolarHBondContact O-OD1 2.99Å; H14-N17 WeakPolarHBondContact O-CA 3.25Å; H14-N17 WeakPolarHBondContact O-CB 3.09Å; H14-N17 PolarHBondContact O-N 2.99Å; N17-L20 PolarHBondContact O-N 2.72Å; N17-H21 WeakPolarHBondContact O-CB 3.27Å; N17-H21 PolarHBondContact O-N 3.22Å; N17-V66 HydrophobicContact CB-CG1 4.25Å; N17-V66 WeakPolarHBondContact CB-O 3.32Å; N17-V66 PolarHBondContact ND2-O 3.43Å; N17-S68 PolarHBondContact ND2-O 2.88Å; N17-R72 PolarHBondContact OD1-NE 3.2Å; N17-R72 PolarHBondContact OD1-NH2 3.13Å; N17-I75 HydrophobicContact CB-CD1 4.01Å
18	V	96.9	Very high	95.2	Very high	69 Å²	69	59.7 Å²	59.7	42%	0.418	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-45.4	175.1	173	0	0	0	0	111	H14 S15 V16 L20 H21 G22 V66	H14-V18 WeakPolarHBondContact O-CG2 3.32Å; H14-V18 PolarHBondContact O-N 3.16Å; S15-V18 PolarHBondContact O-N 3.33Å; V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 3.21Å; V18-L20 PolarHBondContact O-N 3.34Å; V18-H21 PolarHBondContact O-N 3.41Å; V18-G22 PolarHBondContact O-N 3.13Å; V18-V66 HydrophobicContact CG2-CG1 3.78Å
19	L	97.2	Very high	95.4	Very high	123 Å²	123	57 Å²	57	64%	0.644	31%	0.309	S	S	*	.	H	α-helix	trans	-60.7	-45.4	175.5	-71.6	172.5	0	0	0	111.6	S15 V16 H21 G22 I23	S15-L19 WeakPolarHBondContact O-CG 3.38Å; S15-L19 PolarHBondContact O-N 3.2Å; V16-L19 PolarHBondContact O-N 3.33Å; L19-H21 PolarHBondContact O-N 3.07Å; L19-G22 PolarHBondContact O-N 3.44Å; L19-I23 WeakPolarHBondContact O-CG1 3.1Å; L19-I23 PolarHBondContact O-N 3.12Å
20	L	97.7	Very high	95.6	Very high	30 Å²	30	55.9 Å²	55.9	16%	0.157	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-43	176.7	-70.9	171.6	0	0	0	111.7	V16 N17 V18 G22 I23 V24 R72 I75 I76 L79	V16-L20 HydrophobicContact CG1-CD1 4.02Å; V16-L20 HydrophobicContact CG1-CG 4.39Å; V16-L20 VanDerWaalsContact O-CG 3.3Å; V16-L20 WeakPolarHBondContact O-CG 3.38Å; V16-L20 PolarHBondContact O-N 3.43Å; N17-L20 PolarHBondContact O-N 2.72Å; V18-L20 PolarHBondContact O-N 3.34Å; L20-G22 VanDerWaalsContact C-N 3.33Å; L20-G22 PolarHBondContact O-N 3.17Å; L20-I23 PolarHBondContact O-N 3.04Å; L20-V24 VanDerWaalsContact O-CG2 3.3Å; L20-V24 WeakPolarHBondContact O-CG2 3.38Å; L20-V24 PolarHBondContact O-N 3.22Å; L20-R72 HydrophobicContact CD1-CG 4.29Å; L20-I75 HydrophobicContact CB-CG2 3.57Å; L20-I76 HydrophobicContact CD1-CG1 4.09Å; L20-L79 HydrophobicContact CD2-CD2 4.22Å
21	H	98	Very high	95.8	Very high	28 Å²	28	51.5 Å²	51.5	13%	0.13	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-39.6	174.9	178.7	62.5	0	0	0	112.1	N17 V18 L19 V24 T25 A57 H62 V66 Y278	N17-H21 WeakPolarHBondContact O-CB 3.27Å; N17-H21 PolarHBondContact O-N 3.22Å; V18-H21 PolarHBondContact O-N 3.41Å; L19-H21 PolarHBondContact O-N 3.07Å; H21-V24 PolarHBondContact O-N 3.49Å; H21-T25 VanDerWaalsContact O-CB 3.3Å; H21-T25 WeakPolarHBondContact O-CB 3.43Å; H21-T25 PolarHBondContact O-N 3.27Å; H21-T25 PolarHBondContact O-OG1 3.38Å; H21-A57 PolarHBondContact NE2-O 2.9Å; H21-H62 AromaticContact CE1-CD2 3.98Å; H21-V66 HydrophobicContact CB-CG2 3.76Å; H21-Y278 AromaticContact ND1-CE2 3.66Å; H21-Y278 AromaticContact ND1-CZ 3.62Å; H21-Y278 PolarHBondContact ND1-OH 3.24Å
22	G	97.8	Very high	95.9	Very high	34 Å²	34	44.8 Å²	44.8	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-59.9	-45.9	173	0	0	0	0	0	112.6	V18 L19 L20 T25 V26	V18-G22 PolarHBondContact O-N 3.13Å; L19-G22 PolarHBondContact O-N 3.44Å; L20-G22 VanDerWaalsContact C-N 3.33Å; L20-G22 PolarHBondContact O-N 3.17Å; G22-T25 WeakPolarHBondContact O-CB 3.46Å; G22-T25 PolarHBondContact O-N 3.49Å; G22-V26 WeakPolarHBondContact O-CG2 3.32Å; G22-V26 PolarHBondContact O-N 3.25Å
23	I	98.3	Very high	95.9	Very high	83 Å²	83	43.8 Å²	43.8	43%	0.426	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-47.5	176.1	-65.3	165.3	0	0	0	110.8	L19 L20 T25 V26 L27 L79	L19-I23 WeakPolarHBondContact O-CG1 3.1Å; L19-I23 PolarHBondContact O-N 3.12Å; L20-I23 PolarHBondContact O-N 3.04Å; I23-T25 VanDerWaalsContact C-N 3.26Å; I23-T25 PolarHBondContact O-N 3.33Å; I23-V26 PolarHBondContact O-N 3.19Å; I23-L27 HydrophobicContact CG2-CD1 3.84Å; I23-L27 HydrophobicContact CG2-CG 4.42Å; I23-L27 WeakPolarHBondContact O-CB 3.47Å; I23-L27 WeakPolarHBondContact O-CG 3.48Å; I23-L27 PolarHBondContact O-N 2.94Å; I23-L79 HydrophobicContact CG2-CD1 3.72Å
24	V	98	Very high	95.6	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-40.5	176.9	171.6	0	0	0	0	110.9	L20 H21 L27 S28 F56 I75 L79 I82 Y278	L20-V24 VanDerWaalsContact O-CG2 3.3Å; L20-V24 WeakPolarHBondContact O-CG2 3.38Å; L20-V24 PolarHBondContact O-N 3.22Å; H21-V24 PolarHBondContact O-N 3.49Å; V24-L27 PolarHBondContact O-N 3.19Å; V24-S28 WeakPolarHBondContact O-CB 3.3Å; V24-S28 PolarHBondContact O-N 3.02Å; V24-F56 HydrophobicContact CG1-CE1 3.81Å; V24-F56 HydrophobicContact CG1-CZ 3.98Å; V24-I75 HydrophobicContact CG2-CG2 4.01Å; V24-L79 HydrophobicContact CG2-CB 3.67Å; V24-L79 HydrophobicContact CG2-CD1 4.08Å; V24-L79 HydrophobicContact CG2-CG 4.44Å; V24-I82 HydrophobicContact CG1-CD1 3.84Å; V24-Y278 HydrophobicContact CG1-CE1 4.06Å
25	T	97.7	Very high	95.1	Very high	23 Å²	23	41.5 Å²	41.5	14%	0.141	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-45.6	178	-66.1	0	0	0	0	111.6	H21 G22 I23 S28 A57	H21-T25 VanDerWaalsContact O-CB 3.3Å; H21-T25 WeakPolarHBondContact O-CB 3.43Å; H21-T25 PolarHBondContact O-N 3.27Å; H21-T25 PolarHBondContact O-OG1 3.38Å; G22-T25 WeakPolarHBondContact O-CB 3.46Å; G22-T25 PolarHBondContact O-N 3.49Å; I23-T25 VanDerWaalsContact C-N 3.26Å; I23-T25 PolarHBondContact O-N 3.33Å; T25-S28 WeakPolarHBondContact O-CB 3.41Å; T25-S28 PolarHBondContact O-N 2.89Å; T25-S28 PolarHBondContact O-OG 3.02Å; T25-A57 HydrophobicContact CG2-CB 3.41Å; T25-A57 VanDerWaalsContact CG2-CB 3.41Å
26	V	97.3	Very high	94.5	Very high	104 Å²	104	40.4 Å²	40.4	63%	0.63	24%	0.235	S	C	*	.	H	α-helix	trans	-62.7	-48.5	175.9	173	0	0	0	0	110.7	G22 I23 S28 M29	G22-V26 WeakPolarHBondContact O-CG2 3.32Å; G22-V26 PolarHBondContact O-N 3.25Å; I23-V26 PolarHBondContact O-N 3.19Å; V26-S28 PolarHBondContact O-N 3.45Å; V26-M29 VanDerWaalsContact O-CB 3.28Å; V26-M29 WeakPolarHBondContact O-CB 3.35Å; V26-M29 PolarHBondContact O-N 3.46Å
27	L	96.9	Very high	93.6	Very high	38 Å²	38	38.3 Å²	38.3	20%	0.199	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-24	178.7	-69.9	173.5	0	0	0	113.3	I23 V24 M29 D30 F31 L79 I82 L86	I23-L27 HydrophobicContact CG2-CD1 3.84Å; I23-L27 HydrophobicContact CG2-CG 4.42Å; I23-L27 WeakPolarHBondContact O-CB 3.47Å; I23-L27 WeakPolarHBondContact O-CG 3.48Å; I23-L27 PolarHBondContact O-N 2.94Å; V24-L27 PolarHBondContact O-N 3.19Å; L27-M29 PolarHBondContact O-N 3.16Å; L27-D30 PolarHBondContact O-N 2.95Å; L27-F31 PolarHBondContact O-N 3.35Å; L27-L79 HydrophobicContact CD1-CD1 3.39Å; L27-I82 HydrophobicContact CB-CG2 3.83Å; L27-L86 HydrophobicContact CD2-CD1 4.46Å
28	S	96.2	Very high	92.5	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-30.1	173.6	81.3	0	0	0	0	111.3	V24 T25 V26 F31 Y32 S53	V24-S28 WeakPolarHBondContact O-CB 3.3Å; V24-S28 PolarHBondContact O-N 3.02Å; T25-S28 WeakPolarHBondContact O-CB 3.41Å; T25-S28 PolarHBondContact O-N 2.89Å; T25-S28 PolarHBondContact O-OG 3.02Å; V26-S28 PolarHBondContact O-N 3.45Å; S28-F31 WeakPolarHBondContact O-CB 3.47Å; S28-F31 PolarHBondContact O-N 2.96Å; S28-Y32 WeakPolarHBondContact O-CB 3.44Å; S28-Y32 WeakPolarHBondContact O-CD2 3.43Å; S28-Y32 VanDerWaalsContact O-CG 3.22Å; S28-Y32 PolarHBondContact O-N 3.05Å; S28-S53 WeakPolarHBondContact OG-CB 3.5Å; S28-S53 PolarHBondContact OG-OG 2.96Å
29	M	96.1	Very high	91.3	Very high	85 Å²	85	43.2 Å²	43.2	42%	0.419	26%	0.255	S	S	.	.	H	α-helix	trans	-67.4	-39.8	178.5	-169.9	171.2	176.9	0	0	111.5	V26 L27 S33 P49 F50 S53	V26-M29 VanDerWaalsContact O-CB 3.28Å; V26-M29 WeakPolarHBondContact O-CB 3.35Å; V26-M29 PolarHBondContact O-N 3.46Å; L27-M29 PolarHBondContact O-N 3.16Å; M29-S33 VanDerWaalsContact O-CB 3.31Å; M29-S33 WeakPolarHBondContact O-CB 3.48Å; M29-S33 PolarHBondContact O-N 3.47Å; M29-S33 PolarHBondContact O-OG 3.37Å; M29-P49 HydrophobicContact CG-CB 4.36Å; M29-F50 HydrophobicContact CE-CB 4.3Å; M29-S53 WeakPolarHBondContact CA-OG 3.22Å; M29-S53 WeakPolarHBondContact CB-OG 3.31Å; M29-S53 PolarHBondContact N-OG 3.38Å
30	D	94.3	Very high	90	Very high	83 Å²	83	46.1 Å²	46.1	44%	0.444	27%	0.266	S	S	.	.	H	α-helix	trans	-68.6	-42.4	172.8	-68.9	-34.9	0	0	0	111	L27 Y32 S33 A34 L86	L27-D30 PolarHBondContact O-N 2.95Å; D30-Y32 VanDerWaalsContact C-N 3.32Å; D30-Y32 PolarHBondContact O-N 3.11Å; D30-S33 PolarHBondContact O-N 3.45Å; D30-A34 VanDerWaalsContact O-CB 3.27Å; D30-A34 WeakPolarHBondContact O-CB 3.37Å; D30-A34 PolarHBondContact O-N 3.18Å; D30-L86 HydrophobicContact CB-CD1 3.83Å; D30-L86 HydrophobicContact CB-CD2 3.93Å
31	F	93	Very high	88.8	Confident	3 Å²	3	46 Å²	46	1%	0.013	27%	0.268	C	S	.	.	H	α-helix	trans	-55.2	-49.5	175.5	172.1	-97.7	0	0	0	111	L27 S28 A34 M35 Y81 I82 F85 L282	L27-F31 PolarHBondContact O-N 3.35Å; S28-F31 WeakPolarHBondContact O-CB 3.47Å; S28-F31 PolarHBondContact O-N 2.96Å; F31-A34 PolarHBondContact O-N 2.93Å; F31-M35 HydrophobicContact CD1-SD 4.03Å; F31-M35 HydrophobicContact CE1-CG 4.44Å; F31-M35 HydrophobicContact CE1-SD 3.31Å; F31-M35 WeakPolarHBondContact CE1-SD 3.32Å; F31-M35 HydrophobicContact CE2-SD 4.28Å; F31-M35 HydrophobicContact CZ-CG 4.42Å; F31-M35 HydrophobicContact CZ-SD 3.45Å; F31-M35 WeakPolarHBondContact CZ-SD 3.41Å; F31-M35 WeakPolarHBondContact O-CG 3.34Å; F31-M35 PolarHBondContact O-N 3.31Å; F31-Y81 AromaticContact CE2-CE1 3.8Å; F31-Y81 HydrophobicContact CE2-CE1 3.8Å; F31-Y81 HydrophobicContact CZ-CE1 4.2Å; F31-I82 HydrophobicContact CB-CG1 4.42Å; F31-I82 HydrophobicContact CB-CG2 3.94Å; F31-I82 HydrophobicContact CD2-CG1 4.24Å; F31-I82 HydrophobicContact CG-CG1 4.38Å; F31-F85 HydrophobicContact CD2-CB 4.27Å; F31-F85 AromaticContact CD2-CD1 3.29Å; F31-F85 HydrophobicContact CD2-CD1 3.29Å; F31-F85 AromaticContact CD2-CE1 3.76Å; F31-F85 HydrophobicContact CD2-CE1 3.76Å; F31-F85 AromaticContact CD2-CG 3.9Å; F31-F85 HydrophobicContact CD2-CG 3.9Å; F31-F85 HydrophobicContact CE2-CB 4.3Å; F31-F85 AromaticContact CE2-CD1 3.57Å; F31-F85 HydrophobicContact CE2-CD1 3.57Å; F31-F85 HydrophobicContact CE2-CD2 4.39Å; F31-F85 AromaticContact CE2-CE1 3.9Å; F31-F85 HydrophobicContact CE2-CE1 3.9Å; F31-F85 AromaticContact CE2-CG 3.82Å; F31-F85 HydrophobicContact CE2-CG 3.82Å; F31-F85 HydrophobicContact CE2-CZ 4.47Å; F31-F85 HydrophobicContact CG-CD1 4.32Å; F31-L282 HydrophobicContact CD1-CD1 4.45Å; F31-L282 HydrophobicContact CD1-CD2 4.44Å; F31-L282 HydrophobicContact CE1-CB 4.18Å; F31-L282 HydrophobicContact CE1-CD1 4.14Å; F31-L282 HydrophobicContact CZ-CD1 4.3Å
32	Y	93.5	Very high	87.3	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.2	-41.7	177.7	-66.1	-43.5	0	0	0	112.3	S28 D30 A34 M35 Q36 S52 S53 L282 W286	S28-Y32 WeakPolarHBondContact O-CB 3.44Å; S28-Y32 WeakPolarHBondContact O-CD2 3.43Å; S28-Y32 VanDerWaalsContact O-CG 3.22Å; S28-Y32 PolarHBondContact O-N 3.05Å; D30-Y32 VanDerWaalsContact C-N 3.32Å; D30-Y32 PolarHBondContact O-N 3.11Å; Y32-A34 VanDerWaalsContact C-N 3.26Å; Y32-A34 PolarHBondContact O-N 3.34Å; Y32-M35 HydrophobicContact CD1-SD 4.5Å; Y32-M35 WeakPolarHBondContact O-CB 3.39Å; Y32-M35 PolarHBondContact O-N 3.04Å; Y32-M35 VanDerWaalsContact O-N 3.12Å; Y32-Q36 WeakPolarHBondContact O-CG 3.42Å; Y32-Q36 PolarHBondContact O-N 2.9Å; Y32-S52 VanDerWaalsContact CE2-C 3.42Å; Y32-S53 WeakPolarHBondContact CD2-OG 3.46Å; Y32-L282 VanDerWaalsContact CE1-O 3.25Å; Y32-L282 WeakPolarHBondContact CE1-O 3.34Å; Y32-L282 WeakPolarHBondContact OH-CA 3.4Å; Y32-L282 PolarHBondContact OH-O 3.13Å; Y32-W286 HydrophobicContact CD1-CD2 4.37Å; Y32-W286 AromaticContact CD1-CE3 3.3Å; Y32-W286 HydrophobicContact CD1-CE3 3.3Å; Y32-W286 AromaticContact CD1-CZ3 3.83Å; Y32-W286 HydrophobicContact CD1-CZ3 3.83Å; Y32-W286 HydrophobicContact CE1-CB 4.08Å; Y32-W286 HydrophobicContact CE1-CE3 4.01Å; Y32-W286 AromaticContact CG-CE3 3.92Å; Y32-W286 HydrophobicContact CG-CE3 3.92Å; Y32-W286 HydrophobicContact CG-CZ3 4.18Å; Y32-W286 WeakPolarHBondContact O-CZ3 3.29Å
33	S	91.4	Very high	85.7	Confident	39 Å²	39	55.2 Å²	55.2	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-60	-38.2	175.1	-64.1	0	0	0	0	112	M29 D30 M35 Q36 P49	M29-S33 VanDerWaalsContact O-CB 3.31Å; M29-S33 WeakPolarHBondContact O-CB 3.48Å; M29-S33 PolarHBondContact O-N 3.47Å; M29-S33 PolarHBondContact O-OG 3.37Å; D30-S33 PolarHBondContact O-N 3.45Å; S33-M35 VanDerWaalsContact C-N 3.35Å; S33-Q36 WeakPolarHBondContact O-CB 3.36Å; S33-Q36 PolarHBondContact O-N 2.86Å; S33-P49 WeakPolarHBondContact OG-CB 3.38Å
34	A	86.7	Confident	84.6	Confident	32 Å²	32	56 Å²	56	26%	0.264	30%	0.296	S	S	.	.	H	α-helix	trans	-72.2	-26.2	176.9	0	0	0	0	0	113.3	D30 F31 Y32 Q36 F85 L86 C89	D30-A34 VanDerWaalsContact O-CB 3.27Å; D30-A34 WeakPolarHBondContact O-CB 3.37Å; D30-A34 PolarHBondContact O-N 3.18Å; F31-A34 PolarHBondContact O-N 2.93Å; Y32-A34 VanDerWaalsContact C-N 3.26Å; Y32-A34 PolarHBondContact O-N 3.34Å; A34-Q36 VanDerWaalsContact C-N 3.26Å; A34-F85 HydrophobicContact CB-CE1 3.91Å; A34-L86 HydrophobicContact CB-CD2 3.9Å; A34-C89 HydrophobicContact CB-CB 4.26Å
35	M	84	Confident	83.8	Confident	11 Å²	11	58 Å²	58	5%	0.054	31%	0.307	C	S	.	.	H	α-helix	trans	-73.5	-17.4	172.1	-76.8	-175.9	56.5	0	0	113.3	F31 Y32 S33 F85 R126 L249 W286	F31-M35 HydrophobicContact CD1-SD 4.03Å; F31-M35 HydrophobicContact CE1-CG 4.44Å; F31-M35 HydrophobicContact CE1-SD 3.31Å; F31-M35 WeakPolarHBondContact CE1-SD 3.32Å; F31-M35 HydrophobicContact CE2-SD 4.28Å; F31-M35 HydrophobicContact CZ-CG 4.42Å; F31-M35 HydrophobicContact CZ-SD 3.45Å; F31-M35 WeakPolarHBondContact CZ-SD 3.41Å; F31-M35 WeakPolarHBondContact O-CG 3.34Å; F31-M35 PolarHBondContact O-N 3.31Å; Y32-M35 HydrophobicContact CD1-SD 4.5Å; Y32-M35 WeakPolarHBondContact O-CB 3.39Å; Y32-M35 PolarHBondContact O-N 3.04Å; Y32-M35 VanDerWaalsContact O-N 3.12Å; S33-M35 VanDerWaalsContact C-N 3.35Å; M35-F85 HydrophobicContact CG-CE1 4.01Å; M35-F85 HydrophobicContact CG-CZ 3.84Å; M35-R126 PolarHBondContact SD-NH1 3.1Å; M35-L249 HydrophobicContact CE-CB 3.88Å; M35-W286 HydrophobicContact CB-CE3 4.5Å; M35-W286 HydrophobicContact CB-CH2 3.4Å; M35-W286 HydrophobicContact CB-CZ2 4.2Å; M35-W286 HydrophobicContact CB-CZ3 3.61Å; M35-W286 HydrophobicContact CE-CD2 4.17Å; M35-W286 HydrophobicContact CE-CE3 4.3Å; M35-W286 HydrophobicContact CE-CH2 4.36Å; M35-W286 HydrophobicContact CE-CZ2 4.3Å; M35-W286 HydrophobicContact CE-CZ3 4.39Å; M35-W286 HydrophobicContact SD-CE3 4.5Å; M35-W286 HydrophobicContact SD-CZ3 4.45Å
36	Q	82.8	Confident	83	Confident	14 Å²	14	62.7 Å²	62.7	7%	0.065	34%	0.335	C	S	.	.	S	Bend	trans	-70.9	153.5	179	-62.9	-157.8	-43.7	0	0	112.3	Y32 S33 A34 R44 L45 P49 W286	Y32-Q36 WeakPolarHBondContact O-CG 3.42Å; Y32-Q36 PolarHBondContact O-N 2.9Å; S33-Q36 WeakPolarHBondContact O-CB 3.36Å; S33-Q36 PolarHBondContact O-N 2.86Å; A34-Q36 VanDerWaalsContact C-N 3.26Å; Q36-R44 HydrophobicContact CB-CG 4.43Å; Q36-L45 PolarHBondContact NE2-O 3.2Å; Q36-P49 HydrophobicContact CG-CG 4.28Å; Q36-W286 HydrophobicContact CG-CH2 3.98Å
37	P	75.4	Confident	82.7	Confident	5 Å²	5	61.9 Å²	61.9	3%	0.032	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-56.7	161.8	163.5	-25.1	37.9	0	0	0	112.3	S41 M43	P37-S41 VanDerWaalsContact CB-OG 3.24Å; P37-S41 WeakPolarHBondContact CB-OG 3.46Å; P37-M43 HydrophobicContact CB-CB 3.94Å; P37-M43 HydrophobicContact CB-CG 4.34Å; P37-M43 HydrophobicContact CB-SD 4.17Å; P37-M43 HydrophobicContact CG-CB 3.76Å; P37-M43 HydrophobicContact CG-CE 3.92Å; P37-M43 HydrophobicContact CG-CG 4.41Å; P37-M43 HydrophobicContact CG-SD 4.1Å
38	P	73.8	Confident	82.4	Confident	78 Å²	78	60.1 Å²	60.1	51%	0.506	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-52.8	154.1	-177.7	-25.7	33.7	0	0	0	113.9	E40 S41	P38-E40 VanDerWaalsContact C-N 3.26Å; P38-E40 PolarHBondContact O-N 3.09Å; P38-S41 WeakPolarHBondContact O-CB 3.31Å; P38-S41 PolarHBondContact O-N 2.82Å; P38-S41 PolarHBondContact O-OG 3.49Å
39	P	71.2	Confident	82.3	Confident	94 Å²	94	60.3 Å²	60.3	61%	0.61	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-39.4	-177.3	-26.6	34.6	0	0	0	114.9	S41	P39-S41 PolarHBondContact O-N 3.3Å
40	E	71	Confident	82.3	Confident	185 Å²	185	60.8 Å²	60.8	86%	0.864	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.1	-179.6	-66.5	149.3	-152.4	0	0	113.1	P38 K42	P38-E40 VanDerWaalsContact C-N 3.26Å; P38-E40 PolarHBondContact O-N 3.09Å; E40-K42 PolarHBondContact O-N 3.05Å
41	S	71.4	Confident	82.2	Confident	28 Å²	28	60.2 Å²	60.2	20%	0.196	31%	0.31	C	S	.	.			trans	-76.1	129	-175.5	80.9	0	0	0	0	110.5	P37 P38 P39 M43 R44	P37-S41 VanDerWaalsContact CB-OG 3.24Å; P37-S41 WeakPolarHBondContact CB-OG 3.46Å; P38-S41 WeakPolarHBondContact O-CB 3.31Å; P38-S41 PolarHBondContact O-N 2.82Å; P38-S41 PolarHBondContact O-OG 3.49Å; P39-S41 PolarHBondContact O-N 3.3Å; S41-M43 PolarHBondContact O-N 3.49Å; S41-R44 WeakPolarHBondContact O-CB 3.42Å; S41-R44 PolarHBondContact O-N 3.41Å
42	K	66.8	Low	82.4	Confident	216 Å²	216	60 Å²	60	94%	0.939	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-9.3	166.8	-63.7	-175.8	180	-180	0	112.8	E40 R44	E40-K42 PolarHBondContact O-N 3.05Å; K42-R44 VanDerWaalsContact C-N 3.33Å
43	M	65.1	Low	82.5	Confident	39 Å²	39	60.5 Å²	60.5	19%	0.192	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-19	177	-40.3	-165.4	42.4	0	0	113.8	P37 S41 L45 M242	P37-M43 HydrophobicContact CB-CB 3.94Å; P37-M43 HydrophobicContact CB-CG 4.34Å; P37-M43 HydrophobicContact CB-SD 4.17Å; P37-M43 HydrophobicContact CG-CB 3.76Å; P37-M43 HydrophobicContact CG-CE 3.92Å; P37-M43 HydrophobicContact CG-CG 4.41Å; P37-M43 HydrophobicContact CG-SD 4.1Å; S41-M43 PolarHBondContact O-N 3.49Å; M43-L45 PolarHBondContact O-N 3.08Å; M43-M242 VanDerWaalsContact CA-CE 3.41Å; M43-M242 HydrophobicContact CB-CE 3.34Å; M43-M242 HydrophobicContact CB-SD 4.08Å; M43-M242 HydrophobicContact CE-CB 3.93Å; M43-M242 HydrophobicContact CE-CE 3.74Å; M43-M242 HydrophobicContact CE-CG 4.02Å; M43-M242 HydrophobicContact CE-SD 3.17Å; M43-M242 WeakPolarHBondContact CE-SD 3.49Å; M43-M242 HydrophobicContact CG-CE 3.17Å; M43-M242 HydrophobicContact CG-SD 3.3Å; M43-M242 WeakPolarHBondContact CG-SD 3.41Å; M43-M242 HydrophobicContact SD-CE 3.98Å; M43-M242 HydrophobicContact SD-SD 3.31Å
44	R	74.9	Confident	82.7	Confident	99 Å²	99	61.6 Å²	61.6	37%	0.374	32%	0.315	S	S	.	.			trans	-75.1	123.8	-168.5	-166.9	173.7	-179.5	-167	2.5	111.3	Q36 S41 K42	Q36-R44 HydrophobicContact CB-CG 4.43Å; S41-R44 WeakPolarHBondContact O-CB 3.42Å; S41-R44 PolarHBondContact O-N 3.41Å; K42-R44 VanDerWaalsContact C-N 3.33Å
45	L	81.2	Confident	83.2	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.225	30%	0.304	C	S	.	.			trans	-96.6	94.8	175.7	-70	170.6	0	0	0	109.6	Q36 M43 N47 L48 Y290 L293	Q36-L45 PolarHBondContact NE2-O 3.2Å; M43-L45 PolarHBondContact O-N 3.08Å; L45-N47 PolarHBondContact O-N 2.89Å; L45-N47 VanDerWaalsContact O-N 3.07Å; L45-L48 HydrophobicContact CB-CB 3.66Å; L45-L48 HydrophobicContact CB-CD2 4.33Å; L45-L48 HydrophobicContact CD1-CB 4.49Å; L45-L48 HydrophobicContact CD1-CD2 4.09Å; L45-L48 WeakPolarHBondContact O-CB 3.45Å; L45-L48 PolarHBondContact O-N 3.4Å; L45-Y290 HydrophobicContact CD1-CD2 3.64Å; L45-Y290 HydrophobicContact CD1-CE2 3.59Å; L45-L293 HydrophobicContact CB-CD1 4.47Å
46	V	81	Confident	83.8	Confident	120 Å²	120	59.8 Å²	59.8	73%	0.727	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-41.9	-171.9	179.9	0	0	0	0	113.3	P49	V46-P49 WeakPolarHBondContact O-CD 3.13Å
47	N	89.3	Confident	84.5	Confident	88 Å²	88	60.8 Å²	60.8	47%	0.471	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.1	-176.5	-61.6	-29.3	0	0	0	114.4	L45 F50 W51 L293	L45-N47 PolarHBondContact O-N 2.89Å; L45-N47 VanDerWaalsContact O-N 3.07Å; N47-F50 PolarHBondContact O-N 3.46Å; N47-W51 PolarHBondContact O-N 3.49Å; N47-L293 HydrophobicContact CB-CD2 4.5Å
48	L	91.5	Very high	85.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-45	-176.3	176.2	65.2	0	0	0	113.2	L45 F50 W51 S52 W286 A289 Y290 L293	L45-L48 HydrophobicContact CB-CB 3.66Å; L45-L48 HydrophobicContact CB-CD2 4.33Å; L45-L48 HydrophobicContact CD1-CB 4.49Å; L45-L48 HydrophobicContact CD1-CD2 4.09Å; L45-L48 WeakPolarHBondContact O-CB 3.45Å; L45-L48 PolarHBondContact O-N 3.4Å; L48-F50 PolarHBondContact O-N 2.94Å; L48-W51 PolarHBondContact O-N 3.24Å; L48-S52 VanDerWaalsContact O-CB 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.36Å; L48-S52 PolarHBondContact O-N 3.3Å; L48-S52 PolarHBondContact O-OG 2.98Å; L48-W286 HydrophobicContact CD2-CD2 4.2Å; L48-W286 HydrophobicContact CD2-CE3 4.33Å; L48-W286 HydrophobicContact CD2-CH2 4Å; L48-W286 HydrophobicContact CD2-CZ2 3.78Å; L48-W286 HydrophobicContact CD2-CZ3 4.23Å; L48-W286 HydrophobicContact CG-CE3 4.47Å; L48-A289 HydrophobicContact CD1-CB 3.66Å; L48-Y290 HydrophobicContact CD2-CD2 4.13Å; L48-L293 VanDerWaalsContact CA-CD1 3.49Å; L48-L293 HydrophobicContact CB-CD1 3.67Å; L48-L293 HydrophobicContact CD1-CD1 4.02Å; L48-L293 HydrophobicContact CG-CD1 4.48Å
49	P	94.5	Very high	86.6	Confident	4 Å²	4	57.8 Å²	57.8	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-45.9	178.7	-24.7	37.3	0	0	0	111.8	M29 S33 Q36 V46 S52 S53	M29-P49 HydrophobicContact CG-CB 4.36Å; S33-P49 WeakPolarHBondContact OG-CB 3.38Å; Q36-P49 HydrophobicContact CG-CG 4.28Å; V46-P49 WeakPolarHBondContact O-CD 3.13Å; P49-S52 PolarHBondContact O-N 3.37Å; P49-S53 WeakPolarHBondContact O-CB 3.43Å; P49-S53 PolarHBondContact O-N 2.89Å; P49-S53 PolarHBondContact O-OG 3.39Å
50	F	95	Very high	87.8	Confident	96 Å²	96	53.3 Å²	53.3	42%	0.421	26%	0.264	S	S	.	.	H	α-helix	trans	-58.1	-52.3	177.8	175.8	-98.8	0	0	0	112.3	M29 N47 L48 S52 S53 L54	M29-F50 HydrophobicContact CE-CB 4.3Å; N47-F50 PolarHBondContact O-N 3.46Å; L48-F50 PolarHBondContact O-N 2.94Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 3.34Å; F50-S53 PolarHBondContact O-N 3.37Å; F50-L54 HydrophobicContact CE1-CD2 4.31Å; F50-L54 HydrophobicContact CZ-CD2 4.46Å; F50-L54 WeakPolarHBondContact O-CB 3.12Å; F50-L54 PolarHBondContact O-N 3.36Å
51	W	93.8	Very high	89	Confident	70 Å²	70	44.5 Å²	44.5	27%	0.265	22%	0.223	S	C	.	.	H	α-helix	trans	-66.8	-33.3	-179.1	-68	118.2	0	0	0	112.9	N47 L48 L54 L55 A289 F312 L316	N47-W51 PolarHBondContact O-N 3.49Å; L48-W51 PolarHBondContact O-N 3.24Å; W51-L54 HydrophobicContact CE3-CD2 3.9Å; W51-L54 HydrophobicContact CZ3-CD2 3.76Å; W51-L55 WeakPolarHBondContact O-CB 3.45Å; W51-L55 WeakPolarHBondContact O-CG 3.45Å; W51-L55 PolarHBondContact O-N 2.95Å; W51-A289 HydrophobicContact CB-CB 3.99Å; W51-F312 HydrophobicContact CD2-CE1 4.11Å; W51-F312 HydrophobicContact CD2-CZ 4.2Å; W51-F312 AromaticContact CE3-CE1 3.4Å; W51-F312 HydrophobicContact CE3-CE1 3.4Å; W51-F312 AromaticContact CE3-CZ 3.68Å; W51-F312 HydrophobicContact CE3-CZ 3.68Å; W51-F312 HydrophobicContact CH2-CE1 4.35Å; W51-F312 HydrophobicContact CZ3-CD1 4.47Å; W51-F312 AromaticContact CZ3-CE1 3.54Å; W51-F312 HydrophobicContact CZ3-CE1 3.54Å; W51-F312 HydrophobicContact CZ3-CZ 4.3Å; W51-L316 HydrophobicContact CZ3-CD1 4.37Å
52	S	95.4	Very high	90.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-44.7	175.7	-53.8	0	0	0	0	110.7	Y32 L48 P49 F50 L55 F56 A289	Y32-S52 VanDerWaalsContact CE2-C 3.42Å; L48-S52 VanDerWaalsContact O-CB 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.36Å; L48-S52 PolarHBondContact O-N 3.3Å; L48-S52 PolarHBondContact O-OG 2.98Å; P49-S52 PolarHBondContact O-N 3.37Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 3.34Å; S52-L55 PolarHBondContact O-N 3.08Å; S52-F56 WeakPolarHBondContact O-CB 3.43Å; S52-F56 PolarHBondContact O-N 3.47Å; S52-A289 WeakPolarHBondContact OG-CB 3.34Å
53	S	97.1	Very high	91.7	Very high	9 Å²	9	33.4 Å²	33.4	6%	0.063	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-39.4	176.3	-68.3	0	0	0	0	112.8	S28 M29 Y32 P49 F50 F56 A57	S28-S53 WeakPolarHBondContact OG-CB 3.5Å; S28-S53 PolarHBondContact OG-OG 2.96Å; M29-S53 WeakPolarHBondContact CA-OG 3.22Å; M29-S53 WeakPolarHBondContact CB-OG 3.31Å; M29-S53 PolarHBondContact N-OG 3.38Å; Y32-S53 WeakPolarHBondContact CD2-OG 3.46Å; P49-S53 WeakPolarHBondContact O-CB 3.43Å; P49-S53 PolarHBondContact O-N 2.89Å; P49-S53 PolarHBondContact O-OG 3.39Å; F50-S53 PolarHBondContact O-N 3.37Å; S53-F56 PolarHBondContact O-N 3.5Å; S53-A57 WeakPolarHBondContact O-CB 3.45Å; S53-A57 PolarHBondContact O-N 3.25Å
54	L	95.8	Very high	93.1	Very high	62 Å²	62	31.6 Å²	31.6	33%	0.325	16%	0.163	S	C	.	.	H	α-helix	trans	-65.3	-43.5	176.9	-174.9	64	0	0	0	111.5	F50 W51 F56 A57 C58 L316	F50-L54 HydrophobicContact CE1-CD2 4.31Å; F50-L54 HydrophobicContact CZ-CD2 4.46Å; F50-L54 WeakPolarHBondContact O-CB 3.12Å; F50-L54 PolarHBondContact O-N 3.36Å; W51-L54 HydrophobicContact CE3-CD2 3.9Å; W51-L54 HydrophobicContact CZ3-CD2 3.76Å; L54-F56 VanDerWaalsContact C-N 3.31Å; L54-F56 PolarHBondContact O-N 3.17Å; L54-A57 WeakPolarHBondContact O-CB 3.5Å; L54-A57 PolarHBondContact O-N 2.87Å; L54-C58 PolarHBondContact O-N 2.99Å; L54-C58 PolarHBondContact O-SG 3.25Å; L54-L316 HydrophobicContact CD2-CD1 3.86Å; L54-L316 HydrophobicContact CD2-CD2 4.35Å; L54-L316 HydrophobicContact CG-CD2 4.18Å
55	L	95.9	Very high	94.1	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-40.6	174.4	-76.5	169.5	0	0	0	111.9	W51 S52 H59 C285 T288 A289 F312 L316	W51-L55 WeakPolarHBondContact O-CB 3.45Å; W51-L55 WeakPolarHBondContact O-CG 3.45Å; W51-L55 PolarHBondContact O-N 2.95Å; S52-L55 PolarHBondContact O-N 3.08Å; L55-H59 WeakPolarHBondContact O-CB 3.45Å; L55-H59 PolarHBondContact O-N 2.68Å; L55-C285 HydrophobicContact CB-CB 4.1Å; L55-T288 WeakPolarHBondContact CD1-OG1 3.41Å; L55-A289 HydrophobicContact CD1-CB 4.01Å; L55-F312 HydrophobicContact CD1-CE2 4.1Å; L55-F312 HydrophobicContact CD1-CZ 4.38Å; L55-F312 HydrophobicContact CD2-CE2 4.29Å; L55-F312 HydrophobicContact CD2-CZ 4.41Å; L55-F312 HydrophobicContact CG-CE2 4.42Å; L55-F312 HydrophobicContact CG-CZ 4.34Å; L55-L316 HydrophobicContact CD2-CD2 3.64Å; L55-L316 HydrophobicContact CD2-CG 4.48Å; L55-L316 HydrophobicContact CG-CD2 4.25Å
56	F	97.2	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.5	-45.1	175.6	-177.6	-90.1	0	0	0	111.1	V24 S52 S53 L54 C58 H59 H62 Y278 S281 L282 C285	V24-F56 HydrophobicContact CG1-CE1 3.81Å; V24-F56 HydrophobicContact CG1-CZ 3.98Å; S52-F56 WeakPolarHBondContact O-CB 3.43Å; S52-F56 PolarHBondContact O-N 3.47Å; S53-F56 PolarHBondContact O-N 3.5Å; L54-F56 VanDerWaalsContact C-N 3.31Å; L54-F56 PolarHBondContact O-N 3.17Å; F56-C58 PolarHBondContact O-N 2.96Å; F56-H59 PolarHBondContact O-N 2.89Å; F56-H62 AromaticContact CD2-CE1 3.98Å; F56-H62 AromaticContact CD2-NE2 3.54Å; F56-H62 AromaticContact CE2-CE1 3.48Å; F56-H62 VanDerWaalsContact CE2-CE1 3.48Å; F56-H62 WeakPolarHBondContact CE2-CE1 3.5Å; F56-H62 AromaticContact CE2-NE2 3.5Å; F56-H62 WeakPolarHBondContact CE2-NE2 3.3Å; F56-H62 AromaticContact CG-NE2 3.96Å; F56-H62 AromaticContact CZ-CE1 3.78Å; F56-H62 AromaticContact CZ-NE2 3.86Å; F56-H62 PolarHBondContact O-CD2 3.42Å; F56-H62 PolarHBondContact O-NE2 3.03Å; F56-Y278 HydrophobicContact CZ-CD1 4.38Å; F56-Y278 AromaticContact CZ-CE1 3.78Å; F56-Y278 HydrophobicContact CZ-CE1 3.78Å; F56-Y278 AromaticContact CZ-CZ 3.95Å; F56-S281 WeakPolarHBondContact CD2-OG 3.36Å; F56-S281 WeakPolarHBondContact CE2-OG 3.45Å; F56-L282 HydrophobicContact CD2-CD2 3.59Å; F56-L282 HydrophobicContact CD2-CG 4.16Å; F56-L282 HydrophobicContact CE1-CD2 4.48Å; F56-L282 HydrophobicContact CE2-CD2 3.44Å; F56-L282 VanDerWaalsContact CE2-CD2 3.44Å; F56-L282 HydrophobicContact CE2-CG 3.71Å; F56-L282 HydrophobicContact CG-CD2 4.17Å; F56-L282 HydrophobicContact CZ-CD2 3.93Å; F56-L282 HydrophobicContact CZ-CG 4.37Å; F56-C285 VanDerWaalsContact CA-SG 3.6Å; F56-C285 HydrophobicContact CB-CB 4.25Å
57	A	97	Very high	95.5	Very high	36 Å²	36	20.6 Å²	20.6	30%	0.298	11%	0.111	S	C	.	.	H	α-helix	trans	-56	-37.8	179.8	0	0	0	0	0	113.4	H21 T25 S53 L54	H21-A57 PolarHBondContact NE2-O 2.9Å; T25-A57 HydrophobicContact CG2-CB 3.41Å; T25-A57 VanDerWaalsContact CG2-CB 3.41Å; S53-A57 WeakPolarHBondContact O-CB 3.45Å; S53-A57 PolarHBondContact O-N 3.25Å; L54-A57 WeakPolarHBondContact O-CB 3.5Å; L54-A57 PolarHBondContact O-N 2.87Å
58	C	95.7	Very high	95.7	Very high	18 Å²	18	17.3 Å²	17.3	12%	0.122	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	8.1	-175.2	69.6	0	0	0	0	113.7	L54 F56 P60 F319 C323	L54-C58 PolarHBondContact O-N 2.99Å; L54-C58 PolarHBondContact O-SG 3.25Å; F56-C58 PolarHBondContact O-N 2.96Å; C58-P60 WeakPolarHBondContact O-CD 3.38Å; C58-F319 CarbonylContact O-C 3.1Å; C58-F319 WeakPolarHBondContact O-CB 3.29Å; C58-C323 PolarHBondContact O-SG 3.21Å
59	H	97.4	Very high	95.7	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.117	C	C	.	.			trans	-73.2	123.4	-173.3	-163.6	-72	0	0	0	111.9	L55 F56 V61 H62 L189 F284 F319	L55-H59 WeakPolarHBondContact O-CB 3.45Å; L55-H59 PolarHBondContact O-N 2.68Å; F56-H59 PolarHBondContact O-N 2.89Å; H59-V61 VanDerWaalsContact C-N 3.27Å; H59-V61 WeakPolarHBondContact ND1-CB 3.31Å; H59-V61 WeakPolarHBondContact ND1-CG1 3.41Å; H59-V61 PolarHBondContact ND1-N 3.23Å; H59-V61 PolarHBondContact O-N 3.48Å; H59-V61 VanDerWaalsContact O-N 3.12Å; H59-H62 WeakPolarHBondContact O-CB 3.41Å; H59-H62 PolarHBondContact O-CD2 3.28Å; H59-H62 VanDerWaalsContact O-CD2 3.25Å; H59-H62 PolarHBondContact O-N 3.42Å; H59-H62 VanDerWaalsContact O-N 3.09Å; H59-L189 PolarHBondContact NE2-O 3.1Å; H59-F284 AromaticContact CD2-CE1 3.95Å; H59-F284 AromaticContact NE2-CD1 3.83Å; H59-F284 AromaticContact NE2-CE1 3.52Å; H59-F319 AromaticContact CD2-CE2 3.62Å
60	P	97.4	Very high	95.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.1	-173.4	-27.5	36	0	0	0	116.1	C58 H62 V63 P192 L195 F319 R322 C323	C58-P60 WeakPolarHBondContact O-CD 3.38Å; P60-H62 PolarHBondContact O-N 3.2Å; P60-V63 WeakPolarHBondContact O-CG2 3.24Å; P60-V63 PolarHBondContact O-N 3.26Å; P60-P192 HydrophobicContact CB-CB 3.84Å; P60-P192 HydrophobicContact CB-CG 3.98Å; P60-P192 HydrophobicContact CG-CB 4.1Å; P60-P192 HydrophobicContact CG-CG 3.64Å; P60-L195 HydrophobicContact CB-CD1 3.82Å; P60-F319 HydrophobicContact CG-CB 4.2Å; P60-F319 HydrophobicContact CG-CD1 4.21Å; P60-F319 HydrophobicContact CG-CG 4.23Å; P60-F319 WeakPolarHBondContact CG-O 3.26Å; P60-R322 HydrophobicContact CB-CB 4Å; P60-R322 HydrophobicContact CG-CB 3.59Å; P60-C323 VanDerWaalsContact CA-SG 3.52Å
61	V	96.6	Very high	95.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-19	176.5	86.3	0	0	0	0	113.6	H59 V63 I188 L189 E274 L277	H59-V61 VanDerWaalsContact C-N 3.27Å; H59-V61 WeakPolarHBondContact ND1-CB 3.31Å; H59-V61 WeakPolarHBondContact ND1-CG1 3.41Å; H59-V61 PolarHBondContact ND1-N 3.23Å; H59-V61 PolarHBondContact O-N 3.48Å; H59-V61 VanDerWaalsContact O-N 3.12Å; V61-V63 VanDerWaalsContact C-N 3.31Å; V61-I188 HydrophobicContact CG2-CG2 3.91Å; V61-L189 HydrophobicContact CG1-CD2 4.17Å; V61-E274 HydrophobicContact CG2-CB 4Å; V61-E274 HydrophobicContact CG2-CG 4.39Å; V61-L277 HydrophobicContact CG2-CB 3.75Å; V61-L277 HydrophobicContact CG2-CD1 3.92Å; V61-L277 HydrophobicContact CG2-CG 4.43Å
62	H	97.2	Very high	95.4	Very high	5 Å²	5	20.5 Å²	20.5	2%	0.023	12%	0.12	C	C	.	.	H	α-helix	trans	-77.1	-17.6	179.6	-63.3	-44.3	0	0	0	113.6	H21 F56 H59 P60 D64 A65 V66 Y278 S281	H21-H62 AromaticContact CE1-CD2 3.98Å; F56-H62 AromaticContact CD2-CE1 3.98Å; F56-H62 AromaticContact CD2-NE2 3.54Å; F56-H62 AromaticContact CE2-CE1 3.48Å; F56-H62 VanDerWaalsContact CE2-CE1 3.48Å; F56-H62 WeakPolarHBondContact CE2-CE1 3.5Å; F56-H62 AromaticContact CE2-NE2 3.5Å; F56-H62 WeakPolarHBondContact CE2-NE2 3.3Å; F56-H62 AromaticContact CG-NE2 3.96Å; F56-H62 AromaticContact CZ-CE1 3.78Å; F56-H62 AromaticContact CZ-NE2 3.86Å; F56-H62 PolarHBondContact O-CD2 3.42Å; F56-H62 PolarHBondContact O-NE2 3.03Å; H59-H62 WeakPolarHBondContact O-CB 3.41Å; H59-H62 PolarHBondContact O-CD2 3.28Å; H59-H62 VanDerWaalsContact O-CD2 3.25Å; H59-H62 PolarHBondContact O-N 3.42Å; H59-H62 VanDerWaalsContact O-N 3.09Å; P60-H62 PolarHBondContact O-N 3.2Å; H62-D64 PolarHBondContact O-N 2.89Å; H62-A65 PolarHBondContact O-N 3.41Å; H62-V66 WeakPolarHBondContact O-CG2 3.36Å; H62-V66 PolarHBondContact O-N 3.09Å; H62-Y278 HydrophobicContact CB-CD2 4.07Å; H62-Y278 HydrophobicContact CB-CE2 3.97Å; H62-Y278 AromaticContact CE1-CD2 3.79Å; H62-Y278 AromaticContact CG-CD2 3.81Å; H62-Y278 AromaticContact CG-CE2 3.81Å; H62-Y278 AromaticContact ND1-CD2 3Å; H62-Y278 WeakPolarHBondContact ND1-CD2 3.37Å; H62-Y278 AromaticContact ND1-CE2 3.36Å; H62-Y278 WeakPolarHBondContact ND1-CE2 3.17Å; H62-Y278 AromaticContact ND1-CG 3.61Å; H62-S281 PolarHBondContact CE1-OG 3.47Å; H62-S281 PolarHBondContact NE2-OG 3.14Å
63	V	96.5	Very high	95.3	Very high	6 Å²	6	21.9 Å²	21.9	4%	0.036	13%	0.131	C	C	.	.	H	α-helix	trans	-62.7	-41.3	-173.2	177.3	0	0	0	0	111.8	P60 V61 A65 V66 A67 C323 Q326	P60-V63 WeakPolarHBondContact O-CG2 3.24Å; P60-V63 PolarHBondContact O-N 3.26Å; V61-V63 VanDerWaalsContact C-N 3.31Å; V63-A65 PolarHBondContact O-N 3.44Å; V63-V66 PolarHBondContact O-N 3.14Å; V63-A67 HydrophobicContact CG1-CB 4.28Å; V63-A67 WeakPolarHBondContact O-CB 3.29Å; V63-A67 PolarHBondContact O-N 3.4Å; V63-C323 HydrophobicContact CG2-CB 4.17Å; V63-Q326 HydrophobicContact CB-CB 4.04Å; V63-Q326 HydrophobicContact CB-CG 3.7Å; V63-Q326 HydrophobicContact CG1-CB 3.82Å; V63-Q326 HydrophobicContact CG1-CG 3.52Å; V63-Q326 HydrophobicContact CG2-CB 4.06Å; V63-Q326 HydrophobicContact CG2-CG 4.27Å
64	D	95.3	Very high	95.1	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.011	13%	0.129	C	C	.	.	H	α-helix	trans	-57.7	-48.3	174.9	178.2	20.4	0	0	0	111.5	H62 V66 S68 E274 R275 W330	H62-D64 PolarHBondContact O-N 2.89Å; D64-V66 VanDerWaalsContact C-N 3.29Å; D64-V66 PolarHBondContact O-N 3.39Å; D64-S68 WeakPolarHBondContact O-CB 3.05Å; D64-S68 PolarHBondContact O-N 2.69Å; D64-E274 HydrophobicContact CB-CB 3.87Å; D64-R275 WeakPolarHBondContact OD2-CB 3.44Å; D64-R275 PolarHBondContact OD2-N 3.25Å; D64-R275 VanDerWaalsContact OD2-N 3.16Å; D64-R275 IonicContact OD2-NH1 2.76Å; D64-W330 HydrophobicContact CB-CZ2 3.99Å; D64-W330 WeakPolarHBondContact OD1-CH2 3.42Å; D64-W330 WeakPolarHBondContact OD1-CZ2 3.27Å
65	A	95.6	Very high	95.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.7	-34	179.3	0	0	0	0	0	113.1	H62 V63 G71 I75 R275 Y278	H62-A65 PolarHBondContact O-N 3.41Å; V63-A65 PolarHBondContact O-N 3.44Å; A65-G71 CarbonylContact O-C 3.48Å; A65-G71 VanDerWaalsContact O-CA 3.31Å; A65-G71 WeakPolarHBondContact O-CA 3.42Å; A65-I75 HydrophobicContact CB-CG1 4.29Å; A65-I75 VanDerWaalsContact O-CD1 3.31Å; A65-I75 WeakPolarHBondContact O-CD1 3.43Å; A65-R275 HydrophobicContact CB-CB 4.28Å; A65-Y278 HydrophobicContact CB-CD2 3.52Å; A65-Y278 HydrophobicContact CB-CE2 4.19Å; A65-Y278 HydrophobicContact CB-CG 4.23Å
66	V	96.9	Very high	95.1	Very high	11 Å²	11	21.4 Å²	21.4	7%	0.067	13%	0.127	C	C	.	.	H	α-helix	trans	-86.7	-41.7	-177.1	179.2	0	0	0	0	112.5	H14 N17 V18 H21 H62 V63 D64 I75	H14-V66 PolarHBondContact ND1-O 3.11Å; N17-V66 HydrophobicContact CB-CG1 4.25Å; N17-V66 WeakPolarHBondContact CB-O 3.32Å; N17-V66 PolarHBondContact ND2-O 3.43Å; V18-V66 HydrophobicContact CG2-CG1 3.78Å; H21-V66 HydrophobicContact CB-CG2 3.76Å; H62-V66 WeakPolarHBondContact O-CG2 3.36Å; H62-V66 PolarHBondContact O-N 3.09Å; V63-V66 PolarHBondContact O-N 3.14Å; D64-V66 VanDerWaalsContact C-N 3.29Å; D64-V66 PolarHBondContact O-N 3.39Å; V66-I75 HydrophobicContact CB-CD1 4.43Å; V66-I75 HydrophobicContact CG2-CD1 3.88Å
67	A	95.2	Very high	94.9	Very high	20 Å²	20	21.4 Å²	21.4	17%	0.165	13%	0.127	C	C	.	.	H	α-helix	trans	-73.4	-40	-179.4	0	0	0	0	0	112	V63 W330	V63-A67 HydrophobicContact CG1-CB 4.28Å; V63-A67 WeakPolarHBondContact O-CB 3.29Å; V63-A67 PolarHBondContact O-N 3.4Å; A67-W330 HydrophobicContact CB-CB 3.76Å; A67-W330 HydrophobicContact CB-CD2 3.67Å; A67-W330 HydrophobicContact CB-CE3 3.94Å; A67-W330 HydrophobicContact CB-CG 3.6Å
68	S	92.9	Very high	94.7	Very high	19 Å²	19	19.7 Å²	19.7	13%	0.133	11%	0.113	C	C	.	.	S	Bend	trans	-76.5	136.9	-179.8	-174.2	0	0	0	0	112.3	N17 D64 V70 G71	N17-S68 PolarHBondContact ND2-O 2.88Å; D64-S68 WeakPolarHBondContact O-CB 3.05Å; D64-S68 PolarHBondContact O-N 2.69Å; S68-V70 VanDerWaalsContact C-N 3.25Å; S68-V70 PolarHBondContact O-N 3.01Å; S68-V70 PolarHBondContact OG-N 2.96Å; S68-G71 PolarHBondContact O-N 3.3Å
69	I	91.7	Very high	94.7	Very high	92 Å²	92	20.3 Å²	20.3	47%	0.472	12%	0.115	S	C	.	.	S	Bend	trans	-62.9	-37.8	171	-59.8	178.9	0	0	0	110.5	Y13 G71 R72	Y13-I69 HydrophobicContact CD1-CD1 4.07Å; Y13-I69 HydrophobicContact CD1-CG1 4.33Å; Y13-I69 HydrophobicContact CD1-CG2 4.03Å; Y13-I69 HydrophobicContact CD2-CD1 4.39Å; Y13-I69 HydrophobicContact CG-CD1 3.92Å; Y13-I69 HydrophobicContact CG-CG1 4.24Å; I69-G71 VanDerWaalsContact C-N 3.28Å; I69-G71 PolarHBondContact O-N 3.2Å; I69-R72 VanDerWaalsContact O-CB 3.26Å; I69-R72 WeakPolarHBondContact O-CB 3.36Å; I69-R72 PolarHBondContact O-N 3.32Å
70	V	89.1	Confident	94.5	Very high	97 Å²	97	21.6 Å²	21.6	59%	0.588	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-35.9	178.1	-176.9	0	0	0	0	110.6	S68 R72 A73 E74	S68-V70 VanDerWaalsContact C-N 3.25Å; S68-V70 PolarHBondContact O-N 3.01Å; S68-V70 PolarHBondContact OG-N 2.96Å; V70-R72 PolarHBondContact O-N 3.18Å; V70-R72 VanDerWaalsContact O-N 3.08Å; V70-A73 PolarHBondContact O-N 3.41Å; V70-E74 VanDerWaalsContact O-OE2 3.14Å
71	G	92.4	Very high	94.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.5	177.3	0	0	0	0	0	115.4	A65 S68 I69 A73 E74 I75	A65-G71 CarbonylContact O-C 3.48Å; A65-G71 VanDerWaalsContact O-CA 3.31Å; A65-G71 WeakPolarHBondContact O-CA 3.42Å; S68-G71 PolarHBondContact O-N 3.3Å; I69-G71 VanDerWaalsContact C-N 3.28Å; I69-G71 PolarHBondContact O-N 3.2Å; G71-A73 PolarHBondContact O-N 3.43Å; G71-E74 WeakPolarHBondContact CA-OE2 3.42Å; G71-E74 WeakPolarHBondContact O-CB 3.48Å; G71-E74 PolarHBondContact O-N 2.92Å; G71-E74 VanDerWaalsContact O-N 3.16Å; G71-I75 PolarHBondContact O-N 3.44Å
72	R	94.5	Very high	94	Very high	47 Å²	47	22 Å²	22	18%	0.177	12%	0.124	C	C	.	.	H	α-helix	trans	-58.3	-35.1	177.2	-177.2	-179.5	-64.7	-175.4	-1.8	112.3	N2 Y13 N17 L20 I69 V70 E74 I75 I76	N2-R72 PolarHBondContact OD1-NH1 3.05Å; Y13-R72 PolarHBondContact O-NH2 3.38Å; Y13-R72 VanDerWaalsContact O-NH2 3.09Å; N17-R72 PolarHBondContact OD1-NE 3.2Å; N17-R72 PolarHBondContact OD1-NH2 3.13Å; L20-R72 HydrophobicContact CD1-CG 4.29Å; I69-R72 VanDerWaalsContact O-CB 3.26Å; I69-R72 WeakPolarHBondContact O-CB 3.36Å; I69-R72 PolarHBondContact O-N 3.32Å; V70-R72 PolarHBondContact O-N 3.18Å; V70-R72 VanDerWaalsContact O-N 3.08Å; R72-E74 VanDerWaalsContact C-N 3.25Å; R72-E74 PolarHBondContact O-N 3.36Å; R72-I75 PolarHBondContact O-N 2.62Å; R72-I76 HydrophobicContact CG-CD1 3.72Å; R72-I76 HydrophobicContact CG-CG1 4.19Å; R72-I76 WeakPolarHBondContact O-CG1 3.43Å; R72-I76 PolarHBondContact O-N 3.36Å
73	A	93.1	Very high	93.8	Very high	29 Å²	29	23.4 Å²	23.4	24%	0.24	13%	0.134	C	C	.	.	H	α-helix	trans	-60.1	-39.8	179.9	0	0	0	0	0	111.2	V70 G71 S77 K117	V70-A73 PolarHBondContact O-N 3.41Å; G71-A73 PolarHBondContact O-N 3.43Å; A73-S77 WeakPolarHBondContact O-CB 3.3Å; A73-S77 PolarHBondContact O-N 3.45Å; A73-K117 HydrophobicContact CB-CD 4.2Å
74	E	93.6	Very high	93.4	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.023	13%	0.132	C	C	.	.	H	α-helix	trans	-67.4	-41.2	178.3	-67.6	72.8	-167.4	0	0	111.3	V70 G71 R72 A78 K117 R275	V70-E74 VanDerWaalsContact O-OE2 3.14Å; G71-E74 WeakPolarHBondContact CA-OE2 3.42Å; G71-E74 WeakPolarHBondContact O-CB 3.48Å; G71-E74 PolarHBondContact O-N 2.92Å; G71-E74 VanDerWaalsContact O-N 3.16Å; R72-E74 VanDerWaalsContact C-N 3.25Å; R72-E74 PolarHBondContact O-N 3.36Å; E74-A78 WeakPolarHBondContact O-CB 3.45Å; E74-A78 PolarHBondContact O-N 2.84Å; E74-K117 VanDerWaalsContact OE1-CE 3.23Å; E74-K117 WeakPolarHBondContact OE1-CE 3.24Å; E74-K117 IonicContact OE1-NZ 3.98Å; E74-K117 PolarHBondContact OE1-NZ 3.32Å; E74-R275 HydrophobicContact CG-CB 4.16Å; E74-R275 HydrophobicContact CG-CG 4.48Å
75	I	96.2	Very high	92.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-66.5	-45.9	177.3	-55	169.6	0	0	0	111	N17 L20 V24 A65 V66 G71 R72 A78 L79 Y278	N17-I75 HydrophobicContact CB-CD1 4.01Å; L20-I75 HydrophobicContact CB-CG2 3.57Å; V24-I75 HydrophobicContact CG2-CG2 4.01Å; A65-I75 HydrophobicContact CB-CG1 4.29Å; A65-I75 VanDerWaalsContact O-CD1 3.31Å; A65-I75 WeakPolarHBondContact O-CD1 3.43Å; V66-I75 HydrophobicContact CB-CD1 4.43Å; V66-I75 HydrophobicContact CG2-CD1 3.88Å; G71-I75 PolarHBondContact O-N 3.44Å; R72-I75 PolarHBondContact O-N 2.62Å; I75-A78 PolarHBondContact O-N 3.36Å; I75-L79 WeakPolarHBondContact O-CB 3.33Å; I75-L79 PolarHBondContact O-N 3.17Å; I75-Y278 HydrophobicContact CG1-CE2 4.13Å
76	I	95.1	Very high	92.7	Very high	61 Å²	61	24.7 Å²	24.7	31%	0.313	14%	0.14	S	C	.	.	H	α-helix	trans	-64.2	-44	178.3	-68.3	174.7	0	0	0	110.4	L20 R72 A78 L79 L80 A116	L20-I76 HydrophobicContact CD1-CG1 4.09Å; R72-I76 HydrophobicContact CG-CD1 3.72Å; R72-I76 HydrophobicContact CG-CG1 4.19Å; R72-I76 WeakPolarHBondContact O-CG1 3.43Å; R72-I76 PolarHBondContact O-N 3.36Å; I76-A78 VanDerWaalsContact C-N 3.29Å; I76-A78 PolarHBondContact O-N 3.3Å; I76-L79 WeakPolarHBondContact O-CB 3.48Å; I76-L79 PolarHBondContact O-N 3.34Å; I76-L80 HydrophobicContact CG2-CD1 3.72Å; I76-L80 HydrophobicContact CG2-CG 4.36Å; I76-L80 WeakPolarHBondContact O-CB 3.47Å; I76-L80 VanDerWaalsContact O-CG 3.31Å; I76-L80 WeakPolarHBondContact O-CG 3.34Å; I76-L80 PolarHBondContact O-N 2.97Å; I76-A116 HydrophobicContact CB-CB 4.43Å; I76-A116 HydrophobicContact CG2-CB 3.96Å
77	S	92.9	Very high	92.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.3	-43.1	174.7	179.4	0	0	0	0	111.2	A73 Y81 A113	A73-S77 WeakPolarHBondContact O-CB 3.3Å; A73-S77 PolarHBondContact O-N 3.45Å; S77-Y81 WeakPolarHBondContact O-CB 3.49Å; S77-Y81 PolarHBondContact O-N 3.36Å; S77-A113 PolarHBondContact OG-O 2.95Å
78	A	94.4	Very high	91.6	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-67.8	-40.6	178.4	0	0	0	0	0	112.9	E74 I75 I76 Y81 I82 Y278 L279	E74-A78 WeakPolarHBondContact O-CB 3.45Å; E74-A78 PolarHBondContact O-N 2.84Å; I75-A78 PolarHBondContact O-N 3.36Å; I76-A78 VanDerWaalsContact C-N 3.29Å; I76-A78 PolarHBondContact O-N 3.3Å; A78-Y81 WeakPolarHBondContact O-CB 3.3Å; A78-Y81 PolarHBondContact O-N 3.16Å; A78-I82 WeakPolarHBondContact O-CG1 3.48Å; A78-I82 PolarHBondContact O-N 3.44Å; A78-Y278 HydrophobicContact CB-CD1 3.68Å; A78-Y278 HydrophobicContact CB-CE1 3.53Å; A78-L279 HydrophobicContact CB-CD1 3.91Å
79	L	95.8	Very high	91.2	Very high	31 Å²	31	27.5 Å²	27.5	16%	0.162	15%	0.147	C	C	.	.	H	α-helix	trans	-56.7	-53.2	174	176.6	60.9	0	0	0	111	L20 I23 V24 L27 I75 I76 Y81 I82 C83	L20-L79 HydrophobicContact CD2-CD2 4.22Å; I23-L79 HydrophobicContact CG2-CD1 3.72Å; V24-L79 HydrophobicContact CG2-CB 3.67Å; V24-L79 HydrophobicContact CG2-CD1 4.08Å; V24-L79 HydrophobicContact CG2-CG 4.44Å; L27-L79 HydrophobicContact CD1-CD1 3.39Å; I75-L79 WeakPolarHBondContact O-CB 3.33Å; I75-L79 PolarHBondContact O-N 3.17Å; I76-L79 WeakPolarHBondContact O-CB 3.48Å; I76-L79 PolarHBondContact O-N 3.34Å; L79-Y81 VanDerWaalsContact C-N 3.34Å; L79-Y81 PolarHBondContact O-N 3.37Å; L79-I82 PolarHBondContact O-N 2.87Å; L79-C83 PolarHBondContact O-N 2.82Å; L79-C83 PolarHBondContact O-SG 2.85Å; L79-C83 VanDerWaalsContact O-SG 3.35Å
80	L	93.3	Very high	90.9	Very high	28 Å²	28	27.7 Å²	27.7	15%	0.147	14%	0.144	C	C	.	.	H	α-helix	trans	-66.7	-36.8	-179.1	-66.2	169.2	0	0	0	111.8	I76 C83 S84 L109 M112 A113	I76-L80 HydrophobicContact CG2-CD1 3.72Å; I76-L80 HydrophobicContact CG2-CG 4.36Å; I76-L80 WeakPolarHBondContact O-CB 3.47Å; I76-L80 VanDerWaalsContact O-CG 3.31Å; I76-L80 WeakPolarHBondContact O-CG 3.34Å; I76-L80 PolarHBondContact O-N 2.97Å; L80-C83 PolarHBondContact O-N 2.88Å; L80-S84 WeakPolarHBondContact O-CB 3.5Å; L80-S84 PolarHBondContact O-N 3.45Å; L80-L109 HydrophobicContact CD2-CD2 3.73Å; L80-M112 HydrophobicContact CD1-CB 3.68Å; L80-M112 HydrophobicContact CD2-CB 4.36Å; L80-A113 HydrophobicContact CB-CB 3.66Å
81	Y	90.5	Very high	90.6	Very high	8 Å²	8	23.3 Å²	23.3	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-57.4	-48.6	172.3	172.6	-82	0	0	0	111.5	F31 S77 A78 L79 S84 F85 T122 V123 L279 L282	F31-Y81 AromaticContact CE2-CE1 3.8Å; F31-Y81 HydrophobicContact CE2-CE1 3.8Å; F31-Y81 HydrophobicContact CZ-CE1 4.2Å; S77-Y81 WeakPolarHBondContact O-CB 3.49Å; S77-Y81 PolarHBondContact O-N 3.36Å; A78-Y81 WeakPolarHBondContact O-CB 3.3Å; A78-Y81 PolarHBondContact O-N 3.16Å; L79-Y81 VanDerWaalsContact C-N 3.34Å; L79-Y81 PolarHBondContact O-N 3.37Å; Y81-S84 PolarHBondContact O-N 3.25Å; Y81-F85 WeakPolarHBondContact O-CB 3.37Å; Y81-F85 PolarHBondContact O-N 3.31Å; Y81-T122 WeakPolarHBondContact CE2-OG1 3.46Å; Y81-V123 HydrophobicContact CD2-CB 4.3Å; Y81-V123 HydrophobicContact CD2-CG2 3.12Å; Y81-V123 HydrophobicContact CE2-CB 4.34Å; Y81-V123 HydrophobicContact CE2-CG2 3.57Å; Y81-V123 HydrophobicContact CG-CG2 3.75Å; Y81-L279 HydrophobicContact CD1-CD1 3.63Å; Y81-L279 HydrophobicContact CD1-CD2 4.41Å; Y81-L279 HydrophobicContact CD2-CD1 4.46Å; Y81-L279 HydrophobicContact CD2-CD2 3.77Å; Y81-L279 HydrophobicContact CE1-CD1 4.06Å; Y81-L279 HydrophobicContact CE2-CD2 4.21Å; Y81-L279 HydrophobicContact CG-CD1 3.88Å; Y81-L279 HydrophobicContact CG-CD2 3.93Å; Y81-L282 HydrophobicContact CE1-CD1 4.37Å
82	I	92.1	Very high	90	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65	-49.1	179.5	-71.2	166.5	0	0	0	110.5	V24 L27 F31 A78 L79 S84 F85 L86 L282	V24-I82 HydrophobicContact CG1-CD1 3.84Å; L27-I82 HydrophobicContact CB-CG2 3.83Å; F31-I82 HydrophobicContact CB-CG1 4.42Å; F31-I82 HydrophobicContact CB-CG2 3.94Å; F31-I82 HydrophobicContact CD2-CG1 4.24Å; F31-I82 HydrophobicContact CG-CG1 4.38Å; A78-I82 WeakPolarHBondContact O-CG1 3.48Å; A78-I82 PolarHBondContact O-N 3.44Å; L79-I82 PolarHBondContact O-N 2.87Å; I82-S84 VanDerWaalsContact C-N 3.3Å; I82-S84 PolarHBondContact O-N 2.95Å; I82-F85 WeakPolarHBondContact O-CB 3.46Å; I82-F85 PolarHBondContact O-N 2.94Å; I82-F85 VanDerWaalsContact O-N 3.14Å; I82-L86 HydrophobicContact CG2-CD1 3.93Å; I82-L86 HydrophobicContact CG2-CG 4.3Å; I82-L86 WeakPolarHBondContact O-CG 3.48Å; I82-L86 PolarHBondContact O-N 2.96Å; I82-L282 HydrophobicContact CD1-CD1 4.14Å; I82-L282 HydrophobicContact CD1-CD2 4.45Å; I82-L282 HydrophobicContact CG1-CD1 4.11Å
83	C	93	Very high	89.3	Confident	35 Å²	35	33 Å²	33	24%	0.236	18%	0.175	C	C	.	.	H	α-helix	trans	-57.1	-45.9	177.9	-69	0	0	0	0	111.1	L79 L80 F85 L86 E87 L109	L79-C83 PolarHBondContact O-N 2.82Å; L79-C83 PolarHBondContact O-SG 2.85Å; L79-C83 VanDerWaalsContact O-SG 3.35Å; L80-C83 PolarHBondContact O-N 2.88Å; C83-F85 VanDerWaalsContact C-N 3.33Å; C83-F85 PolarHBondContact O-N 3.09Å; C83-L86 PolarHBondContact O-N 3.33Å; C83-E87 WeakPolarHBondContact O-CG 3.4Å; C83-E87 PolarHBondContact O-N 3.4Å; C83-L109 HydrophobicContact CB-CD1 3.84Å
84	S	88.2	Confident	88.7	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-43	177.3	-170.1	0	0	0	0	112.1	L80 Y81 I82 E87 Y88 C106 S110 V123	L80-S84 WeakPolarHBondContact O-CB 3.5Å; L80-S84 PolarHBondContact O-N 3.45Å; Y81-S84 PolarHBondContact O-N 3.25Å; I82-S84 VanDerWaalsContact C-N 3.3Å; I82-S84 PolarHBondContact O-N 2.95Å; S84-E87 PolarHBondContact O-N 3.27Å; S84-Y88 PolarHBondContact O-N 3.4Å; S84-C106 PolarHBondContact O-SG 3.43Å; S84-C106 PolarHBondContact OG-O 3.2Å; S84-C106 PolarHBondContact OG-SG 3.33Å; S84-S110 PolarHBondContact OG-OG 3.04Å; S84-V123 WeakPolarHBondContact OG-CG1 3.45Å
85	F	85.5	Confident	87.4	Confident	13 Å²	13	42.4 Å²	42.4	6%	0.057	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-41.9	176.2	176.7	-99.7	0	0	0	112.2	F31 A34 M35 Y81 I82 C83 Y88 C89	F31-F85 HydrophobicContact CD2-CB 4.27Å; F31-F85 AromaticContact CD2-CD1 3.29Å; F31-F85 HydrophobicContact CD2-CD1 3.29Å; F31-F85 AromaticContact CD2-CE1 3.76Å; F31-F85 HydrophobicContact CD2-CE1 3.76Å; F31-F85 AromaticContact CD2-CG 3.9Å; F31-F85 HydrophobicContact CD2-CG 3.9Å; F31-F85 HydrophobicContact CE2-CB 4.3Å; F31-F85 AromaticContact CE2-CD1 3.57Å; F31-F85 HydrophobicContact CE2-CD1 3.57Å; F31-F85 HydrophobicContact CE2-CD2 4.39Å; F31-F85 AromaticContact CE2-CE1 3.9Å; F31-F85 HydrophobicContact CE2-CE1 3.9Å; F31-F85 AromaticContact CE2-CG 3.82Å; F31-F85 HydrophobicContact CE2-CG 3.82Å; F31-F85 HydrophobicContact CE2-CZ 4.47Å; F31-F85 HydrophobicContact CG-CD1 4.32Å; A34-F85 HydrophobicContact CB-CE1 3.91Å; M35-F85 HydrophobicContact CG-CE1 4.01Å; M35-F85 HydrophobicContact CG-CZ 3.84Å; Y81-F85 WeakPolarHBondContact O-CB 3.37Å; Y81-F85 PolarHBondContact O-N 3.31Å; I82-F85 WeakPolarHBondContact O-CB 3.46Å; I82-F85 PolarHBondContact O-N 2.94Å; I82-F85 VanDerWaalsContact O-N 3.14Å; C83-F85 VanDerWaalsContact C-N 3.33Å; C83-F85 PolarHBondContact O-N 3.09Å; F85-Y88 WeakPolarHBondContact O-CB 3.45Å; F85-Y88 PolarHBondContact O-N 3.27Å; F85-C89 PolarHBondContact O-N 3.43Å; F85-C89 PolarHBondContact O-SG 2.87Å; F85-C89 VanDerWaalsContact O-SG 3.42Å
86	L	90	Very high	86.2	Confident	22 Å²	22	47.3 Å²	47.3	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-41.5	177.9	-68.2	175.7	0	0	0	112	L27 D30 A34 I82 C83 Y88 C89 K90	L27-L86 HydrophobicContact CD2-CD1 4.46Å; D30-L86 HydrophobicContact CB-CD1 3.83Å; D30-L86 HydrophobicContact CB-CD2 3.93Å; A34-L86 HydrophobicContact CB-CD2 3.9Å; I82-L86 HydrophobicContact CG2-CD1 3.93Å; I82-L86 HydrophobicContact CG2-CG 4.3Å; I82-L86 WeakPolarHBondContact O-CG 3.48Å; I82-L86 PolarHBondContact O-N 2.96Å; C83-L86 PolarHBondContact O-N 3.33Å; L86-Y88 VanDerWaalsContact C-N 3.3Å; L86-Y88 PolarHBondContact O-N 3.02Å; L86-C89 WeakPolarHBondContact O-CB 3.38Å; L86-C89 PolarHBondContact O-N 3.07Å; L86-C89 VanDerWaalsContact O-N 3.16Å; L86-K90 WeakPolarHBondContact O-CG 3.47Å; L86-K90 PolarHBondContact O-N 3.27Å
87	E	87.4	Confident	85.3	Confident	22 Å²	22	48.5 Å²	48.5	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-37.7	174.7	-68.9	-53.3	130.3	0	0	112	C83 S84 K90 A91 H102 L105 C106 L109	C83-E87 WeakPolarHBondContact O-CG 3.4Å; C83-E87 PolarHBondContact O-N 3.4Å; S84-E87 PolarHBondContact O-N 3.27Å; E87-K90 PolarHBondContact O-N 2.86Å; E87-K90 IonicContact OE1-NZ 3.03Å; E87-K90 PolarHBondContact OE1-NZ 3.34Å; E87-A91 WeakPolarHBondContact O-CB 3.49Å; E87-A91 PolarHBondContact O-N 3.28Å; E87-H102 IonicContact OE2-CE1 2.74Å; E87-H102 IonicContact OE2-CG 3.52Å; E87-H102 IonicContact OE2-ND1 3.64Å; E87-H102 PolarHBondContact OE2-ND1 3.28Å; E87-L105 HydrophobicContact CG-CD2 3.68Å; E87-L105 HydrophobicContact CG-CG 3.99Å; E87-C106 HydrophobicContact CB-CB 4.12Å; E87-L109 HydrophobicContact CG-CD1 4.03Å
88	Y	82.9	Confident	84.8	Confident	63 Å²	63	55.9 Å²	55.9	25%	0.247	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-46.4	170.4	170.8	-114.5	0	0	0	112.5	S84 F85 L86 K90 A91 A92 L127	S84-Y88 PolarHBondContact O-N 3.4Å; F85-Y88 WeakPolarHBondContact O-CB 3.45Å; F85-Y88 PolarHBondContact O-N 3.27Å; L86-Y88 VanDerWaalsContact C-N 3.3Å; L86-Y88 PolarHBondContact O-N 3.02Å; Y88-K90 PolarHBondContact O-N 3.34Å; Y88-A91 WeakPolarHBondContact O-CB 3.26Å; Y88-A91 PolarHBondContact O-N 3.44Å; Y88-A91 VanDerWaalsContact O-N 3.15Å; Y88-A92 PolarHBondContact O-N 2.88Å; Y88-L127 HydrophobicContact CD2-CD2 3.16Å; Y88-L127 HydrophobicContact CD2-CG 4.11Å; Y88-L127 HydrophobicContact CE2-CD2 3.42Å; Y88-L127 VanDerWaalsContact CE2-CD2 3.42Å; Y88-L127 HydrophobicContact CE2-CG 4.28Å; Y88-L127 HydrophobicContact CG-CD2 3.78Å; Y88-L127 HydrophobicContact CG-CG 4.33Å
89	C	83.1	Confident	84	Confident	24 Å²	24	59.4 Å²	59.4	16%	0.162	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-33.6	177.6	-70.9	0	0	0	0	112.4	A34 F85 L86 K93	A34-C89 HydrophobicContact CB-CB 4.26Å; F85-C89 PolarHBondContact O-N 3.43Å; F85-C89 PolarHBondContact O-SG 2.87Å; F85-C89 VanDerWaalsContact O-SG 3.42Å; L86-C89 WeakPolarHBondContact O-CB 3.38Å; L86-C89 PolarHBondContact O-N 3.07Å; L86-C89 VanDerWaalsContact O-N 3.16Å; C89-K93 WeakPolarHBondContact O-CG 3.47Å
90	K	86.2	Confident	83.3	Confident	96 Å²	96	62.6 Å²	62.6	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-68.2	-47.1	171.9	-67.9	172.3	-170.4	170.7	0	111.2	L86 E87 Y88 A92 K93 K94	L86-K90 WeakPolarHBondContact O-CG 3.47Å; L86-K90 PolarHBondContact O-N 3.27Å; E87-K90 PolarHBondContact O-N 2.86Å; E87-K90 IonicContact OE1-NZ 3.03Å; E87-K90 PolarHBondContact OE1-NZ 3.34Å; Y88-K90 PolarHBondContact O-N 3.34Å; K90-A92 PolarHBondContact O-N 3.15Å; K90-K93 PolarHBondContact O-N 2.79Å; K90-K94 WeakPolarHBondContact O-CG 3.22Å; K90-K94 PolarHBondContact O-N 3.5Å
91	A	82.1	Confident	82.9	Confident	5 Å²	5	65.9 Å²	65.9	4%	0.041	35%	0.345	C	S	.	.	H	α-helix	trans	-57.4	-36.8	176.8	0	0	0	0	0	112.5	E87 Y88 K93 H102	E87-A91 WeakPolarHBondContact O-CB 3.49Å; E87-A91 PolarHBondContact O-N 3.28Å; Y88-A91 WeakPolarHBondContact O-CB 3.26Å; Y88-A91 PolarHBondContact O-N 3.44Å; Y88-A91 VanDerWaalsContact O-N 3.15Å; A91-K93 VanDerWaalsContact C-N 3.28Å; A91-K93 PolarHBondContact O-N 3.29Å; A91-H102 HydrophobicContact CB-CB 3.63Å
92	A	79.6	Confident	82.6	Confident	71 Å²	71	66.9 Å²	66.9	59%	0.587	35%	0.35	S	S	*	.	H	α-helix	trans	-67.6	-25.5	178.7	0	0	0	0	0	113.5	Y88 K90	Y88-A92 PolarHBondContact O-N 2.88Å; K90-A92 PolarHBondContact O-N 3.15Å
93	K	81.1	Confident	82.1	Confident	178 Å²	178	68.5 Å²	68.5	77%	0.774	36%	0.358	S	S	*	.	H	α-helix	trans	-93.9	-17.8	-179.5	-66.7	175.9	-177	179.7	0	113.7	C89 K90 A91	C89-K93 WeakPolarHBondContact O-CG 3.47Å; K90-K93 PolarHBondContact O-N 2.79Å; A91-K93 VanDerWaalsContact C-N 3.28Å; A91-K93 PolarHBondContact O-N 3.29Å
94	K	78.8	Confident	81.6	Confident	114 Å²	114	72 Å²	72	50%	0.496	37%	0.374	S	S	.	.	S	Bend	trans	-95.7	154.3	-172.9	-68.3	-72.3	-174.7	175.9	0	112.6	K90 W98	K90-K94 WeakPolarHBondContact O-CG 3.22Å; K90-K94 PolarHBondContact O-N 3.5Å; K94-W98 HydrophobicContact CB-CB 4.29Å; K94-W98 HydrophobicContact CG-CB 4.49Å
95	T	68.1	Low	81.5	Confident	119 Å²	119	75.7 Å²	75.7	73%	0.73	39%	0.393	S	S	*	.			trans	-84.8	173.4	172.8	49.7	0	0	0	0	112.1	S97 K99	T95-S97 PolarHBondContact O-N 3.4Å; T95-S97 VanDerWaalsContact O-N 3.12Å; T95-K99 WeakPolarHBondContact O-CB 3.17Å; T95-K99 PolarHBondContact O-N 3.5Å
96	C	70	Confident	81.4	Confident	102 Å²	102	75 Å²	75	69%	0.689	39%	0.39	S	S	*	.	H	α-helix	trans	-45.4	-48.6	-149.2	-145.2	0	0	0	0	117.7
97	S	75.6	Confident	81	Confident	87 Å²	87	77.2 Å²	77.2	61%	0.608	40%	0.401	S	S	*	.	H	α-helix	trans	-71.8	-54.6	-171.9	61.1	0	0	0	0	113.2	T95 K99 N100	T95-S97 PolarHBondContact O-N 3.4Å; T95-S97 VanDerWaalsContact O-N 3.12Å; S97-K99 PolarHBondContact O-N 3Å; S97-N100 PolarHBondContact O-N 3.43Å
98	W	82.4	Confident	80.8	Confident	155 Å²	155	78.5 Å²	78.5	59%	0.587	41%	0.413	S	S	*	.	H	α-helix	trans	-64.8	-29.4	178.7	-69.2	98	0	0	0	112.5	K94 N100 L101 H102	K94-W98 HydrophobicContact CB-CB 4.29Å; K94-W98 HydrophobicContact CG-CB 4.49Å; W98-N100 VanDerWaalsContact C-N 3.31Å; W98-N100 PolarHBondContact O-N 2.71Å; W98-L101 HydrophobicContact CE3-CD2 3.88Å; W98-L101 HydrophobicContact CZ3-CD2 3.81Å; W98-L101 PolarHBondContact O-N 3.45Å; W98-H102 PolarHBondContact O-CD2 3.4Å; W98-H102 PolarHBondContact O-N 3Å
99	K	79.5	Confident	81	Confident	75 Å²	75	76.7 Å²	76.7	33%	0.326	41%	0.407	S	S	.	.	H	α-helix	trans	-57.7	-42.1	175	175.7	174.8	178.7	-179.8	0	112.4	T95 S97 L103	T95-K99 WeakPolarHBondContact O-CB 3.17Å; T95-K99 PolarHBondContact O-N 3.5Å; S97-K99 PolarHBondContact O-N 3Å; K99-L103 VanDerWaalsContact O-CB 3.31Å; K99-L103 WeakPolarHBondContact O-CB 3.39Å; K99-L103 PolarHBondContact O-N 3.43Å
100	N	80.5	Confident	80.9	Confident	98 Å²	98	75.7 Å²	75.7	52%	0.524	40%	0.4	S	S	.	.	H	α-helix	trans	-69.2	-38.9	179.8	-71	-17	0	0	0	111.7	S97 W98 L103 L104	S97-N100 PolarHBondContact O-N 3.43Å; W98-N100 VanDerWaalsContact C-N 3.31Å; W98-N100 PolarHBondContact O-N 2.71Å; N100-L103 PolarHBondContact O-N 3.03Å; N100-L104 WeakPolarHBondContact O-CB 3.26Å; N100-L104 PolarHBondContact O-N 3.2Å
101	L	84.7	Confident	80.5	Confident	97 Å²	97	75 Å²	75	51%	0.508	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-49.3	175.8	-178.4	66.4	0	0	0	111.9	W98 L103 L104 L105	W98-L101 HydrophobicContact CE3-CD2 3.88Å; W98-L101 HydrophobicContact CZ3-CD2 3.81Å; W98-L101 PolarHBondContact O-N 3.45Å; L101-L103 VanDerWaalsContact C-N 3.3Å; L101-L103 PolarHBondContact O-N 3.29Å; L101-L104 PolarHBondContact O-N 3.07Å; L101-L105 PolarHBondContact O-N 3.2Å
102	H	83.7	Confident	80.6	Confident	29 Å²	29	79.8 Å²	79.8	13%	0.134	42%	0.42	C	S	.	.	H	α-helix	trans	-63.9	-35.8	177.5	-72.8	-64.1	0	0	0	112.3	E87 A91 W98 C106	E87-H102 IonicContact OE2-CE1 2.74Å; E87-H102 IonicContact OE2-CG 3.52Å; E87-H102 IonicContact OE2-ND1 3.64Å; E87-H102 PolarHBondContact OE2-ND1 3.28Å; A91-H102 HydrophobicContact CB-CB 3.63Å; W98-H102 PolarHBondContact O-CD2 3.4Å; W98-H102 PolarHBondContact O-N 3Å; H102-C106 VanDerWaalsContact O-CB 3.27Å; H102-C106 WeakPolarHBondContact O-CB 3.2Å; H102-C106 PolarHBondContact O-N 3.24Å
103	L	82.1	Confident	80.9	Confident	34 Å²	34	76.4 Å²	76.4	18%	0.178	39%	0.392	C	S	.	.	H	α-helix	trans	-66.8	-41.3	175.7	-174.7	63.7	0	0	0	111.6	K99 N100 L101 C106 I107 L127	K99-L103 VanDerWaalsContact O-CB 3.31Å; K99-L103 WeakPolarHBondContact O-CB 3.39Å; K99-L103 PolarHBondContact O-N 3.43Å; N100-L103 PolarHBondContact O-N 3.03Å; L101-L103 VanDerWaalsContact C-N 3.3Å; L101-L103 PolarHBondContact O-N 3.29Å; L103-C106 WeakPolarHBondContact O-CB 3.03Å; L103-C106 PolarHBondContact O-N 3.03Å; L103-I107 HydrophobicContact CD1-CD1 4.48Å; L103-I107 HydrophobicContact CG-CD1 4.15Å; L103-I107 VanDerWaalsContact O-CG1 3.31Å; L103-I107 WeakPolarHBondContact O-CG1 3.09Å; L103-I107 PolarHBondContact O-N 3.49Å; L103-L127 HydrophobicContact CD1-CD2 4.32Å
104	L	82	Confident	80.9	Confident	107 Å²	107	69.3 Å²	69.3	56%	0.56	36%	0.363	S	S	*	.	H	α-helix	trans	-60.9	-49.4	174.8	-178.9	64	0	0	0	110.7	N100 L101 C106 I107 S108	N100-L104 WeakPolarHBondContact O-CB 3.26Å; N100-L104 PolarHBondContact O-N 3.2Å; L101-L104 PolarHBondContact O-N 3.07Å; L104-C106 VanDerWaalsContact C-N 3.32Å; L104-C106 PolarHBondContact O-N 3.16Å; L104-I107 PolarHBondContact O-N 2.96Å; L104-I107 VanDerWaalsContact O-N 3.14Å; L104-S108 PolarHBondContact O-N 3.02Å; L104-S108 PolarHBondContact O-OG 3.46Å; L104-S108 VanDerWaalsContact O-OG 3.06Å
105	L	86	Confident	80.7	Confident	78 Å²	78	67.6 Å²	67.6	41%	0.408	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-41.5	178.1	-177	60.5	0	0	0	112.1	E87 L101 S108 L109	E87-L105 HydrophobicContact CG-CD2 3.68Å; E87-L105 HydrophobicContact CG-CG 3.99Å; L101-L105 PolarHBondContact O-N 3.2Å; L105-S108 PolarHBondContact O-N 3.17Å; L105-L109 HydrophobicContact CD1-CD1 4.18Å; L105-L109 HydrophobicContact CD1-CG 4.19Å; L105-L109 HydrophobicContact CG-CD1 3.94Å; L105-L109 HydrophobicContact CG-CG 4.39Å; L105-L109 WeakPolarHBondContact O-CB 3.39Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.3Å; L105-L109 PolarHBondContact O-N 3.48Å
106	C	83.5	Confident	81.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-57.8	-49.4	173.2	175.3	0	0	0	0	111.7	S84 E87 H102 L103 L104 S108 L109 S110	S84-C106 PolarHBondContact O-SG 3.43Å; S84-C106 PolarHBondContact OG-O 3.2Å; S84-C106 PolarHBondContact OG-SG 3.33Å; E87-C106 HydrophobicContact CB-CB 4.12Å; H102-C106 VanDerWaalsContact O-CB 3.27Å; H102-C106 WeakPolarHBondContact O-CB 3.2Å; H102-C106 PolarHBondContact O-N 3.24Å; L103-C106 WeakPolarHBondContact O-CB 3.03Å; L103-C106 PolarHBondContact O-N 3.03Å; L104-C106 VanDerWaalsContact C-N 3.32Å; L104-C106 PolarHBondContact O-N 3.16Å; C106-S108 VanDerWaalsContact C-N 3.34Å; C106-S108 PolarHBondContact O-N 2.91Å; C106-L109 PolarHBondContact O-N 3.48Å; C106-S110 WeakPolarHBondContact O-CB 3.12Å; C106-S110 PolarHBondContact O-N 2.89Å; C106-S110 PolarHBondContact O-OG 3.38Å; C106-S110 VanDerWaalsContact O-OG 3.09Å
107	I	81.4	Confident	81.7	Confident	68 Å²	68	60.4 Å²	60.4	35%	0.349	32%	0.322	S	S	.	.	H	α-helix	trans	-61.8	-43.5	178.5	-67	165.2	0	0	0	110.7	L103 L104 S110 F111	L103-I107 HydrophobicContact CD1-CD1 4.48Å; L103-I107 HydrophobicContact CG-CD1 4.15Å; L103-I107 VanDerWaalsContact O-CG1 3.31Å; L103-I107 WeakPolarHBondContact O-CG1 3.09Å; L103-I107 PolarHBondContact O-N 3.49Å; L104-I107 PolarHBondContact O-N 2.96Å; L104-I107 VanDerWaalsContact O-N 3.14Å; I107-S110 PolarHBondContact O-N 2.94Å; I107-F111 PolarHBondContact O-N 3.5Å
108	S	82.9	Confident	81.6	Confident	49 Å²	49	58.8 Å²	58.8	34%	0.343	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-43.9	177.1	-58.3	0	0	0	0	112.5	L104 L105 C106 F111 M112	L104-S108 PolarHBondContact O-N 3.02Å; L104-S108 PolarHBondContact O-OG 3.46Å; L104-S108 VanDerWaalsContact O-OG 3.06Å; L105-S108 PolarHBondContact O-N 3.17Å; C106-S108 VanDerWaalsContact C-N 3.34Å; C106-S108 PolarHBondContact O-N 2.91Å; S108-F111 WeakPolarHBondContact O-CB 3.42Å; S108-F111 PolarHBondContact O-N 3.31Å; S108-M112 WeakPolarHBondContact O-CG 3.33Å; S108-M112 PolarHBondContact O-N 3.47Å
109	L	87	Confident	81.2	Confident	25 Å²	25	51.6 Å²	51.6	13%	0.131	28%	0.278	C	S	.	.	H	α-helix	trans	-67.8	-39.2	177.5	-71	169.8	0	0	0	111.9	L80 C83 E87 L105 C106 F111 M112 A113	L80-L109 HydrophobicContact CD2-CD2 3.73Å; C83-L109 HydrophobicContact CB-CD1 3.84Å; E87-L109 HydrophobicContact CG-CD1 4.03Å; L105-L109 HydrophobicContact CD1-CD1 4.18Å; L105-L109 HydrophobicContact CD1-CG 4.19Å; L105-L109 HydrophobicContact CG-CD1 3.94Å; L105-L109 HydrophobicContact CG-CG 4.39Å; L105-L109 WeakPolarHBondContact O-CB 3.39Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.3Å; L105-L109 PolarHBondContact O-N 3.48Å; C106-L109 PolarHBondContact O-N 3.48Å; L109-F111 VanDerWaalsContact C-N 3.29Å; L109-F111 PolarHBondContact O-N 2.97Å; L109-M112 PolarHBondContact O-N 3.49Å; L109-A113 WeakPolarHBondContact O-CB 3.49Å; L109-A113 PolarHBondContact O-N 3.3Å
110	S	81.4	Confident	80.4	Confident	2 Å²	2	48 Å²	48	1%	0.014	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-40	172.9	-68.7	0	0	0	0	111.7	S84 C106 I107 A113 L114	S84-S110 PolarHBondContact OG-OG 3.04Å; C106-S110 WeakPolarHBondContact O-CB 3.12Å; C106-S110 PolarHBondContact O-N 2.89Å; C106-S110 PolarHBondContact O-OG 3.38Å; C106-S110 VanDerWaalsContact O-OG 3.09Å; I107-S110 PolarHBondContact O-N 2.94Å; S110-A113 PolarHBondContact O-N 3.16Å; S110-L114 WeakPolarHBondContact O-CB 3.44Å; S110-L114 PolarHBondContact O-N 3.26Å
111	F	79	Confident	79.8	Confident	81 Å²	81	44.9 Å²	44.9	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-62.9	-46.8	174.9	-177.9	-84.1	0	0	0	111.4	I107 S108 L109 A113 L114 A115 I143	I107-F111 PolarHBondContact O-N 3.5Å; S108-F111 WeakPolarHBondContact O-CB 3.42Å; S108-F111 PolarHBondContact O-N 3.31Å; L109-F111 VanDerWaalsContact C-N 3.29Å; L109-F111 PolarHBondContact O-N 2.97Å; F111-A113 VanDerWaalsContact C-N 3.32Å; F111-A113 PolarHBondContact O-N 3.32Å; F111-L114 PolarHBondContact O-N 3.42Å; F111-A115 WeakPolarHBondContact O-CB 3.47Å; F111-A115 PolarHBondContact O-N 2.92Å; F111-I143 HydrophobicContact CD2-CD1 3.61Å; F111-I143 HydrophobicContact CD2-CG1 3.37Å; F111-I143 HydrophobicContact CE2-CB 4.45Å; F111-I143 HydrophobicContact CE2-CD1 4.15Å; F111-I143 HydrophobicContact CE2-CG1 3.36Å
112	M	82.9	Confident	79	Confident	107 Å²	107	40.8 Å²	40.8	53%	0.527	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-37	176.7	-66.3	-179.5	-176.9	0	0	112	L80 S108 L109 A115 A116	L80-M112 HydrophobicContact CD1-CB 3.68Å; L80-M112 HydrophobicContact CD2-CB 4.36Å; S108-M112 WeakPolarHBondContact O-CG 3.33Å; S108-M112 PolarHBondContact O-N 3.47Å; L109-M112 PolarHBondContact O-N 3.49Å; M112-A115 PolarHBondContact O-N 3.17Å; M112-A116 PolarHBondContact O-N 3.44Å
113	A	85.8	Confident	78.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-45.4	175.5	0	0	0	0	0	110.9	S77 L80 L109 S110 F111 A115 A116 K117	S77-A113 PolarHBondContact OG-O 2.95Å; L80-A113 HydrophobicContact CB-CB 3.66Å; L109-A113 WeakPolarHBondContact O-CB 3.49Å; L109-A113 PolarHBondContact O-N 3.3Å; S110-A113 PolarHBondContact O-N 3.16Å; F111-A113 VanDerWaalsContact C-N 3.32Å; F111-A113 PolarHBondContact O-N 3.32Å; A113-A115 VanDerWaalsContact C-N 3.35Å; A113-A116 WeakPolarHBondContact O-CB 3.43Å; A113-A116 PolarHBondContact O-N 3.32Å; A113-A116 VanDerWaalsContact O-N 3.16Å; A113-K117 PolarHBondContact O-N 3.34Å; A113-K117 VanDerWaalsContact O-O 3.06Å
114	L	81.4	Confident	77	Confident	29 Å²	29	39.3 Å²	39.3	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-38.1	176.9	-179.3	49.8	0	0	0	112.4	S110 F111 A116 K117 V121 I143	S110-L114 WeakPolarHBondContact O-CB 3.44Å; S110-L114 PolarHBondContact O-N 3.26Å; F111-L114 PolarHBondContact O-N 3.42Å; L114-A116 VanDerWaalsContact C-N 3.27Å; L114-A116 PolarHBondContact O-N 2.98Å; L114-K117 VanDerWaalsContact CA-O 3.29Å; L114-K117 WeakPolarHBondContact CA-O 3.44Å; L114-K117 CarbonylContact O-C 3.38Å; L114-K117 PolarHBondContact O-N 2.93Å; L114-V121 HydrophobicContact CD1-CB 4.1Å; L114-V121 HydrophobicContact CD2-CB 4.09Å; L114-V121 HydrophobicContact CD2-CG2 4.13Å; L114-I143 HydrophobicContact CD2-CB 4.18Å; L114-I143 HydrophobicContact CD2-CD1 3.9Å; L114-I143 HydrophobicContact CD2-CG1 4.48Å; L114-I143 HydrophobicContact CD2-CG2 3.39Å; L114-I143 HydrophobicContact CG-CG2 3.8Å
115	A	75.4	Confident	75.6	Confident	77 Å²	77	39.8 Å²	39.8	64%	0.636	22%	0.222	S	C	*	.	H	α-helix	trans	-63.8	-33.4	173.3	0	0	0	0	0	112.3	F111 M112 A113	F111-A115 WeakPolarHBondContact O-CB 3.47Å; F111-A115 PolarHBondContact O-N 2.92Å; M112-A115 PolarHBondContact O-N 3.17Å; A113-A115 VanDerWaalsContact C-N 3.35Å
116	A	78.8	Confident	74	Confident	30 Å²	30	38.3 Å²	38.3	25%	0.248	21%	0.211	C	C	.	.	H	α-helix	trans	-73.6	-46	172.9	0	0	0	0	0	112	I76 M112 A113 L114	I76-A116 HydrophobicContact CB-CB 4.43Å; I76-A116 HydrophobicContact CG2-CB 3.96Å; M112-A116 PolarHBondContact O-N 3.44Å; A113-A116 WeakPolarHBondContact O-CB 3.43Å; A113-A116 PolarHBondContact O-N 3.32Å; A113-A116 VanDerWaalsContact O-N 3.16Å; L114-A116 VanDerWaalsContact C-N 3.27Å; L114-A116 PolarHBondContact O-N 2.98Å
117	K	79.6	Confident	72.3	Confident	41 Å²	41	38.9 Å²	38.9	18%	0.178	21%	0.214	C	C	.	.			trans	-157.1	148.2	178	-148.9	71.1	-171	-158.2	0	113.2	A73 E74 A113 L114 Q119 G120	A73-K117 HydrophobicContact CB-CD 4.2Å; E74-K117 VanDerWaalsContact OE1-CE 3.23Å; E74-K117 WeakPolarHBondContact OE1-CE 3.24Å; E74-K117 IonicContact OE1-NZ 3.98Å; E74-K117 PolarHBondContact OE1-NZ 3.32Å; A113-K117 PolarHBondContact O-N 3.34Å; A113-K117 VanDerWaalsContact O-O 3.06Å; L114-K117 VanDerWaalsContact CA-O 3.29Å; L114-K117 WeakPolarHBondContact CA-O 3.44Å; L114-K117 CarbonylContact O-C 3.38Å; L114-K117 PolarHBondContact O-N 2.93Å; K117-Q119 PolarHBondContact O-N 3.01Å; K117-G120 PolarHBondContact O-N 3.39Å
118	E	73.1	Confident	70.6	Confident	52 Å²	52	38.2 Å²	38.2	24%	0.243	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-55	-27.6	-179.9	62.3	-79.9	-179.8	0	0	114.4	G120 V121 P260	E118-G120 PolarHBondContact O-N 2.99Å; E118-V121 VanDerWaalsContact O-CG1 3.29Å; E118-V121 WeakPolarHBondContact O-CG1 3.42Å; E118-V121 PolarHBondContact O-N 3.37Å; E118-P260 HydrophobicContact CB-CB 4.23Å; E118-P260 HydrophobicContact CG-CB 3.81Å
119	Q	74.5	Confident	69	Low	4 Å²	4	40.4 Å²	40.4	2%	0.019	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-66	-22.1	177	-58.6	-173.7	-22.3	0	0	113.1	K117 V121 T122 P257 V276 L279	K117-Q119 PolarHBondContact O-N 3.01Å; Q119-V121 PolarHBondContact O-N 3.34Å; Q119-V121 VanDerWaalsContact O-N 3.16Å; Q119-T122 WeakPolarHBondContact O-CB 3.4Å; Q119-T122 WeakPolarHBondContact O-CG2 3.31Å; Q119-T122 PolarHBondContact O-N 3.3Å; Q119-T122 VanDerWaalsContact O-N 3.13Å; Q119-T122 PolarHBondContact O-OG1 3.47Å; Q119-P257 VanDerWaalsContact CG-O 3.26Å; Q119-P257 WeakPolarHBondContact CG-O 3.45Å; Q119-P257 PolarHBondContact NE2-O 2.95Å; Q119-V276 PolarHBondContact NE2-O 3.12Å; Q119-L279 HydrophobicContact CB-CD2 4.14Å
120	G	62.7	Low	67.2	Low	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-60.1	-23.7	178.4	0	0	0	0	0	114.2	K117 E118 T122	K117-G120 PolarHBondContact O-N 3.39Å; E118-G120 PolarHBondContact O-N 2.99Å; G120-T122 PolarHBondContact O-N 2.98Å; G120-T122 VanDerWaalsContact O-N 3.09Å
121	V	67.6	Low	65.8	Low	33 Å²	33	55.6 Å²	55.6	20%	0.2	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-59.7	-23	176.1	76.3	0	0	0	0	112.7	L114 E118 Q119 V123 I124 F140 P260	L114-V121 HydrophobicContact CD1-CB 4.1Å; L114-V121 HydrophobicContact CD2-CB 4.09Å; L114-V121 HydrophobicContact CD2-CG2 4.13Å; E118-V121 VanDerWaalsContact O-CG1 3.29Å; E118-V121 WeakPolarHBondContact O-CG1 3.42Å; E118-V121 PolarHBondContact O-N 3.37Å; Q119-V121 PolarHBondContact O-N 3.34Å; Q119-V121 VanDerWaalsContact O-N 3.16Å; V121-V123 VanDerWaalsContact C-N 3.27Å; V121-V123 PolarHBondContact O-N 3.05Å; V121-I124 VanDerWaalsContact O-CB 3.27Å; V121-I124 WeakPolarHBondContact O-CB 3.37Å; V121-I124 PolarHBondContact O-N 3.17Å; V121-I124 VanDerWaalsContact O-N 3.15Å; V121-F140 HydrophobicContact CG2-CD2 3.85Å; V121-F140 HydrophobicContact CG2-CE2 4.02Å; V121-P260 HydrophobicContact CG1-CG 4.27Å
122	T	69.1	Low	64.6	Low	10 Å²	10	56.6 Å²	56.6	6%	0.061	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-73.5	-15.7	-168.2	60.3	0	0	0	0	114.3	Y81 Q119 G120 I124 N125 I256 P260	Y81-T122 WeakPolarHBondContact CE2-OG1 3.46Å; Q119-T122 WeakPolarHBondContact O-CB 3.4Å; Q119-T122 WeakPolarHBondContact O-CG2 3.31Å; Q119-T122 PolarHBondContact O-N 3.3Å; Q119-T122 VanDerWaalsContact O-N 3.13Å; Q119-T122 PolarHBondContact O-OG1 3.47Å; G120-T122 PolarHBondContact O-N 2.98Å; G120-T122 VanDerWaalsContact O-N 3.09Å; T122-I124 PolarHBondContact O-N 3.26Å; T122-N125 PolarHBondContact O-N 3.31Å; T122-I256 HydrophobicContact CG2-CG2 3.75Å; T122-I256 VanDerWaalsContact CG2-O 3.32Å; T122-I256 WeakPolarHBondContact CG2-O 3.39Å; T122-P260 HydrophobicContact CG2-CG 4.07Å
123	V	64.3	Low	63.3	Low	3 Å²	3	57.7 Å²	57.7	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-57.2	-40.4	170.5	-172	0	0	0	0	110.3	Y81 S84 V121 N125 R126 L127	Y81-V123 HydrophobicContact CD2-CB 4.3Å; Y81-V123 HydrophobicContact CD2-CG2 3.12Å; Y81-V123 HydrophobicContact CE2-CB 4.34Å; Y81-V123 HydrophobicContact CE2-CG2 3.57Å; Y81-V123 HydrophobicContact CG-CG2 3.75Å; S84-V123 WeakPolarHBondContact OG-CG1 3.45Å; V121-V123 VanDerWaalsContact C-N 3.27Å; V121-V123 PolarHBondContact O-N 3.05Å; V123-N125 PolarHBondContact O-N 3.02Å; V123-N125 VanDerWaalsContact O-N 3.16Å; V123-R126 PolarHBondContact O-N 3.46Å; V123-L127 HydrophobicContact CG1-CD1 4.19Å
124	I	57.7	Low	62.1	Low	29 Å²	29	60 Å²	60	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-22.3	-175.6	-61.1	177.9	0	0	0	112.2	V121 T122 L127 L136	V121-I124 VanDerWaalsContact O-CB 3.27Å; V121-I124 WeakPolarHBondContact O-CB 3.37Å; V121-I124 PolarHBondContact O-N 3.17Å; V121-I124 VanDerWaalsContact O-N 3.15Å; T122-I124 PolarHBondContact O-N 3.26Å; I124-L127 WeakPolarHBondContact O-CB 3.17Å; I124-L127 VanDerWaalsContact O-O 3.12Å; I124-L136 HydrophobicContact CD1-CD2 4.39Å; I124-L136 HydrophobicContact CG1-CD2 4.4Å; I124-L136 HydrophobicContact CG2-CB 3.9Å; I124-L136 HydrophobicContact CG2-CD1 3.26Å; I124-L136 HydrophobicContact CG2-CD2 3.56Å; I124-L136 HydrophobicContact CG2-CG 3.75Å
125	N	54.1	Low	61.1	Low	117 Å²	117	63.4 Å²	63.4	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-85.4	-21.5	-179.3	-152	11.9	0	0	0	113.5	T122 V123 L127 I256	T122-N125 PolarHBondContact O-N 3.31Å; V123-N125 PolarHBondContact O-N 3.02Å; V123-N125 VanDerWaalsContact O-N 3.16Å; N125-L127 VanDerWaalsContact C-N 3.27Å; N125-I256 HydrophobicContact CB-CG2 4.4Å
126	R	52	Low	60.1	Low	48 Å²	48	60.8 Å²	60.8	18%	0.181	32%	0.324	C	S	.	.	H	α-helix	trans	-79	-18.6	170.6	-105.3	-176.8	-174.8	-179.2	4.7	112.6	M35 V123 L249 S252	M35-R126 PolarHBondContact SD-NH1 3.1Å; V123-R126 PolarHBondContact O-N 3.46Å; R126-L249 PolarHBondContact NH2-O 2.85Å; R126-S252 PolarHBondContact NH2-OG 3.12Å
127	L	48	Very low	59.5	Low	11 Å²	11	64.2 Å²	64.2	6%	0.058	34%	0.338	C	S	.	.	S	Bend	trans	-76.9	114.8	170.2	-76.9	152.4	0	0	0	106.8	Y88 L103 V123 I124 N125	Y88-L127 HydrophobicContact CD2-CD2 3.16Å; Y88-L127 HydrophobicContact CD2-CG 4.11Å; Y88-L127 HydrophobicContact CE2-CD2 3.42Å; Y88-L127 VanDerWaalsContact CE2-CD2 3.42Å; Y88-L127 HydrophobicContact CE2-CG 4.28Å; Y88-L127 HydrophobicContact CG-CD2 3.78Å; Y88-L127 HydrophobicContact CG-CG 4.33Å; L103-L127 HydrophobicContact CD1-CD2 4.32Å; V123-L127 HydrophobicContact CG1-CD1 4.19Å; I124-L127 WeakPolarHBondContact O-CB 3.17Å; I124-L127 VanDerWaalsContact O-O 3.12Å; N125-L127 VanDerWaalsContact C-N 3.27Å
128	L	46.2	Very low	59	Low	55 Å²	55	66.2 Å²	66.2	29%	0.288	35%	0.353	S	S	.	.			trans	112.8	136.7	132.4	-50	141.7	0	0	0	120.4	R132 L136	L128-R132 HydrophobicContact CB-CB 4.2Å; L128-R132 HydrophobicContact CD1-CB 4.04Å; L128-R132 HydrophobicContact CD2-CB 3.54Å; L128-R132 HydrophobicContact CD2-CG 3.94Å; L128-R132 HydrophobicContact CG-CB 4.12Å; L128-L136 HydrophobicContact CD1-CD1 3.06Å; L128-L136 HydrophobicContact CD1-CG 4.1Å
129	S	48.8	Very low	58.6	Low	95 Å²	95	65 Å²	65	66%	0.664	35%	0.352	S	S	*	.			trans	-60.5	144.1	152.6	172.4	0	0	0	0	111.2	K131 R132	S129-K131 PolarHBondContact O-N 3.39Å; S129-R132 PolarHBondContact O-N 3.36Å
130	I	49.6	Very low	58.4	Low	148 Å²	148	68.6 Å²	68.6	76%	0.759	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-35.1	-37.7	-176.3	-68.4	159.9	0	0	0	115.3	R132 M133	I130-R132 PolarHBondContact O-N 3.41Å; I130-R132 VanDerWaalsContact O-N 3.1Å; I130-M133 PolarHBondContact O-N 3.06Å
131	K	51.6	Low	59	Low	198 Å²	198	72.5 Å²	72.5	86%	0.861	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-65	-15.1	-173.7	-70	-170.1	177.2	-174.5	0	115.6	S129	S129-K131 PolarHBondContact O-N 3.39Å
132	R	53.6	Low	59.4	Low	101 Å²	101	75.8 Å²	75.8	38%	0.381	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-111.7	7.4	-176	-67.2	174.6	175.7	-171.2	-7	114.2	L128 S129 I130 G134 T135	L128-R132 HydrophobicContact CB-CB 4.2Å; L128-R132 HydrophobicContact CD1-CB 4.04Å; L128-R132 HydrophobicContact CD2-CB 3.54Å; L128-R132 HydrophobicContact CD2-CG 3.94Å; L128-R132 HydrophobicContact CG-CB 4.12Å; S129-R132 PolarHBondContact O-N 3.36Å; I130-R132 PolarHBondContact O-N 3.41Å; I130-R132 VanDerWaalsContact O-N 3.1Å; R132-G134 VanDerWaalsContact C-N 3.29Å; R132-G134 PolarHBondContact O-N 3.09Å; R132-T135 PolarHBondContact O-OG1 3.16Å; R132-T135 VanDerWaalsContact O-OG1 3.1Å
133	M	54.7	Low	59.4	Low	131 Å²	131	76.1 Å²	76.1	65%	0.645	40%	0.404	S	S	*	.	H	α-helix	trans	-62.2	-33.9	173.4	-87.8	179	74.8	0	0	112.6	I130 L136 L137	I130-M133 PolarHBondContact O-N 3.06Å; M133-L136 PolarHBondContact O-N 3.03Å; M133-L137 WeakPolarHBondContact O-CB 3.28Å; M133-L137 PolarHBondContact O-N 3.34Å
134	G	61.5	Low	59.7	Low	47 Å²	47	78.2 Å²	78.2	49%	0.485	42%	0.417	S	S	.	.	H	α-helix	trans	-60.8	-48.8	-176.5	0	0	0	0	0	113.6	R132 L136 L137 V138	R132-G134 VanDerWaalsContact C-N 3.29Å; R132-G134 PolarHBondContact O-N 3.09Å; G134-L136 VanDerWaalsContact C-N 3.27Å; G134-L136 PolarHBondContact O-N 2.94Å; G134-L137 PolarHBondContact O-N 3.03Å; G134-V138 WeakPolarHBondContact O-CG2 3.33Å; G134-V138 PolarHBondContact O-N 3.24Å
135	T	59.5	Low	60.8	Low	102 Å²	102	81.5 Å²	81.5	63%	0.626	43%	0.433	S	S	*	.	H	α-helix	trans	-62.9	-34.2	179	46.5	0	0	0	0	112.7	R132 A139	R132-T135 PolarHBondContact O-OG1 3.16Å; R132-T135 VanDerWaalsContact O-OG1 3.1Å; T135-A139 WeakPolarHBondContact O-CB 3.46Å; T135-A139 PolarHBondContact O-N 2.98Å
136	L	55.7	Low	61.9	Low	21 Å²	21	81 Å²	81	11%	0.11	43%	0.426	C	S	.	.	H	α-helix	trans	-79	-35.1	178.9	-68.7	171.6	0	0	0	113	I124 L128 M133 G134 V138 A139 F140	I124-L136 HydrophobicContact CD1-CD2 4.39Å; I124-L136 HydrophobicContact CG1-CD2 4.4Å; I124-L136 HydrophobicContact CG2-CB 3.9Å; I124-L136 HydrophobicContact CG2-CD1 3.26Å; I124-L136 HydrophobicContact CG2-CD2 3.56Å; I124-L136 HydrophobicContact CG2-CG 3.75Å; L128-L136 HydrophobicContact CD1-CD1 3.06Å; L128-L136 HydrophobicContact CD1-CG 4.1Å; M133-L136 PolarHBondContact O-N 3.03Å; G134-L136 VanDerWaalsContact C-N 3.27Å; G134-L136 PolarHBondContact O-N 2.94Å; L136-V138 VanDerWaalsContact C-N 3.29Å; L136-A139 PolarHBondContact O-N 3.45Å; L136-F140 WeakPolarHBondContact O-CB 3.11Å; L136-F140 PolarHBondContact O-N 3.12Å
137	L	66.5	Low	62.9	Low	103 Å²	103	84.3 Å²	84.3	54%	0.539	44%	0.438	S	S	.	.	H	α-helix	trans	-60.2	-45.8	171.5	-171.8	84.6	0	0	0	109.5	M133 G134 F140 I141	M133-L137 WeakPolarHBondContact O-CB 3.28Å; M133-L137 PolarHBondContact O-N 3.34Å; G134-L137 PolarHBondContact O-N 3.03Å; L137-F140 PolarHBondContact O-N 3.16Å; L137-I141 HydrophobicContact CD2-CD1 4.28Å; L137-I141 HydrophobicContact CG-CD1 3.98Å; L137-I141 WeakPolarHBondContact O-CB 3.38Å; L137-I141 WeakPolarHBondContact O-CG1 3.48Å; L137-I141 PolarHBondContact O-N 3.31Å
138	V	68.4	Low	64.3	Low	82 Å²	82	86.2 Å²	86.2	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-60.6	-48.1	175.1	173.7	0	0	0	0	110.8	G134 L136 F140 I141 I142	G134-V138 WeakPolarHBondContact O-CG2 3.33Å; G134-V138 PolarHBondContact O-N 3.24Å; L136-V138 VanDerWaalsContact C-N 3.29Å; V138-F140 PolarHBondContact O-N 3.4Å; V138-I141 PolarHBondContact O-N 2.82Å; V138-I142 HydrophobicContact CG1-CD1 3.8Å; V138-I142 HydrophobicContact CG1-CG1 4.48Å; V138-I142 VanDerWaalsContact O-CG1 3.26Å; V138-I142 WeakPolarHBondContact O-CG1 3.36Å; V138-I142 PolarHBondContact O-N 3.22Å
139	A	65.1	Low	65.9	Low	27 Å²	27	89.1 Å²	89.1	22%	0.223	46%	0.46	C	S	.	.	H	α-helix	trans	-60	-44.2	176.1	0	0	0	0	0	112.3	T135 L136 I142 I143	T135-A139 WeakPolarHBondContact O-CB 3.46Å; T135-A139 PolarHBondContact O-N 2.98Å; L136-A139 PolarHBondContact O-N 3.45Å; A139-I142 PolarHBondContact O-N 3.39Å; A139-I143 WeakPolarHBondContact O-CB 3.38Å; A139-I143 VanDerWaalsContact O-CD1 3.23Å; A139-I143 WeakPolarHBondContact O-CD1 3.23Å; A139-I143 WeakPolarHBondContact O-CG1 3.33Å; A139-I143 PolarHBondContact O-N 3.32Å
140	F	69	Low	67.3	Low	80 Å²	80	90.5 Å²	90.5	35%	0.351	46%	0.459	S	S	.	.	H	α-helix	trans	-61	-44.6	176.9	176.2	-99.2	0	0	0	111.9	V121 L136 L137 V138 I143 T144	V121-F140 HydrophobicContact CG2-CD2 3.85Å; V121-F140 HydrophobicContact CG2-CE2 4.02Å; L136-F140 WeakPolarHBondContact O-CB 3.11Å; L136-F140 PolarHBondContact O-N 3.12Å; L137-F140 PolarHBondContact O-N 3.16Å; V138-F140 PolarHBondContact O-N 3.4Å; F140-I143 PolarHBondContact O-N 3.06Å; F140-T144 HydrophobicContact CD1-CG2 4.29Å; F140-T144 HydrophobicContact CD2-CG2 4.36Å; F140-T144 HydrophobicContact CE1-CG2 3.84Å; F140-T144 HydrophobicContact CE2-CG2 3.91Å; F140-T144 HydrophobicContact CZ-CG2 3.63Å; F140-T144 WeakPolarHBondContact O-CG2 3.42Å; F140-T144 PolarHBondContact O-N 2.87Å; F140-T144 PolarHBondContact O-OG1 3.04Å; F140-T144 VanDerWaalsContact O-OG1 3.14Å
141	I	75.3	Confident	68.4	Low	82 Å²	82	86.8 Å²	86.8	42%	0.421	44%	0.439	S	S	.	.	H	α-helix	trans	-61.6	-47.4	175.6	-69.1	164.8	0	0	0	110.4	L137 V138 I143 T144 M145	L137-I141 HydrophobicContact CD2-CD1 4.28Å; L137-I141 HydrophobicContact CG-CD1 3.98Å; L137-I141 WeakPolarHBondContact O-CB 3.38Å; L137-I141 WeakPolarHBondContact O-CG1 3.48Å; L137-I141 PolarHBondContact O-N 3.31Å; V138-I141 PolarHBondContact O-N 2.82Å; I141-I143 PolarHBondContact O-N 3.49Å; I141-T144 WeakPolarHBondContact CA-OG1 3.46Å; I141-T144 PolarHBondContact O-N 2.94Å; I141-T144 PolarHBondContact O-OG1 3.14Å; I141-M145 HydrophobicContact CG2-CG 4.28Å; I141-M145 WeakPolarHBondContact O-CB 3.26Å; I141-M145 WeakPolarHBondContact O-CG 3.47Å; I141-M145 PolarHBondContact O-N 2.05Å
142	I	77.5	Confident	69.9	Low	102 Å²	102	80.9 Å²	80.9	52%	0.523	43%	0.427	S	S	.	.	H	α-helix	trans	-57.7	-41.9	176.6	-68.4	166.7	0	0	0	110.4	V138 A139 F146	V138-I142 HydrophobicContact CG1-CD1 3.8Å; V138-I142 HydrophobicContact CG1-CG1 4.48Å; V138-I142 VanDerWaalsContact O-CG1 3.26Å; V138-I142 WeakPolarHBondContact O-CG1 3.36Å; V138-I142 PolarHBondContact O-N 3.22Å; A139-I142 PolarHBondContact O-N 3.39Å; I142-F146 WeakPolarHBondContact O-CB 3.42Å; I142-F146 PolarHBondContact O-N 3.33Å
143	I	69.1	Low	71.2	Confident	17 Å²	17	83 Å²	83	9%	0.087	44%	0.435	C	S	.	.	H	α-helix	trans	-67.5	-46.5	179.7	-65.3	157.1	0	0	0	111.9	F111 L114 A139 F140 I141 M145 F146 R147	F111-I143 HydrophobicContact CD2-CD1 3.61Å; F111-I143 HydrophobicContact CD2-CG1 3.37Å; F111-I143 HydrophobicContact CE2-CB 4.45Å; F111-I143 HydrophobicContact CE2-CD1 4.15Å; F111-I143 HydrophobicContact CE2-CG1 3.36Å; L114-I143 HydrophobicContact CD2-CB 4.18Å; L114-I143 HydrophobicContact CD2-CD1 3.9Å; L114-I143 HydrophobicContact CD2-CG1 4.48Å; L114-I143 HydrophobicContact CD2-CG2 3.39Å; L114-I143 HydrophobicContact CG-CG2 3.8Å; A139-I143 WeakPolarHBondContact O-CB 3.38Å; A139-I143 VanDerWaalsContact O-CD1 3.23Å; A139-I143 WeakPolarHBondContact O-CD1 3.23Å; A139-I143 WeakPolarHBondContact O-CG1 3.33Å; A139-I143 PolarHBondContact O-N 3.32Å; F140-I143 PolarHBondContact O-N 3.06Å; I141-I143 PolarHBondContact O-N 3.49Å; I143-M145 VanDerWaalsContact C-N 3.3Å; I143-M145 PolarHBondContact O-N 3.05Å; I143-F146 PolarHBondContact O-N 3.29Å; I143-R147 WeakPolarHBondContact O-CB 3.44Å; I143-R147 PolarHBondContact O-N 3.1Å
144	T	70.8	Confident	72.2	Confident	47 Å²	47	80.9 Å²	80.9	29%	0.288	43%	0.43	S	S	.	.	H	α-helix	trans	-64.6	-38.5	179.1	52.4	0	0	0	0	110.9	F140 I141 R147 L148	F140-T144 HydrophobicContact CD1-CG2 4.29Å; F140-T144 HydrophobicContact CD2-CG2 4.36Å; F140-T144 HydrophobicContact CE1-CG2 3.84Å; F140-T144 HydrophobicContact CE2-CG2 3.91Å; F140-T144 HydrophobicContact CZ-CG2 3.63Å; F140-T144 WeakPolarHBondContact O-CG2 3.42Å; F140-T144 PolarHBondContact O-N 2.87Å; F140-T144 PolarHBondContact O-OG1 3.04Å; F140-T144 VanDerWaalsContact O-OG1 3.14Å; I141-T144 WeakPolarHBondContact CA-OG1 3.46Å; I141-T144 PolarHBondContact O-N 2.94Å; I141-T144 PolarHBondContact O-OG1 3.14Å; T144-R147 PolarHBondContact O-N 3.03Å; T144-L148 WeakPolarHBondContact O-CB 3.33Å; T144-L148 WeakPolarHBondContact O-CG 3.41Å; T144-L148 PolarHBondContact O-N 3.12Å
145	M	80.2	Confident	72.6	Confident	98 Å²	98	85.6 Å²	85.6	48%	0.483	44%	0.444	S	S	.	.	H	α-helix	trans	-62.8	-46.7	172.6	-65.8	-130	98.6	0	0	112.1	I141 I143 R147 L148 H149 W153	I141-M145 HydrophobicContact CG2-CG 4.28Å; I141-M145 WeakPolarHBondContact O-CB 3.26Å; I141-M145 WeakPolarHBondContact O-CG 3.47Å; I141-M145 PolarHBondContact O-N 2.05Å; I143-M145 VanDerWaalsContact C-N 3.3Å; I143-M145 PolarHBondContact O-N 3.05Å; M145-R147 PolarHBondContact O-N 3.4Å; M145-L148 PolarHBondContact O-N 2.99Å; M145-H149 WeakPolarHBondContact O-CB 3.48Å; M145-H149 PolarHBondContact O-N 2.73Å; M145-W153 HydrophobicContact CE-CH2 3.53Å; M145-W153 HydrophobicContact CE-CZ3 3.67Å; M145-W153 HydrophobicContact SD-CH2 4.49Å
146	F	77.8	Confident	73.2	Confident	107 Å²	107	83.6 Å²	83.6	47%	0.469	43%	0.432	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.8	179.4	-110	0	0	0	112.2	I142 I143 H149 L150	I142-F146 WeakPolarHBondContact O-CB 3.42Å; I142-F146 PolarHBondContact O-N 3.33Å; I143-F146 PolarHBondContact O-N 3.29Å; F146-H149 WeakPolarHBondContact O-CB 3.17Å; F146-H149 PolarHBondContact O-N 3.2Å; F146-L150 HydrophobicContact CD1-CD1 4.06Å; F146-L150 HydrophobicContact CE1-CD1 3.52Å; F146-L150 HydrophobicContact CE1-CG 4.18Å; F146-L150 HydrophobicContact CE2-CG 4.42Å; F146-L150 HydrophobicContact CZ-CD1 3.82Å; F146-L150 HydrophobicContact CZ-CD2 4.25Å; F146-L150 HydrophobicContact CZ-CG 4.09Å; F146-L150 WeakPolarHBondContact O-CG 3.47Å; F146-L150 PolarHBondContact O-N 3.18Å
147	R	71.5	Confident	73.8	Confident	116 Å²	116	91.2 Å²	91.2	44%	0.438	47%	0.467	S	S	.	.	H	α-helix	trans	-63.5	-42.8	176	-172.8	-128.7	-174.6	-173.1	1.4	111.6	I143 T144 M145 H149 L150 M151	I143-R147 WeakPolarHBondContact O-CB 3.44Å; I143-R147 PolarHBondContact O-N 3.1Å; T144-R147 PolarHBondContact O-N 3.03Å; M145-R147 PolarHBondContact O-N 3.4Å; R147-H149 VanDerWaalsContact C-N 3.33Å; R147-L150 PolarHBondContact O-N 3.39Å; R147-M151 HydrophobicContact CG-CE 4.38Å; R147-M151 HydrophobicContact CG-SD 4.4Å; R147-M151 VanDerWaalsContact NE-CE 3.32Å; R147-M151 WeakPolarHBondContact O-CG 3.4Å; R147-M151 PolarHBondContact O-N 3.27Å
148	L	77.6	Confident	74	Confident	52 Å²	52	88.9 Å²	88.9	27%	0.272	45%	0.453	S	S	.	.	H	α-helix	trans	-63.7	-39.8	175	-74.6	170.1	0	0	0	111.3	T144 M145 M151 A152 W153	T144-L148 WeakPolarHBondContact O-CB 3.33Å; T144-L148 WeakPolarHBondContact O-CG 3.41Å; T144-L148 PolarHBondContact O-N 3.12Å; M145-L148 PolarHBondContact O-N 2.99Å; L148-M151 CarbonylContact O-C 3.45Å; L148-M151 WeakPolarHBondContact O-CA 3.32Å; L148-M151 PolarHBondContact O-N 3.05Å; L148-A152 PolarHBondContact O-N 3.47Å; L148-W153 HydrophobicContact CB-CD2 4.46Å; L148-W153 HydrophobicContact CB-CE3 3.78Å; L148-W153 HydrophobicContact CB-CZ3 3.9Å; L148-W153 HydrophobicContact CD1-CE3 4.47Å; L148-W153 HydrophobicContact CD1-CZ3 4.27Å; L148-W153 WeakPolarHBondContact O-CA 3.3Å; L148-W153 PolarHBondContact O-N 2.94Å
149	H	81.1	Confident	74	Confident	116 Å²	116	87.2 Å²	87.2	54%	0.537	45%	0.445	S	S	.	.	H	α-helix	trans	-60.3	-45.1	174.5	-176.8	68.2	0	0	0	112.2	M145 F146 R147 M151 A152 W153	M145-H149 WeakPolarHBondContact O-CB 3.48Å; M145-H149 PolarHBondContact O-N 2.73Å; F146-H149 WeakPolarHBondContact O-CB 3.17Å; F146-H149 PolarHBondContact O-N 3.2Å; R147-H149 VanDerWaalsContact C-N 3.33Å; H149-M151 PolarHBondContact O-N 3.34Å; H149-A152 PolarHBondContact O-N 3.43Å; H149-W153 HydrophobicContact CB-CZ2 4.2Å; H149-W153 AromaticContact ND1-NE1 3.59Å
150	L	77.2	Confident	73.9	Confident	124 Å²	124	92.5 Å²	92.5	65%	0.649	47%	0.469	S	S	*	.	H	α-helix	trans	-61.7	-28.6	173	-70.9	177	0	0	0	112.9	F146 R147 A152	F146-L150 HydrophobicContact CD1-CD1 4.06Å; F146-L150 HydrophobicContact CE1-CD1 3.52Å; F146-L150 HydrophobicContact CE1-CG 4.18Å; F146-L150 HydrophobicContact CE2-CG 4.42Å; F146-L150 HydrophobicContact CZ-CD1 3.82Å; F146-L150 HydrophobicContact CZ-CD2 4.25Å; F146-L150 HydrophobicContact CZ-CG 4.09Å; F146-L150 WeakPolarHBondContact O-CG 3.47Å; F146-L150 PolarHBondContact O-N 3.18Å; R147-L150 PolarHBondContact O-N 3.39Å; L150-A152 PolarHBondContact O-N 2.93Å
151	M	73.4	Confident	73.7	Confident	69 Å²	69	89.4 Å²	89.4	34%	0.34	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	15.7	173.9	-66.4	-180	165.5	0	0	113	R147 L148 H149 W153 T154	R147-M151 HydrophobicContact CG-CE 4.38Å; R147-M151 HydrophobicContact CG-SD 4.4Å; R147-M151 VanDerWaalsContact NE-CE 3.32Å; R147-M151 WeakPolarHBondContact O-CG 3.4Å; R147-M151 PolarHBondContact O-N 3.27Å; L148-M151 CarbonylContact O-C 3.45Å; L148-M151 WeakPolarHBondContact O-CA 3.32Å; L148-M151 PolarHBondContact O-N 3.05Å; H149-M151 PolarHBondContact O-N 3.34Å; M151-W153 PolarHBondContact O-N 3.41Å; M151-W153 VanDerWaalsContact O-N 3.13Å; M151-T154 PolarHBondContact O-N 2.96Å; M151-T154 PolarHBondContact O-OG1 3.49Å
152	A	81.9	Confident	72.9	Confident	74 Å²	74	87.6 Å²	87.6	61%	0.612	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	33.8	-176.5	0	0	0	0	0	113.3	L148 H149 L150 T154	L148-A152 PolarHBondContact O-N 3.47Å; H149-A152 PolarHBondContact O-N 3.43Å; L150-A152 PolarHBondContact O-N 2.93Å; A152-T154 PolarHBondContact O-N 2.89Å; A152-T154 VanDerWaalsContact O-N 3.17Å
153	W	80.9	Confident	72.1	Confident	145 Å²	145	84 Å²	84	55%	0.549	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	19.9	-176.7	-57.8	98.2	0	0	0	115	M145 L148 H149 M151	M145-W153 HydrophobicContact CE-CH2 3.53Å; M145-W153 HydrophobicContact CE-CZ3 3.67Å; M145-W153 HydrophobicContact SD-CH2 4.49Å; L148-W153 HydrophobicContact CB-CD2 4.46Å; L148-W153 HydrophobicContact CB-CE3 3.78Å; L148-W153 HydrophobicContact CB-CZ3 3.9Å; L148-W153 HydrophobicContact CD1-CE3 4.47Å; L148-W153 HydrophobicContact CD1-CZ3 4.27Å; L148-W153 WeakPolarHBondContact O-CA 3.3Å; L148-W153 PolarHBondContact O-N 2.94Å; H149-W153 HydrophobicContact CB-CZ2 4.2Å; H149-W153 AromaticContact ND1-NE1 3.59Å; M151-W153 PolarHBondContact O-N 3.41Å; M151-W153 VanDerWaalsContact O-N 3.13Å
154	T	75.3	Confident	71.5	Confident	87 Å²	87	85.8 Å²	85.8	53%	0.534	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-101	139.7	176.2	63.3	0	0	0	0	111.1	M151 A152	M151-T154 PolarHBondContact O-N 2.96Å; M151-T154 PolarHBondContact O-OG1 3.49Å; A152-T154 PolarHBondContact O-N 2.89Å; A152-T154 VanDerWaalsContact O-N 3.17Å
155	L	71.3	Confident	70.6	Confident	147 Å²	147	86 Å²	86	77%	0.77	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-77.7	140.8	167.3	-72.6	162.7	0	0	0	108.5	H157	L155-H157 PolarHBondContact O-N 3.4Å
156	P	70.9	Confident	69.4	Low	59 Å²	59	82.5 Å²	82.5	38%	0.383	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-60.8	124.5	175.3	25.6	-33.3	0	0	0	109.8	F158	P156-F158 HydrophobicContact CB-CE1 4.1Å; P156-F158 HydrophobicContact CB-CE2 4.02Å; P156-F158 HydrophobicContact CB-CZ 3.64Å; P156-F158 HydrophobicContact CG-CE2 3.74Å; P156-F158 HydrophobicContact CG-CZ 3.61Å
157	H	68.4	Low	68.3	Low	182 Å²	182	81.6 Å²	81.6	84%	0.843	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-82.9	121.8	172.5	-170.6	-68.1	0	0	0	109	L155	L155-H157 PolarHBondContact O-N 3.4Å
158	F	71.8	Confident	67.5	Low	54 Å²	54	82.8 Å²	82.8	24%	0.237	46%	0.458	C	S	.	.			trans	-104.3	141.8	177.4	-60.6	-65.5	0	0	0	110.4	P156 T267 G269	P156-F158 HydrophobicContact CB-CE1 4.1Å; P156-F158 HydrophobicContact CB-CE2 4.02Å; P156-F158 HydrophobicContact CB-CZ 3.64Å; P156-F158 HydrophobicContact CG-CE2 3.74Å; P156-F158 HydrophobicContact CG-CZ 3.61Å; F158-T267 VanDerWaalsContact CE2-O 3.31Å; F158-T267 WeakPolarHBondContact CE2-O 3.31Å; F158-G269 VanDerWaalsContact CE1-N 3.34Å
159	S	67.2	Low	66.6	Low	47 Å²	47	82 Å²	82	33%	0.329	46%	0.455	S	S	.	.			trans	-70.4	159.3	173.9	76.4	0	0	0	0	110.9	G161 D162 S163	S159-G161 PolarHBondContact O-N 3.17Å; S159-G161 VanDerWaalsContact O-N 3.11Å; S159-G161 PolarHBondContact OG-N 3.02Å; S159-D162 WeakPolarHBondContact CB-OD2 3.38Å; S159-D162 PolarHBondContact N-OD2 2.99Å; S159-D162 PolarHBondContact O-N 3.42Å; S159-D162 VanDerWaalsContact O-N 3.13Å; S159-D162 PolarHBondContact OG-N 3.24Å; S159-D162 PolarHBondContact OG-OD2 3.39Å; S159-S163 PolarHBondContact O-N 2.87Å; S159-S163 PolarHBondContact O-OG 2.94Å
160	N	64.3	Low	66.7	Low	137 Å²	137	82.1 Å²	82.1	73%	0.733	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.5	174.3	-71	-15.9	0	0	0	113.1	S163 A165	N160-S163 CarbonylContact C-O 3.48Å; N160-A165 HydrophobicContact CB-CB 4.36Å
161	G	63.9	Low	67.2	Low	16 Å²	16	83.5 Å²	83.5	17%	0.165	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-24.2	177.1	0	0	0	0	0	114.4	S159 S200 M201	S159-G161 PolarHBondContact O-N 3.17Å; S159-G161 VanDerWaalsContact O-N 3.11Å; S159-G161 PolarHBondContact OG-N 3.02Å; G161-S200 WeakPolarHBondContact O-CB 3.33Å; G161-M201 PolarHBondContact O-N 3.1Å
162	D	59.6	Low	67.9	Low	44 Å²	44	85.2 Å²	85.2	24%	0.235	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-37.1	-179.6	-61.1	-42.2	0	0	0	111.8	S159 F270	S159-D162 WeakPolarHBondContact CB-OD2 3.38Å; S159-D162 PolarHBondContact N-OD2 2.99Å; S159-D162 PolarHBondContact O-N 3.42Å; S159-D162 VanDerWaalsContact O-N 3.13Å; S159-D162 PolarHBondContact OG-N 3.24Å; S159-D162 PolarHBondContact OG-OD2 3.39Å; D162-F270 CarbonylContact O-C 3.35Å; D162-F270 WeakPolarHBondContact O-CA 3.21Å; D162-F270 PolarHBondContact O-N 3.32Å
163	S	59.4	Low	68.2	Low	27 Å²	27	83 Å²	83	19%	0.189	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	139.3	167	61.4	0	0	0	0	108.3	S159 N160 A165	S159-S163 PolarHBondContact O-N 2.87Å; S159-S163 PolarHBondContact O-OG 2.94Å; N160-S163 CarbonylContact C-O 3.48Å; S163-A165 PolarHBondContact O-N 2.72Å
164	Q	56	Low	68.4	Low	53 Å²	53	82.5 Å²	82.5	25%	0.248	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	80.2	162.7	-76.1	-164.5	-9.9	0	0	108	L166 I181 V271	Q164-L166 PolarHBondContact O-N 3.14Å; Q164-I181 VanDerWaalsContact CD-CD1 3.47Å; Q164-I181 HydrophobicContact CG-CD1 4.43Å; Q164-V271 HydrophobicContact CG-CB 4.09Å; Q164-V271 HydrophobicContact CG-CG1 3.58Å; Q164-V271 HydrophobicContact CG-CG2 3.52Å
165	A	52.2	Low	69	Low	51 Å²	51	81.7 Å²	81.7	42%	0.421	44%	0.441	S	S	.	.			trans	-65.1	83.9	159.7	0	0	0	0	0	106.1	N160 S163 P167	N160-A165 HydrophobicContact CB-CB 4.36Å; S163-A165 PolarHBondContact O-N 2.72Å; A165-P167 WeakPolarHBondContact O-CD 3.43Å
166	L	56.2	Low	69.9	Low	25 Å²	25	75 Å²	75	13%	0.131	41%	0.408	C	S	.	.			trans	-58	110.8	170.1	-81.9	144.7	0	0	0	105.8	Q164 T168 R174 N177 P206	Q164-L166 PolarHBondContact O-N 3.14Å; L166-T168 PolarHBondContact O-N 2.96Å; L166-R174 HydrophobicContact CD1-CG 4.38Å; L166-N177 HydrophobicContact CD1-CB 3.79Å; L166-N177 HydrophobicContact CD2-CB 3.82Å; L166-N177 WeakPolarHBondContact CD2-ND2 3.43Å; L166-N177 HydrophobicContact CG-CB 4.45Å; L166-P206 HydrophobicContact CD2-CB 3.52Å
167	P	54.7	Low	70.8	Confident	89 Å²	89	72.3 Å²	72.3	58%	0.578	39%	0.39	S	S	*	.			trans	-59.5	106.1	-177.5	-7.7	16.7	0	0	0	106.9	A165 V169	A165-P167 WeakPolarHBondContact O-CD 3.43Å; P167-V169 WeakPolarHBondContact O-CG2 3.41Å; P167-V169 PolarHBondContact O-N 3.08Å
168	T	53.4	Low	71.8	Confident	140 Å²	140	67.7 Å²	67.7	86%	0.859	37%	0.365	S	S	*	.	S	Bend	trans	23	68.4	167.2	53.8	0	0	0	0	115.1	L166	L166-T168 PolarHBondContact O-N 2.96Å
169	V	60.3	Low	72.7	Confident	36 Å²	36	68.7 Å²	68.7	22%	0.218	37%	0.371	C	S	.	.			trans	-106.9	150.1	170.3	-154.1	0	0	0	0	108.9	P167 F173	P167-V169 WeakPolarHBondContact O-CG2 3.41Å; P167-V169 PolarHBondContact O-N 3.08Å; V169-F173 HydrophobicContact CB-CB 4.1Å; V169-F173 HydrophobicContact CG1-CB 3.64Å; V169-F173 HydrophobicContact CG1-CD2 3.68Å; V169-F173 HydrophobicContact CG1-CG 3.95Å
170	N	83.3	Confident	73.9	Confident	119 Å²	119	67.9 Å²	67.9	64%	0.636	36%	0.361	S	S	*	.			trans	-34.1	139	169.6	-71.6	-23.8	0	0	0	112.1	V172 F173 R174	N170-V172 PolarHBondContact O-N 2.76Å; N170-F173 HydrophobicContact CB-CD2 4.22Å; N170-F173 PolarHBondContact O-N 2.78Å; N170-R174 PolarHBondContact O-N 3.49Å
171	F	86.6	Confident	75.2	Confident	152 Å²	152	62.3 Å²	62.3	67%	0.667	33%	0.331	S	S	*	.	H	α-helix	trans	-46.9	-37.3	-178.4	177.6	-106.3	0	0	0	113.8	R174 I175	F171-R174 WeakPolarHBondContact O-CB 3.42Å; F171-R174 PolarHBondContact O-N 3.42Å; F171-I175 HydrophobicContact CD1-CD1 3.85Å; F171-I175 HydrophobicContact CE1-CD1 3.26Å; F171-I175 HydrophobicContact CE1-CG1 4.37Å; F171-I175 HydrophobicContact CE2-CD1 4.09Å; F171-I175 HydrophobicContact CE2-CG1 4.5Å; F171-I175 HydrophobicContact CG-CD1 4.49Å; F171-I175 HydrophobicContact CZ-CD1 3.42Å; F171-I175 VanDerWaalsContact CZ-CD1 3.42Å; F171-I175 HydrophobicContact CZ-CG1 4.27Å; F171-I175 PolarHBondContact O-N 2.94Å
172	V	87.9	Confident	76.5	Confident	105 Å²	105	63.8 Å²	63.8	64%	0.636	33%	0.332	S	S	*	.	H	α-helix	trans	-59.9	-48.8	176.9	179.8	0	0	0	0	112.2	N170 R174 I175 A176	N170-V172 PolarHBondContact O-N 2.76Å; V172-R174 VanDerWaalsContact C-N 3.31Å; V172-R174 PolarHBondContact O-N 3.31Å; V172-I175 PolarHBondContact O-N 3.5Å; V172-A176 WeakPolarHBondContact O-CB 3.42Å; V172-A176 PolarHBondContact O-N 3.32Å
173	F	88.6	Confident	78.1	Confident	28 Å²	28	63.5 Å²	63.5	12%	0.123	33%	0.33	C	S	.	.	H	α-helix	trans	-69	-31.3	178.4	-73.2	-67.6	0	0	0	111.9	V169 N170 A176 N177 I207 Q208 I210	V169-F173 HydrophobicContact CB-CB 4.1Å; V169-F173 HydrophobicContact CG1-CB 3.64Å; V169-F173 HydrophobicContact CG1-CD2 3.68Å; V169-F173 HydrophobicContact CG1-CG 3.95Å; N170-F173 HydrophobicContact CB-CD2 4.22Å; N170-F173 PolarHBondContact O-N 2.78Å; F173-A176 PolarHBondContact O-N 3.49Å; F173-N177 WeakPolarHBondContact O-CB 3.39Å; F173-N177 PolarHBondContact O-N 3.31Å; F173-N177 PolarHBondContact O-ND2 3.45Å; F173-I207 HydrophobicContact CD1-CG2 4.1Å; F173-I207 WeakPolarHBondContact CD1-O 3.34Å; F173-I207 HydrophobicContact CE1-CG2 4.2Å; F173-Q208 WeakPolarHBondContact CZ-O 3.38Å; F173-I210 HydrophobicContact CZ-CG1 3.96Å
174	R	86.2	Confident	79.7	Confident	135 Å²	135	63.8 Å²	63.8	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-60.5	-45.3	171.7	-177	-179.6	-78.7	-176.1	-5.4	111.2	L166 N170 F171 V172 R178	L166-R174 HydrophobicContact CD1-CG 4.38Å; N170-R174 PolarHBondContact O-N 3.49Å; F171-R174 WeakPolarHBondContact O-CB 3.42Å; F171-R174 PolarHBondContact O-N 3.42Å; V172-R174 VanDerWaalsContact C-N 3.31Å; V172-R174 PolarHBondContact O-N 3.31Å; R174-R178 WeakPolarHBondContact O-CB 3.42Å; R174-R178 PolarHBondContact O-N 2.87Å
175	I	87.8	Confident	81.4	Confident	69 Å²	69	61.5 Å²	61.5	35%	0.354	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-45.5	174.7	-67.9	170.9	0	0	0	111	F171 V172 N177 R178 M179	F171-I175 HydrophobicContact CD1-CD1 3.85Å; F171-I175 HydrophobicContact CE1-CD1 3.26Å; F171-I175 HydrophobicContact CE1-CG1 4.37Å; F171-I175 HydrophobicContact CE2-CD1 4.09Å; F171-I175 HydrophobicContact CE2-CG1 4.5Å; F171-I175 HydrophobicContact CG-CD1 4.49Å; F171-I175 HydrophobicContact CZ-CD1 3.42Å; F171-I175 VanDerWaalsContact CZ-CD1 3.42Å; F171-I175 HydrophobicContact CZ-CG1 4.27Å; F171-I175 PolarHBondContact O-N 2.94Å; V172-I175 PolarHBondContact O-N 3.5Å; I175-N177 PolarHBondContact O-N 3.01Å; I175-R178 WeakPolarHBondContact O-CB 3.44Å; I175-R178 PolarHBondContact O-N 2.96Å; I175-M179 HydrophobicContact CG2-CE 4.32Å; I175-M179 HydrophobicContact CG2-CG 4.13Å; I175-M179 WeakPolarHBondContact O-CG 3.49Å; I175-M179 PolarHBondContact O-N 3.07Å
176	A	90.3	Very high	83.3	Confident	8 Å²	8	62.4 Å²	62.4	7%	0.066	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-47.3	-178.1	0	0	0	0	0	111.8	V172 F173 R178 M179 Y180 L215 I218	V172-A176 WeakPolarHBondContact O-CB 3.42Å; V172-A176 PolarHBondContact O-N 3.32Å; F173-A176 PolarHBondContact O-N 3.49Å; A176-R178 VanDerWaalsContact C-N 3.31Å; A176-R178 PolarHBondContact O-N 3.07Å; A176-M179 PolarHBondContact O-N 3.36Å; A176-Y180 WeakPolarHBondContact O-CB 3.41Å; A176-Y180 PolarHBondContact O-N 2.68Å; A176-L215 HydrophobicContact CB-CD1 4.25Å; A176-I218 HydrophobicContact CB-CD1 4.17Å; A176-I218 WeakPolarHBondContact O-CD1 3.11Å
177	N	89.4	Confident	85.1	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.011	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-41.7	176.5	-80.8	-67.4	0	0	0	112.3	L166 F173 I175 Y180 I181 P206 I207	L166-N177 HydrophobicContact CD1-CB 3.79Å; L166-N177 HydrophobicContact CD2-CB 3.82Å; L166-N177 WeakPolarHBondContact CD2-ND2 3.43Å; L166-N177 HydrophobicContact CG-CB 4.45Å; F173-N177 WeakPolarHBondContact O-CB 3.39Å; F173-N177 PolarHBondContact O-N 3.31Å; F173-N177 PolarHBondContact O-ND2 3.45Å; I175-N177 PolarHBondContact O-N 3.01Å; N177-Y180 WeakPolarHBondContact O-CB 3.42Å; N177-Y180 PolarHBondContact O-N 3.49Å; N177-I181 WeakPolarHBondContact O-CG1 3.35Å; N177-I181 PolarHBondContact O-N 3.08Å; N177-P206 VanDerWaalsContact OD1-CA 3.3Å; N177-P206 WeakPolarHBondContact OD1-CA 3.42Å; N177-I207 PolarHBondContact ND2-O 2.59Å; N177-I207 PolarHBondContact OD1-N 3.39Å
178	R	88.4	Confident	87	Confident	84 Å²	84	63.8 Å²	63.8	32%	0.317	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-43.9	176.9	-172.8	175.6	-174.2	140.1	39.4	112.5	R174 I175 A176 Y180 I181 Y182 S262 N263	R174-R178 WeakPolarHBondContact O-CB 3.42Å; R174-R178 PolarHBondContact O-N 2.87Å; I175-R178 WeakPolarHBondContact O-CB 3.44Å; I175-R178 PolarHBondContact O-N 2.96Å; A176-R178 VanDerWaalsContact C-N 3.31Å; A176-R178 PolarHBondContact O-N 3.07Å; R178-Y180 VanDerWaalsContact C-N 3.32Å; R178-I181 PolarHBondContact O-N 2.95Å; R178-Y182 HydrophobicContact CG-CE1 4.17Å; R178-Y182 HydrophobicContact CG-CE2 4.02Å; R178-Y182 WeakPolarHBondContact CG-OH 3.44Å; R178-Y182 PolarHBondContact NE-OH 3.26Å; R178-Y182 PolarHBondContact NH2-OH 3.09Å; R178-Y182 WeakPolarHBondContact O-CD1 3.38Å; R178-Y182 PolarHBondContact O-N 3.19Å; R178-S262 PolarHBondContact NH2-O 2.97Å; R178-N263 PolarHBondContact NH2-O 3.32Å
179	M	91.1	Very high	88.9	Confident	75 Å²	75	57.2 Å²	57.2	37%	0.369	27%	0.268	S	S	.	.	H	α-helix	trans	-64	-38.9	174.1	-68.3	-61.2	178.3	0	0	111.6	I175 A176 I181 Y182 L183 I218	I175-M179 HydrophobicContact CG2-CE 4.32Å; I175-M179 HydrophobicContact CG2-CG 4.13Å; I175-M179 WeakPolarHBondContact O-CG 3.49Å; I175-M179 PolarHBondContact O-N 3.07Å; A176-M179 PolarHBondContact O-N 3.36Å; M179-I181 PolarHBondContact O-N 3.5Å; M179-Y182 WeakPolarHBondContact O-CB 3.47Å; M179-Y182 PolarHBondContact O-N 2.98Å; M179-Y182 HydrophobicContact SD-CD2 3.81Å; M179-Y182 HydrophobicContact SD-CE2 4.05Å; M179-L183 WeakPolarHBondContact O-CG 3.38Å; M179-L183 PolarHBondContact O-N 2.84Å; M179-I218 HydrophobicContact CB-CG2 4Å
180	Y	92.3	Very high	90.4	Very high	30 Å²	30	60.9 Å²	60.9	12%	0.118	28%	0.282	C	S	.	.	H	α-helix	trans	-60.2	-43.6	175.9	-174.5	-121.1	0	0	0	112.2	A176 N177 R178 Y182 L183 L184 I204 I207 R214 L217	A176-Y180 WeakPolarHBondContact O-CB 3.41Å; A176-Y180 PolarHBondContact O-N 2.68Å; N177-Y180 WeakPolarHBondContact O-CB 3.42Å; N177-Y180 PolarHBondContact O-N 3.49Å; R178-Y180 VanDerWaalsContact C-N 3.32Å; Y180-Y182 VanDerWaalsContact C-N 3.29Å; Y180-Y182 PolarHBondContact O-N 3.21Å; Y180-L183 CarbonylContact O-C 3.57Å; Y180-L183 WeakPolarHBondContact O-CB 3.27Å; Y180-L183 PolarHBondContact O-N 2.8Å; Y180-L183 VanDerWaalsContact O-N 3.09Å; Y180-L184 HydrophobicContact CD1-CD1 3.99Å; Y180-L184 HydrophobicContact CD1-CG 4.4Å; Y180-L184 HydrophobicContact CE1-CD1 3.58Å; Y180-L184 HydrophobicContact CE1-CD2 4.35Å; Y180-L184 HydrophobicContact CE1-CG 4.04Å; Y180-L184 HydrophobicContact CE2-CD2 4.3Å; Y180-L184 HydrophobicContact CE2-CG 4.33Å; Y180-L184 WeakPolarHBondContact O-CG 3.32Å; Y180-L184 PolarHBondContact O-N 3.39Å; Y180-I204 HydrophobicContact CD1-CG2 4.24Å; Y180-I204 HydrophobicContact CE1-CG2 3.96Å; Y180-I207 HydrophobicContact CD1-CD1 4.4Å; Y180-I207 HydrophobicContact CG-CD1 4.06Å; Y180-R214 HydrophobicContact CD2-CB 4.15Å; Y180-R214 HydrophobicContact CE2-CB 3.84Å; Y180-R214 HydrophobicContact CE2-CG 3.99Å; Y180-R214 VanDerWaalsContact CZ-CD 3.45Å; Y180-R214 VanDerWaalsContact OH-CD 3.29Å; Y180-R214 WeakPolarHBondContact OH-CD 3.49Å; Y180-L217 HydrophobicContact CE2-CD1 4.41Å
181	I	90.9	Very high	90.8	Very high	20 Å²	20	57.5 Å²	57.5	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-40.3	175.2	-65.3	162.4	0	0	0	111.3	Q164 N177 R178 M179 L183 L184 N185 V271	Q164-I181 VanDerWaalsContact CD-CD1 3.47Å; Q164-I181 HydrophobicContact CG-CD1 4.43Å; N177-I181 WeakPolarHBondContact O-CG1 3.35Å; N177-I181 PolarHBondContact O-N 3.08Å; R178-I181 PolarHBondContact O-N 2.95Å; M179-I181 PolarHBondContact O-N 3.5Å; I181-L183 VanDerWaalsContact C-N 3.29Å; I181-L183 PolarHBondContact O-N 3.32Å; I181-L184 PolarHBondContact O-N 3.17Å; I181-N185 PolarHBondContact O-N 3.26Å; I181-N185 PolarHBondContact O-ND2 3.08Å; I181-V271 HydrophobicContact CD1-CG1 4.39Å; I181-V271 VanDerWaalsContact CG2-O 3.32Å; I181-V271 WeakPolarHBondContact CG2-O 3.15Å
182	Y	91.4	Very high	91.2	Very high	48 Å²	48	50.6 Å²	50.6	19%	0.188	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-38	176.2	-56.3	-23.8	0	0	0	112	R178 M179 Y180 N185 L186 F258 S262 V264	R178-Y182 HydrophobicContact CG-CE1 4.17Å; R178-Y182 HydrophobicContact CG-CE2 4.02Å; R178-Y182 WeakPolarHBondContact CG-OH 3.44Å; R178-Y182 PolarHBondContact NE-OH 3.26Å; R178-Y182 PolarHBondContact NH2-OH 3.09Å; R178-Y182 WeakPolarHBondContact O-CD1 3.38Å; R178-Y182 PolarHBondContact O-N 3.19Å; M179-Y182 WeakPolarHBondContact O-CB 3.47Å; M179-Y182 PolarHBondContact O-N 2.98Å; M179-Y182 HydrophobicContact SD-CD2 3.81Å; M179-Y182 HydrophobicContact SD-CE2 4.05Å; Y180-Y182 VanDerWaalsContact C-N 3.29Å; Y180-Y182 PolarHBondContact O-N 3.21Å; Y182-N185 WeakPolarHBondContact O-CB 3.45Å; Y182-N185 PolarHBondContact O-N 3.46Å; Y182-L186 PolarHBondContact O-N 3.38Å; Y182-F258 AromaticContact CD1-CE1 3.86Å; Y182-F258 HydrophobicContact CD1-CE1 3.86Å; Y182-F258 HydrophobicContact CD1-CZ 4.25Å; Y182-F258 HydrophobicContact CE1-CE1 4.39Å; Y182-F258 HydrophobicContact CG-CE1 4.45Å; Y182-S262 VanDerWaalsContact CE1-O 3.29Å; Y182-S262 WeakPolarHBondContact CE1-O 3.43Å; Y182-S262 PolarHBondContact OH-O 3.47Å; Y182-S262 VanDerWaalsContact OH-O 3.06Å; Y182-V264 WeakPolarHBondContact OH-CG2 3.44Å
183	L	92.6	Very high	91.2	Very high	38 Å²	38	47.9 Å²	47.9	20%	0.199	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-37	174.7	-65.5	174.4	0	0	0	112.1	M179 Y180 I181 L186 W187 I218 S221	M179-L183 WeakPolarHBondContact O-CG 3.38Å; M179-L183 PolarHBondContact O-N 2.84Å; Y180-L183 CarbonylContact O-C 3.57Å; Y180-L183 WeakPolarHBondContact O-CB 3.27Å; Y180-L183 PolarHBondContact O-N 2.8Å; Y180-L183 VanDerWaalsContact O-N 3.09Å; I181-L183 VanDerWaalsContact C-N 3.29Å; I181-L183 PolarHBondContact O-N 3.32Å; L183-L186 PolarHBondContact O-N 3.4Å; L183-W187 WeakPolarHBondContact O-CB 3.42Å; L183-W187 PolarHBondContact O-N 3.25Å; L183-I218 HydrophobicContact CD1-CB 4.21Å; L183-I218 HydrophobicContact CD1-CG1 3.85Å; L183-S221 VanDerWaalsContact CD2-CB 3.41Å; L183-S221 WeakPolarHBondContact CD2-OG 3.33Å
184	L	92.9	Very high	91.2	Very high	32 Å²	32	53.3 Å²	53.3	17%	0.168	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-43.1	173.5	-70.5	178	0	0	0	112	Y180 I181 L186 W187 I188 I204 L272	Y180-L184 HydrophobicContact CD1-CD1 3.99Å; Y180-L184 HydrophobicContact CD1-CG 4.4Å; Y180-L184 HydrophobicContact CE1-CD1 3.58Å; Y180-L184 HydrophobicContact CE1-CD2 4.35Å; Y180-L184 HydrophobicContact CE1-CG 4.04Å; Y180-L184 HydrophobicContact CE2-CD2 4.3Å; Y180-L184 HydrophobicContact CE2-CG 4.33Å; Y180-L184 WeakPolarHBondContact O-CG 3.32Å; Y180-L184 PolarHBondContact O-N 3.39Å; I181-L184 PolarHBondContact O-N 3.17Å; L184-L186 VanDerWaalsContact C-N 3.32Å; L184-L186 PolarHBondContact O-N 2.93Å; L184-W187 PolarHBondContact O-N 2.98Å; L184-I188 WeakPolarHBondContact O-CG1 3.42Å; L184-I188 PolarHBondContact O-N 3.15Å; L184-I204 HydrophobicContact CD1-CD1 3.68Å; L184-I204 HydrophobicContact CD1-CG1 4.19Å; L184-I204 HydrophobicContact CD1-CG2 4.15Å; L184-L272 HydrophobicContact CB-CD2 4.2Å
185	N	93.1	Very high	91.6	Very high	6 Å²	6	47 Å²	47	3%	0.032	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-46.7	173.1	-84.6	-83.3	0	0	0	111.4	I181 Y182 F258 L272 L277	I181-N185 PolarHBondContact O-N 3.26Å; I181-N185 PolarHBondContact O-ND2 3.08Å; Y182-N185 WeakPolarHBondContact O-CB 3.45Å; Y182-N185 PolarHBondContact O-N 3.46Å; N185-F258 HydrophobicContact CB-CE2 3.97Å; N185-F258 HydrophobicContact CB-CZ 3.78Å; N185-F258 VanDerWaalsContact CG-CZ 3.45Å; N185-F258 WeakPolarHBondContact OD1-CE2 3.4Å; N185-L272 HydrophobicContact CB-CD1 4.11Å; N185-L272 WeakPolarHBondContact ND2-CD1 3.31Å; N185-L272 WeakPolarHBondContact OD1-CD1 3.49Å; N185-L277 HydrophobicContact CB-CD2 4.04Å; N185-L277 VanDerWaalsContact O-CD1 3.3Å; N185-L277 WeakPolarHBondContact O-CD1 3.5Å
186	L	92.1	Very high	91.8	Very high	69 Å²	69	43.8 Å²	43.8	36%	0.361	20%	0.204	S	C	.	.	H	α-helix	trans	-66.4	-39.7	177.3	-173.6	64.2	0	0	0	111.7	Y182 L183 L184 I188 L189 F190 V254	Y182-L186 PolarHBondContact O-N 3.38Å; L183-L186 PolarHBondContact O-N 3.4Å; L184-L186 VanDerWaalsContact C-N 3.32Å; L184-L186 PolarHBondContact O-N 2.93Å; L186-I188 VanDerWaalsContact C-N 3.34Å; L186-I188 PolarHBondContact O-N 2.97Å; L186-L189 HydrophobicContact CD1-CD1 4.42Å; L186-L189 WeakPolarHBondContact O-CB 3.37Å; L186-L189 PolarHBondContact O-N 3.31Å; L186-F190 HydrophobicContact CD1-CE2 3.99Å; L186-F190 HydrophobicContact CD2-CE2 4.41Å; L186-F190 HydrophobicContact CG-CD2 4.23Å; L186-F190 HydrophobicContact CG-CE2 3.9Å; L186-F190 WeakPolarHBondContact O-CD2 3.19Å; L186-F190 PolarHBondContact O-N 2.81Å; L186-V254 HydrophobicContact CD1-CG1 4.42Å
187	W	93.5	Very high	91.8	Very high	138 Å²	138	45 Å²	45	52%	0.523	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-39	-179.9	-179.4	-102	0	0	0	112.2	L183 L184 L189 F190 C191	L183-W187 WeakPolarHBondContact O-CB 3.42Å; L183-W187 PolarHBondContact O-N 3.25Å; L184-W187 PolarHBondContact O-N 2.98Å; W187-L189 PolarHBondContact O-N 3.37Å; W187-F190 PolarHBondContact O-N 3.36Å; W187-C191 HydrophobicContact CZ2-CB 3.93Å; W187-C191 PolarHBondContact O-N 2.86Å
188	I	94	Very high	91.8	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-60.8	-31.8	176.6	-73.5	171.9	0	0	0	111.9	V61 L184 L186 P192 L195 L272 L277	V61-I188 HydrophobicContact CG2-CG2 3.91Å; L184-I188 WeakPolarHBondContact O-CG1 3.42Å; L184-I188 PolarHBondContact O-N 3.15Å; L186-I188 VanDerWaalsContact C-N 3.34Å; L186-I188 PolarHBondContact O-N 2.97Å; I188-P192 WeakPolarHBondContact O-CA 3.42Å; I188-P192 WeakPolarHBondContact O-CB 3.22Å; I188-L195 HydrophobicContact CG2-CD2 3.62Å; I188-L272 HydrophobicContact CD1-CD1 4.13Å; I188-L272 HydrophobicContact CD1-CD2 3.76Å; I188-L272 HydrophobicContact CD1-CG 4.15Å; I188-L277 HydrophobicContact CB-CD1 4.23Å; I188-L277 HydrophobicContact CG2-CD1 4.07Å
189	L	94.2	Very high	91.9	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-66.7	-41.6	172.5	-67	168.7	0	0	0	111.6	H59 V61 L186 W187 L277 F284	H59-L189 PolarHBondContact NE2-O 3.1Å; V61-L189 HydrophobicContact CG1-CD2 4.17Å; L186-L189 HydrophobicContact CD1-CD1 4.42Å; L186-L189 WeakPolarHBondContact O-CB 3.37Å; L186-L189 PolarHBondContact O-N 3.31Å; W187-L189 PolarHBondContact O-N 3.37Å; L189-L277 HydrophobicContact CD2-CB 4.18Å; L189-L277 HydrophobicContact CG-CD1 4.4Å; L189-F284 VanDerWaalsContact C-CZ 3.45Å; L189-F284 HydrophobicContact CB-CD1 4.04Å; L189-F284 HydrophobicContact CB-CD2 3.79Å; L189-F284 HydrophobicContact CB-CE1 4.16Å; L189-F284 HydrophobicContact CB-CE2 3.91Å; L189-F284 HydrophobicContact CB-CG 3.86Å; L189-F284 HydrophobicContact CB-CZ 4.11Å; L189-F284 HydrophobicContact CD1-CB 4.11Å; L189-F284 HydrophobicContact CD1-CD2 4.41Å; L189-F284 HydrophobicContact CD1-CG 4.28Å; L189-F284 HydrophobicContact CD2-CD1 4.44Å; L189-F284 HydrophobicContact CD2-CG 4.46Å; L189-F284 HydrophobicContact CG-CG 4.44Å; L189-F284 WeakPolarHBondContact O-CE1 3.44Å; L189-F284 WeakPolarHBondContact O-CZ 3.16Å
190	F	91.5	Very high	91.6	Very high	114 Å²	114	39.3 Å²	39.3	50%	0.5	18%	0.184	S	C	.	.	H	α-helix	trans	-73.8	-43.6	179.3	-76.7	-79.9	0	0	0	113.6	L186 W187 F284	L186-F190 HydrophobicContact CD1-CE2 3.99Å; L186-F190 HydrophobicContact CD2-CE2 4.41Å; L186-F190 HydrophobicContact CG-CD2 4.23Å; L186-F190 HydrophobicContact CG-CE2 3.9Å; L186-F190 WeakPolarHBondContact O-CD2 3.19Å; L186-F190 PolarHBondContact O-N 2.81Å; W187-F190 PolarHBondContact O-N 3.36Å; F190-F284 AromaticContact CD1-CE2 3.62Å; F190-F284 HydrophobicContact CD1-CE2 3.62Å; F190-F284 AromaticContact CD1-CZ 3.97Å; F190-F284 HydrophobicContact CD1-CZ 3.97Å; F190-F284 AromaticContact CD2-CE2 3.89Å; F190-F284 HydrophobicContact CD2-CE2 3.89Å; F190-F284 AromaticContact CE1-CE2 3.6Å; F190-F284 HydrophobicContact CE1-CE2 3.6Å; F190-F284 HydrophobicContact CE1-CZ 4.3Å; F190-F284 HydrophobicContact CE2-CD2 4.41Å; F190-F284 AromaticContact CE2-CE2 3.86Å; F190-F284 HydrophobicContact CE2-CE2 3.86Å; F190-F284 AromaticContact CG-CE2 3.77Å; F190-F284 HydrophobicContact CG-CE2 3.77Å; F190-F284 HydrophobicContact CG-CZ 4.18Å; F190-F284 HydrophobicContact CZ-CD2 4.35Å; F190-F284 AromaticContact CZ-CE2 3.72Å; F190-F284 HydrophobicContact CZ-CE2 3.72Å
191	C	92.5	Very high	91.2	Very high	47 Å²	47	39.4 Å²	39.4	32%	0.318	19%	0.186	S	C	.	.			trans	-135.8	84.5	-174.3	-169	0	0	0	0	109.6	W187 S193	W187-C191 HydrophobicContact CZ2-CB 3.93Å; W187-C191 PolarHBondContact O-N 2.86Å; C191-S193 PolarHBondContact O-N 3.44Å; C191-S193 PolarHBondContact SG-OG 2.94Å
192	P	93.5	Very high	90.5	Very high	8 Å²	8	41 Å²	41	5%	0.052	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	51.3	-179.4	32.8	-36.8	0	0	0	112.2	P60 I188 L195 F319 R322	P60-P192 HydrophobicContact CB-CB 3.84Å; P60-P192 HydrophobicContact CB-CG 3.98Å; P60-P192 HydrophobicContact CG-CB 4.1Å; P60-P192 HydrophobicContact CG-CG 3.64Å; I188-P192 WeakPolarHBondContact O-CA 3.42Å; I188-P192 WeakPolarHBondContact O-CB 3.22Å; P192-L195 HydrophobicContact CB-CD1 4.16Å; P192-L195 HydrophobicContact CB-CD2 3.97Å; P192-L195 HydrophobicContact CB-CG 4.24Å; P192-F319 HydrophobicContact CG-CD1 4.22Å; P192-F319 HydrophobicContact CG-CE1 3.83Å; P192-F319 HydrophobicContact CG-CZ 4.46Å; P192-R322 PolarHBondContact O-NE 3.22Å
193	S	89.1	Confident	90.1	Very high	48 Å²	48	40 Å²	40	34%	0.336	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-37.2	176.1	56.4	0	0	0	0	112.2	C191 L195 R322	C191-S193 PolarHBondContact O-N 3.44Å; C191-S193 PolarHBondContact SG-OG 2.94Å; S193-L195 PolarHBondContact O-N 3.12Å; S193-R322 PolarHBondContact O-NH2 3.26Å
194	Y	88.6	Confident	89.8	Confident	142 Å²	142	39.2 Å²	39.2	56%	0.557	20%	0.203	S	C	*	.	S	Bend	trans	-98	76.8	176.6	-57.6	-87	0	0	0	108.6	Y199 V343	Y194-Y199 PolarHBondContact O-OH 3.5Å; Y194-V343 HydrophobicContact CD1-CG1 4.37Å
195	L	93.4	Very high	89.4	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.222	C	C	.	.			trans	-103.3	130.7	172.6	-61.9	178.6	0	0	0	108.4	P60 I188 P192 S193 E274 Q326 V343	P60-L195 HydrophobicContact CB-CD1 3.82Å; I188-L195 HydrophobicContact CG2-CD2 3.62Å; P192-L195 HydrophobicContact CB-CD1 4.16Å; P192-L195 HydrophobicContact CB-CD2 3.97Å; P192-L195 HydrophobicContact CB-CG 4.24Å; S193-L195 PolarHBondContact O-N 3.12Å; L195-E274 WeakPolarHBondContact CA-OE1 3.46Å; L195-E274 WeakPolarHBondContact CB-OE1 3.37Å; L195-E274 HydrophobicContact CD2-CG 3.95Å; L195-Q326 HydrophobicContact CD1-CG 4.23Å; L195-V343 WeakPolarHBondContact O-CG2 3.17Å
196	C	92.4	Very high	89.1	Confident	2 Å²	2	45 Å²	45	1%	0.014	23%	0.233	C	C	.	.			trans	-144.2	139.4	178.1	-172.4	0	0	0	0	110.3	D198 Y199 E274 V343	C196-D198 PolarHBondContact O-N 3.49Å; C196-D198 PolarHBondContact SG-O 3.18Å; C196-D198 VanDerWaalsContact SG-O 3.33Å; C196-Y199 HydrophobicContact CB-CD2 4.27Å; C196-Y199 HydrophobicContact CB-CE1 4.12Å; C196-Y199 HydrophobicContact CB-CE2 3.66Å; C196-Y199 PolarHBondContact N-OH 3.49Å; C196-Y199 WeakPolarHBondContact O-CE2 3.41Å; C196-E274 PolarHBondContact N-OE1 3.32Å; C196-E274 VanDerWaalsContact O-OE1 3.09Å; C196-V343 HydrophobicContact CB-CB 4.22Å; C196-V343 HydrophobicContact CB-CG1 4.02Å
197	F	91.4	Very high	89	Confident	33 Å²	33	41.8 Å²	41.8	15%	0.145	22%	0.215	C	C	.	.	S	Bend	trans	-64.5	-21.6	178.6	78.7	-87.1	0	0	0	113.4	W330 L336 F337 I350	F197-W330 HydrophobicContact CB-CH2 4.1Å; F197-W330 HydrophobicContact CB-CZ2 3.8Å; F197-L336 HydrophobicContact CB-CD1 3.84Å; F197-L336 HydrophobicContact CB-CG 4.49Å; F197-L336 HydrophobicContact CD1-CD1 3.9Å; F197-L336 HydrophobicContact CD1-CG 3.85Å; F197-L336 HydrophobicContact CE1-CG 4.27Å; F197-L336 HydrophobicContact CG-CD1 3.92Å; F197-L336 HydrophobicContact CG-CD2 4.39Å; F197-L336 HydrophobicContact CG-CG 4.05Å; F197-F337 AromaticContact CE1-CD1 3.86Å; F197-F337 HydrophobicContact CE1-CD1 3.86Å; F197-F337 HydrophobicContact CE1-CE1 4.38Å; F197-F337 HydrophobicContact CE2-CD1 4.31Å; F197-F337 HydrophobicContact CE2-CE1 4.03Å; F197-F337 AromaticContact CZ-CD1 3.47Å; F197-F337 HydrophobicContact CZ-CD1 3.47Å; F197-F337 VanDerWaalsContact CZ-CD1 3.47Å; F197-F337 AromaticContact CZ-CE1 3.63Å; F197-F337 HydrophobicContact CZ-CE1 3.63Å; F197-I350 HydrophobicContact CE1-CD1 3.95Å; F197-I350 HydrophobicContact CE1-CG1 4.03Å; F197-I350 HydrophobicContact CZ-CD1 4.23Å; F197-I350 HydrophobicContact CZ-CG1 3.85Å
198	D	89.2	Confident	88.7	Confident	25 Å²	25	41 Å²	41	13%	0.134	22%	0.218	C	C	.	.			trans	-153.9	120.3	-178.1	-162.9	-13.7	0	0	0	113.2	C196 S200 N347 K349	C196-D198 PolarHBondContact O-N 3.49Å; C196-D198 PolarHBondContact SG-O 3.18Å; C196-D198 VanDerWaalsContact SG-O 3.33Å; D198-S200 WeakPolarHBondContact OD1-CB 3.27Å; D198-S200 PolarHBondContact OD1-N 3.16Å; D198-S200 PolarHBondContact OD1-OG 3.42Å; D198-S200 PolarHBondContact OD2-OG 3.3Å; D198-S200 VanDerWaalsContact OD2-OG 3.13Å; D198-N347 PolarHBondContact O-ND2 2.88Å; D198-K349 VanDerWaalsContact OD2-CD 3.31Å; D198-K349 WeakPolarHBondContact OD2-CD 3.48Å; D198-K349 WeakPolarHBondContact OD2-CE 3.45Å; D198-K349 IonicContact OD2-NZ 2.86Å; D198-K349 PolarHBondContact OD2-NZ 2.89Å
199	Y	89.8	Confident	88.5	Confident	14 Å²	14	44.2 Å²	44.2	6%	0.055	24%	0.237	C	C	.	.			trans	-102.7	12.8	175.9	-70.6	-89.6	0	0	0	113.8	Y194 C196 C203 I204 L272	Y194-Y199 PolarHBondContact O-OH 3.5Å; C196-Y199 HydrophobicContact CB-CD2 4.27Å; C196-Y199 HydrophobicContact CB-CE1 4.12Å; C196-Y199 HydrophobicContact CB-CE2 3.66Å; C196-Y199 PolarHBondContact N-OH 3.49Å; C196-Y199 WeakPolarHBondContact O-CE2 3.41Å; Y199-C203 HydrophobicContact CD1-CB 4.47Å; Y199-C203 WeakPolarHBondContact O-CB 3.36Å; Y199-I204 HydrophobicContact CD1-CD1 4.45Å; Y199-L272 HydrophobicContact CD1-CD2 3.82Å; Y199-L272 HydrophobicContact CD2-CB 3.98Å; Y199-L272 HydrophobicContact CD2-CD2 3.94Å; Y199-L272 HydrophobicContact CD2-CG 3.85Å; Y199-L272 WeakPolarHBondContact CD2-O 3.46Å; Y199-L272 HydrophobicContact CE1-CD2 3.86Å; Y199-L272 HydrophobicContact CE2-CD2 3.98Å; Y199-L272 HydrophobicContact CE2-CG 4.12Å; Y199-L272 HydrophobicContact CG-CB 3.9Å; Y199-L272 HydrophobicContact CG-CD2 3.86Å; Y199-L272 HydrophobicContact CG-CG 4.08Å
200	S	86.3	Confident	88.2	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.021	27%	0.268	C	S	.	.			trans	-71.9	177.9	177.2	63.2	0	0	0	0	113.4	G161 D198 G202 C203 N347	G161-S200 WeakPolarHBondContact O-CB 3.33Å; D198-S200 WeakPolarHBondContact OD1-CB 3.27Å; D198-S200 PolarHBondContact OD1-N 3.16Å; D198-S200 PolarHBondContact OD1-OG 3.42Å; D198-S200 PolarHBondContact OD2-OG 3.3Å; D198-S200 VanDerWaalsContact OD2-OG 3.13Å; S200-G202 PolarHBondContact O-N 2.98Å; S200-C203 PolarHBondContact O-SG 3.04Å; S200-N347 PolarHBondContact O-ND2 3.16Å
201	M	83.5	Confident	88.2	Confident	32 Å²	32	53.9 Å²	53.9	16%	0.158	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	48.3	170.3	-64.9	-73.4	-174.5	0	0	114.8	G161 A348 K349 N378	G161-M201 PolarHBondContact O-N 3.1Å; M201-A348 HydrophobicContact CB-CB 4.2Å; M201-K349 HydrophobicContact CG-CB 4.12Å; M201-N378 PolarHBondContact SD-ND2 2.91Å
202	G	75.8	Confident	88.1	Confident	54 Å²	54	52.7 Å²	52.7	56%	0.557	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	17.8	169.4	0	0	0	0	0	115.9	S200 I204	S200-G202 PolarHBondContact O-N 2.98Å; G202-I204 VanDerWaalsContact C-N 3.28Å; G202-I204 PolarHBondContact O-N 2.8Å
203	C	82.1	Confident	88.2	Confident	26 Å²	26	59.1 Å²	59.1	18%	0.176	30%	0.302	C	S	.	.	S	Bend	trans	-60.3	-36.5	177.2	-67.9	0	0	0	0	113.8	Y199 S200 C344 N347	Y199-C203 HydrophobicContact CD1-CB 4.47Å; Y199-C203 WeakPolarHBondContact O-CB 3.36Å; S200-C203 PolarHBondContact O-SG 3.04Å; C203-C344 HydrophobicContact CB-CB 4.12Å; C203-C344 WeakPolarHBondContact SG-CB 3.38Å; C203-N347 WeakPolarHBondContact SG-CB 3.47Å; C203-N347 VanDerWaalsContact SG-CG 3.51Å; C203-N347 PolarHBondContact SG-ND2 3.26Å
204	I	86.5	Confident	88.4	Confident	21 Å²	21	58.1 Å²	58.1	11%	0.108	29%	0.291	C	S	.	.	S	Bend	trans	-108.5	107.2	-178.7	-60.5	164.3	0	0	0	106.7	Y180 L184 Y199 G202 V271 L272	Y180-I204 HydrophobicContact CD1-CG2 4.24Å; Y180-I204 HydrophobicContact CE1-CG2 3.96Å; L184-I204 HydrophobicContact CD1-CD1 3.68Å; L184-I204 HydrophobicContact CD1-CG1 4.19Å; L184-I204 HydrophobicContact CD1-CG2 4.15Å; Y199-I204 HydrophobicContact CD1-CD1 4.45Å; G202-I204 VanDerWaalsContact C-N 3.28Å; G202-I204 PolarHBondContact O-N 2.8Å; I204-V271 HydrophobicContact CD1-CG1 3.91Å; I204-L272 HydrophobicContact CD1-CB 4.36Å; I204-L272 HydrophobicContact CD1-CD2 4.14Å
205	E	85.3	Confident	88.5	Confident	121 Å²	121	53 Å²	53	57%	0.565	27%	0.273	S	S	*	.			trans	-61	130.5	176.5	-67.8	-175.2	174.4	0	0	110	R214	E205-R214 PolarHBondContact O-NH1 3.36Å; E205-R214 PolarHBondContact O-NH2 3.46Å; E205-R214 VanDerWaalsContact O-NH2 3.15Å
206	P	86.6	Confident	88.4	Confident	40 Å²	40	61.1 Å²	61.1	26%	0.26	30%	0.303	S	S	.	.			trans	-68.8	140.3	178.7	28.5	-34.3	0	0	0	110.8	L166 N177 Q208	L166-P206 HydrophobicContact CD2-CB 3.52Å; N177-P206 VanDerWaalsContact OD1-CA 3.3Å; N177-P206 WeakPolarHBondContact OD1-CA 3.42Å; P206-Q208 HydrophobicContact CG-CG 4.34Å; P206-Q208 PolarHBondContact O-N 2.92Å
207	I	89.1	Confident	88.4	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.323	C	S	.	.			trans	-66.3	113.1	168.1	-58.2	171.2	0	0	0	107.6	F173 N177 Y180 D212 R214 I218	F173-I207 HydrophobicContact CD1-CG2 4.1Å; F173-I207 WeakPolarHBondContact CD1-O 3.34Å; F173-I207 HydrophobicContact CE1-CG2 4.2Å; N177-I207 PolarHBondContact ND2-O 2.59Å; N177-I207 PolarHBondContact OD1-N 3.39Å; Y180-I207 HydrophobicContact CD1-CD1 4.4Å; Y180-I207 HydrophobicContact CG-CD1 4.06Å; I207-D212 HydrophobicContact CG2-CB 3.91Å; I207-R214 HydrophobicContact CD1-CB 3.83Å; I207-R214 HydrophobicContact CG1-CB 4.2Å; I207-I218 HydrophobicContact CD1-CD1 3.9Å
208	Q	87.9	Confident	88.5	Confident	123 Å²	123	63.8 Å²	63.8	58%	0.575	32%	0.318	S	S	*	.			trans	-114.9	-13.8	-180	-67.5	178.9	-6.8	0	0	113.2	F173 P206	F173-Q208 WeakPolarHBondContact CZ-O 3.38Å; P206-Q208 HydrophobicContact CG-CG 4.34Å; P206-Q208 PolarHBondContact O-N 2.92Å
209	T	89.7	Confident	88.6	Confident	71 Å²	71	66.8 Å²	66.8	44%	0.436	33%	0.334	S	S	.	.	S	Bend	trans	-130.1	147.2	-175.7	-177.8	0	0	0	0	111.2	K211 D212	T209-K211 HydrophobicContact CG2-CB 4.32Å; T209-K211 PolarHBondContact O-N 3.39Å; T209-K211 PolarHBondContact OG1-N 3.14Å; T209-D212 HydrophobicContact CG2-CB 4.1Å; T209-D212 VanDerWaalsContact O-CB 3.25Å; T209-D212 WeakPolarHBondContact O-CB 3.33Å; T209-D212 PolarHBondContact O-N 2.8Å
210	I	88.5	Confident	88.6	Confident	126 Å²	126	70.2 Å²	70.2	65%	0.646	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.6	176	-55.6	175.7	0	0	0	110.8	F173 D212 L215	F173-I210 HydrophobicContact CZ-CG1 3.96Å; I210-D212 PolarHBondContact O-N 3.37Å; I210-L215 HydrophobicContact CG2-CD2 4.01Å
211	K	90.7	Very high	88.7	Confident	193 Å²	193	71.7 Å²	71.7	84%	0.839	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-8	176.5	-62.9	-173.6	179.9	-178.2	0	113.6	T209 F213	T209-K211 HydrophobicContact CG2-CB 4.32Å; T209-K211 PolarHBondContact O-N 3.39Å; T209-K211 PolarHBondContact OG1-N 3.14Å; K211-F213 PolarHBondContact O-N 3.02Å
212	D	91.5	Very high	88.9	Confident	23 Å²	23	74.4 Å²	74.4	12%	0.123	38%	0.381	C	S	.	.			trans	-68.8	121.1	179.8	-166.5	-38	0	0	0	110.3	I207 T209 I210 R214 L215	I207-D212 HydrophobicContact CG2-CB 3.91Å; T209-D212 HydrophobicContact CG2-CB 4.1Å; T209-D212 VanDerWaalsContact O-CB 3.25Å; T209-D212 WeakPolarHBondContact O-CB 3.33Å; T209-D212 PolarHBondContact O-N 2.8Å; I210-D212 PolarHBondContact O-N 3.37Å; D212-R214 PolarHBondContact O-N 2.89Å; D212-R214 VanDerWaalsContact OD1-CB 3.23Å; D212-R214 WeakPolarHBondContact OD1-CB 3.36Å; D212-R214 VanDerWaalsContact OD1-CG 3.25Å; D212-R214 WeakPolarHBondContact OD1-CG 3.48Å; D212-R214 IonicContact OD1-CZ 3.75Å; D212-R214 PolarHBondContact OD1-N 3.38Å; D212-R214 IonicContact OD1-NE 3.91Å; D212-R214 PolarHBondContact OD1-NE 3.03Å; D212-R214 IonicContact OD2-CZ 2.69Å; D212-R214 VanDerWaalsContact OD2-CZ 3.25Å; D212-R214 IonicContact OD2-NE 3.25Å; D212-R214 PolarHBondContact OD2-NE 3.25Å; D212-R214 IonicContact OD2-NH2 2.71Å; D212-R214 PolarHBondContact OD2-NH2 3.2Å; D212-L215 WeakPolarHBondContact O-CB 3.18Å; D212-L215 PolarHBondContact O-N 3.17Å
213	F	94.4	Very high	89.5	Confident	143 Å²	143	74.8 Å²	74.8	63%	0.627	38%	0.375	S	S	*	.	H	α-helix	trans	-59.8	-23.7	-178	78.8	-85.4	0	0	0	112.8	K211 L215 W216 L217	K211-F213 PolarHBondContact O-N 3.02Å; F213-L215 PolarHBondContact O-N 2.98Å; F213-W216 WeakPolarHBondContact O-CB 3.49Å; F213-W216 PolarHBondContact O-N 3.16Å; F213-L217 HydrophobicContact CD2-CD1 4.45Å; F213-L217 HydrophobicContact CE2-CD1 4.12Å; F213-L217 PolarHBondContact O-N 2.79Å
214	R	93.3	Very high	89.6	Confident	27 Å²	27	77.4 Å²	77.4	10%	0.102	39%	0.386	C	S	.	.	H	α-helix	trans	-65.2	-23.3	178.5	-61.3	175.8	-70.2	173.1	3.6	112.1	Y180 E205 I207 D212 W216 L217 I218	Y180-R214 HydrophobicContact CD2-CB 4.15Å; Y180-R214 HydrophobicContact CE2-CB 3.84Å; Y180-R214 HydrophobicContact CE2-CG 3.99Å; Y180-R214 VanDerWaalsContact CZ-CD 3.45Å; Y180-R214 VanDerWaalsContact OH-CD 3.29Å; Y180-R214 WeakPolarHBondContact OH-CD 3.49Å; E205-R214 PolarHBondContact O-NH1 3.36Å; E205-R214 PolarHBondContact O-NH2 3.46Å; E205-R214 VanDerWaalsContact O-NH2 3.15Å; I207-R214 HydrophobicContact CD1-CB 3.83Å; I207-R214 HydrophobicContact CG1-CB 4.2Å; D212-R214 PolarHBondContact O-N 2.89Å; D212-R214 VanDerWaalsContact OD1-CB 3.23Å; D212-R214 WeakPolarHBondContact OD1-CB 3.36Å; D212-R214 VanDerWaalsContact OD1-CG 3.25Å; D212-R214 WeakPolarHBondContact OD1-CG 3.48Å; D212-R214 IonicContact OD1-CZ 3.75Å; D212-R214 PolarHBondContact OD1-N 3.38Å; D212-R214 IonicContact OD1-NE 3.91Å; D212-R214 PolarHBondContact OD1-NE 3.03Å; D212-R214 IonicContact OD2-CZ 2.69Å; D212-R214 VanDerWaalsContact OD2-CZ 3.25Å; D212-R214 IonicContact OD2-NE 3.25Å; D212-R214 PolarHBondContact OD2-NE 3.25Å; D212-R214 IonicContact OD2-NH2 2.71Å; D212-R214 PolarHBondContact OD2-NH2 3.2Å; R214-W216 VanDerWaalsContact C-N 3.32Å; R214-L217 WeakPolarHBondContact O-CB 3.5Å; R214-L217 PolarHBondContact O-N 3.25Å; R214-I218 WeakPolarHBondContact O-CG1 3.39Å; R214-I218 PolarHBondContact O-N 3.36Å
215	L	92.3	Very high	89.4	Confident	34 Å²	34	83.3 Å²	83.3	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-64.8	-37.4	171.7	-171.8	62.1	0	0	0	111.6	A176 I210 D212 F213 L217 I218 L219	A176-L215 HydrophobicContact CB-CD1 4.25Å; I210-L215 HydrophobicContact CG2-CD2 4.01Å; D212-L215 WeakPolarHBondContact O-CB 3.18Å; D212-L215 PolarHBondContact O-N 3.17Å; F213-L215 PolarHBondContact O-N 2.98Å; L215-L217 VanDerWaalsContact C-N 3.32Å; L215-L217 PolarHBondContact O-N 2.79Å; L215-I218 HydrophobicContact CD1-CD1 4.23Å; L215-I218 WeakPolarHBondContact O-CB 3.46Å; L215-I218 PolarHBondContact O-N 3.18Å; L215-I218 VanDerWaalsContact O-N 3.16Å; L215-L219 HydrophobicContact CG-CD1 4.43Å; L215-L219 WeakPolarHBondContact O-CG 3.13Å; L215-L219 PolarHBondContact O-N 2.86Å
216	W	90.8	Very high	89.2	Confident	173 Å²	173	81.3 Å²	81.3	66%	0.655	41%	0.409	S	S	*	.	H	α-helix	trans	-65	-36.4	174.8	-67.8	103.1	0	0	0	112.2	F213 R214 I218 L219 V220	F213-W216 WeakPolarHBondContact O-CB 3.49Å; F213-W216 PolarHBondContact O-N 3.16Å; R214-W216 VanDerWaalsContact C-N 3.32Å; W216-I218 VanDerWaalsContact C-N 3.26Å; W216-I218 PolarHBondContact O-N 3.13Å; W216-L219 HydrophobicContact CE3-CD1 4.19Å; W216-L219 HydrophobicContact CZ3-CD1 4.42Å; W216-L219 PolarHBondContact O-N 3.25Å; W216-V220 WeakPolarHBondContact O-CB 3.47Å; W216-V220 VanDerWaalsContact O-CG2 3.24Å; W216-V220 WeakPolarHBondContact O-CG2 3.43Å; W216-V220 PolarHBondContact O-N 3.13Å
217	L	92.1	Very high	89	Confident	83 Å²	83	83.8 Å²	83.8	44%	0.435	42%	0.42	S	S	.	.	H	α-helix	trans	-60	-40	173.3	-62.5	176.8	0	0	0	111.3	Y180 F213 R214 L215 S221	Y180-L217 HydrophobicContact CE2-CD1 4.41Å; F213-L217 HydrophobicContact CD2-CD1 4.45Å; F213-L217 HydrophobicContact CE2-CD1 4.12Å; F213-L217 PolarHBondContact O-N 2.79Å; R214-L217 WeakPolarHBondContact O-CB 3.5Å; R214-L217 PolarHBondContact O-N 3.25Å; L215-L217 VanDerWaalsContact C-N 3.32Å; L215-L217 PolarHBondContact O-N 2.79Å; L217-S221 VanDerWaalsContact O-CB 3.3Å; L217-S221 WeakPolarHBondContact O-CB 3.44Å; L217-S221 PolarHBondContact O-N 3Å; L217-S221 PolarHBondContact O-OG 2.88Å
218	I	93	Very high	88.3	Confident	7 Å²	7	87.6 Å²	87.6	4%	0.036	44%	0.439	C	S	.	.	H	α-helix	trans	-64.3	-50.9	174.8	-59.8	163.2	0	0	0	110.9	A176 M179 L183 I207 R214 L215 W216 V220 S221 I222	A176-I218 HydrophobicContact CB-CD1 4.17Å; A176-I218 WeakPolarHBondContact O-CD1 3.11Å; M179-I218 HydrophobicContact CB-CG2 4Å; L183-I218 HydrophobicContact CD1-CB 4.21Å; L183-I218 HydrophobicContact CD1-CG1 3.85Å; I207-I218 HydrophobicContact CD1-CD1 3.9Å; R214-I218 WeakPolarHBondContact O-CG1 3.39Å; R214-I218 PolarHBondContact O-N 3.36Å; L215-I218 HydrophobicContact CD1-CD1 4.23Å; L215-I218 WeakPolarHBondContact O-CB 3.46Å; L215-I218 PolarHBondContact O-N 3.18Å; L215-I218 VanDerWaalsContact O-N 3.16Å; W216-I218 VanDerWaalsContact C-N 3.26Å; W216-I218 PolarHBondContact O-N 3.13Å; I218-V220 PolarHBondContact O-N 3.39Å; I218-S221 PolarHBondContact O-N 3.39Å; I218-S221 VanDerWaalsContact O-N 3.15Å; I218-I222 HydrophobicContact CG2-CD1 3.61Å; I218-I222 HydrophobicContact CG2-CG1 4.3Å; I218-I222 WeakPolarHBondContact O-CG1 3.31Å; I218-I222 PolarHBondContact O-N 3.01Å
219	L	91.7	Very high	87.8	Confident	89 Å²	89	84.7 Å²	84.7	47%	0.466	44%	0.436	S	S	.	.	H	α-helix	trans	-61.8	-42.6	-177.6	-67.4	174.1	0	0	0	112.2	L215 W216 S221 I222 S223	L215-L219 HydrophobicContact CG-CD1 4.43Å; L215-L219 WeakPolarHBondContact O-CG 3.13Å; L215-L219 PolarHBondContact O-N 2.86Å; W216-L219 HydrophobicContact CE3-CD1 4.19Å; W216-L219 HydrophobicContact CZ3-CD1 4.42Å; W216-L219 PolarHBondContact O-N 3.25Å; L219-S221 VanDerWaalsContact C-N 3.35Å; L219-I222 PolarHBondContact O-N 3.45Å; L219-S223 WeakPolarHBondContact O-CB 3.17Å; L219-S223 PolarHBondContact O-N 2.9Å; L219-S223 PolarHBondContact O-OG 3.4Å
220	V	90.6	Very high	87.3	Confident	85 Å²	85	88 Å²	88	52%	0.515	44%	0.441	S	S	.	.	H	α-helix	trans	-62.9	-42.6	174.5	171.5	0	0	0	0	110.6	W216 I218 I222 S223 I224	W216-V220 WeakPolarHBondContact O-CB 3.47Å; W216-V220 VanDerWaalsContact O-CG2 3.24Å; W216-V220 WeakPolarHBondContact O-CG2 3.43Å; W216-V220 PolarHBondContact O-N 3.13Å; I218-V220 PolarHBondContact O-N 3.39Å; V220-I222 PolarHBondContact O-N 2.95Å; V220-S223 PolarHBondContact O-N 3.39Å; V220-S223 PolarHBondContact O-OG 3.11Å; V220-I224 WeakPolarHBondContact O-CG1 3.33Å; V220-I224 PolarHBondContact O-N 2.85Å
221	S	88.4	Confident	86.6	Confident	34 Å²	34	86.3 Å²	86.3	24%	0.238	43%	0.431	C	S	.	.	H	α-helix	trans	-67.1	-37.9	-179.9	-58.5	0	0	0	0	112.5	L183 L217 I218 L219	L183-S221 VanDerWaalsContact CD2-CB 3.41Å; L183-S221 WeakPolarHBondContact CD2-OG 3.33Å; L217-S221 VanDerWaalsContact O-CB 3.3Å; L217-S221 WeakPolarHBondContact O-CB 3.44Å; L217-S221 PolarHBondContact O-N 3Å; L217-S221 PolarHBondContact O-OG 2.88Å; I218-S221 PolarHBondContact O-N 3.39Å; I218-S221 VanDerWaalsContact O-N 3.15Å; L219-S221 VanDerWaalsContact C-N 3.35Å
222	I	87.8	Confident	85.7	Confident	90 Å²	90	82.9 Å²	82.9	46%	0.462	42%	0.416	S	S	.	.	H	α-helix	trans	-71	-36.3	176.9	-67.1	172.6	0	0	0	110.9	I218 L219 V220 I224 F225 P226	I218-I222 HydrophobicContact CG2-CD1 3.61Å; I218-I222 HydrophobicContact CG2-CG1 4.3Å; I218-I222 WeakPolarHBondContact O-CG1 3.31Å; I218-I222 PolarHBondContact O-N 3.01Å; L219-I222 PolarHBondContact O-N 3.45Å; V220-I222 PolarHBondContact O-N 2.95Å; I222-I224 PolarHBondContact O-N 3.42Å; I222-F225 PolarHBondContact O-N 3.11Å; I222-P226 WeakPolarHBondContact O-CD 3.14Å
223	S	87.7	Confident	85	Confident	61 Å²	61	90.8 Å²	90.8	43%	0.427	45%	0.45	S	S	.	.	H	α-helix	trans	-68.8	-17.5	-179.3	75.2	0	0	0	0	114	L219 V220 F225 P226 L227	L219-S223 WeakPolarHBondContact O-CB 3.17Å; L219-S223 PolarHBondContact O-N 2.9Å; L219-S223 PolarHBondContact O-OG 3.4Å; V220-S223 PolarHBondContact O-N 3.39Å; V220-S223 PolarHBondContact O-OG 3.11Å; S223-F225 VanDerWaalsContact C-N 3.31Å; S223-F225 PolarHBondContact O-N 3.3Å; S223-P226 VanDerWaalsContact O-CD 3.25Å; S223-P226 WeakPolarHBondContact O-CD 3.27Å; S223-P226 VanDerWaalsContact O-CG 3.31Å; S223-P226 WeakPolarHBondContact O-CG 3.41Å; S223-L227 WeakPolarHBondContact O-CB 3.26Å; S223-L227 PolarHBondContact O-N 3.48Å
224	I	84.3	Confident	84	Confident	82 Å²	82	92.6 Å²	92.6	42%	0.421	45%	0.452	S	S	.	.	H	α-helix	trans	-60.5	-38.9	172.3	-67.1	166.9	0	0	0	111.3	V220 I222 L227 L228	V220-I224 WeakPolarHBondContact O-CG1 3.33Å; V220-I224 PolarHBondContact O-N 2.85Å; I222-I224 PolarHBondContact O-N 3.42Å; I224-L227 PolarHBondContact O-N 3.03Å; I224-L228 HydrophobicContact CG2-CD1 3.75Å; I224-L228 HydrophobicContact CG2-CG 4.11Å; I224-L228 WeakPolarHBondContact O-CB 3.5Å; I224-L228 VanDerWaalsContact O-CG 3.24Å; I224-L228 WeakPolarHBondContact O-CG 3.45Å; I224-L228 PolarHBondContact O-N 3.17Å
225	F	81.5	Confident	82.5	Confident	144 Å²	144	100 Å²	100	63%	0.632	48%	0.48	S	S	*	.	H	α-helix	trans	-63.1	-52.8	-178.8	-67.4	-80.5	0	0	0	114.1	I222 S223 L227 L228 A229	I222-F225 PolarHBondContact O-N 3.11Å; S223-F225 VanDerWaalsContact C-N 3.31Å; S223-F225 PolarHBondContact O-N 3.3Å; F225-L227 VanDerWaalsContact C-N 3.31Å; F225-L227 PolarHBondContact O-N 3.29Å; F225-L228 PolarHBondContact O-N 3.26Å; F225-A229 PolarHBondContact O-N 3.19Å
226	P	82.5	Confident	80.5	Confident	79 Å²	79	110.4 Å²	110.4	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-32.6	175.7	24.5	-32.4	0	0	0	112.3	I222 S223 A229 W230	I222-P226 WeakPolarHBondContact O-CD 3.14Å; S223-P226 VanDerWaalsContact O-CD 3.25Å; S223-P226 WeakPolarHBondContact O-CD 3.27Å; S223-P226 VanDerWaalsContact O-CG 3.31Å; S223-P226 WeakPolarHBondContact O-CG 3.41Å; P226-A229 PolarHBondContact O-N 2.96Å; P226-W230 VanDerWaalsContact O-CB 3.3Å; P226-W230 WeakPolarHBondContact O-CB 3.49Å; P226-W230 PolarHBondContact O-N 3.5Å
227	L	80.7	Confident	79	Confident	93 Å²	93	105.1 Å²	105.1	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-46	173.6	-177.5	66.7	0	0	0	111.4	S223 I224 F225 A229 W230 M231	S223-L227 WeakPolarHBondContact O-CB 3.26Å; S223-L227 PolarHBondContact O-N 3.48Å; I224-L227 PolarHBondContact O-N 3.03Å; F225-L227 VanDerWaalsContact C-N 3.31Å; F225-L227 PolarHBondContact O-N 3.29Å; L227-A229 PolarHBondContact O-N 3.36Å; L227-W230 HydrophobicContact CD1-CE3 4.14Å; L227-W230 HydrophobicContact CD1-CZ3 4.47Å; L227-W230 PolarHBondContact O-N 3Å; L227-M231 HydrophobicContact CG-SD 4.39Å; L227-M231 WeakPolarHBondContact O-CB 3.43Å; L227-M231 VanDerWaalsContact O-CG 3.29Å; L227-M231 WeakPolarHBondContact O-CG 3.43Å; L227-M231 PolarHBondContact O-N 3.5Å
228	L	74.5	Confident	77.3	Confident	80 Å²	80	107 Å²	107	42%	0.419	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-40.8	175	-72.1	173.8	0	0	0	111.9	I224 F225 M231 K232	I224-L228 HydrophobicContact CG2-CD1 3.75Å; I224-L228 HydrophobicContact CG2-CG 4.11Å; I224-L228 WeakPolarHBondContact O-CB 3.5Å; I224-L228 VanDerWaalsContact O-CG 3.24Å; I224-L228 WeakPolarHBondContact O-CG 3.45Å; I224-L228 PolarHBondContact O-N 3.17Å; F225-L228 PolarHBondContact O-N 3.26Å; L228-M231 PolarHBondContact O-N 3.27Å; L228-K232 WeakPolarHBondContact O-CB 3.41Å; L228-K232 PolarHBondContact O-N 3.05Å
229	A	78.2	Confident	75.7	Confident	61 Å²	61	112 Å²	112	50%	0.504	55%	0.545	S	S	.	.	H	α-helix	trans	-63.7	-41.8	175.7	0	0	0	0	0	112.1	F225 P226 L227 K232 K233	F225-A229 PolarHBondContact O-N 3.19Å; P226-A229 PolarHBondContact O-N 2.96Å; L227-A229 PolarHBondContact O-N 3.36Å; A229-K232 WeakPolarHBondContact O-CB 3.32Å; A229-K232 PolarHBondContact O-N 3.45Å; A229-K233 PolarHBondContact O-N 3.14Å
230	W	80.1	Confident	74.5	Confident	141 Å²	141	110.7 Å²	110.7	53%	0.534	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-45.2	175.9	177.7	82	0	0	0	112.2	P226 L227 K232 K233 R234	P226-W230 VanDerWaalsContact O-CB 3.3Å; P226-W230 WeakPolarHBondContact O-CB 3.49Å; P226-W230 PolarHBondContact O-N 3.5Å; L227-W230 HydrophobicContact CD1-CE3 4.14Å; L227-W230 HydrophobicContact CD1-CZ3 4.47Å; L227-W230 PolarHBondContact O-N 3Å; W230-K232 VanDerWaalsContact C-N 3.3Å; W230-K232 PolarHBondContact O-N 3.17Å; W230-K233 PolarHBondContact O-N 2.95Å; W230-K233 VanDerWaalsContact O-N 3.17Å; W230-R234 PolarHBondContact O-N 2.85Å; W230-R234 VanDerWaalsContact O-N 3.14Å
231	M	72.8	Confident	73.3	Confident	91 Å²	91	111.6 Å²	111.6	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-59.9	-40.1	174.7	-72.9	179.2	71.1	0	0	111.9	L227 L228 R234 R235	L227-M231 HydrophobicContact CG-SD 4.39Å; L227-M231 WeakPolarHBondContact O-CB 3.43Å; L227-M231 VanDerWaalsContact O-CG 3.29Å; L227-M231 WeakPolarHBondContact O-CG 3.43Å; L227-M231 PolarHBondContact O-N 3.5Å; L228-M231 PolarHBondContact O-N 3.27Å; M231-R234 PolarHBondContact O-N 3.06Å; M231-R235 PolarHBondContact O-N 3.02Å
232	K	71.5	Confident	72.2	Confident	120 Å²	120	111.8 Å²	111.8	52%	0.522	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-43.1	174.9	-176.3	-177.6	176.5	180	0	111.7	L228 A229 W230 R234 F244	L228-K232 WeakPolarHBondContact O-CB 3.41Å; L228-K232 PolarHBondContact O-N 3.05Å; A229-K232 WeakPolarHBondContact O-CB 3.32Å; A229-K232 PolarHBondContact O-N 3.45Å; W230-K232 VanDerWaalsContact C-N 3.3Å; W230-K232 PolarHBondContact O-N 3.17Å; K232-R234 VanDerWaalsContact C-N 3.31Å; K232-R234 PolarHBondContact O-N 3.15Å; K232-F244 HydrophobicContact CD-CD2 4.14Å; K232-F244 HydrophobicContact CD-CE2 3.93Å; K232-F244 HydrophobicContact CD-CZ 4.36Å
233	K	77.4	Confident	71.4	Confident	189 Å²	189	109.7 Å²	109.7	82%	0.822	53%	0.527	S	S	*	.	H	α-helix	trans	-65	-33.1	179.2	-167.6	177.2	-179.2	-179.7	0	112.6	A229 W230	A229-K233 PolarHBondContact O-N 3.14Å; W230-K233 PolarHBondContact O-N 2.95Å; W230-K233 VanDerWaalsContact O-N 3.17Å
234	R	72.9	Confident	70.8	Confident	182 Å²	182	110.3 Å²	110.3	69%	0.687	52%	0.523	S	S	*	.	H	α-helix	trans	-90.6	-22.8	-170.1	-148.9	175.4	-171.3	-170.2	1.4	115.1	W230 M231 K232	W230-R234 PolarHBondContact O-N 2.85Å; W230-R234 VanDerWaalsContact O-N 3.14Å; M231-R234 PolarHBondContact O-N 3.06Å; K232-R234 VanDerWaalsContact C-N 3.31Å; K232-R234 PolarHBondContact O-N 3.15Å
235	R	62.8	Low	70.4	Confident	183 Å²	183	112.1 Å²	112.1	69%	0.691	52%	0.524	S	S	*	.			trans	-124.3	81.8	-179.1	-72.5	-177.1	176.8	170.1	-0	110.7	M231 S237 N240	M231-R235 PolarHBondContact O-N 3.02Å; R235-S237 PolarHBondContact O-N 3.3Å; R235-N240 WeakPolarHBondContact CB-ND2 3.45Å; R235-N240 PolarHBondContact O-ND2 3.41Å
236	W	50.4	Low	70.3	Confident	251 Å²	251	105.3 Å²	105.3	95%	0.951	49%	0.494	S	S	*	.			trans	-83.7	103.7	172	-153.7	10.5	0	0	0	109.6
237	S	57.8	Low	70.3	Confident	62 Å²	62	103.6 Å²	103.6	43%	0.434	48%	0.48	S	S	.	.			trans	-136.2	149.3	168.8	168.9	0	0	0	0	108.5	R235 E239 N240 N241	R235-S237 PolarHBondContact O-N 3.3Å; S237-E239 PolarHBondContact O-N 3.46Å; S237-E239 PolarHBondContact OG-N 2.92Å; S237-N240 WeakPolarHBondContact O-CA 3.25Å; S237-N240 WeakPolarHBondContact O-CB 3.33Å; S237-N240 PolarHBondContact O-N 3.29Å; S237-N241 PolarHBondContact O-N 2.91Å
238	V	56.5	Low	70.2	Confident	122 Å²	122	103.8 Å²	103.8	74%	0.739	48%	0.482	S	S	*	.	H	α-helix	trans	-53.4	-38.5	177.4	177.6	0	0	0	0	111	N240 N241 M242	V238-N240 VanDerWaalsContact C-N 3.3Å; V238-N240 PolarHBondContact O-N 2.88Å; V238-N241 PolarHBondContact O-N 3.33Å; V238-M242 WeakPolarHBondContact O-CG 3.4Å; V238-M242 PolarHBondContact O-N 3.45Å
239	E	60.7	Low	70.4	Confident	113 Å²	113	102 Å²	102	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-33	176.6	-170.9	168.1	-163.8	0	0	112.8	S237 M242 N243 R294	S237-E239 PolarHBondContact O-N 3.46Å; S237-E239 PolarHBondContact OG-N 2.92Å; E239-M242 WeakPolarHBondContact O-CB 3.31Å; E239-M242 PolarHBondContact O-N 3.48Å; E239-N243 PolarHBondContact O-N 3.46Å; E239-N243 VanDerWaalsContact O-N 3.14Å; E239-N243 PolarHBondContact O-ND2 2.91Å; E239-R294 IonicContact OE1-NH1 2.67Å; E239-R294 PolarHBondContact OE1-NH1 3.19Å
240	N	64.8	Low	70.7	Confident	62 Å²	62	99.1 Å²	99.1	33%	0.332	45%	0.448	S	S	.	.	H	α-helix	trans	-71.2	-33.4	176.9	-71.9	-19.3	0	0	0	112.4	R235 S237 V238 M242 N243 F244	R235-N240 WeakPolarHBondContact CB-ND2 3.45Å; R235-N240 PolarHBondContact O-ND2 3.41Å; S237-N240 WeakPolarHBondContact O-CA 3.25Å; S237-N240 WeakPolarHBondContact O-CB 3.33Å; S237-N240 PolarHBondContact O-N 3.29Å; V238-N240 VanDerWaalsContact C-N 3.3Å; V238-N240 PolarHBondContact O-N 2.88Å; N240-M242 PolarHBondContact O-N 2.94Å; N240-N243 PolarHBondContact O-N 3.01Å; N240-F244 WeakPolarHBondContact O-CB 3.21Å; N240-F244 PolarHBondContact O-N 3.15Å
241	N	67.1	Low	70.9	Confident	103 Å²	103	95.7 Å²	95.7	55%	0.551	44%	0.44	S	S	*	.	H	α-helix	trans	-63.8	-35.9	175.4	-157.7	13.7	0	0	0	111.2	S237 V238 F244 R245	S237-N241 PolarHBondContact O-N 2.91Å; V238-N241 PolarHBondContact O-N 3.33Å; N241-F244 WeakPolarHBondContact O-CB 3.48Å; N241-F244 PolarHBondContact O-N 2.92Å; N241-R245 PolarHBondContact O-N 3.33Å
242	M	63.9	Low	71.3	Confident	38 Å²	38	92.6 Å²	92.6	19%	0.187	43%	0.427	C	S	.	.	H	α-helix	trans	-69.2	-44.3	179	-50.9	-106.9	-55.5	0	0	112.1	M43 V238 E239 N240 F244 R245 H246	M43-M242 VanDerWaalsContact CA-CE 3.41Å; M43-M242 HydrophobicContact CB-CE 3.34Å; M43-M242 HydrophobicContact CB-SD 4.08Å; M43-M242 HydrophobicContact CE-CB 3.93Å; M43-M242 HydrophobicContact CE-CE 3.74Å; M43-M242 HydrophobicContact CE-CG 4.02Å; M43-M242 HydrophobicContact CE-SD 3.17Å; M43-M242 WeakPolarHBondContact CE-SD 3.49Å; M43-M242 HydrophobicContact CG-CE 3.17Å; M43-M242 HydrophobicContact CG-SD 3.3Å; M43-M242 WeakPolarHBondContact CG-SD 3.41Å; M43-M242 HydrophobicContact SD-CE 3.98Å; M43-M242 HydrophobicContact SD-SD 3.31Å; V238-M242 WeakPolarHBondContact O-CG 3.4Å; V238-M242 PolarHBondContact O-N 3.45Å; E239-M242 WeakPolarHBondContact O-CB 3.31Å; E239-M242 PolarHBondContact O-N 3.48Å; N240-M242 PolarHBondContact O-N 2.94Å; M242-F244 VanDerWaalsContact C-N 3.28Å; M242-R245 PolarHBondContact O-N 3.21Å; M242-H246 PolarHBondContact O-N 3.32Å; M242-H246 PolarHBondContact O-ND1 3.08Å
243	N	71.9	Confident	72	Confident	47 Å²	47	87 Å²	87	25%	0.251	40%	0.404	S	S	.	.	H	α-helix	trans	-59.9	-42.2	172.9	-70.2	-31	0	0	0	111.1	E239 N240 H246 L247 Y290 R294	E239-N243 PolarHBondContact O-N 3.46Å; E239-N243 VanDerWaalsContact O-N 3.14Å; E239-N243 PolarHBondContact O-ND2 2.91Å; N240-N243 PolarHBondContact O-N 3.01Å; N243-H246 PolarHBondContact O-N 3.27Å; N243-L247 WeakPolarHBondContact O-CB 3.28Å; N243-L247 PolarHBondContact O-N 3.49Å; N243-Y290 WeakPolarHBondContact CA-OH 3.48Å; N243-Y290 PolarHBondContact OD1-OH 2.87Å; N243-R294 PolarHBondContact OD1-NE 3.28Å; N243-R294 PolarHBondContact OD1-NH2 3.07Å
244	F	74.5	Confident	72.5	Confident	74 Å²	74	78.9 Å²	78.9	33%	0.325	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-43.2	179.8	-175.7	-103.1	0	0	0	112.4	K232 N240 N241 M242 L247 L248	K232-F244 HydrophobicContact CD-CD2 4.14Å; K232-F244 HydrophobicContact CD-CE2 3.93Å; K232-F244 HydrophobicContact CD-CZ 4.36Å; N240-F244 WeakPolarHBondContact O-CB 3.21Å; N240-F244 PolarHBondContact O-N 3.15Å; N241-F244 WeakPolarHBondContact O-CB 3.48Å; N241-F244 PolarHBondContact O-N 2.92Å; M242-F244 VanDerWaalsContact C-N 3.28Å; F244-L247 PolarHBondContact O-N 2.94Å; F244-L248 HydrophobicContact CE1-CD2 4.18Å; F244-L248 VanDerWaalsContact O-CB 3.26Å; F244-L248 WeakPolarHBondContact O-CB 3.28Å; F244-L248 PolarHBondContact O-N 2.92Å
245	R	75.4	Confident	73.3	Confident	119 Å²	119	74 Å²	74	45%	0.449	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-46.7	178.2	-177.1	178.1	174.4	-177.7	-1.1	112.6	N241 M242 L247 L248 L249	N241-R245 PolarHBondContact O-N 3.33Å; M242-R245 PolarHBondContact O-N 3.21Å; R245-L247 VanDerWaalsContact C-N 3.35Å; R245-L248 PolarHBondContact O-N 2.93Å; R245-L249 HydrophobicContact CG-CD1 4.02Å; R245-L249 HydrophobicContact CG-CG 4.48Å; R245-L249 WeakPolarHBondContact O-CB 3.26Å; R245-L249 VanDerWaalsContact O-CG 3.29Å; R245-L249 WeakPolarHBondContact O-CG 3.5Å; R245-L249 PolarHBondContact O-N 3.32Å
246	H	80.9	Confident	74.3	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.009	34%	0.339	C	S	.	.	H	α-helix	trans	-62.3	-44.5	178.3	-72.7	82.6	0	0	0	111.2	M242 N243 A250 W286 Y290	M242-H246 PolarHBondContact O-N 3.32Å; M242-H246 PolarHBondContact O-ND1 3.08Å; N243-H246 PolarHBondContact O-N 3.27Å; H246-A250 VanDerWaalsContact O-CB 3.27Å; H246-A250 WeakPolarHBondContact O-CB 3.36Å; H246-A250 PolarHBondContact O-N 3.17Å; H246-W286 AromaticContact CD2-CZ2 3.72Å; H246-Y290 HydrophobicContact CB-CD2 3.93Å; H246-Y290 HydrophobicContact CB-CE1 4.28Å; H246-Y290 HydrophobicContact CB-CE2 3.6Å; H246-Y290 HydrophobicContact CB-CG 4.39Å; H246-Y290 AromaticContact CD2-CD2 3.86Å; H246-Y290 AromaticContact CD2-CE2 3.64Å; H246-Y290 AromaticContact CG-CD2 3.98Å; H246-Y290 AromaticContact CG-CE2 3.47Å; H246-Y290 VanDerWaalsContact CG-CE2 3.47Å; H246-Y290 AromaticContact ND1-CE2 3.96Å
247	L	80.8	Confident	76	Confident	42 Å²	42	55.6 Å²	55.6	22%	0.22	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-45.2	178.7	-176.4	63.4	0	0	0	111.8	N243 F244 R245 A250 L251 F291	N243-L247 WeakPolarHBondContact O-CB 3.28Å; N243-L247 PolarHBondContact O-N 3.49Å; F244-L247 PolarHBondContact O-N 2.94Å; R245-L247 VanDerWaalsContact C-N 3.35Å; L247-A250 PolarHBondContact O-N 3.22Å; L247-L251 HydrophobicContact CD1-CD1 4.05Å; L247-L251 HydrophobicContact CD1-CG 4.1Å; L247-L251 HydrophobicContact CD2-CD1 4.44Å; L247-L251 HydrophobicContact CG-CD1 3.8Å; L247-L251 HydrophobicContact CG-CG 4.27Å; L247-L251 WeakPolarHBondContact O-CB 3.43Å; L247-L251 VanDerWaalsContact O-CG 3.27Å; L247-L251 WeakPolarHBondContact O-CG 3.15Å; L247-L251 PolarHBondContact O-N 2.96Å; L247-F291 HydrophobicContact CD1-CE2 4.33Å; L247-F291 HydrophobicContact CD1-CZ 4.41Å
248	L	79.8	Confident	77.6	Confident	98 Å²	98	54 Å²	54	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-61.9	-45.8	178.4	-177.6	67.1	0	0	0	111.6	F244 R245 A250 S252	F244-L248 HydrophobicContact CE1-CD2 4.18Å; F244-L248 VanDerWaalsContact O-CB 3.26Å; F244-L248 WeakPolarHBondContact O-CB 3.28Å; F244-L248 PolarHBondContact O-N 2.92Å; R245-L248 PolarHBondContact O-N 2.93Å; L248-A250 VanDerWaalsContact C-N 3.3Å; L248-A250 PolarHBondContact O-N 2.68Å; L248-S252 WeakPolarHBondContact O-CB 3.41Å; L248-S252 PolarHBondContact O-N 2.9Å; L248-S252 PolarHBondContact O-OG 3.19Å
249	L	79.1	Confident	79	Confident	43 Å²	43	50.2 Å²	50.2	23%	0.225	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-41.2	176.9	-77.4	173.3	0	0	0	111.6	M35 R126 R245 S252 G253	M35-L249 HydrophobicContact CE-CB 3.88Å; R126-L249 PolarHBondContact NH2-O 2.85Å; R245-L249 HydrophobicContact CG-CD1 4.02Å; R245-L249 HydrophobicContact CG-CG 4.48Å; R245-L249 WeakPolarHBondContact O-CB 3.26Å; R245-L249 VanDerWaalsContact O-CG 3.29Å; R245-L249 WeakPolarHBondContact O-CG 3.5Å; R245-L249 PolarHBondContact O-N 3.32Å; L249-S252 PolarHBondContact O-OG 2.98Å; L249-G253 PolarHBondContact O-N 3.38Å
250	A	83.9	Confident	80	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-74.1	-43.6	-178.5	0	0	0	0	0	112.5	H246 L247 L248 S252 G253 V254 G283 W286 I287	H246-A250 VanDerWaalsContact O-CB 3.27Å; H246-A250 WeakPolarHBondContact O-CB 3.36Å; H246-A250 PolarHBondContact O-N 3.17Å; L247-A250 PolarHBondContact O-N 3.22Å; L248-A250 VanDerWaalsContact C-N 3.3Å; L248-A250 PolarHBondContact O-N 2.68Å; A250-S252 VanDerWaalsContact C-N 3.29Å; A250-S252 PolarHBondContact O-N 2.92Å; A250-G253 WeakPolarHBondContact O-CA 3.49Å; A250-G253 PolarHBondContact O-N 3.19Å; A250-V254 PolarHBondContact O-N 3.32Å; A250-V254 VanDerWaalsContact O-N 3.1Å; A250-G283 WeakPolarHBondContact O-CA 3.26Å; A250-W286 HydrophobicContact CB-CB 4.23Å; A250-W286 HydrophobicContact CB-CG 3.9Å; A250-I287 HydrophobicContact CB-CD1 4.02Å; A250-I287 HydrophobicContact CB-CG1 3.31Å
251	L	85.1	Confident	81	Confident	68 Å²	68	43 Å²	43	36%	0.356	22%	0.223	S	C	.	.	H	α-helix	trans	-59.4	-40	172.7	-73.6	172.8	0	0	0	111.5	L247 G253 V254 V255 I287	L247-L251 HydrophobicContact CD1-CD1 4.05Å; L247-L251 HydrophobicContact CD1-CG 4.1Å; L247-L251 HydrophobicContact CD2-CD1 4.44Å; L247-L251 HydrophobicContact CG-CD1 3.8Å; L247-L251 HydrophobicContact CG-CG 4.27Å; L247-L251 WeakPolarHBondContact O-CB 3.43Å; L247-L251 VanDerWaalsContact O-CG 3.27Å; L247-L251 WeakPolarHBondContact O-CG 3.15Å; L247-L251 PolarHBondContact O-N 2.96Å; L251-G253 VanDerWaalsContact C-N 3.25Å; L251-G253 PolarHBondContact O-N 3.15Å; L251-V254 PolarHBondContact O-N 2.89Å; L251-V254 VanDerWaalsContact O-N 3.13Å; L251-V255 WeakPolarHBondContact O-CG2 3.28Å; L251-V255 PolarHBondContact O-N 3.45Å; L251-I287 HydrophobicContact CD2-CD1 3.92Å; L251-I287 HydrophobicContact CG-CD1 4.27Å
252	S	81.1	Confident	81.9	Confident	26 Å²	26	38.5 Å²	38.5	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-36.7	173.7	75.7	0	0	0	0	112.1	R126 L248 L249 A250 V254 I256 P257	R126-S252 PolarHBondContact NH2-OG 3.12Å; L248-S252 WeakPolarHBondContact O-CB 3.41Å; L248-S252 PolarHBondContact O-N 2.9Å; L248-S252 PolarHBondContact O-OG 3.19Å; L249-S252 PolarHBondContact O-OG 2.98Å; A250-S252 VanDerWaalsContact C-N 3.29Å; A250-S252 PolarHBondContact O-N 2.92Å; S252-V254 VanDerWaalsContact C-N 3.3Å; S252-V254 PolarHBondContact O-N 2.88Å; S252-I256 VanDerWaalsContact O-CB 3.3Å; S252-I256 WeakPolarHBondContact O-CB 3.41Å; S252-I256 VanDerWaalsContact O-CG1 3.28Å; S252-I256 WeakPolarHBondContact O-CG1 3.44Å; S252-I256 PolarHBondContact O-N 3.03Å; S252-P257 WeakPolarHBondContact O-CD 3.44Å
253	G	85.3	Confident	82.7	Confident	4 Å²	4	39 Å²	39	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-71	-22	176.4	0	0	0	0	0	114	L249 A250 L251 P257	L249-G253 PolarHBondContact O-N 3.38Å; A250-G253 WeakPolarHBondContact O-CA 3.49Å; A250-G253 PolarHBondContact O-N 3.19Å; L251-G253 VanDerWaalsContact C-N 3.25Å; L251-G253 PolarHBondContact O-N 3.15Å; G253-P257 VanDerWaalsContact O-CD 3.3Å; G253-P257 WeakPolarHBondContact O-CD 3.23Å; G253-P257 VanDerWaalsContact O-CG 3.29Å; G253-P257 WeakPolarHBondContact O-CG 3.43Å
254	V	88.8	Confident	83.2	Confident	17 Å²	17	39.7 Å²	39.7	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-83.9	-53.9	171.8	179.4	0	0	0	0	110.4	L186 A250 L251 S252 F258 P280 G283 F284 I287	L186-V254 HydrophobicContact CD1-CG1 4.42Å; A250-V254 PolarHBondContact O-N 3.32Å; A250-V254 VanDerWaalsContact O-N 3.1Å; L251-V254 PolarHBondContact O-N 2.89Å; L251-V254 VanDerWaalsContact O-N 3.13Å; S252-V254 VanDerWaalsContact C-N 3.3Å; S252-V254 PolarHBondContact O-N 2.88Å; V254-F258 WeakPolarHBondContact O-CB 3.44Å; V254-P280 HydrophobicContact CG1-CB 4.46Å; V254-G283 VanDerWaalsContact CG2-C 3.48Å; V254-F284 HydrophobicContact CG2-CB 4.18Å; V254-F284 VanDerWaalsContact CG2-N 3.29Å; V254-I287 HydrophobicContact CG2-CD1 4.24Å
255	V	87.8	Confident	83.1	Confident	79 Å²	79	43.3 Å²	43.3	48%	0.479	23%	0.225	S	C	.	.	H	α-helix	trans	-72.7	-51.2	-168.5	175.8	0	0	0	0	111.4	L251 F258 V259	L251-V255 WeakPolarHBondContact O-CG2 3.28Å; L251-V255 PolarHBondContact O-N 3.45Å; V255-F258 WeakPolarHBondContact O-CB 3.08Å; V255-F258 PolarHBondContact O-N 3.14Å; V255-V259 HydrophobicContact CG1-CG2 4.21Å; V255-V259 WeakPolarHBondContact O-CG2 3.29Å; V255-V259 PolarHBondContact O-N 3.41Å; V255-V259 VanDerWaalsContact O-N 3.12Å
256	I	84.1	Confident	83	Confident	48 Å²	48	44 Å²	44	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-49.9	-170.2	-56.2	174.9	0	0	0	111	T122 N125 S252 F258 V259 P260	T122-I256 HydrophobicContact CG2-CG2 3.75Å; T122-I256 VanDerWaalsContact CG2-O 3.32Å; T122-I256 WeakPolarHBondContact CG2-O 3.39Å; N125-I256 HydrophobicContact CB-CG2 4.4Å; S252-I256 VanDerWaalsContact O-CB 3.3Å; S252-I256 WeakPolarHBondContact O-CB 3.41Å; S252-I256 VanDerWaalsContact O-CG1 3.28Å; S252-I256 WeakPolarHBondContact O-CG1 3.44Å; S252-I256 PolarHBondContact O-N 3.03Å; I256-F258 PolarHBondContact O-N 3.1Å; I256-V259 PolarHBondContact O-N 3.46Å; I256-P260 WeakPolarHBondContact O-CD 3.23Å
257	P	87.1	Confident	82.7	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-28	174.7	-29.7	41.5	0	0	0	114.9	Q119 S252 G253 L279 P280	Q119-P257 VanDerWaalsContact CG-O 3.26Å; Q119-P257 WeakPolarHBondContact CG-O 3.45Å; Q119-P257 PolarHBondContact NE2-O 2.95Å; S252-P257 WeakPolarHBondContact O-CD 3.44Å; G253-P257 VanDerWaalsContact O-CD 3.3Å; G253-P257 WeakPolarHBondContact O-CD 3.23Å; G253-P257 VanDerWaalsContact O-CG 3.29Å; G253-P257 WeakPolarHBondContact O-CG 3.43Å; P257-L279 HydrophobicContact CB-CB 4.15Å; P257-L279 HydrophobicContact CB-CD2 3.85Å; P257-L279 HydrophobicContact CB-CG 3.81Å; P257-L279 HydrophobicContact CG-CD2 4.25Å; P257-L279 HydrophobicContact CG-CG 4.12Å; P257-P280 HydrophobicContact CB-CG 4.1Å
258	F	90.2	Very high	82.6	Confident	27 Å²	27	47.1 Å²	47.1	12%	0.118	25%	0.252	C	S	.	.	H	α-helix	trans	-79.1	-30.8	-179.1	-177.1	-111.5	0	0	0	113.2	Y182 N185 V254 V255 I256 A261 S262 V276 L277 P280	Y182-F258 AromaticContact CD1-CE1 3.86Å; Y182-F258 HydrophobicContact CD1-CE1 3.86Å; Y182-F258 HydrophobicContact CD1-CZ 4.25Å; Y182-F258 HydrophobicContact CE1-CE1 4.39Å; Y182-F258 HydrophobicContact CG-CE1 4.45Å; N185-F258 HydrophobicContact CB-CE2 3.97Å; N185-F258 HydrophobicContact CB-CZ 3.78Å; N185-F258 VanDerWaalsContact CG-CZ 3.45Å; N185-F258 WeakPolarHBondContact OD1-CE2 3.4Å; V254-F258 WeakPolarHBondContact O-CB 3.44Å; V255-F258 WeakPolarHBondContact O-CB 3.08Å; V255-F258 PolarHBondContact O-N 3.14Å; I256-F258 PolarHBondContact O-N 3.1Å; F258-A261 CarbonylContact O-C 3.59Å; F258-A261 WeakPolarHBondContact O-CA 3.37Å; F258-A261 PolarHBondContact O-N 3.43Å; F258-S262 VanDerWaalsContact CE1-CB 3.41Å; F258-S262 WeakPolarHBondContact O-CB 3.45Å; F258-S262 PolarHBondContact O-N 3.46Å; F258-V276 HydrophobicContact CE2-CG2 4.31Å; F258-L277 HydrophobicContact CD2-CD2 3.96Å; F258-L277 HydrophobicContact CE2-CD2 4.01Å; F258-P280 HydrophobicContact CB-CG 3.87Å; F258-P280 HydrophobicContact CD2-CG 4.44Å
259	V	86.4	Confident	82.4	Confident	44 Å²	44	43.8 Å²	43.8	27%	0.267	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-53	-44.8	-174.2	169	0	0	0	0	114.4	V255 I256 A261 S262 F265	V255-V259 HydrophobicContact CG1-CG2 4.21Å; V255-V259 WeakPolarHBondContact O-CG2 3.29Å; V255-V259 PolarHBondContact O-N 3.41Å; V255-V259 VanDerWaalsContact O-N 3.12Å; I256-V259 PolarHBondContact O-N 3.46Å; V259-A261 PolarHBondContact O-N 2.96Å; V259-S262 WeakPolarHBondContact CA-OG 3.49Å; V259-S262 PolarHBondContact O-N 2.88Å; V259-S262 PolarHBondContact O-OG 3.39Å; V259-F265 HydrophobicContact CG1-CD2 3.67Å; V259-F265 HydrophobicContact CG1-CE2 3.48Å; V259-F265 VanDerWaalsContact CG1-CE2 3.48Å
260	P	82.6	Confident	82.5	Confident	20 Å²	20	43.2 Å²	43.2	13%	0.13	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-61.4	-32.6	177.7	-26	37.2	0	0	0	113.2	E118 V121 T122 I256	E118-P260 HydrophobicContact CB-CB 4.23Å; E118-P260 HydrophobicContact CG-CB 3.81Å; V121-P260 HydrophobicContact CG1-CG 4.27Å; T122-P260 HydrophobicContact CG2-CG 4.07Å; I256-P260 WeakPolarHBondContact O-CD 3.23Å
261	A	85.3	Confident	82.4	Confident	3 Å²	3	44.1 Å²	44.1	3%	0.025	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-90.3	-7.5	179.7	0	0	0	0	0	113.4	F258 V259 N263 F270 V276	F258-A261 CarbonylContact O-C 3.59Å; F258-A261 WeakPolarHBondContact O-CA 3.37Å; F258-A261 PolarHBondContact O-N 3.43Å; V259-A261 PolarHBondContact O-N 2.96Å; A261-N263 PolarHBondContact O-N 3.18Å; A261-F270 HydrophobicContact CB-CZ 4.2Å; A261-V276 HydrophobicContact CB-CB 3.88Å; A261-V276 HydrophobicContact CB-CG1 3.98Å; A261-V276 HydrophobicContact CB-CG2 4.3Å
262	S	85.4	Confident	82.6	Confident	8 Å²	8	41.2 Å²	41.2	6%	0.056	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	10.6	-174.4	75.9	0	0	0	0	113.6	R178 Y182 F258 V259 V264	R178-S262 PolarHBondContact NH2-O 2.97Å; Y182-S262 VanDerWaalsContact CE1-O 3.29Å; Y182-S262 WeakPolarHBondContact CE1-O 3.43Å; Y182-S262 PolarHBondContact OH-O 3.47Å; Y182-S262 VanDerWaalsContact OH-O 3.06Å; F258-S262 VanDerWaalsContact CE1-CB 3.41Å; F258-S262 WeakPolarHBondContact O-CB 3.45Å; F258-S262 PolarHBondContact O-N 3.46Å; V259-S262 WeakPolarHBondContact CA-OG 3.49Å; V259-S262 PolarHBondContact O-N 2.88Å; V259-S262 PolarHBondContact O-OG 3.39Å; S262-V264 PolarHBondContact O-N 2.92Å; S262-V264 WeakPolarHBondContact OG-CG2 3.36Å
263	N	80.8	Confident	82.9	Confident	49 Å²	49	40.2 Å²	40.2	26%	0.262	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-1.2	-176.7	-156.8	-24.7	0	0	0	113.5	R178 A261 F265 F266 T267 V268	R178-N263 PolarHBondContact NH2-O 3.32Å; A261-N263 PolarHBondContact O-N 3.18Å; N263-F265 PolarHBondContact O-N 2.91Å; N263-F266 CarbonylContact C-O 3.28Å; N263-F266 WeakPolarHBondContact CA-O 3.43Å; N263-F266 PolarHBondContact OD1-O 3.44Å; N263-T267 VanDerWaalsContact OD1-CA 3.3Å; N263-T267 WeakPolarHBondContact OD1-CA 3.47Å; N263-V268 HydrophobicContact CB-CG2 4.03Å
264	V	82	Confident	83.3	Confident	61 Å²	61	40.1 Å²	40.1	37%	0.37	22%	0.219	S	C	.	.	S	Bend	trans	-61.3	-47.5	-165.5	168.8	0	0	0	0	112.1	Y182 S262	Y182-V264 WeakPolarHBondContact OH-CG2 3.44Å; S262-V264 PolarHBondContact O-N 2.92Å; S262-V264 WeakPolarHBondContact OG-CG2 3.36Å
265	F	73.7	Confident	83.5	Confident	150 Å²	150	41.8 Å²	41.8	66%	0.658	22%	0.223	S	C	*	.	S	Bend	trans	-103.1	-28.4	-177.4	-63.7	-71.3	0	0	0	112.6	V259 N263	V259-F265 HydrophobicContact CG1-CD2 3.67Å; V259-F265 HydrophobicContact CG1-CE2 3.48Å; V259-F265 VanDerWaalsContact CG1-CE2 3.48Å; N263-F265 PolarHBondContact O-N 2.91Å
266	F	73.2	Confident	83.7	Confident	134 Å²	134	38.1 Å²	38.1	59%	0.588	20%	0.201	S	C	*	.	S	Bend	trans	-138.2	139.8	-175.2	-53.5	-73.3	0	0	0	110	N263 V268	N263-F266 CarbonylContact C-O 3.28Å; N263-F266 WeakPolarHBondContact CA-O 3.43Å; N263-F266 PolarHBondContact OD1-O 3.44Å; F266-V268 PolarHBondContact O-N 3.31Å
267	T	75.1	Confident	84.2	Confident	95 Å²	95	36 Å²	36	58%	0.583	19%	0.19	S	C	*	.			trans	-66.8	130	171.9	50.2	0	0	0	0	110.4	F158 N263	F158-T267 VanDerWaalsContact CE2-O 3.31Å; F158-T267 WeakPolarHBondContact CE2-O 3.31Å; N263-T267 VanDerWaalsContact OD1-CA 3.3Å; N263-T267 WeakPolarHBondContact OD1-CA 3.47Å
268	V	77.2	Confident	84.6	Confident	15 Å²	15	36 Å²	36	9%	0.091	19%	0.19	C	C	.	.			trans	-114.2	144.8	174.4	-65.2	0	0	0	0	109	N263 F266 F270	N263-V268 HydrophobicContact CB-CG2 4.03Å; F266-V268 PolarHBondContact O-N 3.31Å; V268-F270 HydrophobicContact CB-CD1 4.27Å; V268-F270 HydrophobicContact CB-CE1 3.75Å; V268-F270 HydrophobicContact CB-CZ 3.89Å; V268-F270 HydrophobicContact CG1-CE1 4.45Å; V268-F270 HydrophobicContact CG1-CZ 4.4Å; V268-F270 HydrophobicContact CG2-CD1 4.42Å; V268-F270 HydrophobicContact CG2-CD2 4.37Å; V268-F270 HydrophobicContact CG2-CE1 4.01Å; V268-F270 HydrophobicContact CG2-CE2 3.95Å; V268-F270 HydrophobicContact CG2-CZ 3.72Å; V268-F270 PolarHBondContact O-N 2.87Å
269	G	76.2	Confident	84.8	Confident	27 Å²	27	34.8 Å²	34.8	28%	0.278	19%	0.185	S	C	.	.	S	Bend	trans	-78.9	37.7	-175.6	0	0	0	0	0	114.9	F158	F158-G269 VanDerWaalsContact CE1-N 3.34Å
270	F	81.9	Confident	85.2	Confident	32 Å²	32	32.8 Å²	32.8	14%	0.14	17%	0.173	C	C	.	.			trans	-156	156.4	173.8	55.4	-91.4	0	0	0	110.9	D162 A261 V268 A273 V276	D162-F270 CarbonylContact O-C 3.35Å; D162-F270 WeakPolarHBondContact O-CA 3.21Å; D162-F270 PolarHBondContact O-N 3.32Å; A261-F270 HydrophobicContact CB-CZ 4.2Å; V268-F270 HydrophobicContact CB-CD1 4.27Å; V268-F270 HydrophobicContact CB-CE1 3.75Å; V268-F270 HydrophobicContact CB-CZ 3.89Å; V268-F270 HydrophobicContact CG1-CE1 4.45Å; V268-F270 HydrophobicContact CG1-CZ 4.4Å; V268-F270 HydrophobicContact CG2-CD1 4.42Å; V268-F270 HydrophobicContact CG2-CD2 4.37Å; V268-F270 HydrophobicContact CG2-CE1 4.01Å; V268-F270 HydrophobicContact CG2-CE2 3.95Å; V268-F270 HydrophobicContact CG2-CZ 3.72Å; V268-F270 PolarHBondContact O-N 2.87Å; F270-A273 HydrophobicContact CD2-CB 3.74Å; F270-A273 HydrophobicContact CE2-CB 4.16Å; F270-A273 HydrophobicContact CG-CB 4.09Å; F270-V276 HydrophobicContact CE1-CG1 4.19Å; F270-V276 HydrophobicContact CE2-CG1 3.88Å; F270-V276 HydrophobicContact CE2-CG2 4.14Å; F270-V276 HydrophobicContact CZ-CG1 3.51Å
271	V	82.3	Confident	85.9	Confident	19 Å²	19	31.8 Å²	31.8	12%	0.115	17%	0.167	C	C	.	.	S	Bend	trans	-85	-53.7	177	177.4	0	0	0	0	111.4	Q164 I181 I204	Q164-V271 HydrophobicContact CG-CB 4.09Å; Q164-V271 HydrophobicContact CG-CG1 3.58Å; Q164-V271 HydrophobicContact CG-CG2 3.52Å; I181-V271 HydrophobicContact CD1-CG1 4.39Å; I181-V271 VanDerWaalsContact CG2-O 3.32Å; I181-V271 WeakPolarHBondContact CG2-O 3.15Å; I204-V271 HydrophobicContact CD1-CG1 3.91Å
272	L	87.6	Confident	86.3	Confident	7 Å²	7	31.8 Å²	31.8	4%	0.037	17%	0.166	C	C	.	.			trans	-148.3	133.4	-176.4	175.4	65.2	0	0	0	106	L184 N185 I188 Y199 I204	L184-L272 HydrophobicContact CB-CD2 4.2Å; N185-L272 HydrophobicContact CB-CD1 4.11Å; N185-L272 WeakPolarHBondContact ND2-CD1 3.31Å; N185-L272 WeakPolarHBondContact OD1-CD1 3.49Å; I188-L272 HydrophobicContact CD1-CD1 4.13Å; I188-L272 HydrophobicContact CD1-CD2 3.76Å; I188-L272 HydrophobicContact CD1-CG 4.15Å; Y199-L272 HydrophobicContact CD1-CD2 3.82Å; Y199-L272 HydrophobicContact CD2-CB 3.98Å; Y199-L272 HydrophobicContact CD2-CD2 3.94Å; Y199-L272 HydrophobicContact CD2-CG 3.85Å; Y199-L272 WeakPolarHBondContact CD2-O 3.46Å; Y199-L272 HydrophobicContact CE1-CD2 3.86Å; Y199-L272 HydrophobicContact CE2-CD2 3.98Å; Y199-L272 HydrophobicContact CE2-CG 4.12Å; Y199-L272 HydrophobicContact CG-CB 3.9Å; Y199-L272 HydrophobicContact CG-CD2 3.86Å; Y199-L272 HydrophobicContact CG-CG 4.08Å; I204-L272 HydrophobicContact CD1-CB 4.36Å; I204-L272 HydrophobicContact CD1-CD2 4.14Å
273	A	89.2	Confident	86.7	Confident	5 Å²	5	31.6 Å²	31.6	4%	0.041	17%	0.165	C	C	.	.			trans	-146.7	134	-179.7	0	0	0	0	0	110.2	F270 R275 V276	F270-A273 HydrophobicContact CD2-CB 3.74Å; F270-A273 HydrophobicContact CE2-CB 4.16Å; F270-A273 HydrophobicContact CG-CB 4.09Å; A273-R275 HydrophobicContact CB-CG 4.28Å; A273-V276 HydrophobicContact CB-CG1 4.38Å; A273-V276 HydrophobicContact CB-CG2 4.35Å; A273-V276 WeakPolarHBondContact O-CG2 3.3Å
274	E	92.7	Very high	87.4	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.154	C	C	.	.	S	Bend	trans	-68.4	-42.8	-179.3	-67.9	168.8	-142.3	0	0	111.5	V61 D64 L195 C196 V276 L277	V61-E274 HydrophobicContact CG2-CB 4Å; V61-E274 HydrophobicContact CG2-CG 4.39Å; D64-E274 HydrophobicContact CB-CB 3.87Å; L195-E274 WeakPolarHBondContact CA-OE1 3.46Å; L195-E274 WeakPolarHBondContact CB-OE1 3.37Å; L195-E274 HydrophobicContact CD2-CG 3.95Å; C196-E274 PolarHBondContact N-OE1 3.32Å; C196-E274 VanDerWaalsContact O-OE1 3.09Å; E274-V276 PolarHBondContact O-N 3.14Å; E274-L277 WeakPolarHBondContact O-CA 3.23Å; E274-L277 WeakPolarHBondContact O-CB 3.44Å; E274-L277 PolarHBondContact O-N 2.61Å
275	R	92.9	Very high	88	Confident	52 Å²	52	26.6 Å²	26.6	20%	0.196	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-52.9	-31.6	179.7	62.8	-179.3	174.6	-87.3	-0.8	114.4	D64 A65 E74 A273 L277 Y278	D64-R275 WeakPolarHBondContact OD2-CB 3.44Å; D64-R275 PolarHBondContact OD2-N 3.25Å; D64-R275 VanDerWaalsContact OD2-N 3.16Å; D64-R275 IonicContact OD2-NH1 2.76Å; A65-R275 HydrophobicContact CB-CB 4.28Å; E74-R275 HydrophobicContact CG-CB 4.16Å; E74-R275 HydrophobicContact CG-CG 4.48Å; A273-R275 HydrophobicContact CB-CG 4.28Å; R275-L277 PolarHBondContact O-N 3.47Å; R275-Y278 VanDerWaalsContact O-CB 3.29Å; R275-Y278 WeakPolarHBondContact O-CB 3.28Å; R275-Y278 PolarHBondContact O-N 2.99Å
276	V	91.5	Very high	89	Confident	2 Å²	2	19.5 Å²	19.5	1%	0.012	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-74.2	-13.9	179.2	-58	0	0	0	0	113.5	Q119 F258 A261 F270 A273 E274 Y278 P280	Q119-V276 PolarHBondContact NE2-O 3.12Å; F258-V276 HydrophobicContact CE2-CG2 4.31Å; A261-V276 HydrophobicContact CB-CB 3.88Å; A261-V276 HydrophobicContact CB-CG1 3.98Å; A261-V276 HydrophobicContact CB-CG2 4.3Å; F270-V276 HydrophobicContact CE1-CG1 4.19Å; F270-V276 HydrophobicContact CE2-CG1 3.88Å; F270-V276 HydrophobicContact CE2-CG2 4.14Å; F270-V276 HydrophobicContact CZ-CG1 3.51Å; A273-V276 HydrophobicContact CB-CG1 4.38Å; A273-V276 HydrophobicContact CB-CG2 4.35Å; A273-V276 WeakPolarHBondContact O-CG2 3.3Å; E274-V276 PolarHBondContact O-N 3.14Å; V276-Y278 VanDerWaalsContact C-N 3.34Å; V276-P280 WeakPolarHBondContact O-CD 3.38Å; V276-P280 WeakPolarHBondContact O-CG 3.32Å
277	L	95.1	Very high	89.8	Confident	3 Å²	3	14.2 Å²	14.2	2%	0.016	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-88.8	-2.6	175.9	-58.6	176	0	0	0	112.5	V61 N185 I188 L189 F258 E274 R275 L279 P280 S281	V61-L277 HydrophobicContact CG2-CB 3.75Å; V61-L277 HydrophobicContact CG2-CD1 3.92Å; V61-L277 HydrophobicContact CG2-CG 4.43Å; N185-L277 HydrophobicContact CB-CD2 4.04Å; N185-L277 VanDerWaalsContact O-CD1 3.3Å; N185-L277 WeakPolarHBondContact O-CD1 3.5Å; I188-L277 HydrophobicContact CB-CD1 4.23Å; I188-L277 HydrophobicContact CG2-CD1 4.07Å; L189-L277 HydrophobicContact CD2-CB 4.18Å; L189-L277 HydrophobicContact CG-CD1 4.4Å; F258-L277 HydrophobicContact CD2-CD2 3.96Å; F258-L277 HydrophobicContact CE2-CD2 4.01Å; E274-L277 WeakPolarHBondContact O-CA 3.23Å; E274-L277 WeakPolarHBondContact O-CB 3.44Å; E274-L277 PolarHBondContact O-N 2.61Å; R275-L277 PolarHBondContact O-N 3.47Å; L277-L279 PolarHBondContact O-N 3.27Å; L277-P280 HydrophobicContact CD2-CB 4.5Å; L277-S281 WeakPolarHBondContact O-CB 3.16Å; L277-S281 PolarHBondContact O-N 2.85Å
278	Y	96.3	Very high	90.6	Very high	1 Å²	1	11.6 Å²	11.6	0%	0.004	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-47.5	178.3	-170.7	-78.9	0	0	0	112.2	H21 V24 F56 H62 A65 I75 A78 R275 V276 S281	H21-Y278 AromaticContact ND1-CE2 3.66Å; H21-Y278 AromaticContact ND1-CZ 3.62Å; H21-Y278 PolarHBondContact ND1-OH 3.24Å; V24-Y278 HydrophobicContact CG1-CE1 4.06Å; F56-Y278 HydrophobicContact CZ-CD1 4.38Å; F56-Y278 AromaticContact CZ-CE1 3.78Å; F56-Y278 HydrophobicContact CZ-CE1 3.78Å; F56-Y278 AromaticContact CZ-CZ 3.95Å; H62-Y278 HydrophobicContact CB-CD2 4.07Å; H62-Y278 HydrophobicContact CB-CE2 3.97Å; H62-Y278 AromaticContact CE1-CD2 3.79Å; H62-Y278 AromaticContact CG-CD2 3.81Å; H62-Y278 AromaticContact CG-CE2 3.81Å; H62-Y278 AromaticContact ND1-CD2 3Å; H62-Y278 WeakPolarHBondContact ND1-CD2 3.37Å; H62-Y278 AromaticContact ND1-CE2 3.36Å; H62-Y278 WeakPolarHBondContact ND1-CE2 3.17Å; H62-Y278 AromaticContact ND1-CG 3.61Å; A65-Y278 HydrophobicContact CB-CD2 3.52Å; A65-Y278 HydrophobicContact CB-CE2 4.19Å; A65-Y278 HydrophobicContact CB-CG 4.23Å; I75-Y278 HydrophobicContact CG1-CE2 4.13Å; A78-Y278 HydrophobicContact CB-CD1 3.68Å; A78-Y278 HydrophobicContact CB-CE1 3.53Å; R275-Y278 VanDerWaalsContact O-CB 3.29Å; R275-Y278 WeakPolarHBondContact O-CB 3.28Å; R275-Y278 PolarHBondContact O-N 2.99Å; V276-Y278 VanDerWaalsContact C-N 3.34Å; Y278-S281 PolarHBondContact O-OG 2.98Å
279	L	93.5	Very high	91.3	Very high	3 Å²	3	10.9 Å²	10.9	2%	0.016	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-44.2	177.9	-168.6	63.4	0	0	0	112.9	A78 Y81 Q119 P257 L277 S281 L282	A78-L279 HydrophobicContact CB-CD1 3.91Å; Y81-L279 HydrophobicContact CD1-CD1 3.63Å; Y81-L279 HydrophobicContact CD1-CD2 4.41Å; Y81-L279 HydrophobicContact CD2-CD1 4.46Å; Y81-L279 HydrophobicContact CD2-CD2 3.77Å; Y81-L279 HydrophobicContact CE1-CD1 4.06Å; Y81-L279 HydrophobicContact CE2-CD2 4.21Å; Y81-L279 HydrophobicContact CG-CD1 3.88Å; Y81-L279 HydrophobicContact CG-CD2 3.93Å; Q119-L279 HydrophobicContact CB-CD2 4.14Å; P257-L279 HydrophobicContact CB-CB 4.15Å; P257-L279 HydrophobicContact CB-CD2 3.85Å; P257-L279 HydrophobicContact CB-CG 3.81Å; P257-L279 HydrophobicContact CG-CD2 4.25Å; P257-L279 HydrophobicContact CG-CG 4.12Å; L277-L279 PolarHBondContact O-N 3.27Å; L279-S281 PolarHBondContact O-N 3.43Å; L279-L282 HydrophobicContact CD1-CD1 3.63Å; L279-L282 WeakPolarHBondContact O-CB 3.06Å; L279-L282 PolarHBondContact O-N 2.97Å; L279-L282 VanDerWaalsContact O-N 3.12Å
280	P	94.9	Very high	91.9	Very high	1 Å²	1	10 Å²	10	1%	0.006	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.4	170.4	-30.7	36.3	0	0	0	115.1	V254 P257 F258 V276 L277 L282 G283 F284	V254-P280 HydrophobicContact CG1-CB 4.46Å; P257-P280 HydrophobicContact CB-CG 4.1Å; F258-P280 HydrophobicContact CB-CG 3.87Å; F258-P280 HydrophobicContact CD2-CG 4.44Å; V276-P280 WeakPolarHBondContact O-CD 3.38Å; V276-P280 WeakPolarHBondContact O-CG 3.32Å; L277-P280 HydrophobicContact CD2-CB 4.5Å; P280-L282 PolarHBondContact O-N 3.21Å; P280-G283 PolarHBondContact O-N 3.24Å; P280-G283 VanDerWaalsContact O-N 3.15Å; P280-F284 PolarHBondContact O-N 3.44Å
281	S	96.6	Very high	92.1	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.1	-23.7	179.9	81.8	0	0	0	0	112.4	F56 H62 L277 Y278 L279 G283 F284 C285	F56-S281 WeakPolarHBondContact CD2-OG 3.36Å; F56-S281 WeakPolarHBondContact CE2-OG 3.45Å; H62-S281 PolarHBondContact CE1-OG 3.47Å; H62-S281 PolarHBondContact NE2-OG 3.14Å; L277-S281 WeakPolarHBondContact O-CB 3.16Å; L277-S281 PolarHBondContact O-N 2.85Å; Y278-S281 PolarHBondContact O-OG 2.98Å; L279-S281 PolarHBondContact O-N 3.43Å; S281-G283 VanDerWaalsContact C-N 3.28Å; S281-G283 PolarHBondContact O-N 3.29Å; S281-F284 PolarHBondContact O-N 3.11Å; S281-F284 VanDerWaalsContact O-N 3.1Å; S281-C285 WeakPolarHBondContact O-CB 3.33Å; S281-C285 PolarHBondContact O-N 3.48Å; S281-C285 PolarHBondContact O-SG 3.31Å
282	L	94.9	Very high	92.3	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-55.7	-46	173.6	-75.3	176.2	0	0	0	111	F31 Y32 F56 Y81 I82 L279 P280 W286	F31-L282 HydrophobicContact CD1-CD1 4.45Å; F31-L282 HydrophobicContact CD1-CD2 4.44Å; F31-L282 HydrophobicContact CE1-CB 4.18Å; F31-L282 HydrophobicContact CE1-CD1 4.14Å; F31-L282 HydrophobicContact CZ-CD1 4.3Å; Y32-L282 VanDerWaalsContact CE1-O 3.25Å; Y32-L282 WeakPolarHBondContact CE1-O 3.34Å; Y32-L282 WeakPolarHBondContact OH-CA 3.4Å; Y32-L282 PolarHBondContact OH-O 3.13Å; F56-L282 HydrophobicContact CD2-CD2 3.59Å; F56-L282 HydrophobicContact CD2-CG 4.16Å; F56-L282 HydrophobicContact CE1-CD2 4.48Å; F56-L282 HydrophobicContact CE2-CD2 3.44Å; F56-L282 VanDerWaalsContact CE2-CD2 3.44Å; F56-L282 HydrophobicContact CE2-CG 3.71Å; F56-L282 HydrophobicContact CG-CD2 4.17Å; F56-L282 HydrophobicContact CZ-CD2 3.93Å; F56-L282 HydrophobicContact CZ-CG 4.37Å; Y81-L282 HydrophobicContact CE1-CD1 4.37Å; I82-L282 HydrophobicContact CD1-CD1 4.14Å; I82-L282 HydrophobicContact CD1-CD2 4.45Å; I82-L282 HydrophobicContact CG1-CD1 4.11Å; L279-L282 HydrophobicContact CD1-CD1 3.63Å; L279-L282 WeakPolarHBondContact O-CB 3.06Å; L279-L282 PolarHBondContact O-N 2.97Å; L279-L282 VanDerWaalsContact O-N 3.12Å; P280-L282 PolarHBondContact O-N 3.21Å; L282-W286 PolarHBondContact O-N 3.19Å
283	G	93.3	Very high	92.1	Very high	3 Å²	3	15.1 Å²	15.1	3%	0.031	8%	0.079	C	C	.	.	H	α-helix	trans	-67.8	-39.6	176.5	0	0	0	0	0	112	A250 V254 P280 S281 W286 I287	A250-G283 WeakPolarHBondContact O-CA 3.26Å; V254-G283 VanDerWaalsContact CG2-C 3.48Å; P280-G283 PolarHBondContact O-N 3.24Å; P280-G283 VanDerWaalsContact O-N 3.15Å; S281-G283 VanDerWaalsContact C-N 3.28Å; S281-G283 PolarHBondContact O-N 3.29Å; G283-W286 WeakPolarHBondContact O-CB 3.31Å; G283-W286 PolarHBondContact O-N 2.81Å; G283-I287 WeakPolarHBondContact O-CG1 3.29Å; G283-I287 PolarHBondContact O-N 3.22Å; G283-I287 VanDerWaalsContact O-N 3.12Å
284	F	94.9	Very high	91.7	Very high	6 Å²	6	17.7 Å²	17.7	3%	0.026	9%	0.087	C	C	.	.	H	α-helix	trans	-63.8	-50.1	179.7	173.8	-99.5	0	0	0	112.2	H59 L189 F190 V254 P280 S281 W286 I287 T288	H59-F284 AromaticContact CD2-CE1 3.95Å; H59-F284 AromaticContact NE2-CD1 3.83Å; H59-F284 AromaticContact NE2-CE1 3.52Å; L189-F284 VanDerWaalsContact C-CZ 3.45Å; L189-F284 HydrophobicContact CB-CD1 4.04Å; L189-F284 HydrophobicContact CB-CD2 3.79Å; L189-F284 HydrophobicContact CB-CE1 4.16Å; L189-F284 HydrophobicContact CB-CE2 3.91Å; L189-F284 HydrophobicContact CB-CG 3.86Å; L189-F284 HydrophobicContact CB-CZ 4.11Å; L189-F284 HydrophobicContact CD1-CB 4.11Å; L189-F284 HydrophobicContact CD1-CD2 4.41Å; L189-F284 HydrophobicContact CD1-CG 4.28Å; L189-F284 HydrophobicContact CD2-CD1 4.44Å; L189-F284 HydrophobicContact CD2-CG 4.46Å; L189-F284 HydrophobicContact CG-CG 4.44Å; L189-F284 WeakPolarHBondContact O-CE1 3.44Å; L189-F284 WeakPolarHBondContact O-CZ 3.16Å; F190-F284 AromaticContact CD1-CE2 3.62Å; F190-F284 HydrophobicContact CD1-CE2 3.62Å; F190-F284 AromaticContact CD1-CZ 3.97Å; F190-F284 HydrophobicContact CD1-CZ 3.97Å; F190-F284 AromaticContact CD2-CE2 3.89Å; F190-F284 HydrophobicContact CD2-CE2 3.89Å; F190-F284 AromaticContact CE1-CE2 3.6Å; F190-F284 HydrophobicContact CE1-CE2 3.6Å; F190-F284 HydrophobicContact CE1-CZ 4.3Å; F190-F284 HydrophobicContact CE2-CD2 4.41Å; F190-F284 AromaticContact CE2-CE2 3.86Å; F190-F284 HydrophobicContact CE2-CE2 3.86Å; F190-F284 AromaticContact CG-CE2 3.77Å; F190-F284 HydrophobicContact CG-CE2 3.77Å; F190-F284 HydrophobicContact CG-CZ 4.18Å; F190-F284 HydrophobicContact CZ-CD2 4.35Å; F190-F284 AromaticContact CZ-CE2 3.72Å; F190-F284 HydrophobicContact CZ-CE2 3.72Å; V254-F284 HydrophobicContact CG2-CB 4.18Å; V254-F284 VanDerWaalsContact CG2-N 3.29Å; P280-F284 PolarHBondContact O-N 3.44Å; S281-F284 PolarHBondContact O-N 3.11Å; S281-F284 VanDerWaalsContact O-N 3.1Å; F284-W286 PolarHBondContact O-N 2.8Å; F284-I287 WeakPolarHBondContact O-CA 3.24Å; F284-I287 WeakPolarHBondContact O-CB 3.42Å; F284-I287 PolarHBondContact O-N 3.3Å; F284-T288 HydrophobicContact CD1-CG2 4.36Å; F284-T288 HydrophobicContact CD2-CG2 4.45Å; F284-T288 HydrophobicContact CE1-CG2 3.81Å; F284-T288 HydrophobicContact CE2-CG2 3.91Å; F284-T288 HydrophobicContact CZ-CG2 3.54Å; F284-T288 PolarHBondContact O-N 2.98Å; F284-T288 PolarHBondContact O-OG1 3.42Å
285	C	95.8	Very high	91.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.5	-34.9	179.3	-67.2	0	0	0	0	112.1	L55 F56 S281 T288 A289	L55-C285 HydrophobicContact CB-CB 4.1Å; F56-C285 VanDerWaalsContact CA-SG 3.6Å; F56-C285 HydrophobicContact CB-CB 4.25Å; S281-C285 WeakPolarHBondContact O-CB 3.33Å; S281-C285 PolarHBondContact O-N 3.48Å; S281-C285 PolarHBondContact O-SG 3.31Å; C285-T288 VanDerWaalsContact CA-OG1 3.26Å; C285-T288 WeakPolarHBondContact CA-OG1 3.38Å; C285-T288 PolarHBondContact O-OG1 3.17Å; C285-A289 VanDerWaalsContact O-CB 3.29Å; C285-A289 WeakPolarHBondContact O-CB 3.46Å; C285-A289 PolarHBondContact O-N 3.1Å
286	W	93.6	Very high	90.3	Very high	1 Å²	1	23.7 Å²	23.7	0%	0.004	12%	0.117	C	C	.	.	H	α-helix	trans	-63.6	-47.5	171	178.4	-71.4	0	0	0	112.1	Y32 M35 Q36 L48 H246 A250 L282 G283 F284 T288 A289 Y290	Y32-W286 HydrophobicContact CD1-CD2 4.37Å; Y32-W286 AromaticContact CD1-CE3 3.3Å; Y32-W286 HydrophobicContact CD1-CE3 3.3Å; Y32-W286 AromaticContact CD1-CZ3 3.83Å; Y32-W286 HydrophobicContact CD1-CZ3 3.83Å; Y32-W286 HydrophobicContact CE1-CB 4.08Å; Y32-W286 HydrophobicContact CE1-CE3 4.01Å; Y32-W286 AromaticContact CG-CE3 3.92Å; Y32-W286 HydrophobicContact CG-CE3 3.92Å; Y32-W286 HydrophobicContact CG-CZ3 4.18Å; Y32-W286 WeakPolarHBondContact O-CZ3 3.29Å; M35-W286 HydrophobicContact CB-CE3 4.5Å; M35-W286 HydrophobicContact CB-CH2 3.4Å; M35-W286 HydrophobicContact CB-CZ2 4.2Å; M35-W286 HydrophobicContact CB-CZ3 3.61Å; M35-W286 HydrophobicContact CE-CD2 4.17Å; M35-W286 HydrophobicContact CE-CE3 4.3Å; M35-W286 HydrophobicContact CE-CH2 4.36Å; M35-W286 HydrophobicContact CE-CZ2 4.3Å; M35-W286 HydrophobicContact CE-CZ3 4.39Å; M35-W286 HydrophobicContact SD-CE3 4.5Å; M35-W286 HydrophobicContact SD-CZ3 4.45Å; Q36-W286 HydrophobicContact CG-CH2 3.98Å; L48-W286 HydrophobicContact CD2-CD2 4.2Å; L48-W286 HydrophobicContact CD2-CE3 4.33Å; L48-W286 HydrophobicContact CD2-CH2 4Å; L48-W286 HydrophobicContact CD2-CZ2 3.78Å; L48-W286 HydrophobicContact CD2-CZ3 4.23Å; L48-W286 HydrophobicContact CG-CE3 4.47Å; H246-W286 AromaticContact CD2-CZ2 3.72Å; A250-W286 HydrophobicContact CB-CB 4.23Å; A250-W286 HydrophobicContact CB-CG 3.9Å; L282-W286 PolarHBondContact O-N 3.19Å; G283-W286 WeakPolarHBondContact O-CB 3.31Å; G283-W286 PolarHBondContact O-N 2.81Å; F284-W286 PolarHBondContact O-N 2.8Å; W286-T288 VanDerWaalsContact C-N 3.34Å; W286-T288 PolarHBondContact O-N 3.24Å; W286-A289 PolarHBondContact O-N 3.17Å; W286-Y290 WeakPolarHBondContact O-CB 3.48Å; W286-Y290 PolarHBondContact O-N 3.04Å
287	I	90.5	Very high	89.5	Confident	23 Å²	23	27.6 Å²	27.6	12%	0.118	15%	0.149	C	C	.	.	H	α-helix	trans	-57.2	-49.9	178.9	-68.1	172.3	0	0	0	109.9	A250 L251 V254 G283 F284 Y290 F291	A250-I287 HydrophobicContact CB-CD1 4.02Å; A250-I287 HydrophobicContact CB-CG1 3.31Å; L251-I287 HydrophobicContact CD2-CD1 3.92Å; L251-I287 HydrophobicContact CG-CD1 4.27Å; V254-I287 HydrophobicContact CG2-CD1 4.24Å; G283-I287 WeakPolarHBondContact O-CG1 3.29Å; G283-I287 PolarHBondContact O-N 3.22Å; G283-I287 VanDerWaalsContact O-N 3.12Å; F284-I287 WeakPolarHBondContact O-CA 3.24Å; F284-I287 WeakPolarHBondContact O-CB 3.42Å; F284-I287 PolarHBondContact O-N 3.3Å; I287-Y290 PolarHBondContact O-N 3.38Å; I287-F291 HydrophobicContact CG2-CD2 3.52Å; I287-F291 HydrophobicContact CG2-CE2 3.51Å; I287-F291 WeakPolarHBondContact O-CD2 3.2Å; I287-F291 PolarHBondContact O-N 3.28Å
288	T	91.1	Very high	88.5	Confident	39 Å²	39	29.4 Å²	29.4	24%	0.239	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-46	-178.1	46.9	0	0	0	0	112	L55 F284 C285 W286 F291 A292	L55-T288 WeakPolarHBondContact CD1-OG1 3.41Å; F284-T288 HydrophobicContact CD1-CG2 4.36Å; F284-T288 HydrophobicContact CD2-CG2 4.45Å; F284-T288 HydrophobicContact CE1-CG2 3.81Å; F284-T288 HydrophobicContact CE2-CG2 3.91Å; F284-T288 HydrophobicContact CZ-CG2 3.54Å; F284-T288 PolarHBondContact O-N 2.98Å; F284-T288 PolarHBondContact O-OG1 3.42Å; C285-T288 VanDerWaalsContact CA-OG1 3.26Å; C285-T288 WeakPolarHBondContact CA-OG1 3.38Å; C285-T288 PolarHBondContact O-OG1 3.17Å; W286-T288 VanDerWaalsContact C-N 3.34Å; W286-T288 PolarHBondContact O-N 3.24Å; T288-F291 PolarHBondContact O-N 3.33Å; T288-A292 WeakPolarHBondContact O-CB 3.4Å; T288-A292 PolarHBondContact O-N 3.47Å
289	A	91.9	Very high	87.4	Confident	1 Å²	1	41 Å²	41	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-65.9	-39.6	177.5	0	0	0	0	0	111.9	L48 W51 S52 L55 C285 W286 A292 L293	L48-A289 HydrophobicContact CD1-CB 3.66Å; W51-A289 HydrophobicContact CB-CB 3.99Å; S52-A289 WeakPolarHBondContact OG-CB 3.34Å; L55-A289 HydrophobicContact CD1-CB 4.01Å; C285-A289 VanDerWaalsContact O-CB 3.29Å; C285-A289 WeakPolarHBondContact O-CB 3.46Å; C285-A289 PolarHBondContact O-N 3.1Å; W286-A289 PolarHBondContact O-N 3.17Å; A289-A292 PolarHBondContact O-N 2.86Å; A289-L293 WeakPolarHBondContact O-CG 3.31Å; A289-L293 PolarHBondContact O-N 3.01Å
290	Y	89.3	Confident	86.4	Confident	7 Å²	7	49.7 Å²	49.7	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-49.9	177.3	-179.9	-99.1	0	0	0	111.6	L45 L48 N243 H246 W286 I287 A292 L293 R294	L45-Y290 HydrophobicContact CD1-CD2 3.64Å; L45-Y290 HydrophobicContact CD1-CE2 3.59Å; L48-Y290 HydrophobicContact CD2-CD2 4.13Å; N243-Y290 WeakPolarHBondContact CA-OH 3.48Å; N243-Y290 PolarHBondContact OD1-OH 2.87Å; H246-Y290 HydrophobicContact CB-CD2 3.93Å; H246-Y290 HydrophobicContact CB-CE1 4.28Å; H246-Y290 HydrophobicContact CB-CE2 3.6Å; H246-Y290 HydrophobicContact CB-CG 4.39Å; H246-Y290 AromaticContact CD2-CD2 3.86Å; H246-Y290 AromaticContact CD2-CE2 3.64Å; H246-Y290 AromaticContact CG-CD2 3.98Å; H246-Y290 AromaticContact CG-CE2 3.47Å; H246-Y290 VanDerWaalsContact CG-CE2 3.47Å; H246-Y290 AromaticContact ND1-CE2 3.96Å; W286-Y290 WeakPolarHBondContact O-CB 3.48Å; W286-Y290 PolarHBondContact O-N 3.04Å; I287-Y290 PolarHBondContact O-N 3.38Å; Y290-A292 PolarHBondContact O-N 3.3Å; Y290-L293 PolarHBondContact O-N 3.44Å; Y290-R294 HydrophobicContact CD1-CG 4.26Å; Y290-R294 HydrophobicContact CE1-CG 3.77Å; Y290-R294 HydrophobicContact CE2-CG 4.17Å; Y290-R294 WeakPolarHBondContact O-CB 3.47Å; Y290-R294 WeakPolarHBondContact O-CG 3.31Å; Y290-R294 PolarHBondContact O-N 2.98Å; Y290-R294 PolarHBondContact OH-NE 3.06Å; Y290-R294 PolarHBondContact OH-NH2 3.02Å; Y290-R294 VanDerWaalsContact OH-NH2 3.16Å
291	F	86.3	Confident	85.3	Confident	105 Å²	105	50.5 Å²	50.5	46%	0.461	24%	0.241	S	C	.	.	H	α-helix	trans	-64.1	-40	177.4	-80.9	-63.4	0	0	0	111.9	L247 I287 T288 L293 R294 M295	L247-F291 HydrophobicContact CD1-CE2 4.33Å; L247-F291 HydrophobicContact CD1-CZ 4.41Å; I287-F291 HydrophobicContact CG2-CD2 3.52Å; I287-F291 HydrophobicContact CG2-CE2 3.51Å; I287-F291 WeakPolarHBondContact O-CD2 3.2Å; I287-F291 PolarHBondContact O-N 3.28Å; T288-F291 PolarHBondContact O-N 3.33Å; F291-L293 PolarHBondContact O-N 3.37Å; F291-R294 PolarHBondContact O-N 2.9Å; F291-M295 WeakPolarHBondContact O-CB 3.07Å; F291-M295 VanDerWaalsContact O-CG 3.25Å; F291-M295 WeakPolarHBondContact O-CG 3.21Å; F291-M295 PolarHBondContact O-N 3.44Å
292	A	86	Confident	84.3	Confident	34 Å²	34	61.1 Å²	61.1	28%	0.281	28%	0.282	S	S	.	.	H	α-helix	trans	-59.9	-45.4	175.7	0	0	0	0	0	112.3	T288 A289 Y290 M295 K296 F312	T288-A292 WeakPolarHBondContact O-CB 3.4Å; T288-A292 PolarHBondContact O-N 3.47Å; A289-A292 PolarHBondContact O-N 2.86Å; Y290-A292 PolarHBondContact O-N 3.3Å; A292-M295 PolarHBondContact O-N 3Å; A292-K296 PolarHBondContact O-N 3.16Å; A292-F312 HydrophobicContact CB-CD2 3.97Å; A292-F312 HydrophobicContact CB-CE2 4.11Å
293	L	85	Confident	83.5	Confident	27 Å²	27	65.8 Å²	65.8	14%	0.141	31%	0.314	C	S	.	.	H	α-helix	trans	-68.1	-36.8	177.3	-72.1	175.8	0	0	0	112.8	L45 N47 L48 A289 Y290 F291 K296 A297	L45-L293 HydrophobicContact CB-CD1 4.47Å; N47-L293 HydrophobicContact CB-CD2 4.5Å; L48-L293 VanDerWaalsContact CA-CD1 3.49Å; L48-L293 HydrophobicContact CB-CD1 3.67Å; L48-L293 HydrophobicContact CD1-CD1 4.02Å; L48-L293 HydrophobicContact CG-CD1 4.48Å; A289-L293 WeakPolarHBondContact O-CG 3.31Å; A289-L293 PolarHBondContact O-N 3.01Å; Y290-L293 PolarHBondContact O-N 3.44Å; F291-L293 PolarHBondContact O-N 3.37Å; L293-K296 WeakPolarHBondContact O-CB 3.1Å; L293-K296 PolarHBondContact O-N 3.3Å; L293-A297 PolarHBondContact O-N 3.36Å; L293-A297 VanDerWaalsContact O-N 3.13Å
294	R	80.3	Confident	83.1	Confident	59 Å²	59	68.7 Å²	68.7	22%	0.223	33%	0.329	C	S	.	.	H	α-helix	trans	-67.4	-41	175.1	-78	-64	-168.5	164.1	4	112.2	E239 N243 Y290 F291 K296 A297 S298	E239-R294 IonicContact OE1-NH1 2.67Å; E239-R294 PolarHBondContact OE1-NH1 3.19Å; N243-R294 PolarHBondContact OD1-NE 3.28Å; N243-R294 PolarHBondContact OD1-NH2 3.07Å; Y290-R294 HydrophobicContact CD1-CG 4.26Å; Y290-R294 HydrophobicContact CE1-CG 3.77Å; Y290-R294 HydrophobicContact CE2-CG 4.17Å; Y290-R294 WeakPolarHBondContact O-CB 3.47Å; Y290-R294 WeakPolarHBondContact O-CG 3.31Å; Y290-R294 PolarHBondContact O-N 2.98Å; Y290-R294 PolarHBondContact OH-NE 3.06Å; Y290-R294 PolarHBondContact OH-NH2 3.02Å; Y290-R294 VanDerWaalsContact OH-NH2 3.16Å; F291-R294 PolarHBondContact O-N 2.9Å; R294-K296 VanDerWaalsContact C-N 3.27Å; R294-K296 PolarHBondContact O-N 3.4Å; R294-A297 PolarHBondContact O-N 3Å; R294-A297 VanDerWaalsContact O-N 3.17Å; R294-S298 PolarHBondContact O-N 2.92Å
295	M	79.3	Confident	82.5	Confident	75 Å²	75	74 Å²	74	37%	0.369	35%	0.352	S	S	.	.	H	α-helix	trans	-58	-45.1	171.8	-72.4	-62.9	-72.7	0	0	110	F291 A292 A297 S298 Y301 F308	F291-M295 WeakPolarHBondContact O-CB 3.07Å; F291-M295 VanDerWaalsContact O-CG 3.25Å; F291-M295 WeakPolarHBondContact O-CG 3.21Å; F291-M295 PolarHBondContact O-N 3.44Å; A292-M295 PolarHBondContact O-N 3Å; M295-A297 VanDerWaalsContact C-N 3.26Å; M295-A297 PolarHBondContact O-N 3.3Å; M295-S298 VanDerWaalsContact O-CB 3.32Å; M295-S298 WeakPolarHBondContact O-CB 2.91Å; M295-S298 PolarHBondContact O-N 2.96Å; M295-S298 PolarHBondContact O-OG 3.38Å; M295-Y301 WeakPolarHBondContact O-CB 3.31Å; M295-F308 HydrophobicContact CE-CD1 4.24Å; M295-F308 HydrophobicContact CE-CE1 3.28Å; M295-F308 HydrophobicContact CE-CE2 4.23Å; M295-F308 HydrophobicContact CE-CZ 3.27Å
296	K	75.9	Confident	82.1	Confident	105 Å²	105	80.6 Å²	80.6	46%	0.457	39%	0.387	S	S	.	.	H	α-helix	trans	-56.1	-33.8	175.6	-176.6	163.9	-171.1	-179	0	114.7	A292 L293 R294 Y301	A292-K296 PolarHBondContact O-N 3.16Å; L293-K296 WeakPolarHBondContact O-CB 3.1Å; L293-K296 PolarHBondContact O-N 3.3Å; R294-K296 VanDerWaalsContact C-N 3.27Å; R294-K296 PolarHBondContact O-N 3.4Å; K296-Y301 VanDerWaalsContact CA-CG 3.46Å; K296-Y301 HydrophobicContact CB-CD1 4.39Å; K296-Y301 HydrophobicContact CB-CD2 4.2Å; K296-Y301 HydrophobicContact CB-CE1 4.18Å; K296-Y301 HydrophobicContact CB-CE2 3.97Å; K296-Y301 HydrophobicContact CB-CG 4.42Å; K296-Y301 HydrophobicContact CD-CE1 4.33Å; K296-Y301 HydrophobicContact CG-CD1 4.11Å; K296-Y301 HydrophobicContact CG-CE1 3.57Å; K296-Y301 HydrophobicContact CG-CE2 4.11Å; K296-Y301 VanDerWaalsContact O-CD1 3.23Å; K296-Y301 WeakPolarHBondContact O-CD1 3.11Å
297	A	74.6	Confident	81.8	Confident	83 Å²	83	85.4 Å²	85.4	69%	0.686	41%	0.413	S	S	*	.	H	α-helix	trans	-79.4	-15.7	176.6	0	0	0	0	0	114	L293 R294 M295	L293-A297 PolarHBondContact O-N 3.36Å; L293-A297 VanDerWaalsContact O-N 3.13Å; R294-A297 PolarHBondContact O-N 3Å; R294-A297 VanDerWaalsContact O-N 3.17Å; M295-A297 VanDerWaalsContact C-N 3.26Å; M295-A297 PolarHBondContact O-N 3.3Å
298	S	75	Confident	81.5	Confident	41 Å²	41	86.7 Å²	86.7	29%	0.287	42%	0.417	S	S	.	.	S	Bend	trans	-72.9	148.1	-176.6	76.3	0	0	0	0	112.7	R294 M295 R300 Y301	R294-S298 PolarHBondContact O-N 2.92Å; M295-S298 VanDerWaalsContact O-CB 3.32Å; M295-S298 WeakPolarHBondContact O-CB 2.91Å; M295-S298 PolarHBondContact O-N 2.96Å; M295-S298 PolarHBondContact O-OG 3.38Å; S298-R300 PolarHBondContact O-N 2.76Å; S298-Y301 WeakPolarHBondContact O-CB 3.49Å; S298-Y301 PolarHBondContact O-N 3.36Å; S298-Y301 PolarHBondContact OG-N 2.84Å
299	R	73.6	Confident	81.2	Confident	244 Å²	244	87.4 Å²	87.4	92%	0.921	42%	0.422	S	S	*	.	H	α-helix	trans	-54.5	-36.4	173.4	-71.5	-175	-179.8	178.6	-0.3	112.2	Y301 R302	R299-Y301 VanDerWaalsContact C-N 3.31Å; R299-Y301 PolarHBondContact O-N 3.21Å; R299-R302 WeakPolarHBondContact O-CB 3.32Å; R299-R302 PolarHBondContact O-N 3.5Å
300	R	72.4	Confident	81.2	Confident	186 Å²	186	89.2 Å²	89.2	70%	0.702	44%	0.441	S	S	*	.	H	α-helix	trans	-64.7	-31	179.1	-166.4	171.3	-173.9	161.8	1.1	113.1	S298 N304	S298-R300 PolarHBondContact O-N 2.76Å; R300-N304 PolarHBondContact O-N 3.38Å
301	Y	71.5	Confident	81.2	Confident	19 Å²	19	93.3 Å²	93.3	8%	0.075	46%	0.463	C	S	.	.	H	α-helix	trans	-70.3	-32.8	174.3	176	-84.5	0	0	0	112.6	M295 K296 S298 R299 S303 N304 K305 F308 T309	M295-Y301 WeakPolarHBondContact O-CB 3.31Å; K296-Y301 VanDerWaalsContact CA-CG 3.46Å; K296-Y301 HydrophobicContact CB-CD1 4.39Å; K296-Y301 HydrophobicContact CB-CD2 4.2Å; K296-Y301 HydrophobicContact CB-CE1 4.18Å; K296-Y301 HydrophobicContact CB-CE2 3.97Å; K296-Y301 HydrophobicContact CB-CG 4.42Å; K296-Y301 HydrophobicContact CD-CE1 4.33Å; K296-Y301 HydrophobicContact CG-CD1 4.11Å; K296-Y301 HydrophobicContact CG-CE1 3.57Å; K296-Y301 HydrophobicContact CG-CE2 4.11Å; K296-Y301 VanDerWaalsContact O-CD1 3.23Å; K296-Y301 WeakPolarHBondContact O-CD1 3.11Å; S298-Y301 WeakPolarHBondContact O-CB 3.49Å; S298-Y301 PolarHBondContact O-N 3.36Å; S298-Y301 PolarHBondContact OG-N 2.84Å; R299-Y301 VanDerWaalsContact C-N 3.31Å; R299-Y301 PolarHBondContact O-N 3.21Å; Y301-S303 PolarHBondContact O-N 2.96Å; Y301-N304 CarbonylContact O-C 3.32Å; Y301-N304 PolarHBondContact O-N 2.93Å; Y301-K305 HydrophobicContact CD1-CB 4.23Å; Y301-K305 HydrophobicContact CD1-CG 4.44Å; Y301-K305 HydrophobicContact CE1-CB 3.84Å; Y301-K305 HydrophobicContact CE1-CD 4.19Å; Y301-K305 HydrophobicContact CE1-CG 3.58Å; Y301-K305 WeakPolarHBondContact O-CA 3.36Å; Y301-K305 WeakPolarHBondContact O-CB 3.16Å; Y301-K305 PolarHBondContact O-N 3.39Å; Y301-F308 HydrophobicContact CD2-CB 3.43Å; Y301-F308 VanDerWaalsContact CD2-CB 3.43Å; Y301-F308 AromaticContact CD2-CD2 3.48Å; Y301-F308 HydrophobicContact CD2-CD2 3.48Å; Y301-F308 VanDerWaalsContact CD2-CD2 3.48Å; Y301-F308 HydrophobicContact CD2-CE2 4.45Å; Y301-F308 AromaticContact CD2-CG 3.66Å; Y301-F308 HydrophobicContact CD2-CG 3.66Å; Y301-F308 HydrophobicContact CE2-CB 3.36Å; Y301-F308 HydrophobicContact CE2-CD2 4.29Å; Y301-F308 HydrophobicContact CE2-CG 4.13Å; Y301-F308 HydrophobicContact CG-CD2 4.18Å; Y301-T309 PolarHBondContact OH-OG1 3Å
302	R	75.1	Confident	81.3	Confident	223 Å²	223	90.1 Å²	90.1	84%	0.842	45%	0.449	S	S	*	.	H	α-helix	trans	-59.9	-34.8	177.9	-166.4	175.9	-74.1	173.2	-4.4	111.8	R299	R299-R302 WeakPolarHBondContact O-CB 3.32Å; R299-R302 PolarHBondContact O-N 3.5Å
303	S	79.1	Confident	81.6	Confident	101 Å²	101	91.8 Å²	91.8	71%	0.706	46%	0.457	S	S	*	.	H	α-helix	trans	-72.4	-34.6	173.2	-169.8	0	0	0	0	113.3	Y301	Y301-S303 PolarHBondContact O-N 2.96Å
304	N	82.9	Confident	82	Confident	64 Å²	64	97.2 Å²	97.2	34%	0.342	48%	0.48	S	S	.	.	S	Bend	trans	-121.4	31.3	-169.5	-67.3	-4.9	0	0	0	112.9	R300 Y301 N306 L307 F308	R300-N304 PolarHBondContact O-N 3.38Å; Y301-N304 CarbonylContact O-C 3.32Å; Y301-N304 PolarHBondContact O-N 2.93Å; N304-N306 VanDerWaalsContact C-N 3.3Å; N304-N306 PolarHBondContact O-N 3.19Å; N304-L307 HydrophobicContact CB-CB 4.46Å; N304-L307 WeakPolarHBondContact O-CB 3.27Å; N304-L307 PolarHBondContact O-N 2.91Å; N304-L307 VanDerWaalsContact O-N 3.14Å; N304-F308 HydrophobicContact CB-CD2 4.09Å; N304-F308 HydrophobicContact CB-CE2 3.97Å; N304-F308 WeakPolarHBondContact O-CD2 3.29Å; N304-F308 PolarHBondContact O-N 3.4Å
305	K	83.1	Confident	82.5	Confident	116 Å²	116	96.9 Å²	96.9	50%	0.504	49%	0.485	S	S	.	.	H	α-helix	trans	-56.2	-43.7	-170.6	171.2	178.2	176.4	-165.7	0	112.3	Y301 L307 T309	Y301-K305 HydrophobicContact CD1-CB 4.23Å; Y301-K305 HydrophobicContact CD1-CG 4.44Å; Y301-K305 HydrophobicContact CE1-CB 3.84Å; Y301-K305 HydrophobicContact CE1-CD 4.19Å; Y301-K305 HydrophobicContact CE1-CG 3.58Å; Y301-K305 WeakPolarHBondContact O-CA 3.36Å; Y301-K305 WeakPolarHBondContact O-CB 3.16Å; Y301-K305 PolarHBondContact O-N 3.39Å; K305-L307 VanDerWaalsContact C-N 3.34Å; K305-T309 WeakPolarHBondContact O-CB 3.33Å; K305-T309 PolarHBondContact O-N 3.09Å; K305-T309 PolarHBondContact O-OG1 2.75Å
306	N	87.1	Confident	83.2	Confident	139 Å²	139	94.6 Å²	94.6	74%	0.743	47%	0.474	S	S	*	.	H	α-helix	trans	-65.1	-40.2	-177.6	-66	-5.1	0	0	0	111.1	N304 G310	N304-N306 VanDerWaalsContact C-N 3.3Å; N304-N306 PolarHBondContact O-N 3.19Å; N306-G310 PolarHBondContact O-N 3.32Å
307	L	87.4	Confident	84.1	Confident	102 Å²	102	92.3 Å²	92.3	53%	0.534	48%	0.475	S	S	.	.	H	α-helix	trans	-62.7	-52.6	177.3	178.3	64.3	0	0	0	111.6	N304 K305 T309 G310 L311	N304-L307 HydrophobicContact CB-CB 4.46Å; N304-L307 WeakPolarHBondContact O-CB 3.27Å; N304-L307 PolarHBondContact O-N 2.91Å; N304-L307 VanDerWaalsContact O-N 3.14Å; K305-L307 VanDerWaalsContact C-N 3.34Å; L307-T309 PolarHBondContact O-N 3.3Å; L307-G310 PolarHBondContact O-N 3.34Å; L307-L311 HydrophobicContact CD1-CD1 4.32Å; L307-L311 HydrophobicContact CD1-CG 4.37Å; L307-L311 HydrophobicContact CG-CD1 4.21Å; L307-L311 WeakPolarHBondContact O-CG 3.26Å; L307-L311 PolarHBondContact O-N 3.13Å
308	F	85.1	Confident	85.1	Confident	50 Å²	50	89.9 Å²	89.9	22%	0.219	45%	0.454	C	S	.	.	H	α-helix	trans	-66	-39.3	-177.9	-76.5	-67.2	0	0	0	113	M295 Y301 N304 L311 F312	M295-F308 HydrophobicContact CE-CD1 4.24Å; M295-F308 HydrophobicContact CE-CE1 3.28Å; M295-F308 HydrophobicContact CE-CE2 4.23Å; M295-F308 HydrophobicContact CE-CZ 3.27Å; Y301-F308 HydrophobicContact CD2-CB 3.43Å; Y301-F308 VanDerWaalsContact CD2-CB 3.43Å; Y301-F308 AromaticContact CD2-CD2 3.48Å; Y301-F308 HydrophobicContact CD2-CD2 3.48Å; Y301-F308 VanDerWaalsContact CD2-CD2 3.48Å; Y301-F308 HydrophobicContact CD2-CE2 4.45Å; Y301-F308 AromaticContact CD2-CG 3.66Å; Y301-F308 HydrophobicContact CD2-CG 3.66Å; Y301-F308 HydrophobicContact CE2-CB 3.36Å; Y301-F308 HydrophobicContact CE2-CD2 4.29Å; Y301-F308 HydrophobicContact CE2-CG 4.13Å; Y301-F308 HydrophobicContact CG-CD2 4.18Å; N304-F308 HydrophobicContact CB-CD2 4.09Å; N304-F308 HydrophobicContact CB-CE2 3.97Å; N304-F308 WeakPolarHBondContact O-CD2 3.29Å; N304-F308 PolarHBondContact O-N 3.4Å; F308-L311 PolarHBondContact O-N 2.9Å; F308-F312 PolarHBondContact O-N 3.14Å; F308-F312 VanDerWaalsContact O-N 3.09Å
309	T	85.3	Confident	86	Confident	55 Å²	55	88.9 Å²	88.9	34%	0.337	45%	0.445	S	S	.	.	H	α-helix	trans	-66.6	-42.2	175.9	-48.5	0	0	0	0	110.3	Y301 K305 L307 F312 C313	Y301-T309 PolarHBondContact OH-OG1 3Å; K305-T309 WeakPolarHBondContact O-CB 3.33Å; K305-T309 PolarHBondContact O-N 3.09Å; K305-T309 PolarHBondContact O-OG1 2.75Å; L307-T309 PolarHBondContact O-N 3.3Å; T309-F312 PolarHBondContact O-N 3.32Å; T309-C313 PolarHBondContact O-N 3.25Å; T309-C313 PolarHBondContact O-SG 3.25Å; T309-C313 VanDerWaalsContact O-SG 3.33Å
310	G	90.5	Very high	87.1	Confident	39 Å²	39	80.4 Å²	80.4	40%	0.402	42%	0.42	S	S	.	.	H	α-helix	trans	-59.7	-45.4	174.4	0	0	0	0	0	112.9	N306 L307 F312 C313 F314	N306-G310 PolarHBondContact O-N 3.32Å; L307-G310 PolarHBondContact O-N 3.34Å; G310-F312 PolarHBondContact O-N 2.74Å; G310-C313 PolarHBondContact O-N 3.32Å; G310-F314 VanDerWaalsContact O-CB 3.26Å; G310-F314 WeakPolarHBondContact O-CB 3.4Å; G310-F314 PolarHBondContact O-N 2.89Å
311	L	90.5	Very high	88.2	Confident	92 Å²	92	74.7 Å²	74.7	48%	0.482	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-43.9	176	-75	171.3	0	0	0	112.1	L307 F308 F314 T315	L307-L311 HydrophobicContact CD1-CD1 4.32Å; L307-L311 HydrophobicContact CD1-CG 4.37Å; L307-L311 HydrophobicContact CG-CD1 4.21Å; L307-L311 WeakPolarHBondContact O-CG 3.26Å; L307-L311 PolarHBondContact O-N 3.13Å; F308-L311 PolarHBondContact O-N 2.9Å; L311-F314 WeakPolarHBondContact O-CB 3.36Å; L311-F314 PolarHBondContact O-N 3.45Å; L311-T315 PolarHBondContact O-N 2.96Å; L311-T315 PolarHBondContact O-OG1 3Å
312	F	88.8	Confident	89.4	Confident	38 Å²	38	77.1 Å²	77.1	17%	0.167	42%	0.418	C	S	.	.	H	α-helix	trans	-66.2	-44.8	178.6	-175.1	-97.2	0	0	0	112.3	W51 L55 A292 F308 T309 G310 F314 T315 L316	W51-F312 HydrophobicContact CD2-CE1 4.11Å; W51-F312 HydrophobicContact CD2-CZ 4.2Å; W51-F312 AromaticContact CE3-CE1 3.4Å; W51-F312 HydrophobicContact CE3-CE1 3.4Å; W51-F312 AromaticContact CE3-CZ 3.68Å; W51-F312 HydrophobicContact CE3-CZ 3.68Å; W51-F312 HydrophobicContact CH2-CE1 4.35Å; W51-F312 HydrophobicContact CZ3-CD1 4.47Å; W51-F312 AromaticContact CZ3-CE1 3.54Å; W51-F312 HydrophobicContact CZ3-CE1 3.54Å; W51-F312 HydrophobicContact CZ3-CZ 4.3Å; L55-F312 HydrophobicContact CD1-CE2 4.1Å; L55-F312 HydrophobicContact CD1-CZ 4.38Å; L55-F312 HydrophobicContact CD2-CE2 4.29Å; L55-F312 HydrophobicContact CD2-CZ 4.41Å; L55-F312 HydrophobicContact CG-CE2 4.42Å; L55-F312 HydrophobicContact CG-CZ 4.34Å; A292-F312 HydrophobicContact CB-CD2 3.97Å; A292-F312 HydrophobicContact CB-CE2 4.11Å; F308-F312 PolarHBondContact O-N 3.14Å; F308-F312 VanDerWaalsContact O-N 3.09Å; T309-F312 PolarHBondContact O-N 3.32Å; G310-F312 PolarHBondContact O-N 2.74Å; F312-F314 VanDerWaalsContact C-N 3.31Å; F312-F314 PolarHBondContact O-N 2.62Å; F312-T315 PolarHBondContact O-N 2.9Å; F312-L316 HydrophobicContact CD1-CD1 4.09Å; F312-L316 HydrophobicContact CE1-CD1 3.59Å; F312-L316 HydrophobicContact CE1-CG 4.18Å; F312-L316 HydrophobicContact CZ-CD1 4.25Å; F312-L316 HydrophobicContact CZ-CG 4.49Å; F312-L316 PolarHBondContact O-N 3.02Å; F312-L316 VanDerWaalsContact O-N 3.1Å
313	C	91.1	Very high	90.4	Very high	69 Å²	69	67.5 Å²	67.5	47%	0.466	38%	0.384	S	S	.	.	H	α-helix	trans	-62	-39.4	174.2	-68.7	0	0	0	0	111.8	T309 G310 L316 A317	T309-C313 PolarHBondContact O-N 3.25Å; T309-C313 PolarHBondContact O-SG 3.25Å; T309-C313 VanDerWaalsContact O-SG 3.33Å; G310-C313 PolarHBondContact O-N 3.32Å; C313-L316 PolarHBondContact O-N 3.31Å; C313-A317 WeakPolarHBondContact O-CB 3.45Å; C313-A317 PolarHBondContact O-N 3.39Å
314	F	93.1	Very high	91.1	Very high	141 Å²	141	67.4 Å²	67.4	62%	0.618	38%	0.375	S	S	*	.	H	α-helix	trans	-61.4	-43.3	174	175.7	-95.3	0	0	0	111.6	G310 L311 F312 L316 A317 A318	G310-F314 VanDerWaalsContact O-CB 3.26Å; G310-F314 WeakPolarHBondContact O-CB 3.4Å; G310-F314 PolarHBondContact O-N 2.89Å; L311-F314 WeakPolarHBondContact O-CB 3.36Å; L311-F314 PolarHBondContact O-N 3.45Å; F312-F314 VanDerWaalsContact C-N 3.31Å; F312-F314 PolarHBondContact O-N 2.62Å; F314-L316 PolarHBondContact O-N 2.86Å; F314-A317 PolarHBondContact O-N 2.97Å; F314-A318 HydrophobicContact CE1-CB 4.41Å; F314-A318 WeakPolarHBondContact O-CB 3.49Å; F314-A318 PolarHBondContact O-N 3.36Å
315	T	91.5	Very high	91.7	Very high	53 Å²	53	68.1 Å²	68.1	33%	0.325	38%	0.378	S	S	.	.	H	α-helix	trans	-59.2	-46.6	175.4	-56.7	0	0	0	0	111.7	L311 F312 A317 A318 F319	L311-T315 PolarHBondContact O-N 2.96Å; L311-T315 PolarHBondContact O-OG1 3Å; F312-T315 PolarHBondContact O-N 2.9Å; T315-A317 PolarHBondContact O-N 3.27Å; T315-A318 PolarHBondContact O-N 2.94Å; T315-F319 HydrophobicContact CG2-CD1 4.26Å; T315-F319 HydrophobicContact CG2-CD2 4.31Å; T315-F319 HydrophobicContact CG2-CE1 4.02Å; T315-F319 HydrophobicContact CG2-CE2 4.06Å; T315-F319 HydrophobicContact CG2-CG 4.41Å; T315-F319 HydrophobicContact CG2-CZ 3.93Å; T315-F319 VanDerWaalsContact O-CB 3.27Å; T315-F319 WeakPolarHBondContact O-CB 3.41Å; T315-F319 WeakPolarHBondContact O-CG 3.39Å; T315-F319 PolarHBondContact O-N 3.42Å
316	L	93.2	Very high	92.3	Very high	26 Å²	26	62.7 Å²	62.7	14%	0.136	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-44	176.8	-71.4	174.9	0	0	0	112.2	W51 L54 L55 F312 C313 F314 F319 T320	W51-L316 HydrophobicContact CZ3-CD1 4.37Å; L54-L316 HydrophobicContact CD2-CD1 3.86Å; L54-L316 HydrophobicContact CD2-CD2 4.35Å; L54-L316 HydrophobicContact CG-CD2 4.18Å; L55-L316 HydrophobicContact CD2-CD2 3.64Å; L55-L316 HydrophobicContact CD2-CG 4.48Å; L55-L316 HydrophobicContact CG-CD2 4.25Å; F312-L316 HydrophobicContact CD1-CD1 4.09Å; F312-L316 HydrophobicContact CE1-CD1 3.59Å; F312-L316 HydrophobicContact CE1-CG 4.18Å; F312-L316 HydrophobicContact CZ-CD1 4.25Å; F312-L316 HydrophobicContact CZ-CG 4.49Å; F312-L316 PolarHBondContact O-N 3.02Å; F312-L316 VanDerWaalsContact O-N 3.1Å; C313-L316 PolarHBondContact O-N 3.31Å; F314-L316 PolarHBondContact O-N 2.86Å; L316-F319 PolarHBondContact O-N 3.43Å; L316-T320 WeakPolarHBondContact O-CB 3.3Å; L316-T320 PolarHBondContact O-N 3.18Å; L316-T320 PolarHBondContact O-OG1 3.28Å
317	A	94.9	Very high	92.6	Very high	57 Å²	57	58.5 Å²	58.5	47%	0.471	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-43.8	177.7	0	0	0	0	0	111.8	C313 F314 T315 T320 C321	C313-A317 WeakPolarHBondContact O-CB 3.45Å; C313-A317 PolarHBondContact O-N 3.39Å; F314-A317 PolarHBondContact O-N 2.97Å; T315-A317 PolarHBondContact O-N 3.27Å; A317-T320 PolarHBondContact O-N 2.89Å; A317-C321 VanDerWaalsContact O-CB 3.3Å; A317-C321 WeakPolarHBondContact O-CB 3.36Å; A317-C321 PolarHBondContact O-N 2.91Å
318	A	95.1	Very high	93	Very high	32 Å²	32	57.7 Å²	57.7	26%	0.264	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-44.8	176.8	0	0	0	0	0	111	F314 T315 C321 R322	F314-A318 HydrophobicContact CE1-CB 4.41Å; F314-A318 WeakPolarHBondContact O-CB 3.49Å; F314-A318 PolarHBondContact O-N 3.36Å; T315-A318 PolarHBondContact O-N 2.94Å; A318-C321 PolarHBondContact O-N 3.47Å; A318-R322 WeakPolarHBondContact O-CB 3.41Å; A318-R322 VanDerWaalsContact O-CG 3.23Å; A318-R322 WeakPolarHBondContact O-CG 3.48Å; A318-R322 PolarHBondContact O-N 2.83Å
319	F	95.9	Very high	93.4	Very high	20 Å²	20	57.2 Å²	57.2	9%	0.088	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-45.5	176.1	-82.1	13.4	0	0	0	111.9	C58 H59 P60 P192 T315 L316 C321 R322 C323	C58-F319 CarbonylContact O-C 3.1Å; C58-F319 WeakPolarHBondContact O-CB 3.29Å; H59-F319 AromaticContact CD2-CE2 3.62Å; P60-F319 HydrophobicContact CG-CB 4.2Å; P60-F319 HydrophobicContact CG-CD1 4.21Å; P60-F319 HydrophobicContact CG-CG 4.23Å; P60-F319 WeakPolarHBondContact CG-O 3.26Å; P192-F319 HydrophobicContact CG-CD1 4.22Å; P192-F319 HydrophobicContact CG-CE1 3.83Å; P192-F319 HydrophobicContact CG-CZ 4.46Å; T315-F319 HydrophobicContact CG2-CD1 4.26Å; T315-F319 HydrophobicContact CG2-CD2 4.31Å; T315-F319 HydrophobicContact CG2-CE1 4.02Å; T315-F319 HydrophobicContact CG2-CE2 4.06Å; T315-F319 HydrophobicContact CG2-CG 4.41Å; T315-F319 HydrophobicContact CG2-CZ 3.93Å; T315-F319 VanDerWaalsContact O-CB 3.27Å; T315-F319 WeakPolarHBondContact O-CB 3.41Å; T315-F319 WeakPolarHBondContact O-CG 3.39Å; T315-F319 PolarHBondContact O-N 3.42Å; L316-F319 PolarHBondContact O-N 3.43Å; F319-C321 PolarHBondContact O-N 3.42Å; F319-R322 PolarHBondContact O-N 2.94Å; F319-C323 PolarHBondContact O-N 3Å; F319-C323 PolarHBondContact O-SG 3.35Å
320	T	95.8	Very high	93.9	Very high	66 Å²	66	57.3 Å²	57.3	41%	0.405	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-46.2	175.9	-54.5	0	0	0	0	111.6	L316 A317 R322 C323 I324	L316-T320 WeakPolarHBondContact O-CB 3.3Å; L316-T320 PolarHBondContact O-N 3.18Å; L316-T320 PolarHBondContact O-OG1 3.28Å; A317-T320 PolarHBondContact O-N 2.89Å; T320-R322 PolarHBondContact O-N 3.33Å; T320-C323 WeakPolarHBondContact O-CB 3.32Å; T320-C323 PolarHBondContact O-N 3.02Å; T320-I324 HydrophobicContact CG2-CD1 4.35Å; T320-I324 WeakPolarHBondContact O-CG1 3.42Å; T320-I324 PolarHBondContact O-N 3.49Å
321	C	96.1	Very high	94	Very high	67 Å²	67	61.6 Å²	61.6	45%	0.453	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-44.7	176.4	-178.9	0	0	0	0	111.6	A317 A318 F319 C323 I324 L325	A317-C321 VanDerWaalsContact O-CB 3.3Å; A317-C321 WeakPolarHBondContact O-CB 3.36Å; A317-C321 PolarHBondContact O-N 2.91Å; A318-C321 PolarHBondContact O-N 3.47Å; F319-C321 PolarHBondContact O-N 3.42Å; C321-C323 VanDerWaalsContact C-N 3.33Å; C321-C323 PolarHBondContact O-N 2.73Å; C321-I324 PolarHBondContact O-N 3.09Å; C321-L325 WeakPolarHBondContact O-CG 3.36Å; C321-L325 PolarHBondContact O-N 2.8Å
322	R	95.2	Very high	94.1	Very high	70 Å²	70	61 Å²	61	26%	0.264	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-37.5	175.3	-71.5	-59.7	-63.4	176.7	-2.6	112.2	P60 P192 S193 A318 F319 T320 L325 Q326	P60-R322 HydrophobicContact CB-CB 4Å; P60-R322 HydrophobicContact CG-CB 3.59Å; P192-R322 PolarHBondContact O-NE 3.22Å; S193-R322 PolarHBondContact O-NH2 3.26Å; A318-R322 WeakPolarHBondContact O-CB 3.41Å; A318-R322 VanDerWaalsContact O-CG 3.23Å; A318-R322 WeakPolarHBondContact O-CG 3.48Å; A318-R322 PolarHBondContact O-N 2.83Å; F319-R322 PolarHBondContact O-N 2.94Å; T320-R322 PolarHBondContact O-N 3.33Å; R322-L325 PolarHBondContact O-N 3.1Å; R322-Q326 VanDerWaalsContact O-CB 3.26Å; R322-Q326 WeakPolarHBondContact O-CB 3.29Å; R322-Q326 PolarHBondContact O-N 3.26Å
323	C	95.9	Very high	94.4	Very high	21 Å²	21	65 Å²	65	14%	0.142	35%	0.35	C	S	.	.	H	α-helix	trans	-60.8	-45.4	172.8	-69.9	0	0	0	0	111.9	C58 P60 V63 F319 T320 C321 Q326 N327	C58-C323 PolarHBondContact O-SG 3.21Å; P60-C323 VanDerWaalsContact CA-SG 3.52Å; V63-C323 HydrophobicContact CG2-CB 4.17Å; F319-C323 PolarHBondContact O-N 3Å; F319-C323 PolarHBondContact O-SG 3.35Å; T320-C323 WeakPolarHBondContact O-CB 3.32Å; T320-C323 PolarHBondContact O-N 3.02Å; C321-C323 VanDerWaalsContact C-N 3.33Å; C321-C323 PolarHBondContact O-N 2.73Å; C323-Q326 PolarHBondContact O-N 2.88Å; C323-N327 PolarHBondContact O-N 3.26Å; C323-N327 PolarHBondContact O-ND2 2.87Å
324	I	95.3	Very high	94.6	Very high	99 Å²	99	66.5 Å²	66.5	51%	0.508	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-48.9	178.6	-65.6	165.6	0	0	0	110.2	T320 C321 Q326 N327 N328	T320-I324 HydrophobicContact CG2-CD1 4.35Å; T320-I324 WeakPolarHBondContact O-CG1 3.42Å; T320-I324 PolarHBondContact O-N 3.49Å; C321-I324 PolarHBondContact O-N 3.09Å; I324-Q326 VanDerWaalsContact C-N 3.34Å; I324-Q326 PolarHBondContact O-N 3.26Å; I324-N327 PolarHBondContact O-N 2.96Å; I324-N328 PolarHBondContact O-N 2.98Å; I324-N328 VanDerWaalsContact O-N 3.12Å
325	L	94.8	Very high	94.7	Very high	78 Å²	78	61.8 Å²	61.8	41%	0.408	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-43.1	178.2	-70	175.3	0	0	0	112	C321 R322 N328 Q329	C321-L325 WeakPolarHBondContact O-CG 3.36Å; C321-L325 PolarHBondContact O-N 2.8Å; R322-L325 PolarHBondContact O-N 3.1Å; L325-N328 PolarHBondContact O-N 3.03Å; L325-Q329 WeakPolarHBondContact O-CG 3.49Å; L325-Q329 PolarHBondContact O-N 3.21Å
326	Q	95.1	Very high	94.9	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-42.3	179.8	-165.7	66	17	0	0	110.7	V63 L195 R322 C323 I324 N328 Q329 W330	V63-Q326 HydrophobicContact CB-CB 4.04Å; V63-Q326 HydrophobicContact CB-CG 3.7Å; V63-Q326 HydrophobicContact CG1-CB 3.82Å; V63-Q326 HydrophobicContact CG1-CG 3.52Å; V63-Q326 HydrophobicContact CG2-CB 4.06Å; V63-Q326 HydrophobicContact CG2-CG 4.27Å; L195-Q326 HydrophobicContact CD1-CG 4.23Å; R322-Q326 VanDerWaalsContact O-CB 3.26Å; R322-Q326 WeakPolarHBondContact O-CB 3.29Å; R322-Q326 PolarHBondContact O-N 3.26Å; C323-Q326 PolarHBondContact O-N 2.88Å; I324-Q326 VanDerWaalsContact C-N 3.34Å; I324-Q326 PolarHBondContact O-N 3.26Å; Q326-N328 VanDerWaalsContact C-N 3.27Å; Q326-N328 PolarHBondContact O-N 3.37Å; Q326-Q329 WeakPolarHBondContact O-CB 3.36Å; Q326-Q329 PolarHBondContact O-N 3.05Å; Q326-Q329 VanDerWaalsContact OE1-OE1 3.09Å; Q326-W330 VanDerWaalsContact O-CD1 3.3Å; Q326-W330 PolarHBondContact O-N 3.04Å
327	N	94.7	Very high	95.1	Very high	51 Å²	51	60.5 Å²	60.5	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-38.2	176	-82.5	-74.6	0	0	0	112.2	C323 I324 Q329 W330	C323-N327 PolarHBondContact O-N 3.26Å; C323-N327 PolarHBondContact O-ND2 2.87Å; I324-N327 PolarHBondContact O-N 2.96Å; N327-Q329 PolarHBondContact O-N 3.38Å; N327-W330 PolarHBondContact O-N 3.04Å
328	N	94.8	Very high	95.1	Very high	85 Å²	85	60.2 Å²	60.2	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-62.6	-26.8	175.4	-70.8	-15.8	0	0	0	113.1	I324 L325 Q326 W330 L331	I324-N328 PolarHBondContact O-N 2.98Å; I324-N328 VanDerWaalsContact O-N 3.12Å; L325-N328 PolarHBondContact O-N 3.03Å; Q326-N328 VanDerWaalsContact C-N 3.27Å; Q326-N328 PolarHBondContact O-N 3.37Å; N328-W330 VanDerWaalsContact C-N 3.31Å; N328-L331 HydrophobicContact CB-CD1 4.4Å; N328-L331 WeakPolarHBondContact O-CD1 3.3Å; N328-L331 WeakPolarHBondContact O-CG 3.39Å
329	Q	94.9	Very high	95.1	Very high	40 Å²	40	59.4 Å²	59.4	19%	0.187	30%	0.304	C	S	.	.	H	α-helix	trans	-75.8	-20.5	175.7	-61.7	174.1	14	0	0	113	L325 Q326 N327 L331 T335 L336 S339	L325-Q329 WeakPolarHBondContact O-CG 3.49Å; L325-Q329 PolarHBondContact O-N 3.21Å; Q326-Q329 WeakPolarHBondContact O-CB 3.36Å; Q326-Q329 PolarHBondContact O-N 3.05Å; Q326-Q329 VanDerWaalsContact OE1-OE1 3.09Å; N327-Q329 PolarHBondContact O-N 3.38Å; Q329-L331 VanDerWaalsContact C-N 3.34Å; Q329-T335 CarbonylContact O-C 3.32Å; Q329-T335 PolarHBondContact O-OG1 3.42Å; Q329-L336 WeakPolarHBondContact O-CA 3.47Å; Q329-L336 WeakPolarHBondContact O-CB 3.44Å; Q329-L336 PolarHBondContact O-N 2.99Å; Q329-S339 VanDerWaalsContact OE1-CB 3.26Å; Q329-S339 PolarHBondContact OE1-OG 3.43Å
330	W	94.3	Very high	95	Very high	57 Å²	57	58.5 Å²	58.5	22%	0.216	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	8.1	-179.9	-78.1	83	0	0	0	113.3	D64 A67 F197 Q326 N327 N328 L336	D64-W330 HydrophobicContact CB-CZ2 3.99Å; D64-W330 WeakPolarHBondContact OD1-CH2 3.42Å; D64-W330 WeakPolarHBondContact OD1-CZ2 3.27Å; A67-W330 HydrophobicContact CB-CB 3.76Å; A67-W330 HydrophobicContact CB-CD2 3.67Å; A67-W330 HydrophobicContact CB-CE3 3.94Å; A67-W330 HydrophobicContact CB-CG 3.6Å; F197-W330 HydrophobicContact CB-CH2 4.1Å; F197-W330 HydrophobicContact CB-CZ2 3.8Å; Q326-W330 VanDerWaalsContact O-CD1 3.3Å; Q326-W330 PolarHBondContact O-N 3.04Å; N327-W330 PolarHBondContact O-N 3.04Å; N328-W330 VanDerWaalsContact C-N 3.31Å; W330-L336 HydrophobicContact CD2-CD1 3.89Å; W330-L336 HydrophobicContact CE3-CD1 4.18Å; W330-L336 HydrophobicContact CG-CD1 4.23Å; W330-L336 HydrophobicContact CZ2-CD1 4.4Å
331	L	92.9	Very high	94.9	Very high	130 Å²	130	57.7 Å²	57.7	68%	0.681	29%	0.293	S	S	*	.	S	Bend	trans	-69.2	-44	-176.7	-72.3	174.1	0	0	0	113.2	N328 Q329	N328-L331 HydrophobicContact CB-CD1 4.4Å; N328-L331 WeakPolarHBondContact O-CD1 3.3Å; N328-L331 WeakPolarHBondContact O-CG 3.39Å; Q329-L331 VanDerWaalsContact C-N 3.34Å
332	D	93.3	Very high	94.7	Very high	80 Å²	80	59 Å²	59	43%	0.428	30%	0.303	S	S	.	.	S	Bend	trans	-147.5	166.9	-178.2	63.7	55.1	0	0	0	112.4	W334 T335 L336	D332-W334 PolarHBondContact O-N 3.26Å; D332-W334 WeakPolarHBondContact OD1-CA 3.42Å; D332-W334 WeakPolarHBondContact OD1-CB 3.5Å; D332-W334 PolarHBondContact OD1-N 3.3Å; D332-T335 VanDerWaalsContact CG-OG1 3.26Å; D332-T335 PolarHBondContact N-OG1 3.24Å; D332-T335 PolarHBondContact O-OG1 2.95Å; D332-T335 PolarHBondContact OD1-N 2.78Å; D332-T335 PolarHBondContact OD1-OG1 2.76Å; D332-L336 VanDerWaalsContact O-CB 3.29Å; D332-L336 WeakPolarHBondContact O-CB 3.36Å; D332-L336 PolarHBondContact O-N 2.86Å
333	E	93.9	Very high	94.6	Very high	120 Å²	120	57.4 Å²	57.4	56%	0.561	30%	0.301	S	S	*	.	H	α-helix	trans	-57.3	-36	-179.5	-68.5	-179.1	176.7	0	0	112.5	F337 M357	E333-F337 HydrophobicContact CB-CD2 4.32Å; E333-F337 HydrophobicContact CB-CE2 3.95Å; E333-F337 HydrophobicContact CG-CE2 4.48Å; E333-F337 WeakPolarHBondContact O-CB 3.38Å; E333-F337 WeakPolarHBondContact O-CD2 3.43Å; E333-F337 VanDerWaalsContact O-CG 3.31Å; E333-F337 WeakPolarHBondContact O-CG 3.48Å; E333-F337 PolarHBondContact O-N 3.14Å; E333-M357 HydrophobicContact CB-CE 3.57Å; E333-M357 HydrophobicContact CB-SD 3.75Å
334	W	95.5	Very high	94.4	Very high	102 Å²	102	56.8 Å²	56.8	39%	0.386	30%	0.297	S	S	.	.	H	α-helix	trans	-71	-52.5	-174.6	178	-94	0	0	0	110.5	D332 L336 F337 T338 L354 M357	D332-W334 PolarHBondContact O-N 3.26Å; D332-W334 WeakPolarHBondContact OD1-CA 3.42Å; D332-W334 WeakPolarHBondContact OD1-CB 3.5Å; D332-W334 PolarHBondContact OD1-N 3.3Å; W334-L336 VanDerWaalsContact C-N 3.3Å; W334-L336 PolarHBondContact O-N 3.36Å; W334-F337 PolarHBondContact O-N 3.38Å; W334-T338 HydrophobicContact CD2-CG2 4.23Å; W334-T338 HydrophobicContact CG-CG2 4.47Å; W334-T338 HydrophobicContact CZ2-CG2 4.21Å; W334-T338 WeakPolarHBondContact O-CB 3.43Å; W334-T338 WeakPolarHBondContact O-CG2 3.42Å; W334-T338 PolarHBondContact O-N 2.92Å; W334-T338 PolarHBondContact O-OG1 2.97Å; W334-L354 HydrophobicContact CE3-CD2 4.27Å; W334-L354 HydrophobicContact CZ3-CD2 4.33Å; W334-M357 HydrophobicContact CB-CE 3.74Å; W334-M357 HydrophobicContact CB-SD 4.34Å; W334-M357 HydrophobicContact CE3-CE 4.28Å; W334-M357 HydrophobicContact CE3-SD 4.22Å
335	T	95.8	Very high	94.3	Very high	41 Å²	41	55.5 Å²	55.5	25%	0.252	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-39.8	177.3	49.6	0	0	0	0	111.6	Q329 D332 T338 S339	Q329-T335 CarbonylContact O-C 3.32Å; Q329-T335 PolarHBondContact O-OG1 3.42Å; D332-T335 VanDerWaalsContact CG-OG1 3.26Å; D332-T335 PolarHBondContact N-OG1 3.24Å; D332-T335 PolarHBondContact O-OG1 2.95Å; D332-T335 PolarHBondContact OD1-N 2.78Å; D332-T335 PolarHBondContact OD1-OG1 2.76Å; T335-T338 WeakPolarHBondContact CA-OG1 3.38Å; T335-T338 PolarHBondContact O-OG1 3.4Å; T335-S339 VanDerWaalsContact O-CB 3.26Å; T335-S339 WeakPolarHBondContact O-CB 3.33Å; T335-S339 PolarHBondContact O-N 3.41Å; T335-S339 PolarHBondContact O-OG 3.35Å
336	L	95.7	Very high	94.1	Very high	29 Å²	29	54.8 Å²	54.8	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-48.2	176.6	-174.4	67.8	0	0	0	112.8	F197 Q329 W330 D332 W334 S339 G340	F197-L336 HydrophobicContact CB-CD1 3.84Å; F197-L336 HydrophobicContact CB-CG 4.49Å; F197-L336 HydrophobicContact CD1-CD1 3.9Å; F197-L336 HydrophobicContact CD1-CG 3.85Å; F197-L336 HydrophobicContact CE1-CG 4.27Å; F197-L336 HydrophobicContact CG-CD1 3.92Å; F197-L336 HydrophobicContact CG-CD2 4.39Å; F197-L336 HydrophobicContact CG-CG 4.05Å; Q329-L336 WeakPolarHBondContact O-CA 3.47Å; Q329-L336 WeakPolarHBondContact O-CB 3.44Å; Q329-L336 PolarHBondContact O-N 2.99Å; W330-L336 HydrophobicContact CD2-CD1 3.89Å; W330-L336 HydrophobicContact CE3-CD1 4.18Å; W330-L336 HydrophobicContact CG-CD1 4.23Å; W330-L336 HydrophobicContact CZ2-CD1 4.4Å; D332-L336 VanDerWaalsContact O-CB 3.29Å; D332-L336 WeakPolarHBondContact O-CB 3.36Å; D332-L336 PolarHBondContact O-N 2.86Å; W334-L336 VanDerWaalsContact C-N 3.3Å; W334-L336 PolarHBondContact O-N 3.36Å; L336-S339 PolarHBondContact O-OG 2.79Å; L336-S339 VanDerWaalsContact O-OG 3.1Å; L336-G340 PolarHBondContact O-N 2.89Å
337	F	96.2	Very high	94	Very high	23 Å²	23	54.7 Å²	54.7	10%	0.101	29%	0.291	C	S	.	.	H	α-helix	trans	-74.1	-37.3	-178.7	-65	-43.5	0	0	0	112.5	F197 E333 W334 G340 L341 I350 N353 L354 M357	F197-F337 AromaticContact CE1-CD1 3.86Å; F197-F337 HydrophobicContact CE1-CD1 3.86Å; F197-F337 HydrophobicContact CE1-CE1 4.38Å; F197-F337 HydrophobicContact CE2-CD1 4.31Å; F197-F337 HydrophobicContact CE2-CE1 4.03Å; F197-F337 AromaticContact CZ-CD1 3.47Å; F197-F337 HydrophobicContact CZ-CD1 3.47Å; F197-F337 VanDerWaalsContact CZ-CD1 3.47Å; F197-F337 AromaticContact CZ-CE1 3.63Å; F197-F337 HydrophobicContact CZ-CE1 3.63Å; E333-F337 HydrophobicContact CB-CD2 4.32Å; E333-F337 HydrophobicContact CB-CE2 3.95Å; E333-F337 HydrophobicContact CG-CE2 4.48Å; E333-F337 WeakPolarHBondContact O-CB 3.38Å; E333-F337 WeakPolarHBondContact O-CD2 3.43Å; E333-F337 VanDerWaalsContact O-CG 3.31Å; E333-F337 WeakPolarHBondContact O-CG 3.48Å; E333-F337 PolarHBondContact O-N 3.14Å; W334-F337 PolarHBondContact O-N 3.38Å; F337-G340 PolarHBondContact O-N 3.26Å; F337-L341 PolarHBondContact O-N 2.99Å; F337-I350 HydrophobicContact CB-CG2 4.23Å; F337-I350 WeakPolarHBondContact O-CG2 3.18Å; F337-N353 HydrophobicContact CD1-CB 4Å; F337-N353 HydrophobicContact CD2-CB 3.79Å; F337-N353 HydrophobicContact CE1-CB 3.76Å; F337-N353 VanDerWaalsContact CE1-ND2 3.28Å; F337-N353 WeakPolarHBondContact CE1-ND2 3.3Å; F337-N353 HydrophobicContact CE2-CB 3.55Å; F337-N353 HydrophobicContact CG-CB 4.05Å; F337-N353 HydrophobicContact CZ-CB 3.53Å; F337-N353 WeakPolarHBondContact CZ-ND2 3.31Å; F337-L354 HydrophobicContact CB-CD1 4.48Å; F337-L354 HydrophobicContact CB-CD2 3.53Å; F337-L354 HydrophobicContact CB-CG 3.79Å; F337-L354 HydrophobicContact CG-CD2 4.5Å; F337-M357 HydrophobicContact CD2-SD 3.7Å; F337-M357 HydrophobicContact CE2-SD 4.13Å
338	T	95.6	Very high	93.9	Very high	52 Å²	52	52.3 Å²	52.3	32%	0.319	28%	0.278	S	S	.	.	H	α-helix	trans	-68.4	-38.9	176.8	51.1	0	0	0	0	112.4	W334 T335 L341 S342 L354	W334-T338 HydrophobicContact CD2-CG2 4.23Å; W334-T338 HydrophobicContact CG-CG2 4.47Å; W334-T338 HydrophobicContact CZ2-CG2 4.21Å; W334-T338 WeakPolarHBondContact O-CB 3.43Å; W334-T338 WeakPolarHBondContact O-CG2 3.42Å; W334-T338 PolarHBondContact O-N 2.92Å; W334-T338 PolarHBondContact O-OG1 2.97Å; T335-T338 WeakPolarHBondContact CA-OG1 3.38Å; T335-T338 PolarHBondContact O-OG1 3.4Å; T338-L341 PolarHBondContact O-N 2.92Å; T338-S342 PolarHBondContact O-N 3.45Å; T338-L354 HydrophobicContact CG2-CD2 4.06Å
339	S	95.1	Very high	93.8	Very high	15 Å²	15	51.2 Å²	51.2	11%	0.105	27%	0.269	C	S	.	.	H	α-helix	trans	-65.7	-42.8	173.2	76.4	0	0	0	0	111.2	Q329 T335 L336 L341 S342 V343	Q329-S339 VanDerWaalsContact OE1-CB 3.26Å; Q329-S339 PolarHBondContact OE1-OG 3.43Å; T335-S339 VanDerWaalsContact O-CB 3.26Å; T335-S339 WeakPolarHBondContact O-CB 3.33Å; T335-S339 PolarHBondContact O-N 3.41Å; T335-S339 PolarHBondContact O-OG 3.35Å; L336-S339 PolarHBondContact O-OG 2.79Å; L336-S339 VanDerWaalsContact O-OG 3.1Å; S339-L341 VanDerWaalsContact C-N 3.26Å; S339-L341 PolarHBondContact O-N 2.83Å; S339-S342 WeakPolarHBondContact O-CB 3.43Å; S339-S342 PolarHBondContact O-N 3.36Å; S339-S342 PolarHBondContact O-OG 3.32Å; S339-V343 PolarHBondContact O-N 2.87Å
340	G	93.8	Very high	93.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-37.2	175.2	0	0	0	0	0	112.6	L336 F337 S342 V343 C344 I350	L336-G340 PolarHBondContact O-N 2.89Å; F337-G340 PolarHBondContact O-N 3.26Å; G340-S342 VanDerWaalsContact C-N 3.29Å; G340-S342 PolarHBondContact O-N 3.45Å; G340-V343 PolarHBondContact O-N 3.09Å; G340-C344 PolarHBondContact O-N 2.89Å; G340-I350 VanDerWaalsContact C-CD1 3.46Å
341	L	93.9	Very high	94	Very high	50 Å²	50	47.5 Å²	47.5	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-65.4	-31.7	176.3	-170.5	67.3	0	0	0	112.7	F337 T338 S339 V343 C344 P345 I350 H351 L354	F337-L341 PolarHBondContact O-N 2.99Å; T338-L341 PolarHBondContact O-N 2.92Å; S339-L341 VanDerWaalsContact C-N 3.26Å; S339-L341 PolarHBondContact O-N 2.83Å; L341-V343 PolarHBondContact O-N 3.38Å; L341-C344 CarbonylContact O-C 3.6Å; L341-P345 VanDerWaalsContact O-CA 3.32Å; L341-P345 WeakPolarHBondContact O-CA 3.12Å; L341-I350 HydrophobicContact CB-CG2 3.96Å; L341-I350 HydrophobicContact CD1-CG2 4.28Å; L341-H351 WeakPolarHBondContact CD1-CE1 3.48Å; L341-H351 VanDerWaalsContact CD1-NE2 3.3Å; L341-H351 WeakPolarHBondContact CD1-NE2 3.15Å; L341-L354 HydrophobicContact CD2-CD1 4.07Å
342	S	92.9	Very high	94.2	Very high	95 Å²	95	42.6 Å²	42.6	66%	0.664	23%	0.227	S	C	*	.	H	α-helix	trans	-67.6	-24.5	177	77.5	0	0	0	0	113.4	T338 S339 G340	T338-S342 PolarHBondContact O-N 3.45Å; S339-S342 WeakPolarHBondContact O-CB 3.43Å; S339-S342 PolarHBondContact O-N 3.36Å; S339-S342 PolarHBondContact O-OG 3.32Å; G340-S342 VanDerWaalsContact C-N 3.29Å; G340-S342 PolarHBondContact O-N 3.45Å
343	V	92.2	Very high	94.4	Very high	36 Å²	36	40.2 Å²	40.2	22%	0.218	22%	0.215	C	C	.	.	H	α-helix	trans	-99	-40.4	179.6	-178.8	0	0	0	0	111.4	Y194 L195 C196 S339 G340 L341 P345	Y194-V343 HydrophobicContact CD1-CG1 4.37Å; L195-V343 WeakPolarHBondContact O-CG2 3.17Å; C196-V343 HydrophobicContact CB-CB 4.22Å; C196-V343 HydrophobicContact CB-CG1 4.02Å; S339-V343 PolarHBondContact O-N 2.87Å; G340-V343 PolarHBondContact O-N 3.09Å; L341-V343 PolarHBondContact O-N 3.38Å; V343-P345 WeakPolarHBondContact O-CD 3.15Å
344	C	91.5	Very high	94.6	Very high	7 Å²	7	35 Å²	35	5%	0.047	19%	0.19	C	C	.	.			trans	-124.9	72.3	-177.1	-63.3	0	0	0	0	110.8	C203 G340 L341 N346 N347	C203-C344 HydrophobicContact CB-CB 4.12Å; C203-C344 WeakPolarHBondContact SG-CB 3.38Å; G340-C344 PolarHBondContact O-N 2.89Å; L341-C344 CarbonylContact O-C 3.6Å; C344-N346 PolarHBondContact O-N 2.98Å; C344-N346 VanDerWaalsContact O-N 3.1Å; C344-N347 HydrophobicContact CB-CB 4.05Å; C344-N347 WeakPolarHBondContact O-CB 3.4Å; C344-N347 PolarHBondContact O-N 3.3Å; C344-N347 VanDerWaalsContact O-N 3.08Å
345	P	92.7	Very high	94.7	Very high	72 Å²	72	30.1 Å²	30.1	47%	0.468	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21	-175.7	24.8	-35	0	0	0	113.8	L341 V343 H351	L341-P345 VanDerWaalsContact O-CA 3.32Å; L341-P345 WeakPolarHBondContact O-CA 3.12Å; V343-P345 WeakPolarHBondContact O-CD 3.15Å; P345-H351 PolarHBondContact O-NE2 3.02Å
346	N	91.4	Very high	94.8	Very high	64 Å²	64	34 Å²	34	34%	0.342	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	12.1	179.6	-69.7	-19.3	0	0	0	113.6	C344 A348 L377	C344-N346 PolarHBondContact O-N 2.98Å; C344-N346 VanDerWaalsContact O-N 3.1Å; N346-A348 PolarHBondContact O-N 3.31Å; N346-L377 HydrophobicContact CB-CD2 3.81Å; N346-L377 WeakPolarHBondContact O-CD1 3.46Å
347	N	92.4	Very high	94.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.			trans	-76.2	107.2	175.8	-169.2	-36.2	0	0	0	111.4	D198 S200 C203 C344 K349 I350 H351	D198-N347 PolarHBondContact O-ND2 2.88Å; S200-N347 PolarHBondContact O-ND2 3.16Å; C203-N347 WeakPolarHBondContact SG-CB 3.47Å; C203-N347 VanDerWaalsContact SG-CG 3.51Å; C203-N347 PolarHBondContact SG-ND2 3.26Å; C344-N347 HydrophobicContact CB-CB 4.05Å; C344-N347 WeakPolarHBondContact O-CB 3.4Å; C344-N347 PolarHBondContact O-N 3.3Å; C344-N347 VanDerWaalsContact O-N 3.08Å; N347-K349 PolarHBondContact O-N 3.36Å; N347-K349 WeakPolarHBondContact OD1-CA 3.47Å; N347-K349 VanDerWaalsContact OD1-CB 3.23Å; N347-K349 WeakPolarHBondContact OD1-CB 3.27Å; N347-K349 PolarHBondContact OD1-N 3.06Å; N347-I350 HydrophobicContact CB-CB 4.08Å; N347-I350 HydrophobicContact CB-CD1 3.67Å; N347-I350 HydrophobicContact CB-CG1 3.78Å; N347-I350 PolarHBondContact O-N 3.43Å; N347-I350 PolarHBondContact OD1-N 3.09Å; N347-H351 PolarHBondContact O-CD2 3.4Å; N347-H351 VanDerWaalsContact O-CD2 3.25Å; N347-H351 PolarHBondContact O-N 3.29Å
348	A	93.3	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-34.3	179.6	0	0	0	0	0	113.3	M201 N346 H351 Y352 A374 L377 N378 Y381	M201-A348 HydrophobicContact CB-CB 4.2Å; N346-A348 PolarHBondContact O-N 3.31Å; A348-H351 PolarHBondContact O-N 3.08Å; A348-Y352 WeakPolarHBondContact O-CB 3.32Å; A348-Y352 PolarHBondContact O-N 3.36Å; A348-A374 WeakPolarHBondContact O-CB 3.31Å; A348-L377 HydrophobicContact CB-CB 3.89Å; A348-N378 HydrophobicContact CB-CB 3.81Å; A348-Y381 HydrophobicContact CB-CD1 4.17Å; A348-Y381 HydrophobicContact CB-CE1 4.45Å
349	K	93.6	Very high	95	Very high	62 Å²	62	33 Å²	33	27%	0.27	18%	0.183	S	C	.	.	H	α-helix	trans	-67.8	-38.3	-179.5	-169.7	174.8	174.4	-172.6	0	112.3	D198 M201 N347 Y352 N353	D198-K349 VanDerWaalsContact OD2-CD 3.31Å; D198-K349 WeakPolarHBondContact OD2-CD 3.48Å; D198-K349 WeakPolarHBondContact OD2-CE 3.45Å; D198-K349 IonicContact OD2-NZ 2.86Å; D198-K349 PolarHBondContact OD2-NZ 2.89Å; M201-K349 HydrophobicContact CG-CB 4.12Å; N347-K349 PolarHBondContact O-N 3.36Å; N347-K349 WeakPolarHBondContact OD1-CA 3.47Å; N347-K349 VanDerWaalsContact OD1-CB 3.23Å; N347-K349 WeakPolarHBondContact OD1-CB 3.27Å; N347-K349 PolarHBondContact OD1-N 3.06Å; K349-Y352 PolarHBondContact O-N 2.71Å; K349-N353 PolarHBondContact O-N 3.44Å; K349-N353 PolarHBondContact O-ND2 3.13Å
350	I	95.6	Very high	95.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-49	175.6	-64.1	-180	0	0	0	110.1	F197 F337 G340 L341 N347 Y352 N353 L354	F197-I350 HydrophobicContact CE1-CD1 3.95Å; F197-I350 HydrophobicContact CE1-CG1 4.03Å; F197-I350 HydrophobicContact CZ-CD1 4.23Å; F197-I350 HydrophobicContact CZ-CG1 3.85Å; F337-I350 HydrophobicContact CB-CG2 4.23Å; F337-I350 WeakPolarHBondContact O-CG2 3.18Å; G340-I350 VanDerWaalsContact C-CD1 3.46Å; L341-I350 HydrophobicContact CB-CG2 3.96Å; L341-I350 HydrophobicContact CD1-CG2 4.28Å; N347-I350 HydrophobicContact CB-CB 4.08Å; N347-I350 HydrophobicContact CB-CD1 3.67Å; N347-I350 HydrophobicContact CB-CG1 3.78Å; N347-I350 PolarHBondContact O-N 3.43Å; N347-I350 PolarHBondContact OD1-N 3.09Å; I350-Y352 VanDerWaalsContact C-N 3.31Å; I350-Y352 PolarHBondContact O-N 2.97Å; I350-N353 PolarHBondContact O-N 3.19Å; I350-L354 HydrophobicContact CG2-CD1 4.02Å; I350-L354 HydrophobicContact CG2-CG 4.45Å; I350-L354 WeakPolarHBondContact O-CG 3.49Å; I350-L354 PolarHBondContact O-N 2.92Å
351	H	96.8	Very high	95.2	Very high	20 Å²	20	43.9 Å²	43.9	9%	0.093	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-43.3	175.7	-75.1	-71.6	0	0	0	112	L341 P345 N347 A348 N353 G355 C370 A374 L377	L341-H351 WeakPolarHBondContact CD1-CE1 3.48Å; L341-H351 VanDerWaalsContact CD1-NE2 3.3Å; L341-H351 WeakPolarHBondContact CD1-NE2 3.15Å; P345-H351 PolarHBondContact O-NE2 3.02Å; N347-H351 PolarHBondContact O-CD2 3.4Å; N347-H351 VanDerWaalsContact O-CD2 3.25Å; N347-H351 PolarHBondContact O-N 3.29Å; A348-H351 PolarHBondContact O-N 3.08Å; H351-N353 PolarHBondContact O-N 2.95Å; H351-G355 PolarHBondContact O-N 3.25Å; H351-C370 WeakPolarHBondContact O-CB 3.46Å; H351-A374 HydrophobicContact CB-CB 3.88Å; H351-L377 WeakPolarHBondContact CD2-CD1 3.38Å
352	Y	97.3	Very high	95.2	Very high	27 Å²	27	44.3 Å²	44.3	11%	0.106	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-47.2	175.5	163.9	-97.4	0	0	0	112.7	A348 K349 I350 G355 K356 Y371 Y381 F383 A384 N387	A348-Y352 WeakPolarHBondContact O-CB 3.32Å; A348-Y352 PolarHBondContact O-N 3.36Å; K349-Y352 PolarHBondContact O-N 2.71Å; I350-Y352 VanDerWaalsContact C-N 3.31Å; I350-Y352 PolarHBondContact O-N 2.97Å; Y352-G355 WeakPolarHBondContact O-CA 3.29Å; Y352-G355 PolarHBondContact O-N 3.16Å; Y352-K356 PolarHBondContact O-N 2.9Å; Y352-Y371 HydrophobicContact CD2-CD1 4.02Å; Y352-Y371 AromaticContact CD2-CE1 3.68Å; Y352-Y371 HydrophobicContact CD2-CE1 3.68Å; Y352-Y371 HydrophobicContact CE2-CE1 4.07Å; Y352-Y371 HydrophobicContact CG-CE1 4.45Å; Y352-Y371 VanDerWaalsContact O-CE1 3.31Å; Y352-Y371 WeakPolarHBondContact O-CE1 3.42Å; Y352-Y381 VanDerWaalsContact CB-CE1 3.4Å; Y352-Y381 HydrophobicContact CD1-CE1 4.37Å; Y352-Y381 AromaticContact CD1-CZ 3.92Å; Y352-Y381 WeakPolarHBondContact CD1-OH 3Å; Y352-Y381 HydrophobicContact CD2-CE1 4.3Å; Y352-Y381 AromaticContact CG-CE1 3.79Å; Y352-Y381 HydrophobicContact CG-CE1 3.79Å; Y352-Y381 AromaticContact CG-CZ 3.72Å; Y352-F383 HydrophobicContact CE2-CB 3.78Å; Y352-A384 HydrophobicContact CD2-CB 3.84Å; Y352-N387 HydrophobicContact CE2-CB 4.48Å; Y352-N387 WeakPolarHBondContact CE2-ND2 3.39Å; Y352-N387 PolarHBondContact OH-ND2 3.01Å
353	N	97.3	Very high	95.4	Very high	30 Å²	30	44.6 Å²	44.6	16%	0.16	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-42.6	-178.8	-75.3	-27.9	0	0	0	112	F337 K349 I350 H351 G355 K356 M357	F337-N353 HydrophobicContact CD1-CB 4Å; F337-N353 HydrophobicContact CD2-CB 3.79Å; F337-N353 HydrophobicContact CE1-CB 3.76Å; F337-N353 VanDerWaalsContact CE1-ND2 3.28Å; F337-N353 WeakPolarHBondContact CE1-ND2 3.3Å; F337-N353 HydrophobicContact CE2-CB 3.55Å; F337-N353 HydrophobicContact CG-CB 4.05Å; F337-N353 HydrophobicContact CZ-CB 3.53Å; F337-N353 WeakPolarHBondContact CZ-ND2 3.31Å; K349-N353 PolarHBondContact O-N 3.44Å; K349-N353 PolarHBondContact O-ND2 3.13Å; I350-N353 PolarHBondContact O-N 3.19Å; H351-N353 PolarHBondContact O-N 2.95Å; N353-G355 VanDerWaalsContact C-N 3.26Å; N353-G355 PolarHBondContact O-N 3.43Å; N353-K356 WeakPolarHBondContact O-CB 3.21Å; N353-K356 PolarHBondContact O-N 3.22Å; N353-K356 VanDerWaalsContact O-N 3.1Å; N353-M357 WeakPolarHBondContact O-CG 3.26Å; N353-M357 PolarHBondContact O-N 3.1Å
354	L	97.6	Very high	95.6	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-39.7	171.1	-71.2	173.3	0	0	0	111.6	W334 F337 T338 L341 I350 K356 M357 N358	W334-L354 HydrophobicContact CE3-CD2 4.27Å; W334-L354 HydrophobicContact CZ3-CD2 4.33Å; F337-L354 HydrophobicContact CB-CD1 4.48Å; F337-L354 HydrophobicContact CB-CD2 3.53Å; F337-L354 HydrophobicContact CB-CG 3.79Å; F337-L354 HydrophobicContact CG-CD2 4.5Å; T338-L354 HydrophobicContact CG2-CD2 4.06Å; L341-L354 HydrophobicContact CD2-CD1 4.07Å; I350-L354 HydrophobicContact CG2-CD1 4.02Å; I350-L354 HydrophobicContact CG2-CG 4.45Å; I350-L354 WeakPolarHBondContact O-CG 3.49Å; I350-L354 PolarHBondContact O-N 2.92Å; L354-K356 VanDerWaalsContact C-N 3.35Å; L354-K356 PolarHBondContact O-N 3.02Å; L354-M357 PolarHBondContact O-N 3.32Å; L354-N358 WeakPolarHBondContact O-CB 3.38Å; L354-N358 PolarHBondContact O-N 3.25Å; L354-N358 PolarHBondContact O-ND2 3.15Å
355	G	98.1	Very high	95.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-42.8	173.5	0	0	0	0	0	112.8	H351 Y352 N353 N358 A359 A367 C370 Y371	H351-G355 PolarHBondContact O-N 3.25Å; Y352-G355 WeakPolarHBondContact O-CA 3.29Å; Y352-G355 PolarHBondContact O-N 3.16Å; N353-G355 VanDerWaalsContact C-N 3.26Å; N353-G355 PolarHBondContact O-N 3.43Å; G355-N358 PolarHBondContact O-N 3.43Å; G355-A359 WeakPolarHBondContact O-CB 3.44Å; G355-A359 PolarHBondContact O-N 2.68Å; G355-A367 WeakPolarHBondContact O-CB 3.5Å; G355-C370 VanDerWaalsContact CA-CB 3.44Å; G355-Y371 VanDerWaalsContact C-CZ 3.49Å
356	K	98.1	Very high	96.2	Very high	123 Å²	123	53.8 Å²	53.8	54%	0.535	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-42.5	175.8	-173.4	-176.9	174.6	-172.6	0	111.8	Y352 N353 L354 A359 K360 Y371	Y352-K356 PolarHBondContact O-N 2.9Å; N353-K356 WeakPolarHBondContact O-CB 3.21Å; N353-K356 PolarHBondContact O-N 3.22Å; N353-K356 VanDerWaalsContact O-N 3.1Å; L354-K356 VanDerWaalsContact C-N 3.35Å; L354-K356 PolarHBondContact O-N 3.02Å; K356-A359 PolarHBondContact O-N 3.04Å; K356-K360 WeakPolarHBondContact O-CB 3.35Å; K356-K360 PolarHBondContact O-N 2.82Å; K356-Y371 WeakPolarHBondContact CA-OH 3.33Å; K356-Y371 PolarHBondContact N-OH 3.48Å; K356-Y371 VanDerWaalsContact N-OH 3.14Å
357	M	97.1	Very high	96.5	Very high	38 Å²	38	50.7 Å²	50.7	19%	0.187	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-47.7	175.9	-65.4	-170.9	78.9	0	0	111.7	E333 W334 F337 N353 L354 A359 K360 A361	E333-M357 HydrophobicContact CB-CE 3.57Å; E333-M357 HydrophobicContact CB-SD 3.75Å; W334-M357 HydrophobicContact CB-CE 3.74Å; W334-M357 HydrophobicContact CB-SD 4.34Å; W334-M357 HydrophobicContact CE3-CE 4.28Å; W334-M357 HydrophobicContact CE3-SD 4.22Å; F337-M357 HydrophobicContact CD2-SD 3.7Å; F337-M357 HydrophobicContact CE2-SD 4.13Å; N353-M357 WeakPolarHBondContact O-CG 3.26Å; N353-M357 PolarHBondContact O-N 3.1Å; L354-M357 PolarHBondContact O-N 3.32Å; M357-A359 VanDerWaalsContact C-N 3.32Å; M357-A359 PolarHBondContact O-N 3.23Å; M357-K360 PolarHBondContact O-N 3.23Å; M357-A361 WeakPolarHBondContact O-CB 3.1Å; M357-A361 PolarHBondContact O-N 3.1Å
358	N	98.1	Very high	96.8	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.032	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-39.8	177.7	-74.7	-33.7	0	0	0	111.9	L354 G355 A361 G362 R363 E366 A367	L354-N358 WeakPolarHBondContact O-CB 3.38Å; L354-N358 PolarHBondContact O-N 3.25Å; L354-N358 PolarHBondContact O-ND2 3.15Å; G355-N358 PolarHBondContact O-N 3.43Å; N358-A361 PolarHBondContact O-N 3.43Å; N358-G362 PolarHBondContact O-N 3.29Å; N358-G362 VanDerWaalsContact O-N 3.15Å; N358-R363 HydrophobicContact CB-CB 4.23Å; N358-R363 PolarHBondContact O-N 3.25Å; N358-R363 VanDerWaalsContact OD1-CZ 3.29Å; N358-R363 PolarHBondContact OD1-NE 3.43Å; N358-R363 PolarHBondContact OD1-NH2 2.65Å; N358-E366 HydrophobicContact CB-CB 4.04Å; N358-E366 PolarHBondContact OD1-OE2 3.08Å; N358-A367 HydrophobicContact CB-CB 3.99Å
359	A	97.3	Very high	97	Very high	37 Å²	37	59.1 Å²	59.1	31%	0.306	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-42.6	174.6	0	0	0	0	0	112.1	G355 K356 M357 A361 G362 A367 L391	G355-A359 WeakPolarHBondContact O-CB 3.44Å; G355-A359 PolarHBondContact O-N 2.68Å; K356-A359 PolarHBondContact O-N 3.04Å; M357-A359 VanDerWaalsContact C-N 3.32Å; M357-A359 PolarHBondContact O-N 3.23Å; A359-A361 VanDerWaalsContact C-N 3.33Å; A359-G362 PolarHBondContact O-N 2.97Å; A359-A367 HydrophobicContact CB-CB 3.94Å; A359-L391 HydrophobicContact CB-CD2 4.29Å
360	K	95.4	Very high	97.3	Very high	187 Å²	187	57 Å²	57	81%	0.813	29%	0.288	S	S	*	.	H	α-helix	trans	-64.9	-36.7	176.1	-172.3	179.9	178.5	-175.2	0	112	K356 M357 G362	K356-K360 WeakPolarHBondContact O-CB 3.35Å; K356-K360 PolarHBondContact O-N 2.82Å; M357-K360 PolarHBondContact O-N 3.23Å; K360-G362 PolarHBondContact O-N 2.89Å
361	A	95.8	Very high	97.4	Very high	57 Å²	57	57.3 Å²	57.3	47%	0.471	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.4	176	0	0	0	0	0	113.9	M357 N358 A359 R363	M357-A361 WeakPolarHBondContact O-CB 3.1Å; M357-A361 PolarHBondContact O-N 3.1Å; N358-A361 PolarHBondContact O-N 3.43Å; A359-A361 VanDerWaalsContact C-N 3.33Å; A361-R363 PolarHBondContact O-N 3.39Å
362	G	95	Very high	97.5	Very high	60 Å²	60	62 Å²	62	62%	0.619	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	3.2	-176.8	0	0	0	0	0	114.7	N358 A359 K360 R364	N358-G362 PolarHBondContact O-N 3.29Å; N358-G362 VanDerWaalsContact O-N 3.15Å; A359-G362 PolarHBondContact O-N 2.97Å; K360-G362 PolarHBondContact O-N 2.89Å; G362-R364 PolarHBondContact O-N 3.2Å
363	R	97.4	Very high	97.5	Very high	101 Å²	101	65 Å²	65	38%	0.381	32%	0.322	S	S	.	.			trans	-77.2	72.6	174.6	-65.5	-169.6	-61.3	-94.9	-0.4	110.4	N358 A361 D365 E366 A367	N358-R363 HydrophobicContact CB-CB 4.23Å; N358-R363 PolarHBondContact O-N 3.25Å; N358-R363 VanDerWaalsContact OD1-CZ 3.29Å; N358-R363 PolarHBondContact OD1-NE 3.43Å; N358-R363 PolarHBondContact OD1-NH2 2.65Å; A361-R363 PolarHBondContact O-N 3.39Å; R363-D365 PolarHBondContact O-N 2.95Å; R363-E366 HydrophobicContact CB-CB 4.31Å; R363-E366 HydrophobicContact CB-CG 4.47Å; R363-E366 WeakPolarHBondContact CD-OE2 3.41Å; R363-E366 IonicContact CZ-OE2 3.72Å; R363-E366 IonicContact NE-OE2 2.95Å; R363-E366 PolarHBondContact NE-OE2 3.04Å; R363-E366 PolarHBondContact O-N 3.36Å; R363-A367 PolarHBondContact O-N 3.39Å; R363-A367 VanDerWaalsContact O-N 3.07Å
364	R	96.6	Very high	97.5	Very high	124 Å²	124	63.6 Å²	63.6	47%	0.468	32%	0.315	S	S	.	.	H	α-helix	trans	-57.5	-47.5	-170.9	-168.3	-169.3	71.5	161.3	-1.2	112.8	G362 E366 A367 F368	G362-R364 PolarHBondContact O-N 3.2Å; R364-E366 PolarHBondContact O-N 3.23Å; R364-A367 WeakPolarHBondContact O-CB 3.32Å; R364-A367 PolarHBondContact O-N 3.06Å; R364-F368 HydrophobicContact CG-CD2 3.9Å; R364-F368 HydrophobicContact CG-CE2 3.69Å; R364-F368 VanDerWaalsContact O-CD2 3.27Å; R364-F368 WeakPolarHBondContact O-CD2 3.11Å; R364-F368 PolarHBondContact O-N 3.24Å
365	D	97.8	Very high	97.4	Very high	98 Å²	98	64 Å²	64	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-71.1	-33.7	-172.2	-58.5	-24.1	0	0	0	111.9	R363 F368 K369	R363-D365 PolarHBondContact O-N 2.95Å; D365-F368 PolarHBondContact O-N 3.27Å; D365-K369 WeakPolarHBondContact O-CG 3.33Å; D365-K369 PolarHBondContact O-N 3.46Å; D365-K369 VanDerWaalsContact O-N 3.09Å
366	E	97.8	Very high	97.3	Very high	85 Å²	85	68 Å²	68	40%	0.397	35%	0.35	S	S	.	.	H	α-helix	trans	-65.6	-42.6	170	-66.5	178.7	178	0	0	111.4	N358 R363 R364 F368 K369 C370	N358-E366 HydrophobicContact CB-CB 4.04Å; N358-E366 PolarHBondContact OD1-OE2 3.08Å; R363-E366 HydrophobicContact CB-CB 4.31Å; R363-E366 HydrophobicContact CB-CG 4.47Å; R363-E366 WeakPolarHBondContact CD-OE2 3.41Å; R363-E366 IonicContact CZ-OE2 3.72Å; R363-E366 IonicContact NE-OE2 2.95Å; R363-E366 PolarHBondContact NE-OE2 3.04Å; R363-E366 PolarHBondContact O-N 3.36Å; R364-E366 PolarHBondContact O-N 3.23Å; E366-F368 VanDerWaalsContact C-N 3.3Å; E366-F368 PolarHBondContact O-N 3.19Å; E366-K369 PolarHBondContact O-N 3.04Å; E366-K369 VanDerWaalsContact O-N 3.14Å; E366-C370 WeakPolarHBondContact O-CB 3.16Å; E366-C370 PolarHBondContact O-N 2.91Å; E366-C370 PolarHBondContact O-SG 3.49Å; E366-C370 VanDerWaalsContact O-SG 3.4Å
367	A	98.4	Very high	97	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.9	-41.5	175.8	0	0	0	0	0	111.8	G355 N358 A359 R363 R364 C370 Y371 L391	G355-A367 WeakPolarHBondContact O-CB 3.5Å; N358-A367 HydrophobicContact CB-CB 3.99Å; A359-A367 HydrophobicContact CB-CB 3.94Å; R363-A367 PolarHBondContact O-N 3.39Å; R363-A367 VanDerWaalsContact O-N 3.07Å; R364-A367 WeakPolarHBondContact O-CB 3.32Å; R364-A367 PolarHBondContact O-N 3.06Å; A367-C370 PolarHBondContact O-N 3.4Å; A367-Y371 HydrophobicContact CB-CE2 4.37Å; A367-Y371 WeakPolarHBondContact O-CD2 3.38Å; A367-Y371 PolarHBondContact O-N 2.7Å; A367-L391 HydrophobicContact CB-CD1 3.7Å
368	F	98.5	Very high	96.8	Very high	23 Å²	23	65 Å²	65	10%	0.101	34%	0.34	C	S	.	.	H	α-helix	trans	-58.6	-47.2	172.4	-88.8	-75.6	0	0	0	112.3	R364 D365 E366 K372 L388 L391 F392	R364-F368 HydrophobicContact CG-CD2 3.9Å; R364-F368 HydrophobicContact CG-CE2 3.69Å; R364-F368 VanDerWaalsContact O-CD2 3.27Å; R364-F368 WeakPolarHBondContact O-CD2 3.11Å; R364-F368 PolarHBondContact O-N 3.24Å; D365-F368 PolarHBondContact O-N 3.27Å; E366-F368 VanDerWaalsContact C-N 3.3Å; E366-F368 PolarHBondContact O-N 3.19Å; F368-K372 WeakPolarHBondContact O-CB 3.32Å; F368-K372 VanDerWaalsContact O-CG 3.25Å; F368-K372 WeakPolarHBondContact O-CG 3.5Å; F368-K372 PolarHBondContact O-N 3.2Å; F368-L388 HydrophobicContact CD1-CD1 3.42Å; F368-L388 VanDerWaalsContact CD1-CD1 3.42Å; F368-L388 HydrophobicContact CE1-CD1 3.73Å; F368-L388 HydrophobicContact CG-CD1 4.41Å; F368-L391 HydrophobicContact CD1-CD1 4.46Å; F368-L391 HydrophobicContact CD2-CD1 4.11Å; F368-L391 HydrophobicContact CE1-CB 3.94Å; F368-L391 HydrophobicContact CE2-CB 3.86Å; F368-L391 HydrophobicContact CE2-CD1 4.26Å; F368-L391 HydrophobicContact CG-CD1 4.2Å; F368-L391 HydrophobicContact CZ-CB 3.53Å; F368-L391 HydrophobicContact CZ-CD1 4.49Å; F368-F392 HydrophobicContact CD1-CE2 4.47Å; F368-F392 HydrophobicContact CD1-CZ 4.31Å; F368-F392 AromaticContact CE1-CD1 3.78Å; F368-F392 HydrophobicContact CE1-CD1 3.78Å; F368-F392 AromaticContact CE1-CD2 3.97Å; F368-F392 HydrophobicContact CE1-CD2 3.97Å; F368-F392 AromaticContact CE1-CE1 3.7Å; F368-F392 HydrophobicContact CE1-CE1 3.7Å; F368-F392 AromaticContact CE1-CE2 3.88Å; F368-F392 HydrophobicContact CE1-CE2 3.88Å; F368-F392 AromaticContact CE1-CG 3.95Å; F368-F392 HydrophobicContact CE1-CG 3.95Å; F368-F392 AromaticContact CE1-CZ 3.76Å; F368-F392 HydrophobicContact CE1-CZ 3.76Å; F368-F392 HydrophobicContact CZ-CD1 4.12Å; F368-F392 HydrophobicContact CZ-CE1 4.35Å; F368-F392 HydrophobicContact CZ-CG 4.38Å
369	K	98.3	Very high	96.5	Very high	153 Å²	153	65.9 Å²	65.9	67%	0.665	35%	0.35	S	S	*	.	H	α-helix	trans	-60.7	-49	178.5	-72.5	175.5	-178.5	178.3	0	111.3	D365 E366 K372 K373	D365-K369 WeakPolarHBondContact O-CG 3.33Å; D365-K369 PolarHBondContact O-N 3.46Å; D365-K369 VanDerWaalsContact O-N 3.09Å; E366-K369 PolarHBondContact O-N 3.04Å; E366-K369 VanDerWaalsContact O-N 3.14Å; K369-K372 PolarHBondContact O-N 3.47Å; K369-K373 WeakPolarHBondContact O-CB 3.08Å; K369-K373 PolarHBondContact O-N 3.32Å
370	C	98.3	Very high	96.2	Very high	19 Å²	19	68.8 Å²	68.8	13%	0.128	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-50.3	179.5	-75	0	0	0	0	112.2	H351 G355 E366 A367 K373 A374	H351-C370 WeakPolarHBondContact O-CB 3.46Å; G355-C370 VanDerWaalsContact CA-CB 3.44Å; E366-C370 WeakPolarHBondContact O-CB 3.16Å; E366-C370 PolarHBondContact O-N 2.91Å; E366-C370 PolarHBondContact O-SG 3.49Å; E366-C370 VanDerWaalsContact O-SG 3.4Å; A367-C370 PolarHBondContact O-N 3.4Å; C370-K373 PolarHBondContact O-N 2.99Å; C370-A374 PolarHBondContact O-N 3Å
371	Y	98.6	Very high	96.1	Very high	6 Å²	6	60.7 Å²	60.7	2%	0.024	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-39.4	179.3	-67.6	-46.1	0	0	0	113	Y352 G355 K356 A367 K373 A374 I375 N387 L388 L391	Y352-Y371 HydrophobicContact CD2-CD1 4.02Å; Y352-Y371 AromaticContact CD2-CE1 3.68Å; Y352-Y371 HydrophobicContact CD2-CE1 3.68Å; Y352-Y371 HydrophobicContact CE2-CE1 4.07Å; Y352-Y371 HydrophobicContact CG-CE1 4.45Å; Y352-Y371 VanDerWaalsContact O-CE1 3.31Å; Y352-Y371 WeakPolarHBondContact O-CE1 3.42Å; G355-Y371 VanDerWaalsContact C-CZ 3.49Å; K356-Y371 WeakPolarHBondContact CA-OH 3.33Å; K356-Y371 PolarHBondContact N-OH 3.48Å; K356-Y371 VanDerWaalsContact N-OH 3.14Å; A367-Y371 HydrophobicContact CB-CE2 4.37Å; A367-Y371 WeakPolarHBondContact O-CD2 3.38Å; A367-Y371 PolarHBondContact O-N 2.7Å; Y371-K373 VanDerWaalsContact C-N 3.31Å; Y371-K373 PolarHBondContact O-N 3.36Å; Y371-A374 PolarHBondContact O-N 2.93Å; Y371-I375 WeakPolarHBondContact O-CD1 3.19Å; Y371-I375 WeakPolarHBondContact O-CG1 3.39Å; Y371-I375 PolarHBondContact O-N 2.95Å; Y371-N387 HydrophobicContact CE1-CB 3.93Å; Y371-N387 HydrophobicContact CE2-CB 3.94Å; Y371-L388 HydrophobicContact CD2-CB 4.49Å; Y371-L388 HydrophobicContact CG-CB 4.46Å; Y371-L391 HydrophobicContact CD2-CD1 3.66Å; Y371-L391 HydrophobicContact CD2-CG 4.45Å; Y371-L391 HydrophobicContact CE2-CD1 3.78Å; Y371-L391 HydrophobicContact CE2-CG 4.29Å
372	K	98.4	Very high	96.1	Very high	117 Å²	117	59 Å²	59	51%	0.509	31%	0.308	S	S	.	.	H	α-helix	trans	-60.2	-41.9	173.7	-76.6	178.4	177.9	-175.7	0	111.6	F368 K369 I375 A376 L388	F368-K372 WeakPolarHBondContact O-CB 3.32Å; F368-K372 VanDerWaalsContact O-CG 3.25Å; F368-K372 WeakPolarHBondContact O-CG 3.5Å; F368-K372 PolarHBondContact O-N 3.2Å; K369-K372 PolarHBondContact O-N 3.47Å; K372-I375 PolarHBondContact O-N 3.46Å; K372-A376 WeakPolarHBondContact O-CB 3.16Å; K372-A376 PolarHBondContact O-N 3.24Å; K372-L388 HydrophobicContact CG-CD2 4.11Å
373	K	97.4	Very high	96.1	Very high	92 Å²	92	60.7 Å²	60.7	40%	0.4	30%	0.299	S	S	.	.	H	α-helix	trans	-66.4	-41	176.6	-173.5	61.2	178	178.7	0	111.7	K369 C370 Y371 I375 A376 L377	K369-K373 WeakPolarHBondContact O-CB 3.08Å; K369-K373 PolarHBondContact O-N 3.32Å; C370-K373 PolarHBondContact O-N 2.99Å; Y371-K373 VanDerWaalsContact C-N 3.31Å; Y371-K373 PolarHBondContact O-N 3.36Å; K373-I375 PolarHBondContact O-N 3.35Å; K373-A376 PolarHBondContact O-N 3.08Å; K373-L377 HydrophobicContact CD-CD1 4.34Å; K373-L377 HydrophobicContact CD-CG 4.43Å; K373-L377 HydrophobicContact CG-CD1 4.04Å; K373-L377 WeakPolarHBondContact O-CD1 3.48Å; K373-L377 VanDerWaalsContact O-CG 3.28Å; K373-L377 WeakPolarHBondContact O-CG 3.4Å; K373-L377 PolarHBondContact O-N 2.69Å
374	A	96.7	Very high	96.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.4	-45.5	174.3	0	0	0	0	0	112	A348 H351 C370 Y371 L377 N378 Y381 A384	A348-A374 WeakPolarHBondContact O-CB 3.31Å; H351-A374 HydrophobicContact CB-CB 3.88Å; C370-A374 PolarHBondContact O-N 3Å; Y371-A374 PolarHBondContact O-N 2.93Å; A374-L377 PolarHBondContact O-N 2.71Å; A374-N378 PolarHBondContact O-N 3.35Å; A374-Y381 HydrophobicContact CB-CD1 4.33Å; A374-A384 HydrophobicContact CB-CB 4.18Å
375	I	96.2	Very high	96.2	Very high	18 Å²	18	50 Å²	50	9%	0.092	26%	0.259	C	S	.	.	H	α-helix	trans	-69.4	-35	178.1	-65	157.7	0	0	0	111.8	Y371 K372 K373 L377 N378 G379 A384 L385 L388	Y371-I375 WeakPolarHBondContact O-CD1 3.19Å; Y371-I375 WeakPolarHBondContact O-CG1 3.39Å; Y371-I375 PolarHBondContact O-N 2.95Å; K372-I375 PolarHBondContact O-N 3.46Å; K373-I375 PolarHBondContact O-N 3.35Å; I375-L377 VanDerWaalsContact C-N 3.29Å; I375-L377 PolarHBondContact O-N 2.9Å; I375-N378 WeakPolarHBondContact CA-O 2.99Å; I375-N378 CarbonylContact O-C 3.09Å; I375-N378 VanDerWaalsContact O-O 3.13Å; I375-G379 VanDerWaalsContact O-CA 3.28Å; I375-G379 WeakPolarHBondContact O-CA 3.47Å; I375-G379 PolarHBondContact O-N 3.01Å; I375-A384 HydrophobicContact CD1-CB 4.5Å; I375-A384 HydrophobicContact CG1-CB 3.91Å; I375-L385 HydrophobicContact CD1-CD2 3.89Å; I375-L385 HydrophobicContact CD1-CG 4.43Å; I375-L385 HydrophobicContact CG1-CD2 4.03Å; I375-L385 HydrophobicContact CG1-CG 4.32Å; I375-L385 HydrophobicContact CG2-CD2 3.95Å; I375-L388 HydrophobicContact CD1-CB 4.14Å; I375-L388 HydrophobicContact CD1-CD2 3.42Å; I375-L388 VanDerWaalsContact CD1-CD2 3.42Å; I375-L388 HydrophobicContact CD1-CG 4.41Å
376	A	96.1	Very high	96.2	Very high	84 Å²	84	45.6 Å²	45.6	69%	0.694	24%	0.235	S	C	*	.	H	α-helix	trans	-66.8	-32.3	175.6	0	0	0	0	0	112.3	K372 K373	K372-A376 WeakPolarHBondContact O-CB 3.16Å; K372-A376 PolarHBondContact O-N 3.24Å; K373-A376 PolarHBondContact O-N 3.08Å
377	L	92.6	Very high	96.3	Very high	56 Å²	56	43.3 Å²	43.3	29%	0.293	23%	0.225	S	C	.	.	H	α-helix	trans	-80.8	-37.5	176.9	-69.7	166	0	0	0	112.4	N346 A348 H351 K373 A374 I375	N346-L377 HydrophobicContact CB-CD2 3.81Å; N346-L377 WeakPolarHBondContact O-CD1 3.46Å; A348-L377 HydrophobicContact CB-CB 3.89Å; H351-L377 WeakPolarHBondContact CD2-CD1 3.38Å; K373-L377 HydrophobicContact CD-CD1 4.34Å; K373-L377 HydrophobicContact CD-CG 4.43Å; K373-L377 HydrophobicContact CG-CD1 4.04Å; K373-L377 WeakPolarHBondContact O-CD1 3.48Å; K373-L377 VanDerWaalsContact O-CG 3.28Å; K373-L377 WeakPolarHBondContact O-CG 3.4Å; K373-L377 PolarHBondContact O-N 2.69Å; A374-L377 PolarHBondContact O-N 2.71Å; I375-L377 VanDerWaalsContact C-N 3.29Å; I375-L377 PolarHBondContact O-N 2.9Å
378	N	91.5	Very high	96.3	Very high	42 Å²	42	43.6 Å²	43.6	23%	0.225	23%	0.227	C	C	.	.			trans	-134.4	102.4	172.5	-179.5	2.5	0	0	0	109.8	M201 A348 A374 I375 D380 Y381	M201-N378 PolarHBondContact SD-ND2 2.91Å; A348-N378 HydrophobicContact CB-CB 3.81Å; A374-N378 PolarHBondContact O-N 3.35Å; I375-N378 WeakPolarHBondContact CA-O 2.99Å; I375-N378 CarbonylContact O-C 3.09Å; I375-N378 VanDerWaalsContact O-O 3.13Å; N378-D380 PolarHBondContact O-N 2.87Å; N378-D380 PolarHBondContact OD1-N 2.75Å; N378-D380 VanDerWaalsContact OD1-N 3.1Å; N378-Y381 WeakPolarHBondContact O-CB 3.45Å; N378-Y381 PolarHBondContact O-N 3.01Å
379	G	91.7	Very high	96.3	Very high	24 Å²	24	42.5 Å²	42.5	25%	0.247	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.4	-178.1	0	0	0	0	0	114	I375 Y381 R407	I375-G379 VanDerWaalsContact O-CA 3.28Å; I375-G379 WeakPolarHBondContact O-CA 3.47Å; I375-G379 PolarHBondContact O-N 3.01Å; G379-Y381 VanDerWaalsContact C-N 3.34Å; G379-R407 VanDerWaalsContact C-NH2 3.26Å; G379-R407 VanDerWaalsContact CA-NH2 3.26Å; G379-R407 PolarHBondContact O-NE 3.25Å; G379-R407 PolarHBondContact O-NH2 3.33Å
380	D	91.5	Very high	96.3	Very high	99 Å²	99	36.9 Å²	36.9	53%	0.529	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	22.2	-174.4	-61.1	-20.8	0	0	0	111.4	N378 D382 V411	N378-D380 PolarHBondContact O-N 2.87Å; N378-D380 PolarHBondContact OD1-N 2.75Å; N378-D380 VanDerWaalsContact OD1-N 3.1Å; D380-D382 VanDerWaalsContact C-N 3.31Å; D380-D382 PolarHBondContact O-N 3.3Å; D380-V411 HydrophobicContact CB-CG1 3.8Å; D380-V411 HydrophobicContact CB-CG2 4.06Å; D380-V411 WeakPolarHBondContact O-CG1 3.44Å
381	Y	93.5	Very high	96.3	Very high	16 Å²	16	36.6 Å²	36.6	6%	0.063	20%	0.198	C	C	.	.			trans	-79.1	81.7	177.2	-161.5	177.8	0	0	0	111.3	A348 Y352 A374 N378 G379 F383 A384 L385	A348-Y381 HydrophobicContact CB-CD1 4.17Å; A348-Y381 HydrophobicContact CB-CE1 4.45Å; Y352-Y381 VanDerWaalsContact CB-CE1 3.4Å; Y352-Y381 HydrophobicContact CD1-CE1 4.37Å; Y352-Y381 AromaticContact CD1-CZ 3.92Å; Y352-Y381 WeakPolarHBondContact CD1-OH 3Å; Y352-Y381 HydrophobicContact CD2-CE1 4.3Å; Y352-Y381 AromaticContact CG-CE1 3.79Å; Y352-Y381 HydrophobicContact CG-CE1 3.79Å; Y352-Y381 AromaticContact CG-CZ 3.72Å; A374-Y381 HydrophobicContact CB-CD1 4.33Å; N378-Y381 WeakPolarHBondContact O-CB 3.45Å; N378-Y381 PolarHBondContact O-N 3.01Å; G379-Y381 VanDerWaalsContact C-N 3.34Å; Y381-F383 HydrophobicContact CD2-CB 4.23Å; Y381-F383 HydrophobicContact CE2-CB 3.89Å; Y381-F383 HydrophobicContact CE2-CD2 4.11Å; Y381-F383 HydrophobicContact CE2-CG 4.49Å; Y381-F383 PolarHBondContact O-N 3.07Å; Y381-A384 HydrophobicContact CD1-CB 3.68Å; Y381-A384 HydrophobicContact CD2-CB 4.36Å; Y381-A384 HydrophobicContact CE1-CB 4.27Å; Y381-A384 HydrophobicContact CG-CB 3.73Å; Y381-A384 WeakPolarHBondContact O-CA 3.38Å; Y381-A384 WeakPolarHBondContact O-CB 3.43Å; Y381-A384 PolarHBondContact O-N 3.48Å; Y381-L385 WeakPolarHBondContact O-CG 3.35Å; Y381-L385 PolarHBondContact O-N 3.26Å
382	D	95	Very high	96.3	Very high	21 Å²	21	37.5 Å²	37.5	11%	0.112	20%	0.202	C	C	.	.	H	α-helix	trans	-45.5	-48.5	179.5	61	-11.5	0	0	0	114.3	D380 A384 L385 N386 V411 N412 F415	D380-D382 VanDerWaalsContact C-N 3.31Å; D380-D382 PolarHBondContact O-N 3.3Å; D382-A384 VanDerWaalsContact C-N 3.34Å; D382-A384 PolarHBondContact O-N 3.23Å; D382-L385 PolarHBondContact O-N 3.05Å; D382-N386 WeakPolarHBondContact O-CB 3.36Å; D382-N386 PolarHBondContact O-N 3.46Å; D382-V411 HydrophobicContact CB-CG1 4.45Å; D382-N412 HydrophobicContact CB-CB 4.19Å; D382-N412 WeakPolarHBondContact OD2-CB 3.26Å; D382-N412 PolarHBondContact OD2-ND2 3.16Å; D382-F415 HydrophobicContact CB-CD1 4.24Å; D382-F415 HydrophobicContact CB-CE1 4.28Å
383	F	96.1	Very high	96.3	Very high	97 Å²	97	33.5 Å²	33.5	43%	0.425	19%	0.186	S	C	.	.	H	α-helix	trans	-62.6	-38.5	177.2	-67.6	-76.2	0	0	0	112.7	Y352 Y381 N387 F415	Y352-F383 HydrophobicContact CE2-CB 3.78Å; Y381-F383 HydrophobicContact CD2-CB 4.23Å; Y381-F383 HydrophobicContact CE2-CB 3.89Å; Y381-F383 HydrophobicContact CE2-CD2 4.11Å; Y381-F383 HydrophobicContact CE2-CG 4.49Å; Y381-F383 PolarHBondContact O-N 3.07Å; F383-N387 WeakPolarHBondContact O-CB 3.3Å; F383-N387 PolarHBondContact O-N 3.12Å; F383-F415 HydrophobicContact CD1-CE2 4.16Å; F383-F415 HydrophobicContact CD1-CZ 4.02Å; F383-F415 AromaticContact CE1-CE2 3.93Å; F383-F415 HydrophobicContact CE1-CE2 3.93Å; F383-F415 HydrophobicContact CE1-CZ 4.27Å
384	A	97.4	Very high	96.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-71.4	-41	177.4	0	0	0	0	0	111.7	Y352 A374 I375 Y381 D382 N387 L388	Y352-A384 HydrophobicContact CD2-CB 3.84Å; A374-A384 HydrophobicContact CB-CB 4.18Å; I375-A384 HydrophobicContact CD1-CB 4.5Å; I375-A384 HydrophobicContact CG1-CB 3.91Å; Y381-A384 HydrophobicContact CD1-CB 3.68Å; Y381-A384 HydrophobicContact CD2-CB 4.36Å; Y381-A384 HydrophobicContact CE1-CB 4.27Å; Y381-A384 HydrophobicContact CG-CB 3.73Å; Y381-A384 WeakPolarHBondContact O-CA 3.38Å; Y381-A384 WeakPolarHBondContact O-CB 3.43Å; Y381-A384 PolarHBondContact O-N 3.48Å; D382-A384 VanDerWaalsContact C-N 3.34Å; D382-A384 PolarHBondContact O-N 3.23Å; A384-N387 PolarHBondContact O-N 3.4Å; A384-L388 VanDerWaalsContact O-CB 3.27Å; A384-L388 WeakPolarHBondContact O-CB 3.19Å; A384-L388 PolarHBondContact O-N 3.24Å
385	L	98.5	Very high	96.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.5	-49.9	173.3	-70	169	0	0	0	111	I375 Y381 D382 L388 A389 L404 R407 A408	I375-L385 HydrophobicContact CD1-CD2 3.89Å; I375-L385 HydrophobicContact CD1-CG 4.43Å; I375-L385 HydrophobicContact CG1-CD2 4.03Å; I375-L385 HydrophobicContact CG1-CG 4.32Å; I375-L385 HydrophobicContact CG2-CD2 3.95Å; Y381-L385 WeakPolarHBondContact O-CG 3.35Å; Y381-L385 PolarHBondContact O-N 3.26Å; D382-L385 PolarHBondContact O-N 3.05Å; L385-L388 PolarHBondContact O-N 3.03Å; L385-A389 WeakPolarHBondContact O-CB 3.39Å; L385-A389 PolarHBondContact O-N 3.23Å; L385-L404 HydrophobicContact CD2-CD2 3.71Å; L385-R407 HydrophobicContact CD1-CB 4.28Å; L385-R407 HydrophobicContact CD1-CG 3.89Å; L385-A408 HydrophobicContact CB-CB 3.82Å; L385-A408 HydrophobicContact CD1-CB 4.31Å
386	N	98.6	Very high	96.3	Very high	6 Å²	6	46 Å²	46	3%	0.032	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-47.9	178.2	172.1	81.7	0	0	0	112.6	D382 L388 A389 V390 L405 F415 N421	D382-N386 WeakPolarHBondContact O-CB 3.36Å; D382-N386 PolarHBondContact O-N 3.46Å; N386-L388 VanDerWaalsContact C-N 3.35Å; N386-L388 PolarHBondContact O-N 3.24Å; N386-A389 WeakPolarHBondContact O-CB 3.38Å; N386-A389 PolarHBondContact O-N 3.31Å; N386-A389 VanDerWaalsContact O-N 3.15Å; N386-V390 WeakPolarHBondContact O-CG2 3.44Å; N386-V390 PolarHBondContact O-N 3.24Å; N386-L405 HydrophobicContact CB-CD2 4.33Å; N386-L405 WeakPolarHBondContact OD1-CD2 3.49Å; N386-F415 HydrophobicContact CB-CE1 3.56Å; N386-F415 HydrophobicContact CB-CZ 3.82Å; N386-N421 PolarHBondContact OD1-ND2 3.15Å
387	N	98.5	Very high	96.4	Very high	36 Å²	36	46.8 Å²	46.8	19%	0.193	23%	0.227	C	C	.	.	H	α-helix	trans	-68.6	-35	-178.1	-72.3	-8.2	0	0	0	112.3	Y352 Y371 F383 A384 A389 V390 L391	Y352-N387 HydrophobicContact CE2-CB 4.48Å; Y352-N387 WeakPolarHBondContact CE2-ND2 3.39Å; Y352-N387 PolarHBondContact OH-ND2 3.01Å; Y371-N387 HydrophobicContact CE1-CB 3.93Å; Y371-N387 HydrophobicContact CE2-CB 3.94Å; F383-N387 WeakPolarHBondContact O-CB 3.3Å; F383-N387 PolarHBondContact O-N 3.12Å; A384-N387 PolarHBondContact O-N 3.4Å; N387-A389 VanDerWaalsContact C-N 3.35Å; N387-V390 PolarHBondContact O-N 2.94Å; N387-L391 PolarHBondContact O-N 2.97Å; N387-L391 VanDerWaalsContact O-N 3.15Å
388	L	98.6	Very high	96.7	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-41.9	170.6	-178.3	59.1	0	0	0	111.4	F368 Y371 K372 I375 A384 L385 N386 V390 L391 F392 L404	F368-L388 HydrophobicContact CD1-CD1 3.42Å; F368-L388 VanDerWaalsContact CD1-CD1 3.42Å; F368-L388 HydrophobicContact CE1-CD1 3.73Å; F368-L388 HydrophobicContact CG-CD1 4.41Å; Y371-L388 HydrophobicContact CD2-CB 4.49Å; Y371-L388 HydrophobicContact CG-CB 4.46Å; K372-L388 HydrophobicContact CG-CD2 4.11Å; I375-L388 HydrophobicContact CD1-CB 4.14Å; I375-L388 HydrophobicContact CD1-CD2 3.42Å; I375-L388 VanDerWaalsContact CD1-CD2 3.42Å; I375-L388 HydrophobicContact CD1-CG 4.41Å; A384-L388 VanDerWaalsContact O-CB 3.27Å; A384-L388 WeakPolarHBondContact O-CB 3.19Å; A384-L388 PolarHBondContact O-N 3.24Å; L385-L388 PolarHBondContact O-N 3.03Å; N386-L388 VanDerWaalsContact C-N 3.35Å; N386-L388 PolarHBondContact O-N 3.24Å; L388-V390 VanDerWaalsContact C-N 3.32Å; L388-V390 PolarHBondContact O-N 3.19Å; L388-L391 WeakPolarHBondContact O-CB 3.34Å; L388-L391 PolarHBondContact O-N 3.14Å; L388-L391 VanDerWaalsContact O-N 3.14Å; L388-F392 HydrophobicContact CD1-CD2 4.18Å; L388-F392 HydrophobicContact CD1-CE2 3.84Å; L388-F392 HydrophobicContact CD2-CE2 4.1Å; L388-F392 HydrophobicContact CG-CD2 3.96Å; L388-F392 HydrophobicContact CG-CE2 3.74Å; L388-F392 WeakPolarHBondContact O-CD2 3.44Å; L388-F392 PolarHBondContact O-N 3.45Å; L388-L404 HydrophobicContact CB-CD1 4.16Å; L388-L404 HydrophobicContact CD2-CD1 3.74Å; L388-L404 HydrophobicContact CD2-CD2 4.23Å; L388-L404 HydrophobicContact CG-CD1 3.64Å
389	A	98.6	Very high	97.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-39.4	175.8	0	0	0	0	0	112.3	L385 N386 N387 L391 F392 L393 A401 L404 L405	L385-A389 WeakPolarHBondContact O-CB 3.39Å; L385-A389 PolarHBondContact O-N 3.23Å; N386-A389 WeakPolarHBondContact O-CB 3.38Å; N386-A389 PolarHBondContact O-N 3.31Å; N386-A389 VanDerWaalsContact O-N 3.15Å; N387-A389 VanDerWaalsContact C-N 3.35Å; A389-L391 VanDerWaalsContact C-N 3.28Å; A389-L391 PolarHBondContact O-N 2.76Å; A389-F392 PolarHBondContact O-N 3.04Å; A389-F392 VanDerWaalsContact O-N 3.14Å; A389-L393 WeakPolarHBondContact O-CB 3.48Å; A389-L393 PolarHBondContact O-N 3.45Å; A389-A401 HydrophobicContact CB-CB 4.28Å; A389-A401 WeakPolarHBondContact O-CB 3.43Å; A389-L404 HydrophobicContact CB-CB 3.84Å; A389-L404 HydrophobicContact CB-CD1 4.36Å; A389-L405 HydrophobicContact CB-CD1 3.78Å; A389-L405 HydrophobicContact CB-CD2 4.02Å; A389-L405 HydrophobicContact CB-CG 3.48Å; A389-L405 VanDerWaalsContact CB-CG 3.48Å
390	V	98.3	Very high	97.4	Very high	35 Å²	35	50.8 Å²	50.8	21%	0.212	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-36.9	173.7	171.1	0	0	0	0	111.5	N386 N387 L388 K394	N386-V390 WeakPolarHBondContact O-CG2 3.44Å; N386-V390 PolarHBondContact O-N 3.24Å; N387-V390 PolarHBondContact O-N 2.94Å; L388-V390 VanDerWaalsContact C-N 3.32Å; L388-V390 PolarHBondContact O-N 3.19Å; V390-K394 WeakPolarHBondContact O-CG 3.39Å; V390-K394 PolarHBondContact O-N 3.4Å
391	L	98.1	Very high	97.7	Very high	13 Å²	13	46.1 Å²	46.1	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-66.1	-42.8	172.7	-65.4	-175.8	0	0	0	112.1	A359 A367 F368 Y371 N387 L388 A389 K394 A395	A359-L391 HydrophobicContact CB-CD2 4.29Å; A367-L391 HydrophobicContact CB-CD1 3.7Å; F368-L391 HydrophobicContact CD1-CD1 4.46Å; F368-L391 HydrophobicContact CD2-CD1 4.11Å; F368-L391 HydrophobicContact CE1-CB 3.94Å; F368-L391 HydrophobicContact CE2-CB 3.86Å; F368-L391 HydrophobicContact CE2-CD1 4.26Å; F368-L391 HydrophobicContact CG-CD1 4.2Å; F368-L391 HydrophobicContact CZ-CB 3.53Å; F368-L391 HydrophobicContact CZ-CD1 4.49Å; Y371-L391 HydrophobicContact CD2-CD1 3.66Å; Y371-L391 HydrophobicContact CD2-CG 4.45Å; Y371-L391 HydrophobicContact CE2-CD1 3.78Å; Y371-L391 HydrophobicContact CE2-CG 4.29Å; N387-L391 PolarHBondContact O-N 2.97Å; N387-L391 VanDerWaalsContact O-N 3.15Å; L388-L391 WeakPolarHBondContact O-CB 3.34Å; L388-L391 PolarHBondContact O-N 3.14Å; L388-L391 VanDerWaalsContact O-N 3.14Å; A389-L391 VanDerWaalsContact C-N 3.28Å; A389-L391 PolarHBondContact O-N 2.76Å; L391-K394 PolarHBondContact O-N 2.96Å; L391-A395 WeakPolarHBondContact O-CB 3.41Å; L391-A395 PolarHBondContact O-N 3.39Å
392	F	98.6	Very high	98	Very high	26 Å²	26	45.9 Å²	45.9	11%	0.114	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-39.8	175.3	-81.3	-62.6	0	0	0	112.5	F368 L388 A389 A395 R396 H397 N400 A401 L404	F368-F392 HydrophobicContact CD1-CE2 4.47Å; F368-F392 HydrophobicContact CD1-CZ 4.31Å; F368-F392 AromaticContact CE1-CD1 3.78Å; F368-F392 HydrophobicContact CE1-CD1 3.78Å; F368-F392 AromaticContact CE1-CD2 3.97Å; F368-F392 HydrophobicContact CE1-CD2 3.97Å; F368-F392 AromaticContact CE1-CE1 3.7Å; F368-F392 HydrophobicContact CE1-CE1 3.7Å; F368-F392 AromaticContact CE1-CE2 3.88Å; F368-F392 HydrophobicContact CE1-CE2 3.88Å; F368-F392 AromaticContact CE1-CG 3.95Å; F368-F392 HydrophobicContact CE1-CG 3.95Å; F368-F392 AromaticContact CE1-CZ 3.76Å; F368-F392 HydrophobicContact CE1-CZ 3.76Å; F368-F392 HydrophobicContact CZ-CD1 4.12Å; F368-F392 HydrophobicContact CZ-CE1 4.35Å; F368-F392 HydrophobicContact CZ-CG 4.38Å; L388-F392 HydrophobicContact CD1-CD2 4.18Å; L388-F392 HydrophobicContact CD1-CE2 3.84Å; L388-F392 HydrophobicContact CD2-CE2 4.1Å; L388-F392 HydrophobicContact CG-CD2 3.96Å; L388-F392 HydrophobicContact CG-CE2 3.74Å; L388-F392 WeakPolarHBondContact O-CD2 3.44Å; L388-F392 PolarHBondContact O-N 3.45Å; A389-F392 PolarHBondContact O-N 3.04Å; A389-F392 VanDerWaalsContact O-N 3.14Å; F392-A395 CarbonylContact O-C 3.42Å; F392-A395 WeakPolarHBondContact O-CA 3.41Å; F392-A395 PolarHBondContact O-N 2.85Å; F392-A395 VanDerWaalsContact O-N 3.16Å; F392-R396 PolarHBondContact O-N 3.37Å; F392-H397 HydrophobicContact CB-CB 4.28Å; F392-H397 HydrophobicContact CD1-CB 3.71Å; F392-H397 HydrophobicContact CG-CB 4.43Å; F392-H397 PolarHBondContact O-N 3.47Å; F392-N400 HydrophobicContact CB-CB 4.48Å; F392-N400 HydrophobicContact CD1-CB 3.92Å; F392-N400 HydrophobicContact CD2-CB 4.21Å; F392-N400 HydrophobicContact CE1-CB 4.1Å; F392-N400 HydrophobicContact CE2-CB 4.38Å; F392-N400 HydrophobicContact CG-CB 3.96Å; F392-N400 HydrophobicContact CZ-CB 4.31Å; F392-A401 HydrophobicContact CB-CB 3.87Å; F392-L404 HydrophobicContact CD2-CD1 3.45Å; F392-L404 VanDerWaalsContact CD2-CD1 3.45Å; F392-L404 HydrophobicContact CE2-CD1 3.58Å
393	L	98	Very high	98.1	Very high	33 Å²	33	51.2 Å²	51.2	17%	0.173	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-48.1	174.1	175.6	59.7	0	0	0	111.1	A389 A395 R396 Y398 A401 T424 V425 K428	A389-L393 WeakPolarHBondContact O-CB 3.48Å; A389-L393 PolarHBondContact O-N 3.45Å; L393-A395 VanDerWaalsContact C-N 3.27Å; L393-A395 PolarHBondContact O-N 2.98Å; L393-R396 PolarHBondContact O-N 3.26Å; L393-Y398 HydrophobicContact CD1-CD1 3.76Å; L393-Y398 HydrophobicContact CD1-CE1 3.82Å; L393-A401 HydrophobicContact CB-CB 4.37Å; L393-T424 HydrophobicContact CD2-CG2 4.12Å; L393-V425 HydrophobicContact CB-CG2 4.26Å; L393-V425 HydrophobicContact CD1-CG2 3.89Å; L393-V425 HydrophobicContact CD2-CG2 4.09Å; L393-V425 HydrophobicContact CG-CG2 4.29Å; L393-K428 HydrophobicContact CD1-CG 4.23Å
394	K	96.7	Very high	98.3	Very high	161 Å²	161	48 Å²	48	70%	0.7	23%	0.226	S	C	*	.	H	α-helix	trans	-62.4	-34.7	175.2	-72.6	178.2	-178.6	-179.2	0	112.4	V390 L391 R396	V390-K394 WeakPolarHBondContact O-CG 3.39Å; V390-K394 PolarHBondContact O-N 3.4Å; L391-K394 PolarHBondContact O-N 2.96Å; K394-R396 PolarHBondContact O-N 3.48Å
395	A	97.1	Very high	98.3	Very high	21 Å²	21	48 Å²	48	17%	0.174	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.2	174.8	0	0	0	0	0	113.9	L391 F392 L393 H397	L391-A395 WeakPolarHBondContact O-CB 3.41Å; L391-A395 PolarHBondContact O-N 3.39Å; F392-A395 CarbonylContact O-C 3.42Å; F392-A395 WeakPolarHBondContact O-CA 3.41Å; F392-A395 PolarHBondContact O-N 2.85Å; F392-A395 VanDerWaalsContact O-N 3.16Å; L393-A395 VanDerWaalsContact C-N 3.27Å; L393-A395 PolarHBondContact O-N 2.98Å; A395-H397 PolarHBondContact O-N 2.87Å
396	R	98.2	Very high	98.3	Very high	190 Å²	190	52.3 Å²	52.3	72%	0.717	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	18.5	-178.8	-52.8	-176.3	172.3	-140.6	-0.9	115.3	F392 L393 K394 Y398	F392-R396 PolarHBondContact O-N 3.37Å; L393-R396 PolarHBondContact O-N 3.26Å; K394-R396 PolarHBondContact O-N 3.48Å; R396-Y398 VanDerWaalsContact C-N 3.32Å; R396-Y398 HydrophobicContact CB-CE1 4.25Å; R396-Y398 HydrophobicContact CB-CE2 4.26Å; R396-Y398 PolarHBondContact O-N 2.87Å
397	H	98.2	Very high	98.3	Very high	101 Å²	101	57.1 Å²	57.1	47%	0.468	26%	0.264	S	S	.	.			trans	-90.1	67.7	173.2	-64.7	-59.2	0	0	0	110.3	F392 A395 V399 N400 A401	F392-H397 HydrophobicContact CB-CB 4.28Å; F392-H397 HydrophobicContact CD1-CB 3.71Å; F392-H397 HydrophobicContact CG-CB 4.43Å; F392-H397 PolarHBondContact O-N 3.47Å; A395-H397 PolarHBondContact O-N 2.87Å; H397-V399 PolarHBondContact O-N 3.18Å; H397-N400 HydrophobicContact CB-CB 4.4Å; H397-N400 PolarHBondContact O-N 3.26Å; H397-A401 PolarHBondContact O-N 3.38Å; H397-A401 VanDerWaalsContact O-N 3.13Å
398	Y	98.6	Very high	98.3	Very high	56 Å²	56	55.4 Å²	55.4	22%	0.22	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-38.6	-168.4	-51	-55.5	0	0	0	113.8	L393 R396 N400 A401 E402 V425 K428	L393-Y398 HydrophobicContact CD1-CD1 3.76Å; L393-Y398 HydrophobicContact CD1-CE1 3.82Å; R396-Y398 VanDerWaalsContact C-N 3.32Å; R396-Y398 HydrophobicContact CB-CE1 4.25Å; R396-Y398 HydrophobicContact CB-CE2 4.26Å; R396-Y398 PolarHBondContact O-N 2.87Å; Y398-N400 VanDerWaalsContact C-N 3.32Å; Y398-N400 PolarHBondContact O-N 2.91Å; Y398-A401 WeakPolarHBondContact O-CB 3.46Å; Y398-A401 PolarHBondContact O-N 3.1Å; Y398-E402 PolarHBondContact O-N 3.44Å; Y398-V425 VanDerWaalsContact O-CG1 3.23Å; Y398-V425 WeakPolarHBondContact O-CG1 3.28Å; Y398-K428 HydrophobicContact CD1-CB 3.8Å; Y398-K428 HydrophobicContact CD1-CG 4.3Å; Y398-K428 HydrophobicContact CD2-CB 4.27Å; Y398-K428 HydrophobicContact CE1-CB 3.83Å; Y398-K428 HydrophobicContact CE1-CG 3.97Å; Y398-K428 HydrophobicContact CE2-CB 4.29Å; Y398-K428 HydrophobicContact CG-CB 4.03Å
399	V	98.5	Very high	98.3	Very high	77 Å²	77	55.4 Å²	55.4	47%	0.467	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-39.9	178.2	179.3	0	0	0	0	111.7	H397 E402 K403 L429	H397-V399 PolarHBondContact O-N 3.18Å; V399-E402 PolarHBondContact O-N 3.06Å; V399-K403 WeakPolarHBondContact O-CG 3.3Å; V399-K403 PolarHBondContact O-N 2.92Å; V399-L429 HydrophobicContact CG2-CD2 4.13Å
400	N	98.3	Very high	98.2	Very high	73 Å²	73	59.4 Å²	59.4	39%	0.39	29%	0.288	S	S	.	.	H	α-helix	trans	-69.6	-38.3	176.6	-69.3	-18.9	0	0	0	111.5	F392 H397 Y398 L404	F392-N400 HydrophobicContact CB-CB 4.48Å; F392-N400 HydrophobicContact CD1-CB 3.92Å; F392-N400 HydrophobicContact CD2-CB 4.21Å; F392-N400 HydrophobicContact CE1-CB 4.1Å; F392-N400 HydrophobicContact CE2-CB 4.38Å; F392-N400 HydrophobicContact CG-CB 3.96Å; F392-N400 HydrophobicContact CZ-CB 4.31Å; H397-N400 HydrophobicContact CB-CB 4.4Å; H397-N400 PolarHBondContact O-N 3.26Å; Y398-N400 VanDerWaalsContact C-N 3.32Å; Y398-N400 PolarHBondContact O-N 2.91Å; N400-L404 WeakPolarHBondContact O-CG 3.34Å; N400-L404 PolarHBondContact O-N 3.2Å
401	A	98.7	Very high	98	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-42.9	175.2	0	0	0	0	0	111.6	A389 F392 L393 H397 Y398 L404 L405 V425	A389-A401 HydrophobicContact CB-CB 4.28Å; A389-A401 WeakPolarHBondContact O-CB 3.43Å; F392-A401 HydrophobicContact CB-CB 3.87Å; L393-A401 HydrophobicContact CB-CB 4.37Å; H397-A401 PolarHBondContact O-N 3.38Å; H397-A401 VanDerWaalsContact O-N 3.13Å; Y398-A401 WeakPolarHBondContact O-CB 3.46Å; Y398-A401 PolarHBondContact O-N 3.1Å; A401-L404 PolarHBondContact O-N 3.02Å; A401-L405 WeakPolarHBondContact O-CD1 3.35Å; A401-L405 WeakPolarHBondContact O-CG 3.39Å; A401-L405 PolarHBondContact O-N 3.22Å; A401-V425 HydrophobicContact CB-CG1 3.98Å; A401-V425 HydrophobicContact CB-CG2 3.77Å
402	E	98.8	Very high	97.8	Very high	12 Å²	12	62.5 Å²	62.5	6%	0.056	31%	0.305	C	S	.	.	H	α-helix	trans	-60.9	-50.4	179.5	-175	-179.5	-141.5	0	0	111.1	Y398 V399 L404 L405 Q406 L422 V425 L429 K431	Y398-E402 PolarHBondContact O-N 3.44Å; V399-E402 PolarHBondContact O-N 3.06Å; E402-L404 VanDerWaalsContact C-N 3.29Å; E402-L404 PolarHBondContact O-N 3.31Å; E402-L405 PolarHBondContact O-N 2.87Å; E402-L405 VanDerWaalsContact O-N 3.17Å; E402-Q406 HydrophobicContact CG-CG 4.34Å; E402-Q406 WeakPolarHBondContact O-CB 3.5Å; E402-Q406 WeakPolarHBondContact O-CG 3.19Å; E402-Q406 PolarHBondContact O-N 3.05Å; E402-L422 HydrophobicContact CG-CD1 4.04Å; E402-V425 HydrophobicContact CB-CG1 3.84Å; E402-L429 HydrophobicContact CB-CD1 4.03Å; E402-L429 HydrophobicContact CG-CD1 4.32Å; E402-L429 WeakPolarHBondContact OE2-CD1 3.45Å; E402-K431 WeakPolarHBondContact OE1-CD 3.42Å; E402-K431 IonicContact OE1-NZ 2.78Å; E402-K431 PolarHBondContact OE1-NZ 3.38Å; E402-K431 IonicContact OE2-NZ 2.76Å; E402-K431 PolarHBondContact OE2-NZ 2.82Å
403	K	98.5	Very high	97.7	Very high	133 Å²	133	66.1 Å²	66.1	58%	0.578	32%	0.322	S	S	*	.	H	α-helix	trans	-56.5	-42.6	178.4	-72.1	179.5	-179.3	-176.5	0	112.5	V399 R407	V399-K403 WeakPolarHBondContact O-CG 3.3Å; V399-K403 PolarHBondContact O-N 2.92Å; K403-R407 PolarHBondContact O-N 3.24Å; K403-R407 VanDerWaalsContact O-N 3.11Å
404	L	98.6	Very high	97.6	Very high	28 Å²	28	71.1 Å²	71.1	15%	0.147	35%	0.345	C	S	.	.	H	α-helix	trans	-68.4	-39.8	179.1	-74	170.2	0	0	0	112.4	L385 L388 A389 F392 N400 A401 E402 R407 A408	L385-L404 HydrophobicContact CD2-CD2 3.71Å; L388-L404 HydrophobicContact CB-CD1 4.16Å; L388-L404 HydrophobicContact CD2-CD1 3.74Å; L388-L404 HydrophobicContact CD2-CD2 4.23Å; L388-L404 HydrophobicContact CG-CD1 3.64Å; A389-L404 HydrophobicContact CB-CB 3.84Å; A389-L404 HydrophobicContact CB-CD1 4.36Å; F392-L404 HydrophobicContact CD2-CD1 3.45Å; F392-L404 VanDerWaalsContact CD2-CD1 3.45Å; F392-L404 HydrophobicContact CE2-CD1 3.58Å; N400-L404 WeakPolarHBondContact O-CG 3.34Å; N400-L404 PolarHBondContact O-N 3.2Å; A401-L404 PolarHBondContact O-N 3.02Å; E402-L404 VanDerWaalsContact C-N 3.29Å; E402-L404 PolarHBondContact O-N 3.31Å; L404-R407 PolarHBondContact O-N 3.16Å; L404-A408 PolarHBondContact O-N 3.4Å
405	L	98.8	Very high	97.5	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-71.6	-40	178.6	-75	158.6	0	0	0	112	N386 A389 A401 E402 R407 A408 V409 N421 L422 V425	N386-L405 HydrophobicContact CB-CD2 4.33Å; N386-L405 WeakPolarHBondContact OD1-CD2 3.49Å; A389-L405 HydrophobicContact CB-CD1 3.78Å; A389-L405 HydrophobicContact CB-CD2 4.02Å; A389-L405 HydrophobicContact CB-CG 3.48Å; A389-L405 VanDerWaalsContact CB-CG 3.48Å; A401-L405 WeakPolarHBondContact O-CD1 3.35Å; A401-L405 WeakPolarHBondContact O-CG 3.39Å; A401-L405 PolarHBondContact O-N 3.22Å; E402-L405 PolarHBondContact O-N 2.87Å; E402-L405 VanDerWaalsContact O-N 3.17Å; L405-R407 VanDerWaalsContact C-N 3.26Å; L405-R407 PolarHBondContact O-N 2.65Å; L405-A408 WeakPolarHBondContact O-CB 3.48Å; L405-A408 PolarHBondContact O-N 3.06Å; L405-A408 VanDerWaalsContact O-N 3.11Å; L405-V409 WeakPolarHBondContact O-CG2 3.36Å; L405-V409 PolarHBondContact O-N 3.31Å; L405-N421 HydrophobicContact CD1-CB 4.05Å; L405-N421 HydrophobicContact CD2-CB 3.68Å; L405-L422 HydrophobicContact CB-CB 4.02Å; L405-L422 HydrophobicContact CB-CD1 3.85Å; L405-L422 HydrophobicContact CB-CG 4.44Å; L405-V425 HydrophobicContact CD1-CB 4.27Å; L405-V425 HydrophobicContact CD1-CG2 3.58Å
406	Q	98.6	Very high	97.5	Very high	90 Å²	90	64.1 Å²	64.1	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-56.2	-43.5	171	-75.4	175.7	-29.5	0	0	111.1	E402 V409 A410 L422	E402-Q406 HydrophobicContact CG-CG 4.34Å; E402-Q406 WeakPolarHBondContact O-CB 3.5Å; E402-Q406 WeakPolarHBondContact O-CG 3.19Å; E402-Q406 PolarHBondContact O-N 3.05Å; Q406-V409 WeakPolarHBondContact O-CG2 3.4Å; Q406-A410 VanDerWaalsContact O-CB 3.27Å; Q406-A410 WeakPolarHBondContact O-CB 3.41Å; Q406-A410 PolarHBondContact O-N 2.81Å; Q406-L422 HydrophobicContact CG-CD1 4Å; Q406-L422 HydrophobicContact CG-CD2 4.32Å
407	R	98.2	Very high	97.5	Very high	107 Å²	107	58 Å²	58	40%	0.404	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-43.1	174	-169.6	-179	171.4	-179.2	5	112.1	G379 L385 K403 L404 L405 V409 A410 V411	G379-R407 VanDerWaalsContact C-NH2 3.26Å; G379-R407 VanDerWaalsContact CA-NH2 3.26Å; G379-R407 PolarHBondContact O-NE 3.25Å; G379-R407 PolarHBondContact O-NH2 3.33Å; L385-R407 HydrophobicContact CD1-CB 4.28Å; L385-R407 HydrophobicContact CD1-CG 3.89Å; K403-R407 PolarHBondContact O-N 3.24Å; K403-R407 VanDerWaalsContact O-N 3.11Å; L404-R407 PolarHBondContact O-N 3.16Å; L405-R407 VanDerWaalsContact C-N 3.26Å; L405-R407 PolarHBondContact O-N 2.65Å; R407-V409 PolarHBondContact O-N 3.33Å; R407-A410 PolarHBondContact O-N 2.62Å; R407-V411 WeakPolarHBondContact O-CG2 3.5Å; R407-V411 PolarHBondContact O-N 3.5Å
408	A	98.1	Very high	97.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-45.1	179.5	0	0	0	0	0	112.2	L385 L404 L405 V411 N412 F415	L385-A408 HydrophobicContact CB-CB 3.82Å; L385-A408 HydrophobicContact CD1-CB 4.31Å; L404-A408 PolarHBondContact O-N 3.4Å; L405-A408 WeakPolarHBondContact O-CB 3.48Å; L405-A408 PolarHBondContact O-N 3.06Å; L405-A408 VanDerWaalsContact O-N 3.11Å; A408-V411 PolarHBondContact O-N 3.25Å; A408-N412 PolarHBondContact O-N 3.18Å; A408-F415 HydrophobicContact CB-CD1 4.33Å; A408-F415 HydrophobicContact CB-CE1 4.37Å
409	V	98	Very high	97.5	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-78.1	-21.3	179.3	-57.1	0	0	0	0	113.6	L405 Q406 R407 N412 H413 W419 L422	L405-V409 WeakPolarHBondContact O-CG2 3.36Å; L405-V409 PolarHBondContact O-N 3.31Å; Q406-V409 WeakPolarHBondContact O-CG2 3.4Å; R407-V409 PolarHBondContact O-N 3.33Å; V409-N412 CarbonylContact O-C 3.19Å; V409-H413 VanDerWaalsContact O-CA 3.26Å; V409-H413 WeakPolarHBondContact O-CA 3.39Å; V409-H413 PolarHBondContact O-N 3.23Å; V409-W419 HydrophobicContact CB-CD2 4.06Å; V409-W419 HydrophobicContact CB-CE3 4.5Å; V409-W419 HydrophobicContact CB-CH2 4.12Å; V409-W419 HydrophobicContact CB-CZ2 3.61Å; V409-W419 HydrophobicContact CG1-CD2 3.78Å; V409-W419 HydrophobicContact CG1-CE3 4.28Å; V409-W419 HydrophobicContact CG1-CG 3.95Å; V409-W419 HydrophobicContact CG1-CZ2 4.29Å; V409-W419 HydrophobicContact CG2-CD2 4.38Å; V409-W419 HydrophobicContact CG2-CE3 4.34Å; V409-W419 HydrophobicContact CG2-CH2 3.64Å; V409-W419 HydrophobicContact CG2-CZ2 3.66Å; V409-W419 HydrophobicContact CG2-CZ3 4Å; V409-L422 HydrophobicContact CG2-CD2 4.14Å
410	A	97.8	Very high	97.5	Very high	85 Å²	85	49.2 Å²	49.2	70%	0.702	25%	0.251	S	S	*	.	H	α-helix	trans	-72	-35.6	170.2	0	0	0	0	0	111.7	Q406 R407	Q406-A410 VanDerWaalsContact O-CB 3.27Å; Q406-A410 WeakPolarHBondContact O-CB 3.41Å; Q406-A410 PolarHBondContact O-N 2.81Å; R407-A410 PolarHBondContact O-N 2.62Å
411	V	94.2	Very high	97.5	Very high	59 Å²	59	46.9 Å²	46.9	36%	0.358	24%	0.239	S	C	.	.	H	α-helix	trans	-72.4	-46.6	175.4	169.8	0	0	0	0	111.4	D380 D382 R407 A408	D380-V411 HydrophobicContact CB-CG1 3.8Å; D380-V411 HydrophobicContact CB-CG2 4.06Å; D380-V411 WeakPolarHBondContact O-CG1 3.44Å; D382-V411 HydrophobicContact CB-CG1 4.45Å; R407-V411 WeakPolarHBondContact O-CG2 3.5Å; R407-V411 PolarHBondContact O-N 3.5Å; A408-V411 PolarHBondContact O-N 3.25Å
412	N	94.3	Very high	97.5	Very high	53 Å²	53	47.1 Å²	47.1	28%	0.283	24%	0.24	S	C	.	.			trans	-128	97.6	179	-179.2	-0.7	0	0	0	109.8	D382 A408 V409 E414 F415	D382-N412 HydrophobicContact CB-CB 4.19Å; D382-N412 WeakPolarHBondContact OD2-CB 3.26Å; D382-N412 PolarHBondContact OD2-ND2 3.16Å; A408-N412 PolarHBondContact O-N 3.18Å; V409-N412 CarbonylContact O-C 3.19Å; N412-E414 VanDerWaalsContact C-N 3.29Å; N412-E414 PolarHBondContact O-N 3.32Å; N412-E414 PolarHBondContact OD1-N 3.06Å; N412-F415 HydrophobicContact CB-CB 4.04Å; N412-F415 WeakPolarHBondContact O-CB 3.33Å; N412-F415 PolarHBondContact O-N 3.22Å
413	H	96.4	Very high	97.5	Very high	102 Å²	102	46.6 Å²	46.6	47%	0.472	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-25.1	-174.2	-166.2	64	0	0	0	113.5	V409 F415 W419 Y445	V409-H413 VanDerWaalsContact O-CA 3.26Å; V409-H413 WeakPolarHBondContact O-CA 3.39Å; V409-H413 PolarHBondContact O-N 3.23Å; H413-F415 PolarHBondContact O-N 3.32Å; H413-W419 AromaticContact CE1-CZ2 3.47Å; H413-W419 VanDerWaalsContact CE1-CZ2 3.47Å; H413-W419 WeakPolarHBondContact CE1-CZ2 3.49Å; H413-W419 AromaticContact ND1-CZ2 3.51Å; H413-W419 PolarHBondContact O-NE1 3.23Å; H413-Y445 PolarHBondContact CD2-OH 2.86Å; H413-Y445 PolarHBondContact NE2-OH 3.12Å; H413-Y445 VanDerWaalsContact O-CE2 3.24Å; H413-Y445 WeakPolarHBondContact O-CE2 3.27Å
414	E	95.1	Very high	97.5	Very high	139 Å²	139	41.5 Å²	41.5	65%	0.65	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	4.9	177	-56.9	-174.2	172.2	0	0	112.5	N412 T416 Y445	N412-E414 VanDerWaalsContact C-N 3.29Å; N412-E414 PolarHBondContact O-N 3.32Å; N412-E414 PolarHBondContact OD1-N 3.06Å; E414-T416 VanDerWaalsContact C-N 3.31Å; E414-T416 PolarHBondContact O-N 3.1Å; E414-Y445 HydrophobicContact CB-CD1 4.26Å; E414-Y445 HydrophobicContact CB-CE1 4.23Å; E414-Y445 HydrophobicContact CG-CD1 4.22Å; E414-Y445 HydrophobicContact CG-CE1 3.77Å
415	F	95.6	Very high	97.6	Very high	17 Å²	17	40.2 Å²	40.2	8%	0.075	21%	0.211	C	C	.	.			trans	-74	80	-175.7	-171	-156.4	0	0	0	112.6	D382 F383 N386 A408 N412 H413 V417 G418 W419	D382-F415 HydrophobicContact CB-CD1 4.24Å; D382-F415 HydrophobicContact CB-CE1 4.28Å; F383-F415 HydrophobicContact CD1-CE2 4.16Å; F383-F415 HydrophobicContact CD1-CZ 4.02Å; F383-F415 AromaticContact CE1-CE2 3.93Å; F383-F415 HydrophobicContact CE1-CE2 3.93Å; F383-F415 HydrophobicContact CE1-CZ 4.27Å; N386-F415 HydrophobicContact CB-CE1 3.56Å; N386-F415 HydrophobicContact CB-CZ 3.82Å; A408-F415 HydrophobicContact CB-CD1 4.33Å; A408-F415 HydrophobicContact CB-CE1 4.37Å; N412-F415 HydrophobicContact CB-CB 4.04Å; N412-F415 WeakPolarHBondContact O-CB 3.33Å; N412-F415 PolarHBondContact O-N 3.22Å; H413-F415 PolarHBondContact O-N 3.32Å; F415-V417 VanDerWaalsContact C-N 3.32Å; F415-V417 HydrophobicContact CD2-CB 4.42Å; F415-V417 HydrophobicContact CE2-CB 3.92Å; F415-V417 HydrophobicContact CZ-CB 4.45Å; F415-V417 PolarHBondContact O-N 2.88Å; F415-G418 WeakPolarHBondContact O-CA 3.16Å; F415-G418 PolarHBondContact O-N 2.88Å; F415-W419 PolarHBondContact O-N 3.36Å; F415-W419 VanDerWaalsContact O-N 3.08Å
416	T	97.2	Very high	97.6	Very high	17 Å²	17	40.7 Å²	40.7	10%	0.104	21%	0.213	C	C	.	.	H	α-helix	trans	-48.3	-48.2	-177.3	-63.7	0	0	0	0	113.3	E414 G418 W419 M420 A442 Y445 Q446	E414-T416 VanDerWaalsContact C-N 3.31Å; E414-T416 PolarHBondContact O-N 3.1Å; T416-G418 VanDerWaalsContact C-N 3.29Å; T416-G418 PolarHBondContact O-N 3.38Å; T416-W419 PolarHBondContact O-N 3Å; T416-M420 PolarHBondContact O-N 3.46Å; T416-A442 HydrophobicContact CG2-CB 4.19Å; T416-Y445 WeakPolarHBondContact OG1-CB 3.4Å; T416-Q446 HydrophobicContact CG2-CB 3.62Å
417	V	97.4	Very high	97.5	Very high	63 Å²	63	36.9 Å²	36.9	38%	0.382	20%	0.196	S	C	.	.	H	α-helix	trans	-64.8	-35.8	-179.7	178.1	0	0	0	0	111.2	F415 M420 N421	F415-V417 VanDerWaalsContact C-N 3.32Å; F415-V417 HydrophobicContact CD2-CB 4.42Å; F415-V417 HydrophobicContact CE2-CB 3.92Å; F415-V417 HydrophobicContact CZ-CB 4.45Å; F415-V417 PolarHBondContact O-N 2.88Å; V417-M420 HydrophobicContact CG1-CE 4.44Å; V417-M420 PolarHBondContact O-N 3.28Å; V417-N421 WeakPolarHBondContact O-CB 3.4Å; V417-N421 PolarHBondContact O-N 3.12Å; V417-N421 PolarHBondContact O-ND2 2.85Å
418	G	98.2	Very high	97.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-47.6	173.9	0	0	0	0	0	111.9	F415 T416 N421 L422	F415-G418 WeakPolarHBondContact O-CA 3.16Å; F415-G418 PolarHBondContact O-N 2.88Å; T416-G418 VanDerWaalsContact C-N 3.29Å; T416-G418 PolarHBondContact O-N 3.38Å; G418-N421 PolarHBondContact O-N 3.23Å; G418-L422 WeakPolarHBondContact O-CB 3.3Å; G418-L422 PolarHBondContact O-N 3.28Å
419	W	98.7	Very high	97.5	Very high	27 Å²	27	39.2 Å²	39.2	10%	0.102	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-44.4	176.1	-75.8	113.6	0	0	0	113.1	V409 H413 F415 T416 N421 L422 G423 I441 A442	V409-W419 HydrophobicContact CB-CD2 4.06Å; V409-W419 HydrophobicContact CB-CE3 4.5Å; V409-W419 HydrophobicContact CB-CH2 4.12Å; V409-W419 HydrophobicContact CB-CZ2 3.61Å; V409-W419 HydrophobicContact CG1-CD2 3.78Å; V409-W419 HydrophobicContact CG1-CE3 4.28Å; V409-W419 HydrophobicContact CG1-CG 3.95Å; V409-W419 HydrophobicContact CG1-CZ2 4.29Å; V409-W419 HydrophobicContact CG2-CD2 4.38Å; V409-W419 HydrophobicContact CG2-CE3 4.34Å; V409-W419 HydrophobicContact CG2-CH2 3.64Å; V409-W419 HydrophobicContact CG2-CZ2 3.66Å; V409-W419 HydrophobicContact CG2-CZ3 4Å; H413-W419 AromaticContact CE1-CZ2 3.47Å; H413-W419 VanDerWaalsContact CE1-CZ2 3.47Å; H413-W419 WeakPolarHBondContact CE1-CZ2 3.49Å; H413-W419 AromaticContact ND1-CZ2 3.51Å; H413-W419 PolarHBondContact O-NE1 3.23Å; F415-W419 PolarHBondContact O-N 3.36Å; F415-W419 VanDerWaalsContact O-N 3.08Å; T416-W419 PolarHBondContact O-N 3Å; W419-N421 PolarHBondContact O-N 2.72Å; W419-L422 HydrophobicContact CE3-CD2 3.94Å; W419-L422 HydrophobicContact CZ3-CD2 3.8Å; W419-L422 WeakPolarHBondContact O-CB 3.49Å; W419-L422 PolarHBondContact O-N 2.88Å; W419-G423 PolarHBondContact O-N 3.41Å; W419-I441 HydrophobicContact CD2-CB 4.1Å; W419-I441 HydrophobicContact CD2-CD1 4.41Å; W419-I441 HydrophobicContact CD2-CG2 3.71Å; W419-I441 HydrophobicContact CE3-CB 4.37Å; W419-I441 HydrophobicContact CE3-CD1 4.09Å; W419-I441 HydrophobicContact CE3-CG2 4.4Å; W419-I441 HydrophobicContact CG-CB 4.28Å; W419-I441 HydrophobicContact CG-CG2 3.81Å; W419-I441 HydrophobicContact CH2-CD1 3.89Å; W419-I441 HydrophobicContact CZ2-CD1 4.22Å; W419-I441 HydrophobicContact CZ2-CG2 4.21Å; W419-I441 HydrophobicContact CZ3-CD1 3.81Å; W419-A442 HydrophobicContact CB-CB 3.76Å
420	M	98.6	Very high	97.5	Very high	21 Å²	21	44.2 Å²	44.2	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-43.3	176.6	179.7	-177.9	62.4	0	0	112.1	T416 V417 T424 Y439 A442 D451 N455	T416-M420 PolarHBondContact O-N 3.46Å; V417-M420 HydrophobicContact CG1-CE 4.44Å; V417-M420 PolarHBondContact O-N 3.28Å; M420-T424 PolarHBondContact O-N 3.2Å; M420-T424 VanDerWaalsContact O-N 3.1Å; M420-T424 PolarHBondContact O-OG1 3.25Å; M420-Y439 HydrophobicContact CG-CE1 4.23Å; M420-Y439 WeakPolarHBondContact O-CE1 3.25Å; M420-A442 HydrophobicContact CB-CB 4.29Å; M420-D451 HydrophobicContact CE-CB 4.38Å; M420-D451 HydrophobicContact SD-CB 3.6Å; M420-N455 PolarHBondContact SD-ND2 3.44Å
421	N	98.7	Very high	97.6	Very high	25 Å²	25	43.6 Å²	43.6	13%	0.134	22%	0.219	C	C	.	.	H	α-helix	trans	-68.7	-36.2	176.9	-74.5	-25.8	0	0	0	111.5	N386 L405 V417 G418 W419 T424 V425	N386-N421 PolarHBondContact OD1-ND2 3.15Å; L405-N421 HydrophobicContact CD1-CB 4.05Å; L405-N421 HydrophobicContact CD2-CB 3.68Å; V417-N421 WeakPolarHBondContact O-CB 3.4Å; V417-N421 PolarHBondContact O-N 3.12Å; V417-N421 PolarHBondContact O-ND2 2.85Å; G418-N421 PolarHBondContact O-N 3.23Å; W419-N421 PolarHBondContact O-N 2.72Å; N421-T424 WeakPolarHBondContact O-CB 3.42Å; N421-T424 PolarHBondContact O-N 3.44Å; N421-V425 WeakPolarHBondContact O-CG2 3.3Å; N421-V425 PolarHBondContact O-N 2.93Å
422	L	98.8	Very high	97.8	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-48.8	174.7	-178.4	56.4	0	0	0	110.9	E402 L405 Q406 V409 G418 W419 T424 V425 Q426	E402-L422 HydrophobicContact CG-CD1 4.04Å; L405-L422 HydrophobicContact CB-CB 4.02Å; L405-L422 HydrophobicContact CB-CD1 3.85Å; L405-L422 HydrophobicContact CB-CG 4.44Å; Q406-L422 HydrophobicContact CG-CD1 4Å; Q406-L422 HydrophobicContact CG-CD2 4.32Å; V409-L422 HydrophobicContact CG2-CD2 4.14Å; G418-L422 WeakPolarHBondContact O-CB 3.3Å; G418-L422 PolarHBondContact O-N 3.28Å; W419-L422 HydrophobicContact CE3-CD2 3.94Å; W419-L422 HydrophobicContact CZ3-CD2 3.8Å; W419-L422 WeakPolarHBondContact O-CB 3.49Å; W419-L422 PolarHBondContact O-N 2.88Å; L422-T424 PolarHBondContact O-N 2.92Å; L422-V425 PolarHBondContact O-N 2.8Å; L422-V425 VanDerWaalsContact O-N 3.15Å; L422-Q426 HydrophobicContact CD1-CG 4.17Å; L422-Q426 HydrophobicContact CG-CG 4.43Å; L422-Q426 WeakPolarHBondContact O-CB 3.39Å; L422-Q426 WeakPolarHBondContact O-CG 3.29Å; L422-Q426 PolarHBondContact O-N 3.22Å
423	G	98.7	Very high	97.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-37.3	175	0	0	0	0	0	112.5	W419 Q426 T427 A435 Y439	W419-G423 PolarHBondContact O-N 3.41Å; G423-Q426 PolarHBondContact O-N 3.36Å; G423-T427 WeakPolarHBondContact O-CB 3.3Å; G423-T427 PolarHBondContact O-N 2.86Å; G423-T427 PolarHBondContact O-OG1 2.99Å; G423-A435 WeakPolarHBondContact O-CB 3.5Å; G423-Y439 VanDerWaalsContact C-CZ 3.47Å; G423-Y439 VanDerWaalsContact C-OH 3.26Å
424	T	98.7	Very high	98	Very high	27 Å²	27	49.8 Å²	49.8	17%	0.166	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-40.7	177.7	-56.6	0	0	0	0	112.2	L393 M420 N421 L422 K428 Y439	L393-T424 HydrophobicContact CD2-CG2 4.12Å; M420-T424 PolarHBondContact O-N 3.2Å; M420-T424 VanDerWaalsContact O-N 3.1Å; M420-T424 PolarHBondContact O-OG1 3.25Å; N421-T424 WeakPolarHBondContact O-CB 3.42Å; N421-T424 PolarHBondContact O-N 3.44Å; L422-T424 PolarHBondContact O-N 2.92Å; T424-K428 PolarHBondContact O-N 2.72Å; T424-Y439 WeakPolarHBondContact CA-OH 3.08Å; T424-Y439 PolarHBondContact N-OH 3.32Å; T424-Y439 PolarHBondContact OG1-OH 2.95Å
425	V	98.7	Very high	98.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-69.5	-43.5	175.4	174.1	0	0	0	0	111.3	L393 Y398 A401 E402 L405 N421 L422 T427 K428 L429	L393-V425 HydrophobicContact CB-CG2 4.26Å; L393-V425 HydrophobicContact CD1-CG2 3.89Å; L393-V425 HydrophobicContact CD2-CG2 4.09Å; L393-V425 HydrophobicContact CG-CG2 4.29Å; Y398-V425 VanDerWaalsContact O-CG1 3.23Å; Y398-V425 WeakPolarHBondContact O-CG1 3.28Å; A401-V425 HydrophobicContact CB-CG1 3.98Å; A401-V425 HydrophobicContact CB-CG2 3.77Å; E402-V425 HydrophobicContact CB-CG1 3.84Å; L405-V425 HydrophobicContact CD1-CB 4.27Å; L405-V425 HydrophobicContact CD1-CG2 3.58Å; N421-V425 WeakPolarHBondContact O-CG2 3.3Å; N421-V425 PolarHBondContact O-N 2.93Å; L422-V425 PolarHBondContact O-N 2.8Å; L422-V425 VanDerWaalsContact O-N 3.15Å; V425-T427 VanDerWaalsContact C-N 3.29Å; V425-T427 PolarHBondContact O-N 3.25Å; V425-K428 WeakPolarHBondContact O-CA 3.41Å; V425-K428 WeakPolarHBondContact O-CB 3.41Å; V425-K428 PolarHBondContact O-N 3.47Å; V425-L429 HydrophobicContact CG1-CD1 4.16Å; V425-L429 PolarHBondContact O-N 3.3Å; V425-L429 VanDerWaalsContact O-N 3.1Å
426	Q	98.8	Very high	98.3	Very high	11 Å²	11	44.8 Å²	44.8	5%	0.051	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-38.4	177.2	-74.7	169.6	-30.3	0	0	111.9	L422 G423 K428 L429 N430 K431 E434 A435 S438	L422-Q426 HydrophobicContact CD1-CG 4.17Å; L422-Q426 HydrophobicContact CG-CG 4.43Å; L422-Q426 WeakPolarHBondContact O-CB 3.39Å; L422-Q426 WeakPolarHBondContact O-CG 3.29Å; L422-Q426 PolarHBondContact O-N 3.22Å; G423-Q426 PolarHBondContact O-N 3.36Å; Q426-K428 VanDerWaalsContact C-N 3.31Å; Q426-K428 PolarHBondContact O-N 2.9Å; Q426-L429 CarbonylContact O-C 3.36Å; Q426-L429 WeakPolarHBondContact O-CA 3.48Å; Q426-L429 WeakPolarHBondContact O-CB 3.48Å; Q426-L429 PolarHBondContact O-N 2.8Å; Q426-N430 PolarHBondContact O-N 3.43Å; Q426-N430 VanDerWaalsContact O-N 3.17Å; Q426-K431 HydrophobicContact CB-CB 4.14Å; Q426-K431 PolarHBondContact O-N 2.93Å; Q426-E434 HydrophobicContact CG-CB 4.5Å; Q426-E434 VanDerWaalsContact OE1-C 3.25Å; Q426-E434 PolarHBondContact OE1-O 2.81Å; Q426-E434 VanDerWaalsContact OE1-O 3.08Å; Q426-A435 HydrophobicContact CB-CB 3.78Å; Q426-S438 PolarHBondContact OE1-OG 3.27Å
427	T	98.4	Very high	98.4	Very high	10 Å²	10	49.7 Å²	49.7	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-57.9	-42.8	171.4	-56.8	0	0	0	0	111.5	G423 V425 L429 N430 Y432 M459	G423-T427 WeakPolarHBondContact O-CB 3.3Å; G423-T427 PolarHBondContact O-N 2.86Å; G423-T427 PolarHBondContact O-OG1 2.99Å; V425-T427 VanDerWaalsContact C-N 3.29Å; V425-T427 PolarHBondContact O-N 3.25Å; T427-L429 PolarHBondContact O-N 3.27Å; T427-N430 PolarHBondContact O-N 3.25Å; T427-N430 VanDerWaalsContact O-N 3.12Å; T427-Y432 HydrophobicContact CG2-CE1 4.39Å; T427-M459 HydrophobicContact CG2-CB 3.81Å; T427-M459 HydrophobicContact CG2-CG 3.9Å; T427-M459 WeakPolarHBondContact OG1-CB 3.31Å; T427-M459 WeakPolarHBondContact OG1-CG 3.41Å
428	K	98.2	Very high	98.4	Very high	113 Å²	113	46.9 Å²	46.9	49%	0.491	22%	0.215	S	C	.	.	H	α-helix	trans	-69.5	-18.5	176.1	-65.4	-57.9	-179.6	-165.5	0	113.9	L393 Y398 T424 V425 Q426	L393-K428 HydrophobicContact CD1-CG 4.23Å; Y398-K428 HydrophobicContact CD1-CB 3.8Å; Y398-K428 HydrophobicContact CD1-CG 4.3Å; Y398-K428 HydrophobicContact CD2-CB 4.27Å; Y398-K428 HydrophobicContact CE1-CB 3.83Å; Y398-K428 HydrophobicContact CE1-CG 3.97Å; Y398-K428 HydrophobicContact CE2-CB 4.29Å; Y398-K428 HydrophobicContact CG-CB 4.03Å; T424-K428 PolarHBondContact O-N 2.72Å; V425-K428 WeakPolarHBondContact O-CA 3.41Å; V425-K428 WeakPolarHBondContact O-CB 3.41Å; V425-K428 PolarHBondContact O-N 3.47Å; Q426-K428 VanDerWaalsContact C-N 3.31Å; Q426-K428 PolarHBondContact O-N 2.9Å
429	L	98.1	Very high	98.5	Very high	42 Å²	42	47.1 Å²	47.1	22%	0.22	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	4.6	173.2	-68.6	169.7	0	0	0	112.8	V399 E402 V425 Q426 T427 K431	V399-L429 HydrophobicContact CG2-CD2 4.13Å; E402-L429 HydrophobicContact CB-CD1 4.03Å; E402-L429 HydrophobicContact CG-CD1 4.32Å; E402-L429 WeakPolarHBondContact OE2-CD1 3.45Å; V425-L429 HydrophobicContact CG1-CD1 4.16Å; V425-L429 PolarHBondContact O-N 3.3Å; V425-L429 VanDerWaalsContact O-N 3.1Å; Q426-L429 CarbonylContact O-C 3.36Å; Q426-L429 WeakPolarHBondContact O-CA 3.48Å; Q426-L429 WeakPolarHBondContact O-CB 3.48Å; Q426-L429 PolarHBondContact O-N 2.8Å; T427-L429 PolarHBondContact O-N 3.27Å; L429-K431 HydrophobicContact CB-CD 4.26Å; L429-K431 HydrophobicContact CB-CG 4.06Å; L429-K431 PolarHBondContact O-N 3.27Å
430	N	97.9	Very high	98.5	Very high	111 Å²	111	52.3 Å²	52.3	59%	0.594	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	22.4	-173.6	-54.1	-35.3	0	0	0	114.2	Q426 T427 Y432	Q426-N430 PolarHBondContact O-N 3.43Å; Q426-N430 VanDerWaalsContact O-N 3.17Å; T427-N430 PolarHBondContact O-N 3.25Å; T427-N430 VanDerWaalsContact O-N 3.12Å; N430-Y432 VanDerWaalsContact C-N 3.3Å; N430-Y432 HydrophobicContact CB-CE2 4.04Å; N430-Y432 WeakPolarHBondContact O-CD2 3.29Å; N430-Y432 PolarHBondContact O-N 3.39Å; N430-Y432 PolarHBondContact OD1-OH 2.81Å
431	K	98.3	Very high	98.4	Very high	72 Å²	72	53.6 Å²	53.6	31%	0.313	24%	0.242	S	C	.	.			trans	-88.3	67.2	175.4	-65.2	-176.3	-174.9	179.8	0	110	E402 Q426 L429 R433 E434 A435	E402-K431 WeakPolarHBondContact OE1-CD 3.42Å; E402-K431 IonicContact OE1-NZ 2.78Å; E402-K431 PolarHBondContact OE1-NZ 3.38Å; E402-K431 IonicContact OE2-NZ 2.76Å; E402-K431 PolarHBondContact OE2-NZ 2.82Å; Q426-K431 HydrophobicContact CB-CB 4.14Å; Q426-K431 PolarHBondContact O-N 2.93Å; L429-K431 HydrophobicContact CB-CD 4.26Å; L429-K431 HydrophobicContact CB-CG 4.06Å; L429-K431 PolarHBondContact O-N 3.27Å; K431-R433 PolarHBondContact O-N 3.37Å; K431-E434 HydrophobicContact CB-CB 4.33Å; K431-E434 WeakPolarHBondContact CB-OE2 3.46Å; K431-E434 PolarHBondContact O-N 2.84Å; K431-A435 VanDerWaalsContact O-CB 3.3Å; K431-A435 WeakPolarHBondContact O-CB 3.44Å; K431-A435 PolarHBondContact O-N 2.93Å
432	Y	98.3	Very high	98.4	Very high	53 Å²	53	52.4 Å²	52.4	21%	0.208	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-37	-167.7	-61	-62.1	0	0	0	113.5	T427 N430 A435 E436 M459 S462 N463	T427-Y432 HydrophobicContact CG2-CE1 4.39Å; N430-Y432 VanDerWaalsContact C-N 3.3Å; N430-Y432 HydrophobicContact CB-CE2 4.04Å; N430-Y432 WeakPolarHBondContact O-CD2 3.29Å; N430-Y432 PolarHBondContact O-N 3.39Å; N430-Y432 PolarHBondContact OD1-OH 2.81Å; Y432-A435 PolarHBondContact O-N 3.33Å; Y432-E436 WeakPolarHBondContact O-CB 3.42Å; Y432-E436 PolarHBondContact O-N 3.35Å; Y432-M459 HydrophobicContact CD1-CG 3.89Å; Y432-S462 PolarHBondContact OH-O 3.28Å; Y432-N463 HydrophobicContact CD1-CB 4Å; Y432-N463 HydrophobicContact CD2-CB 4.22Å; Y432-N463 VanDerWaalsContact CD2-OD1 3.29Å; Y432-N463 WeakPolarHBondContact CD2-OD1 3.38Å; Y432-N463 HydrophobicContact CE1-CB 4.04Å; Y432-N463 HydrophobicContact CE2-CB 4.25Å; Y432-N463 WeakPolarHBondContact CE2-OD1 3.39Å; Y432-N463 HydrophobicContact CG-CB 4.09Å
433	R	98	Very high	98.4	Very high	204 Å²	204	53.6 Å²	53.6	77%	0.77	24%	0.242	S	C	*	.	H	α-helix	trans	-65.6	-43.8	178.6	-69.9	-177	177.6	175.8	-0.6	111.3	K431 E436 M437	K431-R433 PolarHBondContact O-N 3.37Å; R433-E436 PolarHBondContact O-N 3.33Å; R433-M437 WeakPolarHBondContact O-CG 3.25Å; R433-M437 PolarHBondContact O-N 3.41Å; R433-M437 VanDerWaalsContact O-N 3.16Å
434	E	98.3	Very high	98.4	Very high	87 Å²	87	62.1 Å²	62.1	41%	0.407	28%	0.275	S	S	.	.	H	α-helix	trans	-68.9	-39.6	177.7	-59.1	91.9	143.7	0	0	111.3	Q426 K431 E436 M437 S438	Q426-E434 HydrophobicContact CG-CB 4.5Å; Q426-E434 VanDerWaalsContact OE1-C 3.25Å; Q426-E434 PolarHBondContact OE1-O 2.81Å; Q426-E434 VanDerWaalsContact OE1-O 3.08Å; K431-E434 HydrophobicContact CB-CB 4.33Å; K431-E434 WeakPolarHBondContact CB-OE2 3.46Å; K431-E434 PolarHBondContact O-N 2.84Å; E434-E436 VanDerWaalsContact C-N 3.34Å; E434-E436 PolarHBondContact O-N 3.12Å; E434-M437 PolarHBondContact O-N 2.89Å; E434-S438 PolarHBondContact O-N 3.15Å; E434-S438 PolarHBondContact O-OG 3.06Å; E434-S438 VanDerWaalsContact O-OG 3.14Å
435	A	98.5	Very high	98.3	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-45.6	175.3	0	0	0	0	0	111.6	G423 Q426 K431 Y432 M437 S438 Y439 M459	G423-A435 WeakPolarHBondContact O-CB 3.5Å; Q426-A435 HydrophobicContact CB-CB 3.78Å; K431-A435 VanDerWaalsContact O-CB 3.3Å; K431-A435 WeakPolarHBondContact O-CB 3.44Å; K431-A435 PolarHBondContact O-N 2.93Å; Y432-A435 PolarHBondContact O-N 3.33Å; A435-M437 PolarHBondContact O-N 2.99Å; A435-S438 PolarHBondContact O-N 3.32Å; A435-Y439 HydrophobicContact CB-CE2 4.33Å; A435-Y439 WeakPolarHBondContact O-CD2 3.34Å; A435-Y439 PolarHBondContact O-N 3.39Å; A435-M459 HydrophobicContact CB-CG 4.09Å; A435-M459 HydrophobicContact CB-SD 4Å
436	E	98.4	Very high	98.1	Very high	51 Å²	51	68.7 Å²	68.7	24%	0.238	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-46.2	176.3	-179.2	175	175.5	0	0	111.9	Y432 R433 E434 S438 Y439 R440 M456 M459 Y460	Y432-E436 WeakPolarHBondContact O-CB 3.42Å; Y432-E436 PolarHBondContact O-N 3.35Å; R433-E436 PolarHBondContact O-N 3.33Å; E434-E436 VanDerWaalsContact C-N 3.34Å; E434-E436 PolarHBondContact O-N 3.12Å; E436-S438 VanDerWaalsContact C-N 3.35Å; E436-S438 PolarHBondContact O-N 3.43Å; E436-Y439 PolarHBondContact O-N 3.21Å; E436-R440 HydrophobicContact CG-CG 4.46Å; E436-R440 WeakPolarHBondContact O-CB 3.28Å; E436-R440 VanDerWaalsContact O-CG 3.3Å; E436-R440 WeakPolarHBondContact O-CG 3.39Å; E436-R440 PolarHBondContact O-N 3.16Å; E436-R440 IonicContact OE1-CZ 3.21Å; E436-R440 IonicContact OE1-NE 2.89Å; E436-R440 PolarHBondContact OE1-NE 3.28Å; E436-R440 IonicContact OE1-NH2 2.68Å; E436-R440 PolarHBondContact OE1-NH2 2.92Å; E436-M456 HydrophobicContact CG-CE 3.85Å; E436-M459 HydrophobicContact CB-SD 4.23Å; E436-Y460 VanDerWaalsContact CD-OH 3.25Å; E436-Y460 PolarHBondContact OE1-OH 3.24Å; E436-Y460 VanDerWaalsContact OE1-OH 3.1Å; E436-Y460 PolarHBondContact OE2-OH 3.07Å
437	M	98.5	Very high	98	Very high	121 Å²	121	72 Å²	72	60%	0.596	32%	0.324	S	S	*	.	H	α-helix	trans	-58.9	-46.5	175.5	-68.7	-169	-139.2	0	0	111.5	R433 E434 A435 Y439 R440 I441	R433-M437 WeakPolarHBondContact O-CG 3.25Å; R433-M437 PolarHBondContact O-N 3.41Å; R433-M437 VanDerWaalsContact O-N 3.16Å; E434-M437 PolarHBondContact O-N 2.89Å; A435-M437 PolarHBondContact O-N 2.99Å; M437-Y439 VanDerWaalsContact C-N 3.34Å; M437-Y439 PolarHBondContact O-N 3.29Å; M437-R440 PolarHBondContact O-N 2.98Å; M437-I441 WeakPolarHBondContact O-CG1 3.23Å; M437-I441 PolarHBondContact O-N 3.42Å
438	S	98.7	Very high	97.8	Very high	4 Å²	4	77.8 Å²	77.8	3%	0.028	35%	0.354	C	S	.	.	H	α-helix	trans	-59.1	-43.6	178.2	-65.1	0	0	0	0	112.1	Q426 E434 A435 E436 I441 A442	Q426-S438 PolarHBondContact OE1-OG 3.27Å; E434-S438 PolarHBondContact O-N 3.15Å; E434-S438 PolarHBondContact O-OG 3.06Å; E434-S438 VanDerWaalsContact O-OG 3.14Å; A435-S438 PolarHBondContact O-N 3.32Å; E436-S438 VanDerWaalsContact C-N 3.35Å; E436-S438 PolarHBondContact O-N 3.43Å; S438-I441 PolarHBondContact O-N 3.23Å; S438-A442 PolarHBondContact O-N 3.02Å
439	Y	98.6	Very high	97.7	Very high	4 Å²	4	72.9 Å²	72.9	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-66	-39.9	175.3	-70.4	-55.1	0	0	0	112.7	M420 G423 T424 A435 E436 M437 I441 A442 I443 N455 M456 M459	M420-Y439 HydrophobicContact CG-CE1 4.23Å; M420-Y439 WeakPolarHBondContact O-CE1 3.25Å; G423-Y439 VanDerWaalsContact C-CZ 3.47Å; G423-Y439 VanDerWaalsContact C-OH 3.26Å; T424-Y439 WeakPolarHBondContact CA-OH 3.08Å; T424-Y439 PolarHBondContact N-OH 3.32Å; T424-Y439 PolarHBondContact OG1-OH 2.95Å; A435-Y439 HydrophobicContact CB-CE2 4.33Å; A435-Y439 WeakPolarHBondContact O-CD2 3.34Å; A435-Y439 PolarHBondContact O-N 3.39Å; E436-Y439 PolarHBondContact O-N 3.21Å; M437-Y439 VanDerWaalsContact C-N 3.34Å; M437-Y439 PolarHBondContact O-N 3.29Å; Y439-I441 VanDerWaalsContact C-N 3.34Å; Y439-I441 PolarHBondContact O-N 3.18Å; Y439-A442 PolarHBondContact O-N 3.25Å; Y439-I443 WeakPolarHBondContact O-CD1 3.36Å; Y439-I443 VanDerWaalsContact O-CG1 3.27Å; Y439-I443 WeakPolarHBondContact O-CG1 3.43Å; Y439-I443 PolarHBondContact O-N 3.07Å; Y439-N455 HydrophobicContact CD1-CB 4.44Å; Y439-N455 HydrophobicContact CE1-CB 3.52Å; Y439-M456 HydrophobicContact CD1-CB 4.4Å; Y439-M456 HydrophobicContact CD2-CB 3.86Å; Y439-M456 HydrophobicContact CD2-CG 3.96Å; Y439-M456 HydrophobicContact CE2-CB 4.44Å; Y439-M456 HydrophobicContact CG-CB 3.85Å; Y439-M456 HydrophobicContact CG-CG 4.15Å; Y439-M459 HydrophobicContact CE2-CB 3.95Å; Y439-M459 HydrophobicContact CE2-CG 4.44Å
440	R	98.4	Very high	97.6	Very high	137 Å²	137	71.2 Å²	71.2	52%	0.517	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-40.9	177.1	-73.8	177	-179	-74	-1	111.8	E436 M437 I443 Y444 M456	E436-R440 HydrophobicContact CG-CG 4.46Å; E436-R440 WeakPolarHBondContact O-CB 3.28Å; E436-R440 VanDerWaalsContact O-CG 3.3Å; E436-R440 WeakPolarHBondContact O-CG 3.39Å; E436-R440 PolarHBondContact O-N 3.16Å; E436-R440 IonicContact OE1-CZ 3.21Å; E436-R440 IonicContact OE1-NE 2.89Å; E436-R440 PolarHBondContact OE1-NE 3.28Å; E436-R440 IonicContact OE1-NH2 2.68Å; E436-R440 PolarHBondContact OE1-NH2 2.92Å; M437-R440 PolarHBondContact O-N 2.98Å; R440-I443 PolarHBondContact O-N 3.45Å; R440-Y444 WeakPolarHBondContact O-CB 3.39Å; R440-Y444 PolarHBondContact O-N 3.09Å; R440-M456 HydrophobicContact CG-CE 4.38Å
441	I	98.4	Very high	97.6	Very high	48 Å²	48	70 Å²	70	25%	0.246	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-44.3	174.8	-64	166.5	0	0	0	110.7	W419 M437 S438 Y439 I443 Y444 Y445	W419-I441 HydrophobicContact CD2-CB 4.1Å; W419-I441 HydrophobicContact CD2-CD1 4.41Å; W419-I441 HydrophobicContact CD2-CG2 3.71Å; W419-I441 HydrophobicContact CE3-CB 4.37Å; W419-I441 HydrophobicContact CE3-CD1 4.09Å; W419-I441 HydrophobicContact CE3-CG2 4.4Å; W419-I441 HydrophobicContact CG-CB 4.28Å; W419-I441 HydrophobicContact CG-CG2 3.81Å; W419-I441 HydrophobicContact CH2-CD1 3.89Å; W419-I441 HydrophobicContact CZ2-CD1 4.22Å; W419-I441 HydrophobicContact CZ2-CG2 4.21Å; W419-I441 HydrophobicContact CZ3-CD1 3.81Å; M437-I441 WeakPolarHBondContact O-CG1 3.23Å; M437-I441 PolarHBondContact O-N 3.42Å; S438-I441 PolarHBondContact O-N 3.23Å; Y439-I441 VanDerWaalsContact C-N 3.34Å; Y439-I441 PolarHBondContact O-N 3.18Å; I441-I443 VanDerWaalsContact C-N 3.32Å; I441-I443 PolarHBondContact O-N 2.89Å; I441-Y444 WeakPolarHBondContact O-CB 3.42Å; I441-Y444 PolarHBondContact O-N 2.87Å; I441-Y445 HydrophobicContact CG2-CD2 3.85Å; I441-Y445 HydrophobicContact CG2-CE2 3.56Å; I441-Y445 VanDerWaalsContact O-CD2 3.3Å; I441-Y445 WeakPolarHBondContact O-CD2 3.45Å; I441-Y445 PolarHBondContact O-N 2.92Å
442	A	98.3	Very high	97.6	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-44.2	175.4	0	0	0	0	0	112.1	T416 W419 M420 S438 Y439 Y444 Y445 Q446	T416-A442 HydrophobicContact CG2-CB 4.19Å; W419-A442 HydrophobicContact CB-CB 3.76Å; M420-A442 HydrophobicContact CB-CB 4.29Å; S438-A442 PolarHBondContact O-N 3.02Å; Y439-A442 PolarHBondContact O-N 3.25Å; A442-Y444 VanDerWaalsContact C-N 3.34Å; A442-Y445 PolarHBondContact O-N 3.21Å; A442-Q446 PolarHBondContact O-N 3.44Å
443	I	97.9	Very high	97.6	Very high	30 Å²	30	64.2 Å²	64.2	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-68.2	-33.9	178.6	-68.3	160.7	0	0	0	111.5	Y439 R440 I441 Q446 P447 C452 F453 M456	Y439-I443 WeakPolarHBondContact O-CD1 3.36Å; Y439-I443 VanDerWaalsContact O-CG1 3.27Å; Y439-I443 WeakPolarHBondContact O-CG1 3.43Å; Y439-I443 PolarHBondContact O-N 3.07Å; R440-I443 PolarHBondContact O-N 3.45Å; I441-I443 VanDerWaalsContact C-N 3.32Å; I441-I443 PolarHBondContact O-N 2.89Å; I443-Q446 CarbonylContact O-C 3.58Å; I443-Q446 PolarHBondContact O-N 3.03Å; I443-P447 VanDerWaalsContact O-CA 3.24Å; I443-P447 WeakPolarHBondContact O-CA 3.44Å; I443-P447 VanDerWaalsContact O-N 3.08Å; I443-C452 HydrophobicContact CD1-CB 4.36Å; I443-C452 HydrophobicContact CG1-CB 3.72Å; I443-F453 HydrophobicContact CD1-CD1 3.77Å; I443-F453 HydrophobicContact CD1-CE1 3.6Å; I443-F453 HydrophobicContact CD1-CZ 4.38Å; I443-F453 HydrophobicContact CG1-CD1 4.4Å; I443-F453 HydrophobicContact CG1-CE1 3.98Å; I443-F453 HydrophobicContact CG1-CZ 4.28Å; I443-F453 HydrophobicContact CG2-CE1 3.87Å; I443-F453 HydrophobicContact CG2-CZ 3.81Å; I443-M456 HydrophobicContact CD1-SD 4.04Å
444	Y	98	Very high	97.7	Very high	178 Å²	178	56.3 Å²	56.3	70%	0.698	27%	0.266	S	S	*	.	H	α-helix	trans	-60.5	-47.1	175.4	175.2	-97.4	0	0	0	111.4	R440 I441 A442	R440-Y444 WeakPolarHBondContact O-CB 3.39Å; R440-Y444 PolarHBondContact O-N 3.09Å; I441-Y444 WeakPolarHBondContact O-CB 3.42Å; I441-Y444 PolarHBondContact O-N 2.87Å; A442-Y444 VanDerWaalsContact C-N 3.34Å
445	Y	97	Very high	97.7	Very high	74 Å²	74	53.5 Å²	53.5	29%	0.29	25%	0.254	S	S	.	.	H	α-helix	trans	-74.9	-32.3	177.9	-69.9	-62.5	0	0	0	113.6	H413 E414 T416 I441 A442	H413-Y445 PolarHBondContact CD2-OH 2.86Å; H413-Y445 PolarHBondContact NE2-OH 3.12Å; H413-Y445 VanDerWaalsContact O-CE2 3.24Å; H413-Y445 WeakPolarHBondContact O-CE2 3.27Å; E414-Y445 HydrophobicContact CB-CD1 4.26Å; E414-Y445 HydrophobicContact CB-CE1 4.23Å; E414-Y445 HydrophobicContact CG-CD1 4.22Å; E414-Y445 HydrophobicContact CG-CE1 3.77Å; T416-Y445 WeakPolarHBondContact OG1-CB 3.4Å; I441-Y445 HydrophobicContact CG2-CD2 3.85Å; I441-Y445 HydrophobicContact CG2-CE2 3.56Å; I441-Y445 VanDerWaalsContact O-CD2 3.3Å; I441-Y445 WeakPolarHBondContact O-CD2 3.45Å; I441-Y445 PolarHBondContact O-N 2.92Å; A442-Y445 PolarHBondContact O-N 3.21Å
446	Q	95.8	Very high	97.7	Very high	92 Å²	92	53.8 Å²	53.8	43%	0.43	26%	0.256	S	S	.	.			trans	-132.5	85.1	176.4	-164.7	174.3	-5	0	0	111.9	T416 A442 I443 N448 C449	T416-Q446 HydrophobicContact CG2-CB 3.62Å; A442-Q446 PolarHBondContact O-N 3.44Å; I443-Q446 CarbonylContact O-C 3.58Å; I443-Q446 PolarHBondContact O-N 3.03Å; Q446-N448 PolarHBondContact O-N 2.99Å; Q446-N448 VanDerWaalsContact O-N 3.12Å; Q446-C449 HydrophobicContact CB-CB 4.11Å; Q446-C449 HydrophobicContact CG-CB 4.02Å; Q446-C449 WeakPolarHBondContact O-CB 3.38Å; Q446-C449 PolarHBondContact O-N 3.25Å
447	P	96.1	Very high	97.7	Very high	81 Å²	81	51.4 Å²	51.4	53%	0.526	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26	-177.1	-27.5	36	0	0	0	114.6	I443 C449 F453	I443-P447 VanDerWaalsContact O-CA 3.24Å; I443-P447 WeakPolarHBondContact O-CA 3.44Å; I443-P447 VanDerWaalsContact O-N 3.08Å; P447-C449 VanDerWaalsContact C-N 3.34Å; P447-F453 WeakPolarHBondContact O-CE2 3.4Å
448	N	94.2	Very high	97.6	Very high	131 Å²	131	47.3 Å²	47.3	70%	0.701	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	20	179	-65.7	-21.9	0	0	0	113.2	Q446 A450 T479	Q446-N448 PolarHBondContact O-N 2.99Å; Q446-N448 VanDerWaalsContact O-N 3.12Å; N448-A450 PolarHBondContact O-N 3.44Å; N448-A450 VanDerWaalsContact O-N 3.16Å; N448-T479 HydrophobicContact CB-CG2 4.21Å; N448-T479 VanDerWaalsContact O-CG2 3.26Å; N448-T479 WeakPolarHBondContact O-CG2 3.31Å
449	C	95.5	Very high	97.6	Very high	10 Å²	10	47.2 Å²	47.2	7%	0.068	22%	0.224	C	C	.	.			trans	-79.3	92.5	176.6	179.1	0	0	0	0	111.3	Q446 P447 D451 C452 F453	Q446-C449 HydrophobicContact CB-CB 4.11Å; Q446-C449 HydrophobicContact CG-CB 4.02Å; Q446-C449 WeakPolarHBondContact O-CB 3.38Å; Q446-C449 PolarHBondContact O-N 3.25Å; P447-C449 VanDerWaalsContact C-N 3.34Å; C449-D451 VanDerWaalsContact C-N 3.31Å; C449-D451 PolarHBondContact O-N 3.47Å; C449-C452 HydrophobicContact CB-CB 3.68Å; C449-C452 WeakPolarHBondContact CB-SG 2.94Å; C449-C452 WeakPolarHBondContact O-CB 3.44Å; C449-C452 PolarHBondContact O-N 3.1Å; C449-C452 VanDerWaalsContact O-N 3.14Å; C449-C452 WeakPolarHBondContact SG-CB 3.34Å; C449-C452 PolarHBondContact SG-N 3.13Å; C449-C452 CovalentContact SG-SG 2.05Å; C449-C452 PolarHBondContact SG-SG 3.3Å; C449-F453 VanDerWaalsContact O-CD2 3.31Å; C449-F453 WeakPolarHBondContact O-CD2 3.4Å; C449-F453 PolarHBondContact O-N 2.65Å
450	A	97.5	Very high	97.6	Very high	8 Å²	8	48.2 Å²	48.2	7%	0.066	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-40.3	178.6	0	0	0	0	0	112.6	N448 C452 F453 Y454 A476 T479 N480	N448-A450 PolarHBondContact O-N 3.44Å; N448-A450 VanDerWaalsContact O-N 3.16Å; A450-C452 PolarHBondContact O-N 3.02Å; A450-F453 PolarHBondContact O-N 2.87Å; A450-Y454 PolarHBondContact O-N 3.45Å; A450-A476 WeakPolarHBondContact O-CB 3.37Å; A450-T479 HydrophobicContact CB-CG2 4.11Å; A450-N480 HydrophobicContact CB-CB 3.64Å
451	D	97.7	Very high	97.6	Very high	84 Å²	84	44.9 Å²	44.9	45%	0.449	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-33	176.3	-68.6	-52.5	0	0	0	112.5	M420 C449 Y454 N455 H483	M420-D451 HydrophobicContact CE-CB 4.38Å; M420-D451 HydrophobicContact SD-CB 3.6Å; C449-D451 VanDerWaalsContact C-N 3.31Å; C449-D451 PolarHBondContact O-N 3.47Å; D451-Y454 PolarHBondContact O-N 3.33Å; D451-N455 VanDerWaalsContact O-CB 3.26Å; D451-N455 WeakPolarHBondContact O-CB 3.45Å; D451-N455 PolarHBondContact O-N 2.88Å; D451-N455 PolarHBondContact O-ND2 3.09Å; D451-H483 IonicContact OD1-CE1 3.75Å; D451-H483 IonicContact OD1-NE2 3.45Å; D451-H483 PolarHBondContact OD1-NE2 3.12Å
452	C	98.1	Very high	97.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.2	-45.8	179.1	-59.7	0	0	0	0	110.8	I443 C449 A450 M456	I443-C452 HydrophobicContact CD1-CB 4.36Å; I443-C452 HydrophobicContact CG1-CB 3.72Å; C449-C452 HydrophobicContact CB-CB 3.68Å; C449-C452 WeakPolarHBondContact CB-SG 2.94Å; C449-C452 WeakPolarHBondContact O-CB 3.44Å; C449-C452 PolarHBondContact O-N 3.1Å; C449-C452 VanDerWaalsContact O-N 3.14Å; C449-C452 WeakPolarHBondContact SG-CB 3.34Å; C449-C452 PolarHBondContact SG-N 3.13Å; C449-C452 CovalentContact SG-SG 2.05Å; C449-C452 PolarHBondContact SG-SG 3.3Å; A450-C452 PolarHBondContact O-N 3.02Å; C452-M456 VanDerWaalsContact O-CB 3.29Å; C452-M456 WeakPolarHBondContact O-CB 3.39Å; C452-M456 PolarHBondContact O-N 3.04Å
453	F	98.4	Very high	97.3	Very high	5 Å²	5	48.7 Å²	48.7	2%	0.022	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-42.7	174	-62.5	-60.8	0	0	0	111.7	I443 P447 C449 A450 N455 M456 G457 L472 K475 A476	I443-F453 HydrophobicContact CD1-CD1 3.77Å; I443-F453 HydrophobicContact CD1-CE1 3.6Å; I443-F453 HydrophobicContact CD1-CZ 4.38Å; I443-F453 HydrophobicContact CG1-CD1 4.4Å; I443-F453 HydrophobicContact CG1-CE1 3.98Å; I443-F453 HydrophobicContact CG1-CZ 4.28Å; I443-F453 HydrophobicContact CG2-CE1 3.87Å; I443-F453 HydrophobicContact CG2-CZ 3.81Å; P447-F453 WeakPolarHBondContact O-CE2 3.4Å; C449-F453 VanDerWaalsContact O-CD2 3.31Å; C449-F453 WeakPolarHBondContact O-CD2 3.4Å; C449-F453 PolarHBondContact O-N 2.65Å; A450-F453 PolarHBondContact O-N 2.87Å; F453-N455 PolarHBondContact O-N 3Å; F453-M456 PolarHBondContact O-N 3.41Å; F453-G457 PolarHBondContact O-N 2.86Å; F453-L472 HydrophobicContact CD1-CD2 4.07Å; F453-K475 HydrophobicContact CD1-CD 3.66Å; F453-K475 HydrophobicContact CD1-CG 4.07Å; F453-K475 HydrophobicContact CD2-CD 4.49Å; F453-K475 HydrophobicContact CD2-CG 4.13Å; F453-K475 HydrophobicContact CE1-CD 3.53Å; F453-K475 HydrophobicContact CE1-CG 4.21Å; F453-K475 HydrophobicContact CE2-CD 4.37Å; F453-K475 HydrophobicContact CE2-CG 4.26Å; F453-K475 HydrophobicContact CG-CB 4.37Å; F453-K475 HydrophobicContact CG-CD 4.17Å; F453-K475 HydrophobicContact CG-CG 4.05Å; F453-K475 HydrophobicContact CZ-CD 3.92Å; F453-K475 HydrophobicContact CZ-CG 4.31Å; F453-A476 HydrophobicContact CB-CB 3.95Å
454	Y	98.6	Very high	97.2	Very high	37 Å²	37	54.3 Å²	54.3	15%	0.145	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-47.5	177.9	164.3	-101.6	0	0	0	112.5	A450 D451 G457 N458 W473 H483 E485 A486 N489	A450-Y454 PolarHBondContact O-N 3.45Å; D451-Y454 PolarHBondContact O-N 3.33Å; Y454-G457 PolarHBondContact O-N 2.67Å; Y454-N458 WeakPolarHBondContact CE1-ND2 3.39Å; Y454-N458 VanDerWaalsContact O-CG 3.3Å; Y454-N458 PolarHBondContact O-N 2.95Å; Y454-N458 PolarHBondContact O-ND2 3.22Å; Y454-N458 PolarHBondContact OH-ND2 3.24Å; Y454-W473 AromaticContact CD2-CD1 3.83Å; Y454-W473 AromaticContact CD2-NE1 3.97Å; Y454-W473 PolarHBondContact O-NE1 3.31Å; Y454-H483 WeakPolarHBondContact CB-NE2 3.42Å; Y454-H483 AromaticContact CD1-CE1 3.87Å; Y454-H483 AromaticContact CD1-NE2 3.9Å; Y454-H483 AromaticContact CG-CE1 3.65Å; Y454-H483 AromaticContact CG-NE2 3.5Å; Y454-E485 HydrophobicContact CD2-CB 4.26Å; Y454-E485 HydrophobicContact CE1-CB 4.17Å; Y454-E485 HydrophobicContact CE2-CB 3.52Å; Y454-E485 VanDerWaalsContact CZ-CB 3.48Å; Y454-A486 HydrophobicContact CD2-CB 3.95Å; Y454-N489 VanDerWaalsContact CE2-ND2 3.29Å; Y454-N489 WeakPolarHBondContact CE2-ND2 3.42Å
455	N	98.3	Very high	97.1	Very high	28 Å²	28	47.9 Å²	47.9	15%	0.15	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-38.6	179.9	-72.9	-34.2	0	0	0	112.1	M420 Y439 D451 F453 G457 N458 M459	M420-N455 PolarHBondContact SD-ND2 3.44Å; Y439-N455 HydrophobicContact CD1-CB 4.44Å; Y439-N455 HydrophobicContact CE1-CB 3.52Å; D451-N455 VanDerWaalsContact O-CB 3.26Å; D451-N455 WeakPolarHBondContact O-CB 3.45Å; D451-N455 PolarHBondContact O-N 2.88Å; D451-N455 PolarHBondContact O-ND2 3.09Å; F453-N455 PolarHBondContact O-N 3Å; N455-G457 VanDerWaalsContact C-N 3.34Å; N455-G457 PolarHBondContact O-N 3.04Å; N455-N458 WeakPolarHBondContact O-CB 3.37Å; N455-N458 PolarHBondContact O-N 3.22Å; N455-M459 PolarHBondContact O-N 3.17Å
456	M	98.4	Very high	97	Very high	7 Å²	7	47.1 Å²	47.1	3%	0.034	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-40	172.4	-168.8	179.2	175.2	0	0	111.5	E436 Y439 R440 I443 C452 F453 N458 M459 Y460 L472	E436-M456 HydrophobicContact CG-CE 3.85Å; Y439-M456 HydrophobicContact CD1-CB 4.4Å; Y439-M456 HydrophobicContact CD2-CB 3.86Å; Y439-M456 HydrophobicContact CD2-CG 3.96Å; Y439-M456 HydrophobicContact CE2-CB 4.44Å; Y439-M456 HydrophobicContact CG-CB 3.85Å; Y439-M456 HydrophobicContact CG-CG 4.15Å; R440-M456 HydrophobicContact CG-CE 4.38Å; I443-M456 HydrophobicContact CD1-SD 4.04Å; C452-M456 VanDerWaalsContact O-CB 3.29Å; C452-M456 WeakPolarHBondContact O-CB 3.39Å; C452-M456 PolarHBondContact O-N 3.04Å; F453-M456 PolarHBondContact O-N 3.41Å; M456-N458 VanDerWaalsContact C-N 3.33Å; M456-N458 PolarHBondContact O-N 3.28Å; M456-M459 WeakPolarHBondContact O-CB 3.23Å; M456-M459 PolarHBondContact O-N 3.37Å; M456-M459 VanDerWaalsContact O-N 3.16Å; M456-Y460 HydrophobicContact CE-CE2 3.63Å; M456-Y460 HydrophobicContact CG-CD2 4.28Å; M456-Y460 HydrophobicContact CG-CE2 3.98Å; M456-Y460 WeakPolarHBondContact O-CD2 3.42Å; M456-Y460 PolarHBondContact O-N 3.18Å; M456-L472 HydrophobicContact CB-CD1 4.03Å; M456-L472 HydrophobicContact CE-CD1 4.43Å; M456-L472 HydrophobicContact CG-CD1 3.68Å; M456-L472 HydrophobicContact SD-CD1 4.08Å; M456-L472 HydrophobicContact SD-CD2 4.24Å
457	G	98.3	Very high	96.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-39.1	172.8	0	0	0	0	0	112.8	F453 Y454 N455 M459 Y460 N461 A469	F453-G457 PolarHBondContact O-N 2.86Å; Y454-G457 PolarHBondContact O-N 2.67Å; N455-G457 VanDerWaalsContact C-N 3.34Å; N455-G457 PolarHBondContact O-N 3.04Å; G457-M459 VanDerWaalsContact C-N 3.28Å; G457-M459 PolarHBondContact O-N 2.94Å; G457-Y460 PolarHBondContact O-N 2.95Å; G457-N461 WeakPolarHBondContact O-CB 3.43Å; G457-N461 PolarHBondContact O-N 3.02Å; G457-A469 VanDerWaalsContact O-CB 3.22Å; G457-A469 WeakPolarHBondContact O-CB 3.27Å
458	N	98.3	Very high	97	Very high	36 Å²	36	49.8 Å²	49.8	19%	0.193	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-33.6	174.2	-66.6	-25.1	0	0	0	112.9	Y454 N455 M456 S462 W473 N489	Y454-N458 WeakPolarHBondContact CE1-ND2 3.39Å; Y454-N458 VanDerWaalsContact O-CG 3.3Å; Y454-N458 PolarHBondContact O-N 2.95Å; Y454-N458 PolarHBondContact O-ND2 3.22Å; Y454-N458 PolarHBondContact OH-ND2 3.24Å; N455-N458 WeakPolarHBondContact O-CB 3.37Å; N455-N458 PolarHBondContact O-N 3.22Å; M456-N458 VanDerWaalsContact C-N 3.33Å; M456-N458 PolarHBondContact O-N 3.28Å; N458-S462 WeakPolarHBondContact O-CB 3.45Å; N458-S462 PolarHBondContact O-N 3.33Å; N458-S462 PolarHBondContact O-OG 3.36Å; N458-W473 WeakPolarHBondContact OD1-CZ2 3.35Å; N458-W473 PolarHBondContact OD1-NE1 2.84Å; N458-W473 VanDerWaalsContact OD1-NE1 3.15Å; N458-N489 PolarHBondContact OD1-ND2 3.48Å
459	M	98.2	Very high	97.1	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-49.4	173.1	177	-127.6	61.6	0	0	111	T427 Y432 A435 E436 Y439 N455 M456 G457 N461 S462 N463	T427-M459 HydrophobicContact CG2-CB 3.81Å; T427-M459 HydrophobicContact CG2-CG 3.9Å; T427-M459 WeakPolarHBondContact OG1-CB 3.31Å; T427-M459 WeakPolarHBondContact OG1-CG 3.41Å; Y432-M459 HydrophobicContact CD1-CG 3.89Å; A435-M459 HydrophobicContact CB-CG 4.09Å; A435-M459 HydrophobicContact CB-SD 4Å; E436-M459 HydrophobicContact CB-SD 4.23Å; Y439-M459 HydrophobicContact CE2-CB 3.95Å; Y439-M459 HydrophobicContact CE2-CG 4.44Å; N455-M459 PolarHBondContact O-N 3.17Å; M456-M459 WeakPolarHBondContact O-CB 3.23Å; M456-M459 PolarHBondContact O-N 3.37Å; M456-M459 VanDerWaalsContact O-N 3.16Å; G457-M459 VanDerWaalsContact C-N 3.28Å; G457-M459 PolarHBondContact O-N 2.94Å; M459-N461 VanDerWaalsContact C-N 3.31Å; M459-N461 PolarHBondContact O-N 3.27Å; M459-S462 CarbonylContact O-C 3.07Å; M459-S462 WeakPolarHBondContact O-CA 3.25Å; M459-S462 WeakPolarHBondContact O-CB 3.33Å; M459-S462 PolarHBondContact O-N 2.92Å; M459-N463 PolarHBondContact O-N 3.21Å
460	Y	98.3	Very high	97.3	Very high	25 Å²	25	45.4 Å²	45.4	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-43.1	177.6	-81.9	-72.5	0	0	0	111.6	E436 M456 G457 S462 N463 N464 D465 N468 L472	E436-Y460 VanDerWaalsContact CD-OH 3.25Å; E436-Y460 PolarHBondContact OE1-OH 3.24Å; E436-Y460 VanDerWaalsContact OE1-OH 3.1Å; E436-Y460 PolarHBondContact OE2-OH 3.07Å; M456-Y460 HydrophobicContact CE-CE2 3.63Å; M456-Y460 HydrophobicContact CG-CD2 4.28Å; M456-Y460 HydrophobicContact CG-CE2 3.98Å; M456-Y460 WeakPolarHBondContact O-CD2 3.42Å; M456-Y460 PolarHBondContact O-N 3.18Å; G457-Y460 PolarHBondContact O-N 2.95Å; Y460-S462 PolarHBondContact O-N 2.59Å; Y460-N463 CarbonylContact O-C 3.39Å; Y460-N463 WeakPolarHBondContact O-CA 3.42Å; Y460-N463 PolarHBondContact O-N 3.2Å; Y460-N464 PolarHBondContact O-N 3.04Å; Y460-D465 CarbonylContact C-O 3.2Å; Y460-D465 WeakPolarHBondContact CB-O 3.09Å; Y460-D465 HydrophobicContact CD1-CB 3.91Å; Y460-D465 VanDerWaalsContact CD1-OD2 3.32Å; Y460-D465 WeakPolarHBondContact CD1-OD2 3.33Å; Y460-D465 PolarHBondContact O-N 2.94Å; Y460-N468 HydrophobicContact CD1-CB 3.8Å; Y460-N468 HydrophobicContact CD2-CB 4.14Å; Y460-N468 HydrophobicContact CE1-CB 4.15Å; Y460-N468 HydrophobicContact CE2-CB 4.44Å; Y460-N468 HydrophobicContact CG-CB 3.8Å; Y460-L472 HydrophobicContact CD2-CD1 3.34Å; Y460-L472 HydrophobicContact CE2-CD1 3.49Å; Y460-L472 VanDerWaalsContact CE2-CD1 3.49Å
461	N	97.2	Very high	97.3	Very high	66 Å²	66	49.1 Å²	49.1	35%	0.353	27%	0.266	S	S	.	.	H	α-helix	trans	-62.4	-32.9	176.1	-170.7	70.1	0	0	0	112.6	G457 M459 N463 N464 A469 W473	G457-N461 WeakPolarHBondContact O-CB 3.43Å; G457-N461 PolarHBondContact O-N 3.02Å; M459-N461 VanDerWaalsContact C-N 3.31Å; M459-N461 PolarHBondContact O-N 3.27Å; N461-N463 VanDerWaalsContact C-N 3.33Å; N461-N464 PolarHBondContact O-N 3.3Å; N461-A469 HydrophobicContact CB-CB 3.75Å; N461-W473 HydrophobicContact CB-CH2 3.81Å; N461-W473 HydrophobicContact CB-CZ2 3.95Å
462	S	95.9	Very high	97.3	Very high	55 Å²	55	46.2 Å²	46.2	39%	0.385	25%	0.251	S	S	.	.	H	α-helix	trans	-73.9	-26.3	175	-56.2	0	0	0	0	112.1	Y432 N458 M459 Y460 N464	Y432-S462 PolarHBondContact OH-O 3.28Å; N458-S462 WeakPolarHBondContact O-CB 3.45Å; N458-S462 PolarHBondContact O-N 3.33Å; N458-S462 PolarHBondContact O-OG 3.36Å; M459-S462 CarbonylContact O-C 3.07Å; M459-S462 WeakPolarHBondContact O-CA 3.25Å; M459-S462 WeakPolarHBondContact O-CB 3.33Å; M459-S462 PolarHBondContact O-N 2.92Å; Y460-S462 PolarHBondContact O-N 2.59Å; S462-N464 VanDerWaalsContact C-N 3.25Å; S462-N464 PolarHBondContact O-N 3.44Å
463	N	96.1	Very high	97.3	Very high	73 Å²	73	46.5 Å²	46.5	39%	0.39	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	16.9	171.7	-165.8	42.5	0	0	0	113.2	Y432 M459 Y460 N461 D465	Y432-N463 HydrophobicContact CD1-CB 4Å; Y432-N463 HydrophobicContact CD2-CB 4.22Å; Y432-N463 VanDerWaalsContact CD2-OD1 3.29Å; Y432-N463 WeakPolarHBondContact CD2-OD1 3.38Å; Y432-N463 HydrophobicContact CE1-CB 4.04Å; Y432-N463 HydrophobicContact CE2-CB 4.25Å; Y432-N463 WeakPolarHBondContact CE2-OD1 3.39Å; Y432-N463 HydrophobicContact CG-CB 4.09Å; M459-N463 PolarHBondContact O-N 3.21Å; Y460-N463 CarbonylContact O-C 3.39Å; Y460-N463 WeakPolarHBondContact O-CA 3.42Å; Y460-N463 PolarHBondContact O-N 3.2Å; N461-N463 VanDerWaalsContact C-N 3.33Å; N463-D465 PolarHBondContact O-N 3.18Å
464	N	94.8	Very high	97.3	Very high	149 Å²	149	50.7 Å²	50.7	80%	0.797	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	18.1	-176.9	-58.6	-45.6	0	0	0	115.7	Y460 N461 S462 S466	Y460-N464 PolarHBondContact O-N 3.04Å; N461-N464 PolarHBondContact O-N 3.3Å; S462-N464 VanDerWaalsContact C-N 3.25Å; S462-N464 PolarHBondContact O-N 3.44Å; N464-S466 PolarHBondContact O-N 3.46Å
465	D	95.5	Very high	97.3	Very high	43 Å²	43	53.9 Å²	53.9	23%	0.23	29%	0.288	C	S	.	.			trans	-99.2	77	175.3	-173.6	-13	0	0	0	109.5	Y460 N463 E467 N468 A469	Y460-D465 CarbonylContact C-O 3.2Å; Y460-D465 WeakPolarHBondContact CB-O 3.09Å; Y460-D465 HydrophobicContact CD1-CB 3.91Å; Y460-D465 VanDerWaalsContact CD1-OD2 3.32Å; Y460-D465 WeakPolarHBondContact CD1-OD2 3.33Å; Y460-D465 PolarHBondContact O-N 2.94Å; N463-D465 PolarHBondContact O-N 3.18Å; D465-E467 VanDerWaalsContact C-N 3.27Å; D465-E467 PolarHBondContact O-N 3.34Å; D465-N468 WeakPolarHBondContact OD1-CB 3.34Å; D465-N468 PolarHBondContact OD1-N 3.42Å; D465-N468 VanDerWaalsContact OD1-N 3.07Å; D465-N468 PolarHBondContact OD1-ND2 2.86Å; D465-N468 PolarHBondContact OD2-ND2 3.04Å; D465-A469 WeakPolarHBondContact O-CB 3.32Å; D465-A469 PolarHBondContact O-N 3.29Å
466	S	94.8	Very high	97.3	Very high	57 Å²	57	52.5 Å²	52.5	40%	0.399	28%	0.281	S	S	.	.	H	α-helix	trans	-69.4	-25.1	-177.8	-62.4	0	0	0	0	113.1	N464 V470	N464-S466 PolarHBondContact O-N 3.46Å; S466-V470 WeakPolarHBondContact O-CG2 3.21Å; S466-V470 PolarHBondContact O-N 3.46Å; S466-V470 VanDerWaalsContact O-N 3.12Å
467	E	95.2	Very high	97.3	Very high	158 Å²	158	52.8 Å²	52.8	74%	0.738	28%	0.283	S	S	*	.	H	α-helix	trans	-69.2	-53.1	-179.6	-172.7	174.3	-175.4	0	0	110.8	D465 A469 V470 V471	D465-E467 VanDerWaalsContact C-N 3.27Å; D465-E467 PolarHBondContact O-N 3.34Å; E467-A469 VanDerWaalsContact C-N 3.25Å; E467-A469 PolarHBondContact O-N 2.81Å; E467-V470 PolarHBondContact O-N 3.34Å; E467-V471 PolarHBondContact O-N 2.96Å
468	N	96.7	Very high	97.2	Very high	71 Å²	71	61.5 Å²	61.5	38%	0.38	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-31.9	176.1	-77.8	-50.6	0	0	0	112.2	Y460 D465 V470 V471 L472	Y460-N468 HydrophobicContact CD1-CB 3.8Å; Y460-N468 HydrophobicContact CD2-CB 4.14Å; Y460-N468 HydrophobicContact CE1-CB 4.15Å; Y460-N468 HydrophobicContact CE2-CB 4.44Å; Y460-N468 HydrophobicContact CG-CB 3.8Å; D465-N468 WeakPolarHBondContact OD1-CB 3.34Å; D465-N468 PolarHBondContact OD1-N 3.42Å; D465-N468 VanDerWaalsContact OD1-N 3.07Å; D465-N468 PolarHBondContact OD1-ND2 2.86Å; D465-N468 PolarHBondContact OD2-ND2 3.04Å; N468-V470 PolarHBondContact O-N 3.24Å; N468-V471 PolarHBondContact O-N 3.11Å; N468-L472 WeakPolarHBondContact O-CG 3.37Å; N468-L472 PolarHBondContact O-N 3.24Å; N468-L472 VanDerWaalsContact O-N 3.08Å
469	A	98.1	Very high	97.2	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.5	-46.5	174.1	0	0	0	0	0	112.4	G457 N461 D465 E467 L472 W473	G457-A469 VanDerWaalsContact O-CB 3.22Å; G457-A469 WeakPolarHBondContact O-CB 3.27Å; N461-A469 HydrophobicContact CB-CB 3.75Å; D465-A469 WeakPolarHBondContact O-CB 3.32Å; D465-A469 PolarHBondContact O-N 3.29Å; E467-A469 VanDerWaalsContact C-N 3.25Å; E467-A469 PolarHBondContact O-N 2.81Å; A469-L472 PolarHBondContact O-N 3.12Å; A469-W473 HydrophobicContact CB-CE3 4.31Å; A469-W473 HydrophobicContact CB-CH2 3.83Å; A469-W473 HydrophobicContact CB-CZ2 4.07Å; A469-W473 HydrophobicContact CB-CZ3 3.93Å; A469-W473 VanDerWaalsContact O-CD2 3.25Å; A469-W473 VanDerWaalsContact O-CG 3.3Å; A469-W473 PolarHBondContact O-N 2.87Å
470	V	98	Very high	97.1	Very high	50 Å²	50	65.4 Å²	65.4	30%	0.303	34%	0.344	S	S	.	.	H	α-helix	trans	-62.7	-44	178.4	167.7	0	0	0	0	111.4	S466 E467 N468 L472 W473 L474 L490 A493	S466-V470 WeakPolarHBondContact O-CG2 3.21Å; S466-V470 PolarHBondContact O-N 3.46Å; S466-V470 VanDerWaalsContact O-N 3.12Å; E467-V470 PolarHBondContact O-N 3.34Å; N468-V470 PolarHBondContact O-N 3.24Å; V470-L472 VanDerWaalsContact C-N 3.3Å; V470-L472 PolarHBondContact O-N 3.27Å; V470-W473 HydrophobicContact CG2-CE3 4.3Å; V470-W473 HydrophobicContact CG2-CZ3 4.33Å; V470-W473 PolarHBondContact O-N 3.18Å; V470-L474 HydrophobicContact CG1-CD1 3.97Å; V470-L474 HydrophobicContact CG1-CG 4.47Å; V470-L474 WeakPolarHBondContact O-CB 3.12Å; V470-L474 WeakPolarHBondContact O-CG 3.3Å; V470-L474 PolarHBondContact O-N 3.38Å; V470-L490 HydrophobicContact CB-CD2 4.31Å; V470-L490 HydrophobicContact CG1-CD2 3.85Å; V470-L490 HydrophobicContact CG2-CD2 4.3Å; V470-A493 HydrophobicContact CG2-CB 4.08Å
471	V	98.1	Very high	97.1	Very high	85 Å²	85	70 Å²	70	52%	0.515	37%	0.366	S	S	.	.	H	α-helix	trans	-57.9	-44	177.1	176	0	0	0	0	111	E467 N468 L474 K475	E467-V471 PolarHBondContact O-N 2.96Å; N468-V471 PolarHBondContact O-N 3.11Å; V471-L474 PolarHBondContact O-N 3.47Å; V471-K475 PolarHBondContact O-N 3.15Å
472	L	98.2	Very high	97.1	Very high	23 Å²	23	72.6 Å²	72.6	12%	0.12	38%	0.375	C	S	.	.	H	α-helix	trans	-72.8	-36.6	-179.2	-72.7	169.1	0	0	0	113.3	F453 M456 Y460 N468 A469 V470 K475 A476	F453-L472 HydrophobicContact CD1-CD2 4.07Å; M456-L472 HydrophobicContact CB-CD1 4.03Å; M456-L472 HydrophobicContact CE-CD1 4.43Å; M456-L472 HydrophobicContact CG-CD1 3.68Å; M456-L472 HydrophobicContact SD-CD1 4.08Å; M456-L472 HydrophobicContact SD-CD2 4.24Å; Y460-L472 HydrophobicContact CD2-CD1 3.34Å; Y460-L472 HydrophobicContact CE2-CD1 3.49Å; Y460-L472 VanDerWaalsContact CE2-CD1 3.49Å; N468-L472 WeakPolarHBondContact O-CG 3.37Å; N468-L472 PolarHBondContact O-N 3.24Å; N468-L472 VanDerWaalsContact O-N 3.08Å; A469-L472 PolarHBondContact O-N 3.12Å; V470-L472 VanDerWaalsContact C-N 3.3Å; V470-L472 PolarHBondContact O-N 3.27Å; L472-K475 WeakPolarHBondContact O-CB 3.24Å; L472-K475 PolarHBondContact O-N 2.79Å; L472-A476 PolarHBondContact O-N 3.26Å
473	W	98.6	Very high	97.2	Very high	6 Å²	6	70.3 Å²	70.3	2%	0.023	36%	0.359	C	S	.	.	H	α-helix	trans	-66.4	-37.8	172.9	-64.4	-34.5	0	0	0	112.2	Y454 N458 N461 A469 V470 K475 A476 I477 N489 L490 A493	Y454-W473 AromaticContact CD2-CD1 3.83Å; Y454-W473 AromaticContact CD2-NE1 3.97Å; Y454-W473 PolarHBondContact O-NE1 3.31Å; N458-W473 WeakPolarHBondContact OD1-CZ2 3.35Å; N458-W473 PolarHBondContact OD1-NE1 2.84Å; N458-W473 VanDerWaalsContact OD1-NE1 3.15Å; N461-W473 HydrophobicContact CB-CH2 3.81Å; N461-W473 HydrophobicContact CB-CZ2 3.95Å; A469-W473 HydrophobicContact CB-CE3 4.31Å; A469-W473 HydrophobicContact CB-CH2 3.83Å; A469-W473 HydrophobicContact CB-CZ2 4.07Å; A469-W473 HydrophobicContact CB-CZ3 3.93Å; A469-W473 VanDerWaalsContact O-CD2 3.25Å; A469-W473 VanDerWaalsContact O-CG 3.3Å; A469-W473 PolarHBondContact O-N 2.87Å; V470-W473 HydrophobicContact CG2-CE3 4.3Å; V470-W473 HydrophobicContact CG2-CZ3 4.33Å; V470-W473 PolarHBondContact O-N 3.18Å; W473-K475 VanDerWaalsContact C-N 3.31Å; W473-K475 PolarHBondContact O-N 3.37Å; W473-A476 WeakPolarHBondContact O-CB 3.43Å; W473-A476 PolarHBondContact O-N 3.02Å; W473-I477 WeakPolarHBondContact O-CG1 3.35Å; W473-I477 PolarHBondContact O-N 2.83Å; W473-N489 HydrophobicContact CD2-CB 3.8Å; W473-N489 HydrophobicContact CE3-CB 4Å; W473-N489 HydrophobicContact CG-CB 4.37Å; W473-N489 HydrophobicContact CH2-CB 4.11Å; W473-N489 HydrophobicContact CZ2-CB 3.91Å; W473-N489 WeakPolarHBondContact CZ2-ND2 3.41Å; W473-N489 HydrophobicContact CZ3-CB 4.17Å; W473-L490 HydrophobicContact CB-CD2 3.89Å; W473-L490 HydrophobicContact CB-CG 3.9Å; W473-L490 HydrophobicContact CE3-CD2 4.1Å; W473-A493 HydrophobicContact CZ3-CB 3.86Å
474	L	98.3	Very high	97.2	Very high	94 Å²	94	67.2 Å²	67.2	49%	0.492	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-41	170.9	-74.6	168.8	0	0	0	111.4	V470 V471 I477 K478 L490	V470-L474 HydrophobicContact CG1-CD1 3.97Å; V470-L474 HydrophobicContact CG1-CG 4.47Å; V470-L474 WeakPolarHBondContact O-CB 3.12Å; V470-L474 WeakPolarHBondContact O-CG 3.3Å; V470-L474 PolarHBondContact O-N 3.38Å; V471-L474 PolarHBondContact O-N 3.47Å; L474-I477 PolarHBondContact O-N 2.81Å; L474-K478 WeakPolarHBondContact O-CB 3.37Å; L474-K478 PolarHBondContact O-N 3.33Å; L474-L490 HydrophobicContact CD2-CD1 3.64Å; L474-L490 HydrophobicContact CG-CD1 4.04Å; L474-L490 HydrophobicContact CG-CD2 4.21Å
475	K	97.8	Very high	97.4	Very high	103 Å²	103	63.1 Å²	63.1	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-41.2	174.5	-167	169.9	-178.6	-176.7	0	112	F453 V471 L472 W473 I477 K478 T479	F453-K475 HydrophobicContact CD1-CD 3.66Å; F453-K475 HydrophobicContact CD1-CG 4.07Å; F453-K475 HydrophobicContact CD2-CD 4.49Å; F453-K475 HydrophobicContact CD2-CG 4.13Å; F453-K475 HydrophobicContact CE1-CD 3.53Å; F453-K475 HydrophobicContact CE1-CG 4.21Å; F453-K475 HydrophobicContact CE2-CD 4.37Å; F453-K475 HydrophobicContact CE2-CG 4.26Å; F453-K475 HydrophobicContact CG-CB 4.37Å; F453-K475 HydrophobicContact CG-CD 4.17Å; F453-K475 HydrophobicContact CG-CG 4.05Å; F453-K475 HydrophobicContact CZ-CD 3.92Å; F453-K475 HydrophobicContact CZ-CG 4.31Å; V471-K475 PolarHBondContact O-N 3.15Å; L472-K475 WeakPolarHBondContact O-CB 3.24Å; L472-K475 PolarHBondContact O-N 2.79Å; W473-K475 VanDerWaalsContact C-N 3.31Å; W473-K475 PolarHBondContact O-N 3.37Å; K475-I477 VanDerWaalsContact C-N 3.34Å; K475-I477 PolarHBondContact O-N 3.22Å; K475-K478 PolarHBondContact O-N 3.42Å; K475-T479 PolarHBondContact O-N 2.64Å; K475-T479 PolarHBondContact O-OG1 3.1Å
476	A	98.2	Very high	97.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.5	-44.5	175.5	0	0	0	0	0	112	A450 F453 L472 W473 T479 N480 A486	A450-A476 WeakPolarHBondContact O-CB 3.37Å; F453-A476 HydrophobicContact CB-CB 3.95Å; L472-A476 PolarHBondContact O-N 3.26Å; W473-A476 WeakPolarHBondContact O-CB 3.43Å; W473-A476 PolarHBondContact O-N 3.02Å; A476-T479 PolarHBondContact O-N 2.97Å; A476-N480 PolarHBondContact O-N 2.99Å; A476-A486 HydrophobicContact CB-CB 4.01Å
477	I	97.7	Very high	97.7	Very high	12 Å²	12	59.7 Å²	59.7	6%	0.062	29%	0.294	C	S	.	.	H	α-helix	trans	-69.2	-38.5	177.3	-69.9	159.1	0	0	0	111.8	W473 L474 K475 T479 N480 Q481 A486 W487 L490	W473-I477 WeakPolarHBondContact O-CG1 3.35Å; W473-I477 PolarHBondContact O-N 2.83Å; L474-I477 PolarHBondContact O-N 2.81Å; K475-I477 VanDerWaalsContact C-N 3.34Å; K475-I477 PolarHBondContact O-N 3.22Å; I477-T479 PolarHBondContact O-N 2.97Å; I477-N480 CarbonylContact O-C 3.33Å; I477-N480 PolarHBondContact O-N 3.33Å; I477-Q481 WeakPolarHBondContact O-CA 3.35Å; I477-Q481 PolarHBondContact O-N 3.37Å; I477-Q481 VanDerWaalsContact O-N 3.09Å; I477-A486 HydrophobicContact CD1-CB 4.11Å; I477-A486 HydrophobicContact CG1-CB 3.76Å; I477-W487 HydrophobicContact CD1-CD2 3.62Å; I477-W487 HydrophobicContact CD1-CE3 3.8Å; I477-W487 HydrophobicContact CD1-CG 3.95Å; I477-W487 HydrophobicContact CD1-CZ2 4.46Å; I477-W487 HydrophobicContact CD1-CZ3 4.29Å; I477-W487 HydrophobicContact CG1-CD2 4.12Å; I477-W487 HydrophobicContact CG1-CG 4.22Å; I477-W487 HydrophobicContact CG2-CD2 4.34Å; I477-W487 HydrophobicContact CG2-CH2 3.94Å; I477-W487 HydrophobicContact CG2-CZ2 3.33Å; I477-L490 HydrophobicContact CD1-CD1 3.29Å; I477-L490 HydrophobicContact CD1-CG 4.26Å
478	K	97.4	Very high	97.8	Very high	183 Å²	183	52.9 Å²	52.9	80%	0.796	26%	0.264	S	S	*	.	H	α-helix	trans	-60.6	-38.2	174.6	-175.2	177.1	178.6	178.6	0	111.2	L474 K475	L474-K478 WeakPolarHBondContact O-CB 3.37Å; L474-K478 PolarHBondContact O-N 3.33Å; K475-K478 PolarHBondContact O-N 3.42Å
479	T	97.2	Very high	97.9	Very high	51 Å²	51	51 Å²	51	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-74.4	-40.4	176.3	-56.2	0	0	0	0	112.2	N448 A450 K475 A476 I477	N448-T479 HydrophobicContact CB-CG2 4.21Å; N448-T479 VanDerWaalsContact O-CG2 3.26Å; N448-T479 WeakPolarHBondContact O-CG2 3.31Å; A450-T479 HydrophobicContact CB-CG2 4.11Å; K475-T479 PolarHBondContact O-N 2.64Å; K475-T479 PolarHBondContact O-OG1 3.1Å; A476-T479 PolarHBondContact O-N 2.97Å; I477-T479 PolarHBondContact O-N 2.97Å
480	N	97.5	Very high	97.9	Very high	70 Å²	70	51.3 Å²	51.3	37%	0.374	26%	0.255	S	S	.	.			trans	-141.6	103.7	175.8	179	5.6	0	0	0	110.9	A450 A476 I477 H482 H483	A450-N480 HydrophobicContact CB-CB 3.64Å; A476-N480 PolarHBondContact O-N 2.99Å; I477-N480 CarbonylContact O-C 3.33Å; I477-N480 PolarHBondContact O-N 3.33Å; N480-H482 PolarHBondContact O-N 3.38Å; N480-H482 VanDerWaalsContact O-N 3.16Å; N480-H482 WeakPolarHBondContact OD1-CB 3.43Å; N480-H482 PolarHBondContact OD1-N 3Å; N480-H483 HydrophobicContact CB-CB 4.36Å; N480-H483 VanDerWaalsContact O-CB 3.26Å; N480-H483 WeakPolarHBondContact O-CB 3.44Å; N480-H483 PolarHBondContact O-N 3.18Å
481	Q	97.1	Very high	97.9	Very high	121 Å²	121	49 Å²	49	57%	0.565	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.4	-178.8	-66	-175.3	-11.1	0	0	113.4	I477 H483 W487 V513	I477-Q481 WeakPolarHBondContact O-CA 3.35Å; I477-Q481 PolarHBondContact O-N 3.37Å; I477-Q481 VanDerWaalsContact O-N 3.09Å; Q481-H483 VanDerWaalsContact C-N 3.31Å; Q481-W487 PolarHBondContact O-NE1 2.82Å; Q481-V513 HydrophobicContact CB-CG1 4.11Å; Q481-V513 WeakPolarHBondContact O-CG1 3.26Å
482	H	97.2	Very high	97.8	Very high	120 Å²	120	47.6 Å²	47.6	56%	0.556	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	6.1	175.9	-65.2	-80.5	0	0	0	113.5	N480 A484 L514	N480-H482 PolarHBondContact O-N 3.38Å; N480-H482 VanDerWaalsContact O-N 3.16Å; N480-H482 WeakPolarHBondContact OD1-CB 3.43Å; N480-H482 PolarHBondContact OD1-N 3Å; H482-A484 PolarHBondContact O-N 3.02Å; H482-L514 HydrophobicContact CB-CD2 4.31Å
483	H	97.6	Very high	97.7	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.037	23%	0.233	C	C	.	.			trans	-73.5	89.4	178.1	-165.5	-17.1	0	0	0	111.8	D451 Y454 N480 Q481 E485 A486 W487	D451-H483 IonicContact OD1-CE1 3.75Å; D451-H483 IonicContact OD1-NE2 3.45Å; D451-H483 PolarHBondContact OD1-NE2 3.12Å; Y454-H483 WeakPolarHBondContact CB-NE2 3.42Å; Y454-H483 AromaticContact CD1-CE1 3.87Å; Y454-H483 AromaticContact CD1-NE2 3.9Å; Y454-H483 AromaticContact CG-CE1 3.65Å; Y454-H483 AromaticContact CG-NE2 3.5Å; N480-H483 HydrophobicContact CB-CB 4.36Å; N480-H483 VanDerWaalsContact O-CB 3.26Å; N480-H483 WeakPolarHBondContact O-CB 3.44Å; N480-H483 PolarHBondContact O-N 3.18Å; Q481-H483 VanDerWaalsContact C-N 3.31Å; H483-E485 IonicContact ND1-OE2 3.04Å; H483-E485 PolarHBondContact O-N 3.28Å; H483-A486 HydrophobicContact CB-CB 4.31Å; H483-A486 PolarHBondContact O-N 3.42Å; H483-W487 PolarHBondContact O-N 3Å
484	A	97.6	Very high	97.6	Very high	7 Å²	7	47.6 Å²	47.6	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-36.7	-170.6	0	0	0	0	0	114.9	H482 W487 T488 L514 H517	H482-A484 PolarHBondContact O-N 3.02Å; A484-W487 PolarHBondContact O-N 2.81Å; A484-T488 WeakPolarHBondContact O-CB 3.32Å; A484-T488 PolarHBondContact O-N 2.76Å; A484-T488 PolarHBondContact O-OG1 3.41Å; A484-L514 HydrophobicContact CB-CD1 3.66Å; A484-H517 WeakPolarHBondContact CB-CD2 3.43Å; A484-H517 WeakPolarHBondContact CB-NE2 3.38Å
485	E	97.8	Very high	97.5	Very high	64 Å²	64	46 Å²	46	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-63.8	-41.6	177.7	-73.4	69	-158.2	0	0	112.2	Y454 H483 T488 N489 K519	Y454-E485 HydrophobicContact CD2-CB 4.26Å; Y454-E485 HydrophobicContact CE1-CB 4.17Å; Y454-E485 HydrophobicContact CE2-CB 3.52Å; Y454-E485 VanDerWaalsContact CZ-CB 3.48Å; H483-E485 IonicContact ND1-OE2 3.04Å; H483-E485 PolarHBondContact O-N 3.28Å; E485-T488 PolarHBondContact O-N 2.68Å; E485-N489 PolarHBondContact O-N 3.25Å; E485-K519 IonicContact OE1-NZ 2.94Å; E485-K519 PolarHBondContact OE1-NZ 3.28Å
486	A	98.2	Very high	97.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-43.8	177.1	0	0	0	0	0	111.3	Y454 A476 I477 H483 T488 N489 L490	Y454-A486 HydrophobicContact CD2-CB 3.95Å; A476-A486 HydrophobicContact CB-CB 4.01Å; I477-A486 HydrophobicContact CD1-CB 4.11Å; I477-A486 HydrophobicContact CG1-CB 3.76Å; H483-A486 HydrophobicContact CB-CB 4.31Å; H483-A486 PolarHBondContact O-N 3.42Å; A486-T488 VanDerWaalsContact C-N 3.34Å; A486-T488 PolarHBondContact O-N 3.27Å; A486-N489 PolarHBondContact O-N 3.18Å; A486-L490 PolarHBondContact O-N 3.45Å
487	W	98.5	Very high	97	Very high	27 Å²	27	56.9 Å²	56.9	10%	0.102	27%	0.269	C	S	.	.	H	α-helix	trans	-57.8	-46.9	172.4	-80.2	116.2	0	0	0	112.2	I477 Q481 H483 A484 N489 L490 I491 I506 L509 A510 I520	I477-W487 HydrophobicContact CD1-CD2 3.62Å; I477-W487 HydrophobicContact CD1-CE3 3.8Å; I477-W487 HydrophobicContact CD1-CG 3.95Å; I477-W487 HydrophobicContact CD1-CZ2 4.46Å; I477-W487 HydrophobicContact CD1-CZ3 4.29Å; I477-W487 HydrophobicContact CG1-CD2 4.12Å; I477-W487 HydrophobicContact CG1-CG 4.22Å; I477-W487 HydrophobicContact CG2-CD2 4.34Å; I477-W487 HydrophobicContact CG2-CH2 3.94Å; I477-W487 HydrophobicContact CG2-CZ2 3.33Å; Q481-W487 PolarHBondContact O-NE1 2.82Å; H483-W487 PolarHBondContact O-N 3Å; A484-W487 PolarHBondContact O-N 2.81Å; W487-N489 VanDerWaalsContact C-N 3.31Å; W487-N489 PolarHBondContact O-N 3.48Å; W487-L490 PolarHBondContact O-N 2.9Å; W487-I491 VanDerWaalsContact O-CG1 3.31Å; W487-I491 WeakPolarHBondContact O-CG1 3.2Å; W487-I491 PolarHBondContact O-N 3.43Å; W487-I491 VanDerWaalsContact O-N 3.08Å; W487-I506 HydrophobicContact CE3-CG2 3.85Å; W487-I506 HydrophobicContact CZ3-CG2 3.94Å; W487-L509 HydrophobicContact CH2-CB 3.99Å; W487-L509 HydrophobicContact CZ3-CB 4.11Å; W487-A510 HydrophobicContact CB-CB 3.83Å; W487-A510 HydrophobicContact CD2-CB 3.51Å; W487-A510 HydrophobicContact CE3-CB 3.59Å; W487-A510 HydrophobicContact CG-CB 3.65Å; W487-A510 HydrophobicContact CZ3-CB 4.3Å; W487-I520 HydrophobicContact CB-CD1 4.17Å
488	T	98.2	Very high	96.7	Very high	15 Å²	15	59.1 Å²	59.1	9%	0.092	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-42.7	-179.7	-57	0	0	0	0	111	A484 E485 A486 I491 I492 K519	A484-T488 WeakPolarHBondContact O-CB 3.32Å; A484-T488 PolarHBondContact O-N 2.76Å; A484-T488 PolarHBondContact O-OG1 3.41Å; E485-T488 PolarHBondContact O-N 2.68Å; A486-T488 VanDerWaalsContact C-N 3.34Å; A486-T488 PolarHBondContact O-N 3.27Å; T488-I491 PolarHBondContact O-N 2.9Å; T488-I492 HydrophobicContact CG2-CD1 3.93Å; T488-I492 VanDerWaalsContact O-CG1 3.3Å; T488-I492 WeakPolarHBondContact O-CG1 3.43Å; T488-I492 PolarHBondContact O-N 3.15Å; T488-I492 VanDerWaalsContact O-N 3.09Å; T488-K519 HydrophobicContact CG2-CB 4.15Å
489	N	98.2	Very high	96.5	Very high	33 Å²	33	52.1 Å²	52.1	18%	0.176	27%	0.27	C	S	.	.	H	α-helix	trans	-65.8	-40	177.9	-77.8	3.8	0	0	0	112.6	Y454 N458 W473 E485 A486 W487 I491 I492 A493	Y454-N489 VanDerWaalsContact CE2-ND2 3.29Å; Y454-N489 WeakPolarHBondContact CE2-ND2 3.42Å; N458-N489 PolarHBondContact OD1-ND2 3.48Å; W473-N489 HydrophobicContact CD2-CB 3.8Å; W473-N489 HydrophobicContact CE3-CB 4Å; W473-N489 HydrophobicContact CG-CB 4.37Å; W473-N489 HydrophobicContact CH2-CB 4.11Å; W473-N489 HydrophobicContact CZ2-CB 3.91Å; W473-N489 WeakPolarHBondContact CZ2-ND2 3.41Å; W473-N489 HydrophobicContact CZ3-CB 4.17Å; E485-N489 PolarHBondContact O-N 3.25Å; A486-N489 PolarHBondContact O-N 3.18Å; W487-N489 VanDerWaalsContact C-N 3.31Å; W487-N489 PolarHBondContact O-N 3.48Å; N489-I491 PolarHBondContact O-N 3.27Å; N489-I492 PolarHBondContact O-N 3.43Å; N489-A493 VanDerWaalsContact O-CB 3.3Å; N489-A493 WeakPolarHBondContact O-CB 3.3Å; N489-A493 PolarHBondContact O-N 3.16Å
490	L	98	Very high	96.4	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-41.5	175.2	-76.1	-179.2	0	0	0	113	V470 W473 L474 I477 A486 W487 I492 A493 A494 I506	V470-L490 HydrophobicContact CB-CD2 4.31Å; V470-L490 HydrophobicContact CG1-CD2 3.85Å; V470-L490 HydrophobicContact CG2-CD2 4.3Å; W473-L490 HydrophobicContact CB-CD2 3.89Å; W473-L490 HydrophobicContact CB-CG 3.9Å; W473-L490 HydrophobicContact CE3-CD2 4.1Å; L474-L490 HydrophobicContact CD2-CD1 3.64Å; L474-L490 HydrophobicContact CG-CD1 4.04Å; L474-L490 HydrophobicContact CG-CD2 4.21Å; I477-L490 HydrophobicContact CD1-CD1 3.29Å; I477-L490 HydrophobicContact CD1-CG 4.26Å; A486-L490 PolarHBondContact O-N 3.45Å; W487-L490 PolarHBondContact O-N 2.9Å; L490-I492 VanDerWaalsContact C-N 3.32Å; L490-I492 PolarHBondContact O-N 3.39Å; L490-A493 PolarHBondContact O-N 3.24Å; L490-A494 WeakPolarHBondContact O-CB 3.44Å; L490-A494 PolarHBondContact O-N 3.28Å; L490-I506 HydrophobicContact CB-CG2 3.94Å
491	I	98	Very high	96.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-45.3	176.4	-61	161.5	0	0	0	109.9	W487 T488 N489 R495 A503 I506 I520 A523	W487-I491 VanDerWaalsContact O-CG1 3.31Å; W487-I491 WeakPolarHBondContact O-CG1 3.2Å; W487-I491 PolarHBondContact O-N 3.43Å; W487-I491 VanDerWaalsContact O-N 3.08Å; T488-I491 PolarHBondContact O-N 2.9Å; N489-I491 PolarHBondContact O-N 3.27Å; I491-R495 VanDerWaalsContact O-CB 3.32Å; I491-R495 WeakPolarHBondContact O-CB 3.49Å; I491-R495 PolarHBondContact O-N 2.96Å; I491-A503 HydrophobicContact CG2-CB 4.31Å; I491-I506 HydrophobicContact CG1-CB 4.25Å; I491-I506 HydrophobicContact CG1-CG2 3.7Å; I491-I520 HydrophobicContact CD1-CG2 4.08Å; I491-A523 HydrophobicContact CB-CB 4.15Å; I491-A523 HydrophobicContact CD1-CB 4.18Å; I491-A523 HydrophobicContact CG2-CB 3.69Å
492	I	96.5	Very high	96.3	Very high	57 Å²	57	53.1 Å²	53.1	29%	0.292	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-42.8	178.7	-68.3	168.1	0	0	0	110.7	T488 N489 L490 R495 N496	T488-I492 HydrophobicContact CG2-CD1 3.93Å; T488-I492 VanDerWaalsContact O-CG1 3.3Å; T488-I492 WeakPolarHBondContact O-CG1 3.43Å; T488-I492 PolarHBondContact O-N 3.15Å; T488-I492 VanDerWaalsContact O-N 3.09Å; N489-I492 PolarHBondContact O-N 3.43Å; L490-I492 VanDerWaalsContact C-N 3.32Å; L490-I492 PolarHBondContact O-N 3.39Å; I492-R495 PolarHBondContact O-N 3.46Å; I492-N496 WeakPolarHBondContact O-CB 3.31Å; I492-N496 PolarHBondContact O-N 3.46Å; I492-N496 PolarHBondContact O-OD1 3.26Å
493	A	96.2	Very high	96.3	Very high	21 Å²	21	47.4 Å²	47.4	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-49.4	179.2	0	0	0	0	0	111.9	V470 W473 N489 L490 R495 N496 W497	V470-A493 HydrophobicContact CG2-CB 4.08Å; W473-A493 HydrophobicContact CZ3-CB 3.86Å; N489-A493 VanDerWaalsContact O-CB 3.3Å; N489-A493 WeakPolarHBondContact O-CB 3.3Å; N489-A493 PolarHBondContact O-N 3.16Å; L490-A493 PolarHBondContact O-N 3.24Å; A493-R495 VanDerWaalsContact C-N 3.28Å; A493-R495 PolarHBondContact O-N 3.02Å; A493-N496 PolarHBondContact O-N 2.86Å; A493-N496 VanDerWaalsContact O-N 3.16Å; A493-W497 WeakPolarHBondContact O-CB 3.34Å; A493-W497 PolarHBondContact O-N 3.02Å
494	A	96.5	Very high	96.4	Very high	8 Å²	8	47.7 Å²	47.7	7%	0.066	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-36.5	177.4	0	0	0	0	0	112.6	L490 S499 L502 A503 I506	L490-A494 WeakPolarHBondContact O-CB 3.44Å; L490-A494 PolarHBondContact O-N 3.28Å; A494-S499 PolarHBondContact O-N 2.91Å; A494-S499 VanDerWaalsContact O-N 3.11Å; A494-L502 HydrophobicContact CB-CB 4.43Å; A494-L502 HydrophobicContact CB-CD2 4.16Å; A494-L502 HydrophobicContact CB-CG 4.11Å; A494-A503 HydrophobicContact CB-CB 3.94Å; A494-I506 HydrophobicContact CB-CD1 3.84Å
495	R	95.9	Very high	96.4	Very high	59 Å²	59	55.2 Å²	55.2	22%	0.223	27%	0.271	C	S	.	.	H	α-helix	trans	-67.2	-45.2	174.5	-177.6	-165.7	69.4	178.2	0.1	111.5	I491 I492 A493 W497 G498 A503 L530	I491-R495 VanDerWaalsContact O-CB 3.32Å; I491-R495 WeakPolarHBondContact O-CB 3.49Å; I491-R495 PolarHBondContact O-N 2.96Å; I492-R495 PolarHBondContact O-N 3.46Å; A493-R495 VanDerWaalsContact C-N 3.28Å; A493-R495 PolarHBondContact O-N 3.02Å; R495-W497 VanDerWaalsContact C-N 3.25Å; R495-W497 PolarHBondContact O-N 3.02Å; R495-G498 PolarHBondContact O-N 3.07Å; R495-A503 HydrophobicContact CB-CB 4Å; R495-L530 HydrophobicContact CG-CD1 3.88Å
496	N	93.3	Very high	96.4	Very high	115 Å²	115	53.4 Å²	53.4	62%	0.615	26%	0.263	S	S	*	.	H	α-helix	trans	-67.3	-28.6	179.1	-67.6	-1	0	0	0	111.9	I492 A493 G498	I492-N496 WeakPolarHBondContact O-CB 3.31Å; I492-N496 PolarHBondContact O-N 3.46Å; I492-N496 PolarHBondContact O-OD1 3.26Å; A493-N496 PolarHBondContact O-N 2.86Å; A493-N496 VanDerWaalsContact O-N 3.16Å; N496-G498 PolarHBondContact O-N 3.32Å
497	W	92.8	Very high	96.3	Very high	217 Å²	217	53.4 Å²	53.4	82%	0.822	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.1	169.9	-168.4	-97.8	0	0	0	113.5	A493 R495	A493-W497 WeakPolarHBondContact O-CB 3.34Å; A493-W497 PolarHBondContact O-N 3.02Å; R495-W497 VanDerWaalsContact C-N 3.25Å; R495-W497 PolarHBondContact O-N 3.02Å
498	G	90.5	Very high	96.3	Very high	59 Å²	59	56.5 Å²	56.5	61%	0.608	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-1.8	179.5	0	0	0	0	0	114.8	R495 N496 I500	R495-G498 PolarHBondContact O-N 3.07Å; N496-G498 PolarHBondContact O-N 3.32Å; G498-I500 PolarHBondContact O-N 2.8Å
499	S	94	Very high	96.3	Very high	37 Å²	37	60.2 Å²	60.2	26%	0.259	30%	0.296	S	S	.	.			trans	-95.9	80.9	179.7	-169.5	0	0	0	0	111.9	A494 K501 L502 A503	A494-S499 PolarHBondContact O-N 2.91Å; A494-S499 VanDerWaalsContact O-N 3.11Å; S499-K501 PolarHBondContact O-N 3.33Å; S499-L502 PolarHBondContact O-N 3.31Å; S499-L502 WeakPolarHBondContact OG-CB 3.48Å; S499-L502 PolarHBondContact OG-N 3.15Å; S499-A503 PolarHBondContact O-N 3.27Å
500	I	95.6	Very high	96.3	Very high	36 Å²	36	58.6 Å²	58.6	19%	0.185	29%	0.288	C	S	.	.	H	α-helix	trans	-61.3	-35.2	177.7	-47.8	177.7	0	0	0	111	G498 L502 A503 L504 C527 L530 W531	G498-I500 PolarHBondContact O-N 2.8Å; I500-L502 PolarHBondContact O-N 2.79Å; I500-A503 PolarHBondContact O-N 2.88Å; I500-L504 HydrophobicContact CG2-CD1 4.23Å; I500-L504 HydrophobicContact CG2-CG 4.35Å; I500-L504 WeakPolarHBondContact O-CG 3.33Å; I500-L504 PolarHBondContact O-N 2.82Å; I500-C527 HydrophobicContact CG2-CB 3.91Å; I500-C527 WeakPolarHBondContact CG2-O 3.27Å; I500-L530 HydrophobicContact CD1-CB 3.88Å; I500-W531 HydrophobicContact CB-CE3 3.77Å; I500-W531 HydrophobicContact CB-CZ3 4.19Å; I500-W531 HydrophobicContact CG2-CB 4.39Å; I500-W531 HydrophobicContact CG2-CE3 3.58Å; I500-W531 HydrophobicContact CG2-CZ3 4.32Å
501	K	95.7	Very high	96.3	Very high	152 Å²	152	59.4 Å²	59.4	66%	0.661	29%	0.292	S	S	*	.	H	α-helix	trans	-56.8	-49.2	174.6	-76.8	-179.5	-177.6	173.1	0	111.7	S499 R505 W531	S499-K501 PolarHBondContact O-N 3.33Å; K501-R505 PolarHBondContact O-N 2.8Å; K501-R505 VanDerWaalsContact O-N 3.07Å; K501-W531 HydrophobicContact CB-CZ3 4.23Å; K501-W531 HydrophobicContact CD-CH2 4.01Å; K501-W531 HydrophobicContact CD-CZ3 4.48Å; K501-W531 VanDerWaalsContact CE-CH2 3.48Å; K501-W531 HydrophobicContact CG-CH2 3.29Å; K501-W531 HydrophobicContact CG-CZ3 3.35Å
502	L	96.4	Very high	96.3	Very high	74 Å²	74	63.9 Å²	63.9	39%	0.387	32%	0.323	S	S	.	.	H	α-helix	trans	-66.7	-43.7	178.9	-179	62.3	0	0	0	111.1	A494 S499 I500 L504 R505 I506	A494-L502 HydrophobicContact CB-CB 4.43Å; A494-L502 HydrophobicContact CB-CD2 4.16Å; A494-L502 HydrophobicContact CB-CG 4.11Å; S499-L502 PolarHBondContact O-N 3.31Å; S499-L502 WeakPolarHBondContact OG-CB 3.48Å; S499-L502 PolarHBondContact OG-N 3.15Å; I500-L502 PolarHBondContact O-N 2.79Å; L502-L504 VanDerWaalsContact C-N 3.32Å; L502-L504 PolarHBondContact O-N 3.32Å; L502-R505 WeakPolarHBondContact O-CB 3.47Å; L502-R505 PolarHBondContact O-N 2.94Å; L502-R505 VanDerWaalsContact O-N 3.12Å; L502-I506 HydrophobicContact CD1-CD1 4.24Å; L502-I506 HydrophobicContact CD1-CG1 4.31Å; L502-I506 HydrophobicContact CG-CD1 3.93Å; L502-I506 HydrophobicContact CG-CG1 4.42Å; L502-I506 WeakPolarHBondContact O-CG1 3.22Å; L502-I506 PolarHBondContact O-N 3.4Å
503	A	97.6	Very high	96.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.2	-43.1	178.1	0	0	0	0	0	112.3	I491 A494 R495 S499 I500 G507	I491-A503 HydrophobicContact CG2-CB 4.31Å; A494-A503 HydrophobicContact CB-CB 3.94Å; R495-A503 HydrophobicContact CB-CB 4Å; S499-A503 PolarHBondContact O-N 3.27Å; I500-A503 PolarHBondContact O-N 2.88Å; A503-G507 PolarHBondContact O-N 3.38Å
504	L	98	Very high	96.4	Very high	14 Å²	14	62.9 Å²	62.9	7%	0.073	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-42.9	174.3	-71.6	172.5	0	0	0	111.7	I500 L502 G507 F508 I524 C527 Y528 W531	I500-L504 HydrophobicContact CG2-CD1 4.23Å; I500-L504 HydrophobicContact CG2-CG 4.35Å; I500-L504 WeakPolarHBondContact O-CG 3.33Å; I500-L504 PolarHBondContact O-N 2.82Å; L502-L504 VanDerWaalsContact C-N 3.32Å; L502-L504 PolarHBondContact O-N 3.32Å; L504-G507 PolarHBondContact O-N 3.48Å; L504-G507 VanDerWaalsContact O-N 3.16Å; L504-F508 HydrophobicContact CB-CE2 4.44Å; L504-F508 WeakPolarHBondContact O-CD2 3.26Å; L504-F508 PolarHBondContact O-N 3.26Å; L504-I524 HydrophobicContact CD2-CG2 3.88Å; L504-C527 HydrophobicContact CD2-CB 3.67Å; L504-C527 HydrophobicContact CG-CB 4.04Å; L504-Y528 HydrophobicContact CD1-CD1 4.13Å; L504-Y528 HydrophobicContact CD1-CE1 3.79Å; L504-Y528 HydrophobicContact CD2-CD1 4.22Å; L504-Y528 HydrophobicContact CD2-CD2 3.9Å; L504-Y528 HydrophobicContact CD2-CE1 4.05Å; L504-Y528 HydrophobicContact CD2-CE2 3.71Å; L504-Y528 HydrophobicContact CD2-CG 4.15Å; L504-W531 HydrophobicContact CD1-CE3 3.91Å; L504-W531 HydrophobicContact CD1-CZ3 4.14Å
505	R	97.8	Very high	96.4	Very high	166 Å²	166	67 Å²	67	63%	0.626	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-46.8	176.8	-171.2	176.7	-177.2	-178.5	-0.2	111.8	K501 L502 G507 F508 L509	K501-R505 PolarHBondContact O-N 2.8Å; K501-R505 VanDerWaalsContact O-N 3.07Å; L502-R505 WeakPolarHBondContact O-CB 3.47Å; L502-R505 PolarHBondContact O-N 2.94Å; L502-R505 VanDerWaalsContact O-N 3.12Å; R505-G507 VanDerWaalsContact C-N 3.3Å; R505-G507 PolarHBondContact O-N 3.36Å; R505-F508 PolarHBondContact O-N 3.29Å; R505-L509 WeakPolarHBondContact O-CG 3.35Å; R505-L509 PolarHBondContact O-N 2.9Å
506	I	97.7	Very high	96.3	Very high	25 Å²	25	67.4 Å²	67.4	13%	0.128	36%	0.358	C	S	.	.	H	α-helix	trans	-59.8	-43.8	174.3	-65	169.6	0	0	0	109.8	W487 L490 I491 A494 L502 F508 L509 A510	W487-I506 HydrophobicContact CE3-CG2 3.85Å; W487-I506 HydrophobicContact CZ3-CG2 3.94Å; L490-I506 HydrophobicContact CB-CG2 3.94Å; I491-I506 HydrophobicContact CG1-CB 4.25Å; I491-I506 HydrophobicContact CG1-CG2 3.7Å; A494-I506 HydrophobicContact CB-CD1 3.84Å; L502-I506 HydrophobicContact CD1-CD1 4.24Å; L502-I506 HydrophobicContact CD1-CG1 4.31Å; L502-I506 HydrophobicContact CG-CD1 3.93Å; L502-I506 HydrophobicContact CG-CG1 4.42Å; L502-I506 WeakPolarHBondContact O-CG1 3.22Å; L502-I506 PolarHBondContact O-N 3.4Å; I506-F508 PolarHBondContact O-N 3.12Å; I506-L509 PolarHBondContact O-N 3.32Å; I506-A510 WeakPolarHBondContact O-CB 3.11Å; I506-A510 PolarHBondContact O-N 2.86Å
507	G	98	Very high	96.5	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-43.8	177.8	0	0	0	0	0	113.5	A503 L504 R505 A510 L511	A503-G507 PolarHBondContact O-N 3.38Å; L504-G507 PolarHBondContact O-N 3.48Å; L504-G507 VanDerWaalsContact O-N 3.16Å; R505-G507 VanDerWaalsContact C-N 3.3Å; R505-G507 PolarHBondContact O-N 3.36Å; G507-A510 WeakPolarHBondContact O-CB 3.29Å; G507-A510 PolarHBondContact O-N 3.49Å; G507-L511 WeakPolarHBondContact O-CG 3.38Å; G507-L511 PolarHBondContact O-N 2.94Å
508	F	97.7	Very high	96.7	Very high	93 Å²	93	54.4 Å²	54.4	41%	0.408	30%	0.304	S	S	.	.	H	α-helix	trans	-70.9	-33.4	177	-73.6	-62.5	0	0	0	113.1	L504 R505 I506 L511 S512 Y528	L504-F508 HydrophobicContact CB-CE2 4.44Å; L504-F508 WeakPolarHBondContact O-CD2 3.26Å; L504-F508 PolarHBondContact O-N 3.26Å; R505-F508 PolarHBondContact O-N 3.29Å; I506-F508 PolarHBondContact O-N 3.12Å; F508-L511 HydrophobicContact CD1-CD1 4.32Å; F508-L511 PolarHBondContact O-N 3.06Å; F508-S512 PolarHBondContact O-N 3.49Å; F508-Y528 HydrophobicContact CE2-CE2 4.48Å; F508-Y528 VanDerWaalsContact CE2-OH 3.32Å; F508-Y528 WeakPolarHBondContact CE2-OH 3.34Å; F508-Y528 HydrophobicContact CZ-CE2 4.11Å; F508-Y528 VanDerWaalsContact CZ-OH 3.25Å; F508-Y528 WeakPolarHBondContact CZ-OH 3.17Å
509	L	97.9	Very high	97.1	Very high	92 Å²	92	55.4 Å²	55.4	48%	0.482	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-44.3	169	-69.9	171.8	0	0	0	110.9	W487 R505 I506 L511 S512	W487-L509 HydrophobicContact CH2-CB 3.99Å; W487-L509 HydrophobicContact CZ3-CB 4.11Å; R505-L509 WeakPolarHBondContact O-CG 3.35Å; R505-L509 PolarHBondContact O-N 2.9Å; I506-L509 PolarHBondContact O-N 3.32Å; L509-L511 VanDerWaalsContact C-N 3.35Å; L509-L511 PolarHBondContact O-N 3.48Å; L509-S512 WeakPolarHBondContact O-CB 3.48Å; L509-S512 PolarHBondContact O-N 3.38Å; L509-S512 VanDerWaalsContact O-N 3.13Å; L509-S512 PolarHBondContact O-OG 2.84Å
510	A	97.9	Very high	97.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-42.8	176.4	0	0	0	0	0	111.9	W487 I506 G507 S512 V513 L514 I520	W487-A510 HydrophobicContact CB-CB 3.83Å; W487-A510 HydrophobicContact CD2-CB 3.51Å; W487-A510 HydrophobicContact CE3-CB 3.59Å; W487-A510 HydrophobicContact CG-CB 3.65Å; W487-A510 HydrophobicContact CZ3-CB 4.3Å; I506-A510 WeakPolarHBondContact O-CB 3.11Å; I506-A510 PolarHBondContact O-N 2.86Å; G507-A510 WeakPolarHBondContact O-CB 3.29Å; G507-A510 PolarHBondContact O-N 3.49Å; A510-S512 VanDerWaalsContact C-N 3.27Å; A510-S512 PolarHBondContact O-N 2.87Å; A510-V513 PolarHBondContact O-N 3.44Å; A510-L514 WeakPolarHBondContact O-CB 3.29Å; A510-L514 PolarHBondContact O-N 3.43Å; A510-I520 HydrophobicContact CB-CD1 3.85Å; A510-I520 HydrophobicContact CB-CG1 4.38Å; A510-I520 HydrophobicContact CB-CG2 3.94Å
511	L	97.8	Very high	97.4	Very high	23 Å²	23	53 Å²	53	12%	0.12	28%	0.275	C	S	.	.	H	α-helix	trans	-67.2	-23.7	176.1	-72.1	-178.5	0	0	0	113.6	G507 F508 L509 V513 L514 P515 I520 I524	G507-L511 WeakPolarHBondContact O-CG 3.38Å; G507-L511 PolarHBondContact O-N 2.94Å; F508-L511 HydrophobicContact CD1-CD1 4.32Å; F508-L511 PolarHBondContact O-N 3.06Å; L509-L511 VanDerWaalsContact C-N 3.35Å; L509-L511 PolarHBondContact O-N 3.48Å; L511-V513 PolarHBondContact O-N 3.45Å; L511-L514 WeakPolarHBondContact CD2-O 3.38Å; L511-L514 CarbonylContact O-C 3.44Å; L511-P515 WeakPolarHBondContact O-CA 3.37Å; L511-P515 WeakPolarHBondContact O-CB 3.27Å; L511-I520 HydrophobicContact CD2-CB 4.32Å; L511-I520 HydrophobicContact CD2-CG2 3.62Å; L511-I520 HydrophobicContact CG-CG2 3.8Å; L511-I524 HydrophobicContact CD1-CD1 3.42Å; L511-I524 VanDerWaalsContact CD1-CD1 3.42Å; L511-I524 HydrophobicContact CG-CD1 3.78Å
512	S	97.6	Very high	97.5	Very high	93 Å²	93	46.7 Å²	46.7	65%	0.65	25%	0.248	S	C	*	.	H	α-helix	trans	-65.5	-27	174	76.6	0	0	0	0	112.5	F508 L509 A510	F508-S512 PolarHBondContact O-N 3.49Å; L509-S512 WeakPolarHBondContact O-CB 3.48Å; L509-S512 PolarHBondContact O-N 3.38Å; L509-S512 VanDerWaalsContact O-N 3.13Å; L509-S512 PolarHBondContact O-OG 2.84Å; A510-S512 VanDerWaalsContact C-N 3.27Å; A510-S512 PolarHBondContact O-N 2.87Å
513	V	97.4	Very high	97.6	Very high	32 Å²	32	43.4 Å²	43.4	19%	0.194	23%	0.231	C	C	.	.	H	α-helix	trans	-100.7	-32.2	178	-173.6	0	0	0	0	112	Q481 A510 L511	Q481-V513 HydrophobicContact CB-CG1 4.11Å; Q481-V513 WeakPolarHBondContact O-CG1 3.26Å; A510-V513 PolarHBondContact O-N 3.44Å; L511-V513 PolarHBondContact O-N 3.45Å
514	L	97.4	Very high	97.6	Very high	26 Å²	26	43.4 Å²	43.4	14%	0.136	23%	0.231	C	C	.	.	S	Bend	trans	-129.4	67.4	-174.9	-65	169.9	0	0	0	111.1	H482 A484 A510 L511 A516 H517 I520	H482-L514 HydrophobicContact CB-CD2 4.31Å; A484-L514 HydrophobicContact CB-CD1 3.66Å; A510-L514 WeakPolarHBondContact O-CB 3.29Å; A510-L514 PolarHBondContact O-N 3.43Å; L511-L514 WeakPolarHBondContact CD2-O 3.38Å; L511-L514 CarbonylContact O-C 3.44Å; L514-A516 VanDerWaalsContact C-N 3.29Å; L514-A516 PolarHBondContact O-N 3.42Å; L514-H517 HydrophobicContact CB-CB 3.99Å; L514-H517 PolarHBondContact O-N 3.25Å; L514-I520 HydrophobicContact CB-CD1 3.91Å; L514-I520 HydrophobicContact CD1-CD1 3.7Å; L514-I520 HydrophobicContact CG-CD1 4.48Å
515	P	96.6	Very high	97.5	Very high	94 Å²	94	42.7 Å²	42.7	61%	0.61	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-22.1	-164.6	24.5	-35.5	0	0	0	115.5	L511 H521	L511-P515 WeakPolarHBondContact O-CA 3.37Å; L511-P515 WeakPolarHBondContact O-CB 3.27Å; P515-H521 PolarHBondContact O-NE2 3.42Å
516	A	94.5	Very high	97.4	Very high	68 Å²	68	36.7 Å²	36.7	56%	0.562	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.8	13.7	-177.5	0	0	0	0	0	113.2	L514 D518 S547	L514-A516 VanDerWaalsContact C-N 3.29Å; L514-A516 PolarHBondContact O-N 3.42Å; A516-D518 PolarHBondContact O-N 3.37Å; A516-S547 WeakPolarHBondContact O-CB 3.43Å; A516-S547 PolarHBondContact O-OG 3.36Å
517	H	97.6	Very high	97.4	Very high	42 Å²	42	35.6 Å²	35.6	19%	0.194	20%	0.202	C	C	.	.			trans	-77.2	121.5	-172	-167.9	-59.3	0	0	0	112.6	A484 L514 K519 I520 H521	A484-H517 WeakPolarHBondContact CB-CD2 3.43Å; A484-H517 WeakPolarHBondContact CB-NE2 3.38Å; L514-H517 HydrophobicContact CB-CB 3.99Å; L514-H517 PolarHBondContact O-N 3.25Å; H517-K519 PolarHBondContact ND1-N 3.49Å; H517-K519 PolarHBondContact O-N 3.01Å; H517-I520 HydrophobicContact CB-CB 4.34Å; H517-I520 HydrophobicContact CB-CD1 3.92Å; H517-I520 HydrophobicContact CB-CG1 4.33Å; H517-I520 PolarHBondContact O-N 2.87Å; H517-H521 PolarHBondContact O-CD2 3.46Å; H517-H521 VanDerWaalsContact O-CD2 3.26Å; H517-H521 PolarHBondContact O-N 3.14Å; H517-H521 VanDerWaalsContact O-N 3.1Å
518	D	97.4	Very high	97.3	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-59	-49.5	-172.7	68.9	-28	0	0	0	114.3	A516 I520 H521 F522 A544 S547 N548 Y554	A516-D518 PolarHBondContact O-N 3.37Å; D518-I520 VanDerWaalsContact C-N 3.34Å; D518-I520 PolarHBondContact O-N 2.98Å; D518-H521 PolarHBondContact O-N 2.85Å; D518-F522 WeakPolarHBondContact O-CB 3.25Å; D518-F522 PolarHBondContact O-N 3.21Å; D518-A544 WeakPolarHBondContact O-CB 3.38Å; D518-S547 PolarHBondContact N-OG 3.4Å; D518-N548 HydrophobicContact CB-CB 3.84Å; D518-N548 VanDerWaalsContact OD2-CB 3.3Å; D518-N548 WeakPolarHBondContact OD2-CB 3.39Å; D518-N548 PolarHBondContact OD2-ND2 2.97Å; D518-N548 VanDerWaalsContact OD2-ND2 3.08Å; D518-Y554 HydrophobicContact CB-CE2 3.78Å; D518-Y554 VanDerWaalsContact CG-OH 3.26Å; D518-Y554 WeakPolarHBondContact OD2-CE2 3.31Å; D518-Y554 PolarHBondContact OD2-OH 3.46Å
519	K	97.8	Very high	97	Very high	80 Å²	80	33.1 Å²	33.1	35%	0.348	20%	0.196	S	C	.	.	H	α-helix	trans	-63	-36.8	-179.9	-63.4	177.4	-169.3	164.8	0	112.9	E485 T488 H517 F522 A523	E485-K519 IonicContact OE1-NZ 2.94Å; E485-K519 PolarHBondContact OE1-NZ 3.28Å; T488-K519 HydrophobicContact CG2-CB 4.15Å; H517-K519 PolarHBondContact ND1-N 3.49Å; H517-K519 PolarHBondContact O-N 3.01Å; K519-F522 PolarHBondContact O-N 3.32Å; K519-A523 WeakPolarHBondContact O-CB 3.44Å; K519-A523 PolarHBondContact O-N 3.42Å
520	I	98.2	Very high	96.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-48.3	177.9	-67.6	169	0	0	0	109.5	W487 I491 A510 L511 L514 H517 D518 F522 A523 I524	W487-I520 HydrophobicContact CB-CD1 4.17Å; I491-I520 HydrophobicContact CD1-CG2 4.08Å; A510-I520 HydrophobicContact CB-CD1 3.85Å; A510-I520 HydrophobicContact CB-CG1 4.38Å; A510-I520 HydrophobicContact CB-CG2 3.94Å; L511-I520 HydrophobicContact CD2-CB 4.32Å; L511-I520 HydrophobicContact CD2-CG2 3.62Å; L511-I520 HydrophobicContact CG-CG2 3.8Å; L514-I520 HydrophobicContact CB-CD1 3.91Å; L514-I520 HydrophobicContact CD1-CD1 3.7Å; L514-I520 HydrophobicContact CG-CD1 4.48Å; H517-I520 HydrophobicContact CB-CB 4.34Å; H517-I520 HydrophobicContact CB-CD1 3.92Å; H517-I520 HydrophobicContact CB-CG1 4.33Å; H517-I520 PolarHBondContact O-N 2.87Å; D518-I520 VanDerWaalsContact C-N 3.34Å; D518-I520 PolarHBondContact O-N 2.98Å; I520-F522 VanDerWaalsContact C-N 3.29Å; I520-F522 PolarHBondContact O-N 2.98Å; I520-A523 PolarHBondContact O-N 3.46Å; I520-A523 VanDerWaalsContact O-N 3.17Å; I520-I524 HydrophobicContact CG2-CD1 3.89Å; I520-I524 WeakPolarHBondContact O-CG1 3.48Å; I520-I524 PolarHBondContact O-N 2.9Å
521	H	98.3	Very high	96.4	Very high	21 Å²	21	40.1 Å²	40.1	10%	0.097	22%	0.224	C	C	.	.	H	α-helix	trans	-56.7	-43.9	172.4	-80.7	-72.1	0	0	0	111.8	P515 H517 D518 A523 I524 A525 H540 A543 A544	P515-H521 PolarHBondContact O-NE2 3.42Å; H517-H521 PolarHBondContact O-CD2 3.46Å; H517-H521 VanDerWaalsContact O-CD2 3.26Å; H517-H521 PolarHBondContact O-N 3.14Å; H517-H521 VanDerWaalsContact O-N 3.1Å; D518-H521 PolarHBondContact O-N 2.85Å; H521-A523 PolarHBondContact O-N 3.39Å; H521-I524 PolarHBondContact O-N 3.4Å; H521-A525 WeakPolarHBondContact O-CB 3.38Å; H521-A525 PolarHBondContact O-N 3.06Å; H521-H540 AromaticContact CE1-ND1 3.99Å; H521-H540 AromaticContact ND1-CE1 3.91Å; H521-H540 AromaticContact ND1-ND1 3.14Å; H521-H540 PolarHBondContact ND1-ND1 3.41Å; H521-H540 VanDerWaalsContact ND1-ND1 3.14Å; H521-A543 HydrophobicContact CB-CB 4.35Å; H521-A543 WeakPolarHBondContact ND1-CB 3.26Å; H521-A544 HydrophobicContact CB-CB 3.91Å
522	F	98.1	Very high	96	Very high	21 Å²	21	40.8 Å²	40.8	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-40.7	177.1	-176.1	-100.5	0	0	0	112.5	D518 K519 I520 A525 N526 F541 A544 K553 Y554 S557	D518-F522 WeakPolarHBondContact O-CB 3.25Å; D518-F522 PolarHBondContact O-N 3.21Å; K519-F522 PolarHBondContact O-N 3.32Å; I520-F522 VanDerWaalsContact C-N 3.29Å; I520-F522 PolarHBondContact O-N 2.98Å; F522-A525 PolarHBondContact O-N 2.93Å; F522-N526 WeakPolarHBondContact CD1-ND2 3.19Å; F522-N526 WeakPolarHBondContact CE1-ND2 3.47Å; F522-N526 WeakPolarHBondContact CZ-ND2 3.24Å; F522-N526 PolarHBondContact O-N 3.46Å; F522-N526 VanDerWaalsContact O-N 3.16Å; F522-N526 PolarHBondContact O-ND2 2.97Å; F522-F541 AromaticContact CD2-CD1 3.89Å; F522-F541 HydrophobicContact CD2-CD1 3.89Å; F522-F541 AromaticContact CD2-CE1 3.61Å; F522-F541 HydrophobicContact CD2-CE1 3.61Å; F522-F541 HydrophobicContact CE2-CD1 4.11Å; F522-F541 AromaticContact CE2-CE1 3.51Å; F522-F541 HydrophobicContact CE2-CE1 3.51Å; F522-F541 HydrophobicContact CZ-CE1 4.44Å; F522-A544 HydrophobicContact CB-CB 4.24Å; F522-K553 HydrophobicContact CE1-CD 4.23Å; F522-K553 HydrophobicContact CE2-CG 4.4Å; F522-K553 HydrophobicContact CZ-CD 4.01Å; F522-K553 HydrophobicContact CZ-CG 3.97Å; F522-Y554 HydrophobicContact CB-CD1 4.17Å; F522-Y554 HydrophobicContact CB-CE1 3.79Å; F522-Y554 HydrophobicContact CD1-CE1 4.17Å; F522-Y554 AromaticContact CD2-CD1 3.2Å; F522-Y554 HydrophobicContact CD2-CD1 3.2Å; F522-Y554 AromaticContact CD2-CE1 3.61Å; F522-Y554 HydrophobicContact CD2-CE1 3.61Å; F522-Y554 HydrophobicContact CD2-CG 4.15Å; F522-Y554 AromaticContact CE2-CD1 3.62Å; F522-Y554 HydrophobicContact CE2-CD1 3.62Å; F522-Y554 HydrophobicContact CE2-CE1 4.21Å; F522-Y554 AromaticContact CG-CD1 3.72Å; F522-Y554 HydrophobicContact CG-CD1 3.72Å; F522-Y554 AromaticContact CG-CE1 3.57Å; F522-Y554 HydrophobicContact CG-CE1 3.57Å; F522-Y554 HydrophobicContact CZ-CD1 4.45Å; F522-S557 WeakPolarHBondContact CE2-OG 3.23Å
523	A	97.7	Very high	95.7	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.033	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-44.8	176.4	0	0	0	0	0	111.7	I491 K519 I520 H521 N526 C527	I491-A523 HydrophobicContact CB-CB 4.15Å; I491-A523 HydrophobicContact CD1-CB 4.18Å; I491-A523 HydrophobicContact CG2-CB 3.69Å; K519-A523 WeakPolarHBondContact O-CB 3.44Å; K519-A523 PolarHBondContact O-N 3.42Å; I520-A523 PolarHBondContact O-N 3.46Å; I520-A523 VanDerWaalsContact O-N 3.17Å; H521-A523 PolarHBondContact O-N 3.39Å; A523-N526 PolarHBondContact O-N 3.35Å; A523-C527 PolarHBondContact O-N 2.76Å; A523-C527 VanDerWaalsContact O-N 3.11Å; A523-C527 PolarHBondContact O-SG 3.46Å
524	I	98.1	Very high	95.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-41.9	175.9	-65.4	165.4	0	0	0	111.4	L504 L511 I520 H521 N526 C527 Y528 H540	L504-I524 HydrophobicContact CD2-CG2 3.88Å; L511-I524 HydrophobicContact CD1-CD1 3.42Å; L511-I524 VanDerWaalsContact CD1-CD1 3.42Å; L511-I524 HydrophobicContact CG-CD1 3.78Å; I520-I524 HydrophobicContact CG2-CD1 3.89Å; I520-I524 WeakPolarHBondContact O-CG1 3.48Å; I520-I524 PolarHBondContact O-N 2.9Å; H521-I524 PolarHBondContact O-N 3.4Å; I524-N526 VanDerWaalsContact C-N 3.29Å; I524-N526 PolarHBondContact O-N 2.95Å; I524-C527 WeakPolarHBondContact O-CB 3.4Å; I524-C527 PolarHBondContact O-N 3.07Å; I524-Y528 HydrophobicContact CG2-CD2 3.7Å; I524-Y528 HydrophobicContact CG2-CE2 3.6Å; I524-Y528 PolarHBondContact O-N 3.4Å; I524-H540 HydrophobicContact CG2-CB 4.44Å
525	A	97.1	Very high	95.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-43.1	178.2	0	0	0	0	0	111.6	H521 F522 Y528 G529 S537 H540 F541	H521-A525 WeakPolarHBondContact O-CB 3.38Å; H521-A525 PolarHBondContact O-N 3.06Å; F522-A525 PolarHBondContact O-N 2.93Å; A525-Y528 PolarHBondContact O-N 2.68Å; A525-G529 PolarHBondContact O-N 3.31Å; A525-S537 WeakPolarHBondContact O-CB 3.24Å; A525-S537 PolarHBondContact O-OG 2.57Å; A525-H540 HydrophobicContact CB-CB 3.68Å; A525-F541 HydrophobicContact CB-CB 4.4Å; A525-F541 HydrophobicContact CB-CD1 3.61Å; A525-F541 HydrophobicContact CB-CD2 3.75Å; A525-F541 HydrophobicContact CB-CE1 3.64Å; A525-F541 HydrophobicContact CB-CE2 3.81Å; A525-F541 HydrophobicContact CB-CG 3.64Å; A525-F541 HydrophobicContact CB-CZ 3.75Å
526	N	95.8	Very high	95	Very high	40 Å²	40	44.3 Å²	44.3	21%	0.214	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-36.4	174.8	-68.6	-51.1	0	0	0	112.2	F522 A523 I524 G529 L530	F522-N526 WeakPolarHBondContact CD1-ND2 3.19Å; F522-N526 WeakPolarHBondContact CE1-ND2 3.47Å; F522-N526 WeakPolarHBondContact CZ-ND2 3.24Å; F522-N526 PolarHBondContact O-N 3.46Å; F522-N526 VanDerWaalsContact O-N 3.16Å; F522-N526 PolarHBondContact O-ND2 2.97Å; A523-N526 PolarHBondContact O-N 3.35Å; I524-N526 VanDerWaalsContact C-N 3.29Å; I524-N526 PolarHBondContact O-N 2.95Å; N526-G529 PolarHBondContact O-N 3.35Å; N526-L530 WeakPolarHBondContact O-CG 3.35Å; N526-L530 PolarHBondContact O-N 3.18Å
527	C	96.6	Very high	95.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-62.8	-46.7	175.5	-63.8	0	0	0	0	111.4	I500 L504 A523 I524 G529 L530 W531	I500-C527 HydrophobicContact CG2-CB 3.91Å; I500-C527 WeakPolarHBondContact CG2-O 3.27Å; L504-C527 HydrophobicContact CD2-CB 3.67Å; L504-C527 HydrophobicContact CG-CB 4.04Å; A523-C527 PolarHBondContact O-N 2.76Å; A523-C527 VanDerWaalsContact O-N 3.11Å; A523-C527 PolarHBondContact O-SG 3.46Å; I524-C527 WeakPolarHBondContact O-CB 3.4Å; I524-C527 PolarHBondContact O-N 3.07Å; C527-G529 VanDerWaalsContact C-N 3.33Å; C527-G529 PolarHBondContact O-N 3.1Å; C527-L530 PolarHBondContact O-N 2.94Å; C527-W531 PolarHBondContact O-N 3.48Å
528	Y	96	Very high	95	Very high	21 Å²	21	44.9 Å²	44.9	8%	0.082	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-35.8	175.1	-80.8	-57.2	0	0	0	113.3	L504 F508 I524 A525 L530 W531 G532 D533 R536 H540	L504-Y528 HydrophobicContact CD1-CD1 4.13Å; L504-Y528 HydrophobicContact CD1-CE1 3.79Å; L504-Y528 HydrophobicContact CD2-CD1 4.22Å; L504-Y528 HydrophobicContact CD2-CD2 3.9Å; L504-Y528 HydrophobicContact CD2-CE1 4.05Å; L504-Y528 HydrophobicContact CD2-CE2 3.71Å; L504-Y528 HydrophobicContact CD2-CG 4.15Å; F508-Y528 HydrophobicContact CE2-CE2 4.48Å; F508-Y528 VanDerWaalsContact CE2-OH 3.32Å; F508-Y528 WeakPolarHBondContact CE2-OH 3.34Å; F508-Y528 HydrophobicContact CZ-CE2 4.11Å; F508-Y528 VanDerWaalsContact CZ-OH 3.25Å; F508-Y528 WeakPolarHBondContact CZ-OH 3.17Å; I524-Y528 HydrophobicContact CG2-CD2 3.7Å; I524-Y528 HydrophobicContact CG2-CE2 3.6Å; I524-Y528 PolarHBondContact O-N 3.4Å; A525-Y528 PolarHBondContact O-N 2.68Å; Y528-L530 VanDerWaalsContact C-N 3.33Å; Y528-L530 PolarHBondContact O-N 3.44Å; Y528-W531 WeakPolarHBondContact O-CB 3.41Å; Y528-W531 PolarHBondContact O-N 3.07Å; Y528-G532 PolarHBondContact O-N 3.22Å; Y528-G532 VanDerWaalsContact O-N 3.09Å; Y528-D533 HydrophobicContact CD1-CB 3.92Å; Y528-D533 PolarHBondContact O-N 2.95Å; Y528-R536 HydrophobicContact CD1-CB 3.89Å; Y528-R536 HydrophobicContact CD2-CB 3.79Å; Y528-R536 HydrophobicContact CE1-CB 3.99Å; Y528-R536 HydrophobicContact CE1-CG 4.42Å; Y528-R536 HydrophobicContact CE2-CB 3.89Å; Y528-R536 HydrophobicContact CG-CB 3.79Å; Y528-H540 AromaticContact CD2-CD2 3.96Å; Y528-H540 AromaticContact CE2-CD2 3.84Å; Y528-H540 AromaticContact CE2-NE2 3.82Å
529	G	91.4	Very high	94.9	Very high	20 Å²	20	48.5 Å²	48.5	21%	0.206	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-41.7	175	0	0	0	0	0	112.1	A525 N526 C527 G532	A525-G529 PolarHBondContact O-N 3.31Å; N526-G529 PolarHBondContact O-N 3.35Å; C527-G529 VanDerWaalsContact C-N 3.33Å; C527-G529 PolarHBondContact O-N 3.1Å; G529-G532 PolarHBondContact O-N 2.92Å
530	L	91.2	Very high	94.9	Very high	115 Å²	115	45.7 Å²	45.7	60%	0.602	22%	0.218	S	C	*	.	H	α-helix	trans	-71.4	-28.5	174.1	-69	174.2	0	0	0	113.2	R495 I500 N526 C527 Y528 G532	R495-L530 HydrophobicContact CG-CD1 3.88Å; I500-L530 HydrophobicContact CD1-CB 3.88Å; N526-L530 WeakPolarHBondContact O-CG 3.35Å; N526-L530 PolarHBondContact O-N 3.18Å; C527-L530 PolarHBondContact O-N 2.94Å; Y528-L530 VanDerWaalsContact C-N 3.33Å; Y528-L530 PolarHBondContact O-N 3.44Å; L530-G532 VanDerWaalsContact C-N 3.26Å; L530-G532 PolarHBondContact O-N 3.46Å
531	W	91.9	Very high	94.9	Very high	124 Å²	124	45.9 Å²	45.9	47%	0.47	22%	0.219	S	C	.	.	H	α-helix	trans	-70.5	-22.5	173.6	-166.2	-69.9	0	0	0	112.5	I500 K501 L504 C527 Y528	I500-W531 HydrophobicContact CB-CE3 3.77Å; I500-W531 HydrophobicContact CB-CZ3 4.19Å; I500-W531 HydrophobicContact CG2-CB 4.39Å; I500-W531 HydrophobicContact CG2-CE3 3.58Å; I500-W531 HydrophobicContact CG2-CZ3 4.32Å; K501-W531 HydrophobicContact CB-CZ3 4.23Å; K501-W531 HydrophobicContact CD-CH2 4.01Å; K501-W531 HydrophobicContact CD-CZ3 4.48Å; K501-W531 VanDerWaalsContact CE-CH2 3.48Å; K501-W531 HydrophobicContact CG-CH2 3.29Å; K501-W531 HydrophobicContact CG-CZ3 3.35Å; L504-W531 HydrophobicContact CD1-CE3 3.91Å; L504-W531 HydrophobicContact CD1-CZ3 4.14Å; C527-W531 PolarHBondContact O-N 3.48Å; Y528-W531 WeakPolarHBondContact O-CB 3.41Å; Y528-W531 PolarHBondContact O-N 3.07Å
532	G	89.4	Confident	94.8	Very high	37 Å²	37	47 Å²	47	38%	0.381	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	5.9	-171.5	0	0	0	0	0	114.2	Y528 G529 L530 Y534	Y528-G532 PolarHBondContact O-N 3.22Å; Y528-G532 VanDerWaalsContact O-N 3.09Å; G529-G532 PolarHBondContact O-N 2.92Å; L530-G532 VanDerWaalsContact C-N 3.26Å; L530-G532 PolarHBondContact O-N 3.46Å; G532-Y534 VanDerWaalsContact C-N 3.34Å; G532-Y534 WeakPolarHBondContact O-CD2 3.41Å; G532-Y534 WeakPolarHBondContact O-CE2 3.22Å; G532-Y534 PolarHBondContact O-N 2.73Å; G532-Y534 VanDerWaalsContact O-N 3.13Å
533	D	91.6	Very high	94.8	Very high	32 Å²	32	47.1 Å²	47.1	17%	0.171	23%	0.232	C	C	.	.			trans	-87.5	76.2	172.5	-169.2	-22.8	0	0	0	110.3	Y528 H535 R536 S537	Y528-D533 HydrophobicContact CD1-CB 3.92Å; Y528-D533 PolarHBondContact O-N 2.95Å; D533-H535 PolarHBondContact O-N 3.35Å; D533-H535 PolarHBondContact OD1-N 2.97Å; D533-R536 HydrophobicContact CB-CB 4.49Å; D533-R536 PolarHBondContact O-N 3.49Å; D533-R536 PolarHBondContact OD1-N 2.93Å; D533-R536 WeakPolarHBondContact OD2-CD 3.33Å; D533-R536 VanDerWaalsContact OD2-CG 3.24Å; D533-R536 WeakPolarHBondContact OD2-CG 3.5Å; D533-R536 IonicContact OD2-CZ 3.47Å; D533-R536 IonicContact OD2-NE 3.57Å; D533-R536 IonicContact OD2-NH1 2.72Å; D533-R536 PolarHBondContact OD2-NH1 2.88Å; D533-S537 VanDerWaalsContact O-CB 3.27Å; D533-S537 WeakPolarHBondContact O-CB 3.17Å; D533-S537 PolarHBondContact O-N 2.79Å
534	Y	90.7	Very high	94.8	Very high	34 Å²	34	46.9 Å²	46.9	13%	0.133	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-28.2	-179.2	-60.9	-82.3	0	0	0	112.9	G532 R538 L561 W565 E568	G532-Y534 VanDerWaalsContact C-N 3.34Å; G532-Y534 WeakPolarHBondContact O-CD2 3.41Å; G532-Y534 WeakPolarHBondContact O-CE2 3.22Å; G532-Y534 PolarHBondContact O-N 2.73Å; G532-Y534 VanDerWaalsContact O-N 3.13Å; Y534-R538 WeakPolarHBondContact O-CB 3.48Å; Y534-R538 PolarHBondContact O-N 3.45Å; Y534-L561 HydrophobicContact CD1-CD1 3.51Å; Y534-L561 HydrophobicContact CD1-CG 4.06Å; Y534-L561 HydrophobicContact CE1-CD1 4.02Å; Y534-W565 HydrophobicContact CD1-CB 4.13Å; Y534-W565 AromaticContact CD2-CD1 3.9Å; Y534-W565 HydrophobicContact CG-CB 4.18Å; Y534-W565 AromaticContact CG-CD1 3.79Å; Y534-W565 HydrophobicContact CG-CG 4.15Å; Y534-E568 WeakPolarHBondContact CE2-OE2 3.2Å; Y534-E568 VanDerWaalsContact CZ-OE2 3.29Å; Y534-E568 PolarHBondContact OH-OE1 3.43Å; Y534-E568 PolarHBondContact OH-OE2 3.2Å
535	H	91.8	Very high	94.8	Very high	124 Å²	124	48.2 Å²	48.2	57%	0.574	24%	0.237	S	C	*	.	H	α-helix	trans	-68.6	-54.7	178.7	-179.2	-95.2	0	0	0	111.1	D533 S537 R538 I539	D533-H535 PolarHBondContact O-N 3.35Å; D533-H535 PolarHBondContact OD1-N 2.97Å; H535-S537 VanDerWaalsContact C-N 3.33Å; H535-S537 PolarHBondContact O-N 3.37Å; H535-R538 PolarHBondContact O-N 3Å; H535-I539 PolarHBondContact O-N 3.38Å
536	R	94.5	Very high	94.8	Very high	130 Å²	130	58.1 Å²	58.1	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-65.7	-36.9	176.8	-67.8	-171.6	-177.9	119.8	-9.5	111.9	Y528 D533 R538 I539 H540	Y528-R536 HydrophobicContact CD1-CB 3.89Å; Y528-R536 HydrophobicContact CD2-CB 3.79Å; Y528-R536 HydrophobicContact CE1-CB 3.99Å; Y528-R536 HydrophobicContact CE1-CG 4.42Å; Y528-R536 HydrophobicContact CE2-CB 3.89Å; Y528-R536 HydrophobicContact CG-CB 3.79Å; D533-R536 HydrophobicContact CB-CB 4.49Å; D533-R536 PolarHBondContact O-N 3.49Å; D533-R536 PolarHBondContact OD1-N 2.93Å; D533-R536 WeakPolarHBondContact OD2-CD 3.33Å; D533-R536 VanDerWaalsContact OD2-CG 3.24Å; D533-R536 WeakPolarHBondContact OD2-CG 3.5Å; D533-R536 IonicContact OD2-CZ 3.47Å; D533-R536 IonicContact OD2-NE 3.57Å; D533-R536 IonicContact OD2-NH1 2.72Å; D533-R536 PolarHBondContact OD2-NH1 2.88Å; R536-R538 VanDerWaalsContact C-N 3.33Å; R536-R538 PolarHBondContact O-N 2.96Å; R536-I539 PolarHBondContact O-N 3.34Å; R536-H540 PolarHBondContact O-CD2 2.94Å; R536-H540 PolarHBondContact O-N 3.03Å
537	S	95.5	Very high	94.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-47.4	173.8	-176.1	0	0	0	0	111.7	A525 D533 H535 I539 H540 F541 L561	A525-S537 WeakPolarHBondContact O-CB 3.24Å; A525-S537 PolarHBondContact O-OG 2.57Å; D533-S537 VanDerWaalsContact O-CB 3.27Å; D533-S537 WeakPolarHBondContact O-CB 3.17Å; D533-S537 PolarHBondContact O-N 2.79Å; H535-S537 VanDerWaalsContact C-N 3.33Å; H535-S537 PolarHBondContact O-N 3.37Å; S537-I539 PolarHBondContact O-N 3.39Å; S537-H540 PolarHBondContact O-N 2.92Å; S537-F541 VanDerWaalsContact O-CD2 3.31Å; S537-F541 WeakPolarHBondContact O-CD2 3.48Å; S537-F541 PolarHBondContact O-N 3.16Å; S537-F541 VanDerWaalsContact OG-CE2 3.32Å; S537-F541 WeakPolarHBondContact OG-CE2 3.41Å; S537-L561 WeakPolarHBondContact OG-CD2 3.29Å
538	R	95.8	Very high	94.8	Very high	122 Å²	122	61.4 Å²	61.4	46%	0.46	30%	0.296	S	S	.	.	H	α-helix	trans	-59.6	-42.6	176.8	176.1	178.4	168.9	-169.5	-4.4	112.5	Y534 H535 R536 H540 F541 V542 L558 L561	Y534-R538 WeakPolarHBondContact O-CB 3.48Å; Y534-R538 PolarHBondContact O-N 3.45Å; H535-R538 PolarHBondContact O-N 3Å; R536-R538 VanDerWaalsContact C-N 3.33Å; R536-R538 PolarHBondContact O-N 2.96Å; R538-H540 VanDerWaalsContact C-N 3.33Å; R538-H540 PolarHBondContact O-N 3.37Å; R538-F541 PolarHBondContact O-N 3.14Å; R538-V542 HydrophobicContact CG-CG2 4.43Å; R538-V542 WeakPolarHBondContact O-CG2 3.3Å; R538-V542 PolarHBondContact O-N 3.07Å; R538-L558 HydrophobicContact CG-CD1 4.09Å; R538-L561 HydrophobicContact CB-CD2 4.18Å
539	I	96.1	Very high	94.8	Very high	93 Å²	93	64.2 Å²	64.2	48%	0.477	32%	0.317	S	S	.	.	H	α-helix	trans	-57.2	-48.6	178.8	-66.1	170.3	0	0	0	110.3	H535 R536 S537 V542 A543	H535-I539 PolarHBondContact O-N 3.38Å; R536-I539 PolarHBondContact O-N 3.34Å; S537-I539 PolarHBondContact O-N 3.39Å; I539-V542 PolarHBondContact O-N 3.06Å; I539-A543 PolarHBondContact O-N 2.97Å
540	H	97.4	Very high	95	Very high	20 Å²	20	72.3 Å²	72.3	9%	0.093	35%	0.347	C	S	.	.	H	α-helix	trans	-70.6	-34.9	-179.1	-77.3	-90.8	0	0	0	113	H521 I524 A525 Y528 R536 S537 R538 A543 A544	H521-H540 AromaticContact CE1-ND1 3.99Å; H521-H540 AromaticContact ND1-CE1 3.91Å; H521-H540 AromaticContact ND1-ND1 3.14Å; H521-H540 PolarHBondContact ND1-ND1 3.41Å; H521-H540 VanDerWaalsContact ND1-ND1 3.14Å; I524-H540 HydrophobicContact CG2-CB 4.44Å; A525-H540 HydrophobicContact CB-CB 3.68Å; Y528-H540 AromaticContact CD2-CD2 3.96Å; Y528-H540 AromaticContact CE2-CD2 3.84Å; Y528-H540 AromaticContact CE2-NE2 3.82Å; R536-H540 PolarHBondContact O-CD2 2.94Å; R536-H540 PolarHBondContact O-N 3.03Å; S537-H540 PolarHBondContact O-N 2.92Å; R538-H540 VanDerWaalsContact C-N 3.33Å; R538-H540 PolarHBondContact O-N 3.37Å; H540-A543 PolarHBondContact O-N 3.39Å; H540-A544 PolarHBondContact O-N 3.45Å
541	F	97.7	Very high	95.3	Very high	5 Å²	5	68.8 Å²	68.8	2%	0.022	33%	0.33	C	S	.	.	H	α-helix	trans	-62.4	-41.9	171.3	-80.8	-53.7	0	0	0	112.4	F522 A525 S537 R538 A543 A544 I545 L558 L561	F522-F541 AromaticContact CD2-CD1 3.89Å; F522-F541 HydrophobicContact CD2-CD1 3.89Å; F522-F541 AromaticContact CD2-CE1 3.61Å; F522-F541 HydrophobicContact CD2-CE1 3.61Å; F522-F541 HydrophobicContact CE2-CD1 4.11Å; F522-F541 AromaticContact CE2-CE1 3.51Å; F522-F541 HydrophobicContact CE2-CE1 3.51Å; F522-F541 HydrophobicContact CZ-CE1 4.44Å; A525-F541 HydrophobicContact CB-CB 4.4Å; A525-F541 HydrophobicContact CB-CD1 3.61Å; A525-F541 HydrophobicContact CB-CD2 3.75Å; A525-F541 HydrophobicContact CB-CE1 3.64Å; A525-F541 HydrophobicContact CB-CE2 3.81Å; A525-F541 HydrophobicContact CB-CG 3.64Å; A525-F541 HydrophobicContact CB-CZ 3.75Å; S537-F541 VanDerWaalsContact O-CD2 3.31Å; S537-F541 WeakPolarHBondContact O-CD2 3.48Å; S537-F541 PolarHBondContact O-N 3.16Å; S537-F541 VanDerWaalsContact OG-CE2 3.32Å; S537-F541 WeakPolarHBondContact OG-CE2 3.41Å; R538-F541 PolarHBondContact O-N 3.14Å; F541-A543 VanDerWaalsContact C-N 3.34Å; F541-A544 PolarHBondContact O-N 2.88Å; F541-I545 WeakPolarHBondContact O-CG1 3.44Å; F541-I545 PolarHBondContact O-N 3.17Å; F541-L558 HydrophobicContact CB-CB 4.15Å; F541-L558 HydrophobicContact CB-CD1 3.9Å; F541-L558 HydrophobicContact CB-CG 4.42Å; F541-L558 HydrophobicContact CD2-CD1 4.3Å; F541-L558 HydrophobicContact CG-CB 4.35Å; F541-L558 HydrophobicContact CG-CD1 4.42Å; F541-L561 HydrophobicContact CD2-CD2 3.81Å; F541-L561 HydrophobicContact CE2-CB 4.27Å; F541-L561 HydrophobicContact CE2-CD1 4.42Å; F541-L561 HydrophobicContact CE2-CD2 3.93Å; F541-L561 HydrophobicContact CE2-CG 4.44Å
542	V	97.1	Very high	95.4	Very high	43 Å²	43	71.2 Å²	71.2	26%	0.261	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-41.4	175.8	171.1	0	0	0	0	110.7	R538 I539 A544 I545 R546 L558	R538-V542 HydrophobicContact CG-CG2 4.43Å; R538-V542 WeakPolarHBondContact O-CG2 3.3Å; R538-V542 PolarHBondContact O-N 3.07Å; I539-V542 PolarHBondContact O-N 3.06Å; V542-A544 PolarHBondContact O-N 3.32Å; V542-I545 PolarHBondContact O-N 3.39Å; V542-R546 HydrophobicContact CG1-CG 4.34Å; V542-R546 WeakPolarHBondContact O-CB 3.43Å; V542-R546 VanDerWaalsContact O-CG 3.31Å; V542-R546 WeakPolarHBondContact O-CG 3.11Å; V542-R546 PolarHBondContact O-N 3.14Å; V542-L558 HydrophobicContact CG2-CD2 4.24Å
543	A	97.4	Very high	95.7	Very high	24 Å²	24	75.6 Å²	75.6	20%	0.198	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-42.5	174.8	0	0	0	0	0	112.3	H521 I539 H540 F541 I545 R546 S547	H521-A543 HydrophobicContact CB-CB 4.35Å; H521-A543 WeakPolarHBondContact ND1-CB 3.26Å; I539-A543 PolarHBondContact O-N 2.97Å; H540-A543 PolarHBondContact O-N 3.39Å; F541-A543 VanDerWaalsContact C-N 3.34Å; A543-I545 PolarHBondContact O-N 3.47Å; A543-R546 PolarHBondContact O-N 2.84Å; A543-S547 WeakPolarHBondContact O-CB 3.49Å; A543-S547 PolarHBondContact O-N 3.33Å
544	A	97.8	Very high	96	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-42.5	175.2	0	0	0	0	0	112.4	D518 H521 F522 H540 F541 V542 S547 N548 Y554	D518-A544 WeakPolarHBondContact O-CB 3.38Å; H521-A544 HydrophobicContact CB-CB 3.91Å; F522-A544 HydrophobicContact CB-CB 4.24Å; H540-A544 PolarHBondContact O-N 3.45Å; F541-A544 PolarHBondContact O-N 2.88Å; V542-A544 PolarHBondContact O-N 3.32Å; A544-S547 PolarHBondContact O-N 3.27Å; A544-N548 PolarHBondContact O-N 3.5Å; A544-Y554 HydrophobicContact CB-CD2 4.09Å; A544-Y554 HydrophobicContact CB-CE2 4.33Å; A544-Y554 HydrophobicContact CB-CG 4.33Å
545	I	97.6	Very high	96.2	Very high	27 Å²	27	76.5 Å²	76.5	14%	0.138	36%	0.357	C	S	.	.	H	α-helix	trans	-65.7	-41.6	175.9	-69.4	161	0	0	0	111.3	F541 V542 A543 S547 N548 P549 H555 L558	F541-I545 WeakPolarHBondContact O-CG1 3.44Å; F541-I545 PolarHBondContact O-N 3.17Å; V542-I545 PolarHBondContact O-N 3.39Å; A543-I545 PolarHBondContact O-N 3.47Å; I545-S547 VanDerWaalsContact C-N 3.32Å; I545-S547 PolarHBondContact O-N 2.83Å; I545-N548 CarbonylContact O-C 3.6Å; I545-N548 VanDerWaalsContact O-C 3.28Å; I545-N548 PolarHBondContact O-N 3.32Å; I545-P549 WeakPolarHBondContact O-CA 3.35Å; I545-P549 WeakPolarHBondContact O-CB 3.3Å; I545-P549 WeakPolarHBondContact O-CD 3.41Å; I545-H555 VanDerWaalsContact CG2-CE1 3.47Å; I545-H555 WeakPolarHBondContact CG2-CE1 3.25Å; I545-L558 HydrophobicContact CD1-CB 4.35Å; I545-L558 HydrophobicContact CD1-CD2 3.66Å
546	R	97.3	Very high	96.4	Very high	209 Å²	209	74.7 Å²	74.7	79%	0.789	35%	0.354	S	S	*	.	H	α-helix	trans	-61.9	-41.5	176.8	-76.8	176.8	178.3	179.9	-0.8	111.4	V542 A543	V542-R546 HydrophobicContact CG1-CG 4.34Å; V542-R546 WeakPolarHBondContact O-CB 3.43Å; V542-R546 VanDerWaalsContact O-CG 3.31Å; V542-R546 WeakPolarHBondContact O-CG 3.11Å; V542-R546 PolarHBondContact O-N 3.14Å; A543-R546 PolarHBondContact O-N 2.84Å
547	S	96.3	Very high	96.4	Very high	56 Å²	56	69.7 Å²	69.7	39%	0.392	34%	0.339	S	S	.	.	H	α-helix	trans	-67.7	-43.7	177.5	178.6	0	0	0	0	112.5	A516 D518 A543 A544 I545	A516-S547 WeakPolarHBondContact O-CB 3.43Å; A516-S547 PolarHBondContact O-OG 3.36Å; D518-S547 PolarHBondContact N-OG 3.4Å; A543-S547 WeakPolarHBondContact O-CB 3.49Å; A543-S547 PolarHBondContact O-N 3.33Å; A544-S547 PolarHBondContact O-N 3.27Å; I545-S547 VanDerWaalsContact C-N 3.32Å; I545-S547 PolarHBondContact O-N 2.83Å
548	N	96.6	Very high	96.3	Very high	53 Å²	53	70.8 Å²	70.8	28%	0.283	35%	0.345	S	S	.	.			trans	-142.1	88	179.3	-171	-5.3	0	0	0	112.1	D518 A544 I545 K550 V551 Y554	D518-N548 HydrophobicContact CB-CB 3.84Å; D518-N548 VanDerWaalsContact OD2-CB 3.3Å; D518-N548 WeakPolarHBondContact OD2-CB 3.39Å; D518-N548 PolarHBondContact OD2-ND2 2.97Å; D518-N548 VanDerWaalsContact OD2-ND2 3.08Å; A544-N548 PolarHBondContact O-N 3.5Å; I545-N548 CarbonylContact O-C 3.6Å; I545-N548 VanDerWaalsContact O-C 3.28Å; I545-N548 PolarHBondContact O-N 3.32Å; N548-K550 PolarHBondContact O-N 3.33Å; N548-V551 HydrophobicContact CB-CG2 4.38Å; N548-V551 VanDerWaalsContact ND2-CG2 3.31Å; N548-V551 WeakPolarHBondContact ND2-CG2 3.37Å; N548-V551 PolarHBondContact O-N 2.96Å; N548-Y554 HydrophobicContact CB-CE2 4.28Å
549	P	95.9	Very high	96.1	Very high	81 Å²	81	71.4 Å²	71.4	53%	0.526	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-14.9	-172.9	25.5	-33.9	0	0	0	113.7	I545 V551 H555	I545-P549 WeakPolarHBondContact O-CA 3.35Å; I545-P549 WeakPolarHBondContact O-CB 3.3Å; I545-P549 WeakPolarHBondContact O-CD 3.41Å; P549-V551 VanDerWaalsContact C-N 3.33Å; P549-V551 PolarHBondContact O-N 3.47Å; P549-H555 PolarHBondContact O-NE2 3.44Å
550	K	95.8	Very high	95.8	Very high	189 Å²	189	75.2 Å²	75.2	82%	0.822	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-18.3	-176	-63.5	-176.6	-179.5	179.3	0	113.3	N548 K552	N548-K550 PolarHBondContact O-N 3.33Å; K550-K552 PolarHBondContact O-N 3.44Å; K550-K552 VanDerWaalsContact O-N 3.16Å
551	V	96.5	Very high	95.4	Very high	42 Å²	42	75 Å²	75	26%	0.255	36%	0.36	S	S	.	.			trans	-80.7	100.7	-175.7	-179	0	0	0	0	110.4	N548 P549 K553 Y554 H555	N548-V551 HydrophobicContact CB-CG2 4.38Å; N548-V551 VanDerWaalsContact ND2-CG2 3.31Å; N548-V551 WeakPolarHBondContact ND2-CG2 3.37Å; N548-V551 PolarHBondContact O-N 2.96Å; P549-V551 VanDerWaalsContact C-N 3.33Å; P549-V551 PolarHBondContact O-N 3.47Å; V551-K553 HydrophobicContact CG1-CB 3.99Å; V551-K553 PolarHBondContact O-N 3.06Å; V551-K553 VanDerWaalsContact O-N 3.12Å; V551-Y554 HydrophobicContact CB-CD1 4.39Å; V551-Y554 HydrophobicContact CB-CD2 3.59Å; V551-Y554 HydrophobicContact CB-CE1 4.36Å; V551-Y554 HydrophobicContact CB-CE2 3.52Å; V551-Y554 HydrophobicContact CB-CG 4.03Å; V551-Y554 HydrophobicContact CG1-CD1 3.8Å; V551-Y554 HydrophobicContact CG1-CD2 3.93Å; V551-Y554 HydrophobicContact CG1-CE1 3.7Å; V551-Y554 HydrophobicContact CG1-CE2 3.8Å; V551-Y554 HydrophobicContact CG1-CG 3.92Å; V551-Y554 HydrophobicContact CG2-CD2 4.32Å; V551-Y554 HydrophobicContact CG2-CE2 3.78Å; V551-Y554 PolarHBondContact O-N 3.13Å; V551-Y554 VanDerWaalsContact O-N 3.09Å; V551-H555 PolarHBondContact O-CD2 2.91Å
552	K	95.1	Very high	94.9	Very high	174 Å²	174	78.3 Å²	78.3	76%	0.757	38%	0.376	S	S	*	.	H	α-helix	trans	-53	-34.7	179.3	-67.7	-175.3	-179.9	-179.2	0	113.6	K550 Y554 H555 T556	K550-K552 PolarHBondContact O-N 3.44Å; K550-K552 VanDerWaalsContact O-N 3.16Å; K552-Y554 PolarHBondContact O-N 3.29Å; K552-H555 PolarHBondContact O-N 3.36Å; K552-T556 PolarHBondContact O-N 3.5Å; K552-T556 PolarHBondContact O-OG1 2.92Å
553	K	96.2	Very high	94.4	Very high	130 Å²	130	85 Å²	85	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-56.3	-36.2	179.5	-173	-179.9	-178.7	-179.2	0	112.5	F522 V551 T556 S557	F522-K553 HydrophobicContact CE1-CD 4.23Å; F522-K553 HydrophobicContact CE2-CG 4.4Å; F522-K553 HydrophobicContact CZ-CD 4.01Å; F522-K553 HydrophobicContact CZ-CG 3.97Å; V551-K553 HydrophobicContact CG1-CB 3.99Å; V551-K553 PolarHBondContact O-N 3.06Å; V551-K553 VanDerWaalsContact O-N 3.12Å; K553-T556 WeakPolarHBondContact CA-OG1 3.44Å; K553-T556 PolarHBondContact O-OG1 3.31Å; K553-T556 VanDerWaalsContact O-OG1 3.07Å; K553-S557 WeakPolarHBondContact O-CB 3.34Å; K553-S557 PolarHBondContact O-N 3.09Å; K553-S557 PolarHBondContact O-OG 3.5Å; K553-S557 VanDerWaalsContact O-OG 3.09Å
554	Y	96.6	Very high	93.5	Very high	12 Å²	12	85.5 Å²	85.5	5%	0.047	40%	0.398	C	S	.	.	H	α-helix	trans	-69.5	-41.2	-178.7	-55.8	-20.2	0	0	0	111.2	D518 F522 A544 N548 V551 K552 L558	D518-Y554 HydrophobicContact CB-CE2 3.78Å; D518-Y554 VanDerWaalsContact CG-OH 3.26Å; D518-Y554 WeakPolarHBondContact OD2-CE2 3.31Å; D518-Y554 PolarHBondContact OD2-OH 3.46Å; F522-Y554 HydrophobicContact CB-CD1 4.17Å; F522-Y554 HydrophobicContact CB-CE1 3.79Å; F522-Y554 HydrophobicContact CD1-CE1 4.17Å; F522-Y554 AromaticContact CD2-CD1 3.2Å; F522-Y554 HydrophobicContact CD2-CD1 3.2Å; F522-Y554 AromaticContact CD2-CE1 3.61Å; F522-Y554 HydrophobicContact CD2-CE1 3.61Å; F522-Y554 HydrophobicContact CD2-CG 4.15Å; F522-Y554 AromaticContact CE2-CD1 3.62Å; F522-Y554 HydrophobicContact CE2-CD1 3.62Å; F522-Y554 HydrophobicContact CE2-CE1 4.21Å; F522-Y554 AromaticContact CG-CD1 3.72Å; F522-Y554 HydrophobicContact CG-CD1 3.72Å; F522-Y554 AromaticContact CG-CE1 3.57Å; F522-Y554 HydrophobicContact CG-CE1 3.57Å; F522-Y554 HydrophobicContact CZ-CD1 4.45Å; A544-Y554 HydrophobicContact CB-CD2 4.09Å; A544-Y554 HydrophobicContact CB-CE2 4.33Å; A544-Y554 HydrophobicContact CB-CG 4.33Å; N548-Y554 HydrophobicContact CB-CE2 4.28Å; V551-Y554 HydrophobicContact CB-CD1 4.39Å; V551-Y554 HydrophobicContact CB-CD2 3.59Å; V551-Y554 HydrophobicContact CB-CE1 4.36Å; V551-Y554 HydrophobicContact CB-CE2 3.52Å; V551-Y554 HydrophobicContact CB-CG 4.03Å; V551-Y554 HydrophobicContact CG1-CD1 3.8Å; V551-Y554 HydrophobicContact CG1-CD2 3.93Å; V551-Y554 HydrophobicContact CG1-CE1 3.7Å; V551-Y554 HydrophobicContact CG1-CE2 3.8Å; V551-Y554 HydrophobicContact CG1-CG 3.92Å; V551-Y554 HydrophobicContact CG2-CD2 4.32Å; V551-Y554 HydrophobicContact CG2-CE2 3.78Å; V551-Y554 PolarHBondContact O-N 3.13Å; V551-Y554 VanDerWaalsContact O-N 3.09Å; K552-Y554 PolarHBondContact O-N 3.29Å; Y554-L558 WeakPolarHBondContact O-CB 3.38Å; Y554-L558 PolarHBondContact O-N 2.85Å
555	H	95.5	Very high	92.7	Very high	73 Å²	73	89.4 Å²	89.4	34%	0.338	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-42.7	176.4	-64.1	-82.9	0	0	0	112.3	I545 P549 V551 K552 L558 K559	I545-H555 VanDerWaalsContact CG2-CE1 3.47Å; I545-H555 WeakPolarHBondContact CG2-CE1 3.25Å; P549-H555 PolarHBondContact O-NE2 3.44Å; V551-H555 PolarHBondContact O-CD2 2.91Å; K552-H555 PolarHBondContact O-N 3.36Å; H555-L558 PolarHBondContact O-N 3.02Å; H555-K559 WeakPolarHBondContact O-CG 3.49Å; H555-K559 PolarHBondContact O-N 2.86Å
556	T	95.7	Very high	91.8	Very high	85 Å²	85	96.7 Å²	96.7	52%	0.521	44%	0.438	S	S	.	.	H	α-helix	trans	-68.7	-41.3	179.6	54.2	0	0	0	0	111.9	K552 K553 K559 Y560	K552-T556 PolarHBondContact O-N 3.5Å; K552-T556 PolarHBondContact O-OG1 2.92Å; K553-T556 WeakPolarHBondContact CA-OG1 3.44Å; K553-T556 PolarHBondContact O-OG1 3.31Å; K553-T556 VanDerWaalsContact O-OG1 3.07Å; T556-K559 PolarHBondContact O-N 3.49Å; T556-Y560 PolarHBondContact O-N 3.22Å
557	S	93.8	Very high	90.7	Very high	26 Å²	26	92.1 Å²	92.1	18%	0.182	43%	0.43	C	S	.	.	H	α-helix	trans	-62.3	-41	174.6	-67.3	0	0	0	0	112.6	F522 K553 Y560 L561	F522-S557 WeakPolarHBondContact CE2-OG 3.23Å; K553-S557 WeakPolarHBondContact O-CB 3.34Å; K553-S557 PolarHBondContact O-N 3.09Å; K553-S557 PolarHBondContact O-OG 3.5Å; K553-S557 VanDerWaalsContact O-OG 3.09Å; S557-Y560 PolarHBondContact O-N 3.23Å; S557-L561 PolarHBondContact O-N 3.31Å
558	L	93.4	Very high	89.2	Confident	22 Å²	22	92.1 Å²	92.1	12%	0.115	42%	0.424	C	S	.	.	H	α-helix	trans	-64.4	-43.1	175.8	178.6	59.2	0	0	0	112.2	R538 F541 V542 I545 Y554 H555 Y560 L561 Q562	R538-L558 HydrophobicContact CG-CD1 4.09Å; F541-L558 HydrophobicContact CB-CB 4.15Å; F541-L558 HydrophobicContact CB-CD1 3.9Å; F541-L558 HydrophobicContact CB-CG 4.42Å; F541-L558 HydrophobicContact CD2-CD1 4.3Å; F541-L558 HydrophobicContact CG-CB 4.35Å; F541-L558 HydrophobicContact CG-CD1 4.42Å; V542-L558 HydrophobicContact CG2-CD2 4.24Å; I545-L558 HydrophobicContact CD1-CB 4.35Å; I545-L558 HydrophobicContact CD1-CD2 3.66Å; Y554-L558 WeakPolarHBondContact O-CB 3.38Å; Y554-L558 PolarHBondContact O-N 2.85Å; H555-L558 PolarHBondContact O-N 3.02Å; L558-Y560 VanDerWaalsContact C-N 3.32Å; L558-Y560 PolarHBondContact O-N 2.96Å; L558-L561 WeakPolarHBondContact O-CB 3.32Å; L558-L561 PolarHBondContact O-N 3.03Å; L558-Q562 HydrophobicContact CD1-CG 4.47Å; L558-Q562 WeakPolarHBondContact O-CG 3.49Å; L558-Q562 PolarHBondContact O-N 3.22Å
559	K	92.2	Very high	87.5	Confident	135 Å²	135	98.1 Å²	98.1	59%	0.587	44%	0.442	S	S	*	.	H	α-helix	trans	-62	-40.6	176	-74.7	178.8	-178	-175.3	0	111.9	H555 T556 Q562 R563	H555-K559 WeakPolarHBondContact O-CG 3.49Å; H555-K559 PolarHBondContact O-N 2.86Å; T556-K559 PolarHBondContact O-N 3.49Å; K559-Q562 PolarHBondContact O-N 3.32Å; K559-R563 WeakPolarHBondContact O-CG 3.48Å; K559-R563 PolarHBondContact O-N 2.77Å; K559-R563 VanDerWaalsContact O-N 3.12Å
560	Y	90.2	Very high	85.5	Confident	174 Å²	174	104 Å²	104	68%	0.682	46%	0.456	S	S	*	.	H	α-helix	trans	-62	-47	175.6	179.1	-94.9	0	0	0	111.4	T556 S557 L558 Q562 R563 S564	T556-Y560 PolarHBondContact O-N 3.22Å; S557-Y560 PolarHBondContact O-N 3.23Å; L558-Y560 VanDerWaalsContact C-N 3.32Å; L558-Y560 PolarHBondContact O-N 2.96Å; Y560-Q562 VanDerWaalsContact C-N 3.31Å; Y560-Q562 PolarHBondContact O-N 3.37Å; Y560-R563 PolarHBondContact O-N 2.93Å; Y560-S564 PolarHBondContact O-N 3.27Å
561	L	88.6	Confident	82.9	Confident	15 Å²	15	101.4 Å²	101.4	8%	0.079	45%	0.446	C	S	.	.	H	α-helix	trans	-56.5	-44.8	175.7	-172.4	81.2	0	0	0	111.8	Y534 S537 R538 F541 S557 L558 R563 S564 W565	Y534-L561 HydrophobicContact CD1-CD1 3.51Å; Y534-L561 HydrophobicContact CD1-CG 4.06Å; Y534-L561 HydrophobicContact CE1-CD1 4.02Å; S537-L561 WeakPolarHBondContact OG-CD2 3.29Å; R538-L561 HydrophobicContact CB-CD2 4.18Å; F541-L561 HydrophobicContact CD2-CD2 3.81Å; F541-L561 HydrophobicContact CE2-CB 4.27Å; F541-L561 HydrophobicContact CE2-CD1 4.42Å; F541-L561 HydrophobicContact CE2-CD2 3.93Å; F541-L561 HydrophobicContact CE2-CG 4.44Å; S557-L561 PolarHBondContact O-N 3.31Å; L558-L561 WeakPolarHBondContact O-CB 3.32Å; L558-L561 PolarHBondContact O-N 3.03Å; L561-R563 VanDerWaalsContact C-N 3.34Å; L561-R563 PolarHBondContact O-N 3.28Å; L561-S564 PolarHBondContact O-N 3.44Å; L561-W565 WeakPolarHBondContact O-CB 2.96Å; L561-W565 PolarHBondContact O-N 3.01Å
562	Q	87.6	Confident	79.9	Confident	75 Å²	75	105.3 Å²	105.3	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-37	179.3	-73.1	174.1	-12.3	0	0	113	L558 K559 Y560 R566	L558-Q562 HydrophobicContact CD1-CG 4.47Å; L558-Q562 WeakPolarHBondContact O-CG 3.49Å; L558-Q562 PolarHBondContact O-N 3.22Å; K559-Q562 PolarHBondContact O-N 3.32Å; Y560-Q562 VanDerWaalsContact C-N 3.31Å; Y560-Q562 PolarHBondContact O-N 3.37Å; Q562-R566 WeakPolarHBondContact O-CG 3.47Å; Q562-R566 PolarHBondContact O-N 2.84Å; Q562-R566 VanDerWaalsContact O-N 3.14Å
563	R	85.8	Confident	77.5	Confident	184 Å²	184	103.7 Å²	103.7	69%	0.694	47%	0.465	S	S	*	.	H	α-helix	trans	-67.3	-47.2	174.1	-72.8	178.5	177.6	179.8	-2.8	111.1	K559 Y560 L561 W565 R566 N567	K559-R563 WeakPolarHBondContact O-CG 3.48Å; K559-R563 PolarHBondContact O-N 2.77Å; K559-R563 VanDerWaalsContact O-N 3.12Å; Y560-R563 PolarHBondContact O-N 2.93Å; L561-R563 VanDerWaalsContact C-N 3.34Å; L561-R563 PolarHBondContact O-N 3.28Å; R563-W565 VanDerWaalsContact C-N 3.32Å; R563-W565 PolarHBondContact O-N 3.47Å; R563-R566 PolarHBondContact O-N 3.29Å; R563-N567 PolarHBondContact O-N 3.24Å; R563-N567 VanDerWaalsContact O-N 3.09Å; R563-N567 PolarHBondContact O-OD1 3.17Å
564	S	79.8	Confident	74.6	Confident	34 Å²	34	104.8 Å²	104.8	24%	0.238	48%	0.477	C	S	.	.	H	α-helix	trans	-58.6	-43.8	177.2	176.1	0	0	0	0	111.7	Y560 L561 R566 N567 E568	Y560-S564 PolarHBondContact O-N 3.27Å; L561-S564 PolarHBondContact O-N 3.44Å; S564-R566 PolarHBondContact O-N 3.35Å; S564-N567 PolarHBondContact O-N 2.72Å; S564-E568 PolarHBondContact O-N 2.87Å
565	W	79.8	Confident	71.9	Confident	82 Å²	82	112 Å²	112	31%	0.311	52%	0.515	S	S	.	.	H	α-helix	trans	-66.6	-36.1	178.6	-174.7	46.1	0	0	0	113.6	Y534 L561 R563 R569	Y534-W565 HydrophobicContact CD1-CB 4.13Å; Y534-W565 AromaticContact CD2-CD1 3.9Å; Y534-W565 HydrophobicContact CG-CB 4.18Å; Y534-W565 AromaticContact CG-CD1 3.79Å; Y534-W565 HydrophobicContact CG-CG 4.15Å; L561-W565 WeakPolarHBondContact O-CB 2.96Å; L561-W565 PolarHBondContact O-N 3.01Å; R563-W565 VanDerWaalsContact C-N 3.32Å; R563-W565 PolarHBondContact O-N 3.47Å; W565-R569 PolarHBondContact O-N 3.14Å
566	R	79.5	Confident	68.8	Low	179 Å²	179	116.2 Å²	116.2	68%	0.675	54%	0.535	S	S	*	.	H	α-helix	trans	-63.4	-43.5	172.8	-76.8	177.6	-177.6	-171.3	-0.3	111.1	Q562 R563 S564 R569 Y570	Q562-R566 WeakPolarHBondContact O-CG 3.47Å; Q562-R566 PolarHBondContact O-N 2.84Å; Q562-R566 VanDerWaalsContact O-N 3.14Å; R563-R566 PolarHBondContact O-N 3.29Å; S564-R566 PolarHBondContact O-N 3.35Å; R566-R569 PolarHBondContact O-N 2.68Å; R566-Y570 WeakPolarHBondContact O-CD2 3.49Å
567	N	73.2	Confident	65.9	Low	113 Å²	113	116.6 Å²	116.6	60%	0.604	54%	0.541	S	S	*	.	H	α-helix	trans	-65.7	-37.9	179.7	-68.1	0.5	0	0	0	112.3	R563 S564 Y570	R563-N567 PolarHBondContact O-N 3.24Å; R563-N567 VanDerWaalsContact O-N 3.09Å; R563-N567 PolarHBondContact O-OD1 3.17Å; S564-N567 PolarHBondContact O-N 2.72Å; N567-Y570 PolarHBondContact O-N 3.26Å
568	E	65.1	Low	63	Low	57 Å²	57	122.5 Å²	122.5	27%	0.266	57%	0.571	S	S	.	*	H	α-helix	trans	-70	-30.4	175.6	-74.6	-157.9	148.3	0	0	113.5	Y534 S564 Y570 Q571 K573	Y534-E568 WeakPolarHBondContact CE2-OE2 3.2Å; Y534-E568 VanDerWaalsContact CZ-OE2 3.29Å; Y534-E568 PolarHBondContact OH-OE1 3.43Å; Y534-E568 PolarHBondContact OH-OE2 3.2Å; S564-E568 PolarHBondContact O-N 2.87Å; E568-Y570 PolarHBondContact O-N 2.97Å; E568-Q571 CarbonylContact O-C 3.56Å; E568-Q571 PolarHBondContact O-N 3.28Å; E568-K573 IonicContact OE1-NZ 2.99Å; E568-K573 PolarHBondContact OE1-NZ 2.79Å
569	R	61.6	Low	60.1	Low	179 Å²	179	128.4 Å²	128.4	68%	0.675	60%	0.602	S	S	*	*	H	α-helix	trans	-63	-23.4	171.5	-76.4	-167.5	-170.6	-161.1	0.6	113.2	W565 R566 Q571	W565-R569 PolarHBondContact O-N 3.14Å; R566-R569 PolarHBondContact O-N 2.68Å; R569-Q571 VanDerWaalsContact C-N 3.29Å
570	Y	53.2	Low	57.1	Low	205 Å²	205	127 Å²	127	80%	0.804	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-7.4	172.6	-80.4	-81.8	0	0	0	113.2	R566 N567 E568	R566-Y570 WeakPolarHBondContact O-CD2 3.49Å; N567-Y570 PolarHBondContact O-N 3.26Å; E568-Y570 PolarHBondContact O-N 2.97Å
571	Q	42.6	Very low	54.3	Low	134 Å²	134	125 Å²	125	63%	0.626	61%	0.612	S	S	*	*	S	Bend	trans	-126.9	91.9	173.7	-69.3	-171.8	-4.8	0	0	109.4	E568 R569 K573	E568-Q571 CarbonylContact O-C 3.56Å; E568-Q571 PolarHBondContact O-N 3.28Å; R569-Q571 VanDerWaalsContact C-N 3.29Å; Q571-K573 PolarHBondContact O-N 3.17Å
572	P	33.4	Very low	51.5	Low	123 Å²	123	132.2 Å²	132.2	80%	0.799	65%	0.646	S	S	*	*			trans	-60.2	102.4	175.6	24	-31.2	0	0	0	109.4	N574	P572-N574 PolarHBondContact O-N 3.26Å
573	K	44.4	Very low	48.9	Very low	140 Å²	140	133.4 Å²	133.4	61%	0.609	66%	0.662	S	S	*	*			trans	-79	117.7	166.4	-78	-179.2	-178.4	163.7	0	107.3	E568 Q571 I575	E568-K573 IonicContact OE1-NZ 2.99Å; E568-K573 PolarHBondContact OE1-NZ 2.79Å; Q571-K573 PolarHBondContact O-N 3.17Å; K573-I575 PolarHBondContact O-N 3.03Å
574	N	35.5	Very low	46.4	Very low	153 Å²	153	133 Å²	133	82%	0.818	67%	0.668	S	S	*	*			trans	-48.4	106.5	163	-78	-22.3	0	0	0	108	P572 Q576	P572-N574 PolarHBondContact O-N 3.26Å; N574-Q576 PolarHBondContact O-N 3.25Å
575	I	39.6	Very low	44.1	Very low	164 Å²	164	138.5 Å²	138.5	84%	0.841	69%	0.694	S	S	*	*			trans	-71.3	82.4	167.3	-60.5	170.1	0	0	0	104.6	K573 S577	K573-I575 PolarHBondContact O-N 3.03Å; I575-S577 PolarHBondContact O-N 3.37Å; I575-S577 VanDerWaalsContact O-N 3.11Å
576	Q	30.8	Very low	41.8	Very low	162 Å²	162	146.2 Å²	146.2	76%	0.757	72%	0.723	S	S	*	*			trans	-64.7	111.8	164.7	-101.4	175.3	-31.8	0	0	106.7	N574 D578	N574-Q576 PolarHBondContact O-N 3.25Å; Q576-D578 PolarHBondContact O-N 3.4Å
577	S	33	Very low	39.4	Very low	93 Å²	93	147.1 Å²	147.1	65%	0.65	73%	0.732	S	S	*	*			trans	-64.3	76.2	170.6	53.2	0	0	0	0	109.9	I575 L579	I575-S577 PolarHBondContact O-N 3.37Å; I575-S577 VanDerWaalsContact O-N 3.11Å; S577-L579 PolarHBondContact O-N 3.06Å
578	D	34.7	Very low	37.3	Very low	150 Å²	150	153.1 Å²	153.1	80%	0.802	76%	0.764	S	S	*	*			trans	-78.9	86.1	162.9	-76.7	-13.5	0	0	0	108.1	Q576 V580	Q576-D578 PolarHBondContact O-N 3.4Å; D578-V580 PolarHBondContact O-N 3.19Å
579	L	32.5	Very low	35.9	Very low	146 Å²	146	157.9 Å²	157.9	76%	0.764	79%	0.788	S	S	*	*			trans	-40.3	119.8	157.8	-71.5	147.5	0	0	0	110.2	S577	S577-L579 PolarHBondContact O-N 3.06Å
580	V	28	Very low	34.6	Very low	106 Å²	106	156.8 Å²	156.8	64%	0.642	79%	0.794	S	S	*	*			trans	20.6	123	135.5	-176.9	0	0	0	0	116.1	D578 Q582	D578-V580 PolarHBondContact O-N 3.19Å; V580-Q582 HydrophobicContact CG1-CB 4.37Å; V580-Q582 HydrophobicContact CG1-CG 3.63Å
581	P	30.9	Very low	33.5	Very low	131 Å²	131	154.1 Å²	154.1	85%	0.851	79%	0.794	S	S	*	*				-111	129.2	119.6	-5.7	23.5	0	0	0	111.5
582	Q	31.1	Very low	33	Very low	167 Å²	167	155.3 Å²	155.3	78%	0.78	80%	0.804	S	S	*	*			trans	-72	166.4	167.3	-73.2	178.5	-9.9	0	0	110.9	V580	V580-Q582 HydrophobicContact CG1-CB 4.37Å; V580-Q582 HydrophobicContact CG1-CG 3.63Å
583	S	32.3	Very low	33	Very low	100 Å²	100	157.3 Å²	157.3	70%	0.699	80%	0.804	S	S	*	*			trans	96	141.8	165.3	78.4	0	0	0	0	116.1
584	H	32.6	Very low	32.2	Very low	175 Å²	175	158.5 Å²	158.5	81%	0.81	82%	0.817	S	S	*	*			trans	86.5	47.8	-176.1	-48.5	-61.6	0	0	0	119.4
585	L	33.3	Very low	32	Very low	150 Å²	150	158.9 Å²	158.9	79%	0.785	82%	0.817	S	S	*	*			trans	-137.1	62.7	145.7	-81.3	170.8	0	0	0	110.4
586	R	30.2	Very low	31.4	Very low	243 Å²	243	158.5 Å²	158.5	92%	0.917	82%	0.815	S	S	*	*			trans	-122.4	98.6	154.7	-83.4	-171.4	-177.9	-175.7	1.4	106.8
587	K	29	Very low	31.5	Very low	199 Å²	199	158.2 Å²	158.2	87%	0.865	82%	0.82	S	S	*	*			trans	161.8	129.8	143	-90.7	171.1	-179.5	-174.9	0	109.5
588	N	29.9	Very low	31.3	Very low	238 Å²	238	164.1 Å²	164.1	100%	1.273	84%	0.835	S	S	*	*			trans	77.7	0	171.9	-57.4	-8.3	0	0	0	116.7

Retrieved 588 of 588 residues in 271.7 ms (Link to these results)

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