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Protoheme IX farnesyltransferase

Converts heme B (protoheme IX) to heme O by substitution of the vinyl group on carbon 2 of heme B porphyrin ring with a hydroxyethyl farnesyl side group.

AlphaFold DB , UniProt , Accession Q2G2B9, Species STAA8 (Staphylococcus aureus (strain NCTC 8325 / PS 47)), Gene ctaB, Length 303 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	37	Very low	45.4	Very low	255 Å²	255	149.3 Å²	149.3	100%	1.256	78%	0.778	S	S	*	*				0	101.1	0	-99.6	173.6	160.4	0	0	108.9
2	S	41.8	Very low	47.3	Very low	118 Å²	118	142.1 Å²	142.1	83%	0.825	75%	0.75	S	S	*	*			trans	-137.3	90.7	162.6	64.3	0	0	0	0	108.7
3	K	44.5	Very low	49.8	Very low	195 Å²	195	149.5 Å²	149.5	85%	0.848	76%	0.761	S	S	*	*			trans	18.2	108.7	152.6	-68.8	174.9	176.2	178.8	0	117.1	H5	K3-H5 PolarHBondContact O-N 3.22Å
4	E	44.4	Very low	52.4	Low	177 Å²	177	142.2 Å²	142.2	83%	0.827	73%	0.727	S	S	*	*			trans	-16.8	97.3	138.8	-66.3	167.6	158.3	0	0	113.2	T6	E4-T6 PolarHBondContact O-N 2.86Å
5	H	45.1	Very low	55.1	Low	171 Å²	171	137.8 Å²	137.8	79%	0.792	71%	0.706	S	S	*	*			trans	-88.7	64	146.9	-93.3	-78.7	0	0	0	107.6	K3 L7	K3-H5 PolarHBondContact O-N 3.22Å; H5-L7 PolarHBondContact O-N 3.27Å
6	T	45	Very low	57.5	Low	115 Å²	115	138.1 Å²	138.1	71%	0.706	70%	0.701	S	S	*	*			trans	-68.1	83.2	148.1	43.4	0	0	0	0	105.5	E4 S8	E4-T6 PolarHBondContact O-N 2.86Å; T6-S8 PolarHBondContact O-N 3.18Å
7	L	44.5	Very low	59.7	Low	139 Å²	139	138.9 Å²	138.9	73%	0.728	70%	0.699	S	S	*	*			trans	-52.3	95.8	153.4	-84.3	151.9	0	0	0	104.5	H5 Q9	H5-L7 PolarHBondContact O-N 3.27Å; L7-Q9 PolarHBondContact O-N 3.48Å
8	S	45.3	Very low	61.6	Low	99 Å²	99	132.7 Å²	132.7	69%	0.692	67%	0.667	S	S	*	*			trans	-56.5	94.9	157.7	50.3	0	0	0	0	103.8	T6 N10	T6-S8 PolarHBondContact O-N 3.18Å; S8-N10 VanDerWaalsContact C-N 3.28Å; S8-N10 PolarHBondContact O-N 3.26Å
9	Q	47.6	Very low	63.4	Low	142 Å²	142	128.8 Å²	128.8	66%	0.664	65%	0.648	S	S	*	*			trans	-54.9	108.8	168.4	-70.8	-176.5	-15.1	0	0	103.4	L7 I11	L7-Q9 PolarHBondContact O-N 3.48Å; Q9-I11 PolarHBondContact O-N 2.91Å
10	N	48	Very low	65	Low	155 Å²	155	125.5 Å²	125.5	83%	0.829	63%	0.63	S	S	*	*			trans	-60.7	87.2	167.7	-96.8	-35.1	0	0	0	104.7	S8 S12	S8-N10 VanDerWaalsContact C-N 3.28Å; S8-N10 PolarHBondContact O-N 3.26Å; N10-S12 PolarHBondContact O-N 3.01Å
11	I	55.8	Low	66.5	Low	76 Å²	76	124.2 Å²	124.2	39%	0.39	62%	0.622	S	S	.	*			trans	-64.1	95.1	171.3	-59.3	175.9	0	0	0	103.4	Q9 R13 R98 T100	Q9-I11 PolarHBondContact O-N 2.91Å; I11-R13 PolarHBondContact O-N 3.33Å; I11-R98 WeakPolarHBondContact CG2-O 3.25Å; I11-T100 HydrophobicContact CD1-CG2 3.62Å
12	S	68.6	Low	69.3	Low	63 Å²	63	112.1 Å²	112.1	44%	0.441	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-54.2	136.6	174.1	57	0	0	0	0	107.8	N10 V14 R98	N10-S12 PolarHBondContact O-N 3.01Å; S12-V14 PolarHBondContact O-N 3.26Å; S12-R98 PolarHBondContact OG-NH1 2.91Å; S12-R98 PolarHBondContact OG-NH2 3.07Å
13	R	79.8	Confident	71.9	Confident	239 Å²	239	107 Å²	107	90%	0.902	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-48	133.7	-179.1	-69	-177.8	178.1	179	-0.7	109.5	I11 N15	I11-R13 PolarHBondContact O-N 3.33Å; R13-N15 PolarHBondContact O-N 3.25Å; R13-N15 VanDerWaalsContact O-N 3.15Å
14	V	86.9	Confident	74.4	Confident	47 Å²	47	99.5 Å²	99.5	29%	0.285	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-49.7	121.2	172.9	176.1	0	0	0	0	108.2	S12 E18 L19 I22 R98 I99	S12-V14 PolarHBondContact O-N 3.26Å; V14-E18 WeakPolarHBondContact CA-OE2 3.22Å; V14-E18 HydrophobicContact CG1-CB 3.6Å; V14-L19 HydrophobicContact CG1-CB 4.26Å; V14-I22 HydrophobicContact CG1-CD1 3.79Å; V14-I22 HydrophobicContact CG2-CD1 4.46Å; V14-R98 WeakPolarHBondContact CG2-O 3.16Å; V14-I99 HydrophobicContact CG2-CB 3.91Å; V14-I99 HydrophobicContact CG2-CD1 4.43Å; V14-I99 HydrophobicContact CG2-CG1 4.33Å
15	N	93	Very high	76.8	Confident	76 Å²	76	93.1 Å²	93.1	41%	0.406	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-79	168.2	178.1	70.9	51.1	0	0	0	110.8	R13 K17 E18 L19	R13-N15 PolarHBondContact O-N 3.25Å; R13-N15 VanDerWaalsContact O-N 3.15Å; N15-K17 VanDerWaalsContact C-N 3.3Å; N15-K17 PolarHBondContact O-N 3Å; N15-K17 WeakPolarHBondContact OD1-CA 3.41Å; N15-K17 WeakPolarHBondContact OD1-CB 3.46Å; N15-K17 PolarHBondContact OD1-N 2.98Å; N15-E18 PolarHBondContact N-OE2 2.67Å; N15-E18 VanDerWaalsContact ND2-CD 3.33Å; N15-E18 PolarHBondContact ND2-OE2 2.9Å; N15-E18 WeakPolarHBondContact O-CB 3.32Å; N15-E18 PolarHBondContact O-N 2.92Å; N15-E18 VanDerWaalsContact O-N 3.12Å; N15-E18 WeakPolarHBondContact OD1-CG 3.4Å; N15-E18 PolarHBondContact OD1-N 3.07Å; N15-L19 PolarHBondContact O-N 3.29Å
16	F	93	Very high	79.1	Confident	142 Å²	142	87.6 Å²	87.6	62%	0.623	45%	0.453	S	S	*	.	H	α-helix	trans	-60.1	-36.5	-176.5	-174.9	-109.7	0	0	0	113.8	L19 Q20	F16-L19 PolarHBondContact O-N 3.1Å; F16-Q20 HydrophobicContact CD1-CG 4.43Å; F16-Q20 HydrophobicContact CE1-CG 4.14Å; F16-Q20 HydrophobicContact CZ-CG 4.28Å; F16-Q20 WeakPolarHBondContact O-CG 3.47Å; F16-Q20 PolarHBondContact O-N 3.14Å
17	K	93.9	Very high	81.5	Confident	153 Å²	153	85.4 Å²	85.4	67%	0.665	44%	0.436	S	S	*	.	H	α-helix	trans	-67.4	-39	177	-67	-177.3	178.1	178.8	0	111.4	N15 Q20 Q21	N15-K17 VanDerWaalsContact C-N 3.3Å; N15-K17 PolarHBondContact O-N 3Å; N15-K17 WeakPolarHBondContact OD1-CA 3.41Å; N15-K17 WeakPolarHBondContact OD1-CB 3.46Å; N15-K17 PolarHBondContact OD1-N 2.98Å; K17-Q20 PolarHBondContact O-N 3.36Å; K17-Q21 WeakPolarHBondContact O-CG 3.38Å; K17-Q21 PolarHBondContact O-N 2.89Å; K17-Q21 VanDerWaalsContact O-N 3.15Å
18	E	95	Very high	84	Confident	27 Å²	27	78.8 Å²	78.8	13%	0.126	40%	0.402	C	S	.	.	H	α-helix	trans	-66.3	-41.1	175.1	-67.7	173.5	145.9	0	0	110.8	V14 N15 Q20 Q21 I22 P93 R98	V14-E18 WeakPolarHBondContact CA-OE2 3.22Å; V14-E18 HydrophobicContact CG1-CB 3.6Å; N15-E18 PolarHBondContact N-OE2 2.67Å; N15-E18 VanDerWaalsContact ND2-CD 3.33Å; N15-E18 PolarHBondContact ND2-OE2 2.9Å; N15-E18 WeakPolarHBondContact O-CB 3.32Å; N15-E18 PolarHBondContact O-N 2.92Å; N15-E18 VanDerWaalsContact O-N 3.12Å; N15-E18 WeakPolarHBondContact OD1-CG 3.4Å; N15-E18 PolarHBondContact OD1-N 3.07Å; E18-Q20 PolarHBondContact O-N 2.88Å; E18-Q21 WeakPolarHBondContact O-CB 3.4Å; E18-Q21 PolarHBondContact O-N 3.14Å; E18-Q21 VanDerWaalsContact O-N 3.12Å; E18-I22 VanDerWaalsContact O-CG1 3.32Å; E18-I22 WeakPolarHBondContact O-CG1 3.22Å; E18-I22 PolarHBondContact O-N 3.4Å; E18-P93 HydrophobicContact CB-CB 4.16Å; E18-P93 HydrophobicContact CB-CG 3.74Å; E18-P93 HydrophobicContact CG-CB 4.43Å; E18-P93 HydrophobicContact CG-CG 3.91Å; E18-R98 IonicContact OE1-CZ 3.92Å; E18-R98 IonicContact OE1-NE 2.74Å; E18-R98 PolarHBondContact OE1-NE 3.37Å; E18-R98 IonicContact OE1-NH2 3.16Å; E18-R98 PolarHBondContact OE1-NH2 3.48Å; E18-R98 IonicContact OE2-CZ 3.32Å; E18-R98 IonicContact OE2-NE 3.64Å; E18-R98 IonicContact OE2-NH2 2.68Å; E18-R98 PolarHBondContact OE2-NH2 3.24Å; E18-R98 VanDerWaalsContact OE2-NH2 3.16Å
19	L	95.4	Very high	86.4	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.304	39%	0.394	S	S	.	.	H	α-helix	trans	-58.7	-46.2	173.4	-179.3	62.9	0	0	0	111.4	V14 N15 F16 Q21 I22 I23 L107	V14-L19 HydrophobicContact CG1-CB 4.26Å; N15-L19 PolarHBondContact O-N 3.29Å; F16-L19 PolarHBondContact O-N 3.1Å; L19-Q21 PolarHBondContact O-N 2.75Å; L19-I22 WeakPolarHBondContact O-CB 3.43Å; L19-I22 PolarHBondContact O-N 3.25Å; L19-I22 VanDerWaalsContact O-N 3.09Å; L19-I23 HydrophobicContact CD1-CG2 4.22Å; L19-I23 WeakPolarHBondContact O-CG1 3.11Å; L19-I23 PolarHBondContact O-N 3.5Å; L19-L107 HydrophobicContact CD1-CD1 4.43Å; L19-L107 HydrophobicContact CD1-CD2 3.88Å
20	Q	96	Very high	88.7	Confident	63 Å²	63	73.8 Å²	73.8	29%	0.294	37%	0.374	S	S	.	.	H	α-helix	trans	-58.4	-34.3	175.6	-73	178.7	-36.7	0	0	112.9	F16 K17 E18 K24 M25	F16-Q20 HydrophobicContact CD1-CG 4.43Å; F16-Q20 HydrophobicContact CE1-CG 4.14Å; F16-Q20 HydrophobicContact CZ-CG 4.28Å; F16-Q20 WeakPolarHBondContact O-CG 3.47Å; F16-Q20 PolarHBondContact O-N 3.14Å; K17-Q20 PolarHBondContact O-N 3.36Å; E18-Q20 PolarHBondContact O-N 2.88Å; Q20-K24 PolarHBondContact O-N 2.86Å; Q20-K24 VanDerWaalsContact O-N 3.15Å; Q20-M25 HydrophobicContact CB-CB 4.05Å; Q20-M25 HydrophobicContact CG-CB 4.28Å; Q20-M25 PolarHBondContact O-N 3.32Å
21	Q	95.7	Very high	91.1	Very high	99 Å²	99	67.6 Å²	67.6	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-73.1	-38.8	174.6	-68.7	178.5	35.3	0	0	112.4	K17 E18 L19 K24 P93	K17-Q21 WeakPolarHBondContact O-CG 3.38Å; K17-Q21 PolarHBondContact O-N 2.89Å; K17-Q21 VanDerWaalsContact O-N 3.15Å; E18-Q21 WeakPolarHBondContact O-CB 3.4Å; E18-Q21 PolarHBondContact O-N 3.14Å; E18-Q21 VanDerWaalsContact O-N 3.12Å; L19-Q21 PolarHBondContact O-N 2.75Å; Q21-K24 PolarHBondContact O-N 3.29Å; Q21-P93 HydrophobicContact CB-CG 4.2Å
22	I	96.9	Very high	93.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.9	-46.7	177.3	-70.4	163.6	0	0	0	110.6	V14 E18 L19 K24 A73 N76 P93 T94 I99 L104 L107	V14-I22 HydrophobicContact CG1-CD1 3.79Å; V14-I22 HydrophobicContact CG2-CD1 4.46Å; E18-I22 VanDerWaalsContact O-CG1 3.32Å; E18-I22 WeakPolarHBondContact O-CG1 3.22Å; E18-I22 PolarHBondContact O-N 3.4Å; L19-I22 WeakPolarHBondContact O-CB 3.43Å; L19-I22 PolarHBondContact O-N 3.25Å; L19-I22 VanDerWaalsContact O-N 3.09Å; I22-K24 VanDerWaalsContact C-N 3.28Å; I22-K24 PolarHBondContact O-N 3.06Å; I22-A73 HydrophobicContact CG2-CB 3.74Å; I22-A73 WeakPolarHBondContact O-CA 3.32Å; I22-N76 PolarHBondContact O-ND2 3.11Å; I22-P93 HydrophobicContact CD1-CB 4.14Å; I22-P93 HydrophobicContact CG1-CB 4.07Å; I22-P93 HydrophobicContact CG1-CG 4.38Å; I22-T94 HydrophobicContact CG1-CG2 4.01Å; I22-I99 HydrophobicContact CD1-CB 4.48Å; I22-I99 HydrophobicContact CD1-CD1 4.2Å; I22-I99 HydrophobicContact CD1-CG2 4.16Å; I22-L104 HydrophobicContact CG2-CD1 3.67Å; I22-L107 HydrophobicContact CG2-CD2 3.89Å
23	I	96.4	Very high	94.5	Very high	11 Å²	11	65.6 Å²	65.6	6%	0.056	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.6	179.8	70.2	174	0	0	0	113.5	L19 M25 C72 M111	L19-I23 HydrophobicContact CD1-CG2 4.22Å; L19-I23 WeakPolarHBondContact O-CG1 3.11Å; L19-I23 PolarHBondContact O-N 3.5Å; I23-M25 HydrophobicContact CD1-CE 3.58Å; I23-M25 HydrophobicContact CD1-SD 4.06Å; I23-M25 HydrophobicContact CG1-CB 4.38Å; I23-C72 WeakPolarHBondContact O-CB 3.1Å; I23-M111 HydrophobicContact CG2-CE 3.87Å; I23-M111 HydrophobicContact CG2-SD 3.86Å
24	K	96.3	Very high	95.4	Very high	37 Å²	37	54.3 Å²	54.3	16%	0.161	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	55.8	-176.3	-56.7	-178.7	-175.6	-179.1	0	112.5	Q20 Q21 I22 G26 L27 V28 C72 N75 N76	Q20-K24 PolarHBondContact O-N 2.86Å; Q20-K24 VanDerWaalsContact O-N 3.15Å; Q21-K24 PolarHBondContact O-N 3.29Å; I22-K24 VanDerWaalsContact C-N 3.28Å; I22-K24 PolarHBondContact O-N 3.06Å; K24-G26 PolarHBondContact O-N 3.39Å; K24-L27 HydrophobicContact CB-CB 4.21Å; K24-L27 WeakPolarHBondContact O-CA 3.46Å; K24-L27 WeakPolarHBondContact O-CB 3.46Å; K24-L27 PolarHBondContact O-N 3.46Å; K24-V28 PolarHBondContact O-N 3.39Å; K24-C72 HydrophobicContact CB-CB 3.99Å; K24-C72 HydrophobicContact CD-CB 3.94Å; K24-C72 HydrophobicContact CG-CB 3.97Å; K24-N75 PolarHBondContact NZ-OD1 3.48Å; K24-N76 VanDerWaalsContact CE-CG 3.41Å; K24-N76 WeakPolarHBondContact CE-ND2 3.48Å; K24-N76 WeakPolarHBondContact CE-OD1 3.25Å; K24-N76 PolarHBondContact NZ-OD1 3.45Å; K24-N76 VanDerWaalsContact NZ-OD1 3.12Å
25	M	95.1	Very high	95.9	Very high	44 Å²	44	52 Å²	52	22%	0.217	27%	0.269	C	S	.	.	H	α-helix	trans	-51.3	-36.7	-171.1	-171.5	61.5	97	0	0	114.3	Q20 I23 L27 V28 Q29	Q20-M25 HydrophobicContact CB-CB 4.05Å; Q20-M25 HydrophobicContact CG-CB 4.28Å; Q20-M25 PolarHBondContact O-N 3.32Å; I23-M25 HydrophobicContact CD1-CE 3.58Å; I23-M25 HydrophobicContact CD1-SD 4.06Å; I23-M25 HydrophobicContact CG1-CB 4.38Å; M25-L27 VanDerWaalsContact C-N 3.3Å; M25-L27 PolarHBondContact O-N 3.11Å; M25-V28 WeakPolarHBondContact O-CB 3.35Å; M25-V28 PolarHBondContact O-N 3.48Å; M25-V28 HydrophobicContact SD-CB 4.37Å; M25-V28 HydrophobicContact SD-CG1 4.49Å; M25-Q29 HydrophobicContact CG-CG 4.23Å; M25-Q29 WeakPolarHBondContact O-CB 3.4Å; M25-Q29 VanDerWaalsContact O-CG 3.3Å; M25-Q29 WeakPolarHBondContact O-CG 3.33Å; M25-Q29 PolarHBondContact O-N 2.91Å; M25-Q29 HydrophobicContact SD-CG 4.43Å
26	G	93.9	Very high	96.2	Very high	54 Å²	54	52 Å²	52	56%	0.557	27%	0.265	S	S	*	.	H	α-helix	trans	-62.8	-34.1	176.4	0	0	0	0	0	113.9	K24 G30	K24-G26 PolarHBondContact O-N 3.39Å; G26-G30 PolarHBondContact O-N 2.86Å; G26-G30 VanDerWaalsContact O-N 3.08Å
27	L	94.3	Very high	96.4	Very high	69 Å²	69	45.4 Å²	45.4	36%	0.361	24%	0.236	S	C	.	.	H	α-helix	trans	-70.7	-41.6	174.4	-168.4	102.8	0	0	0	110.7	K24 M25 G30 N31 C72	K24-L27 HydrophobicContact CB-CB 4.21Å; K24-L27 WeakPolarHBondContact O-CA 3.46Å; K24-L27 WeakPolarHBondContact O-CB 3.46Å; K24-L27 PolarHBondContact O-N 3.46Å; M25-L27 VanDerWaalsContact C-N 3.3Å; M25-L27 PolarHBondContact O-N 3.11Å; L27-G30 PolarHBondContact O-N 3.38Å; L27-N31 PolarHBondContact O-N 3.45Å; L27-N31 VanDerWaalsContact O-N 3.11Å; L27-N31 PolarHBondContact O-ND2 3.06Å; L27-C72 VanDerWaalsContact CD2-SG 3.55Å
28	V	97.4	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-53.2	176	177.4	0	0	0	0	109.8	K24 M25 G30 N31 L32 T65 M68	K24-V28 PolarHBondContact O-N 3.39Å; M25-V28 WeakPolarHBondContact O-CB 3.35Å; M25-V28 PolarHBondContact O-N 3.48Å; M25-V28 HydrophobicContact SD-CB 4.37Å; M25-V28 HydrophobicContact SD-CG1 4.49Å; V28-G30 VanDerWaalsContact C-N 3.32Å; V28-G30 PolarHBondContact O-N 3.37Å; V28-N31 CarbonylContact O-C 3.54Å; V28-N31 PolarHBondContact O-N 3.15Å; V28-L32 HydrophobicContact CG1-CD1 4.15Å; V28-L32 HydrophobicContact CG1-CG 4.35Å; V28-L32 WeakPolarHBondContact O-CG 3.49Å; V28-L32 PolarHBondContact O-N 3.2Å; V28-T65 HydrophobicContact CG1-CG2 4.01Å; V28-M68 HydrophobicContact CG1-CE 4.08Å; V28-M68 HydrophobicContact CG2-CB 4.02Å
29	Q	95.7	Very high	96.8	Very high	113 Å²	113	36.8 Å²	36.8	53%	0.528	20%	0.199	S	C	.	.	H	α-helix	trans	-56	-44.7	178	-72.5	171.9	-31	0	0	112.4	M25 N31 L32 I33	M25-Q29 HydrophobicContact CG-CG 4.23Å; M25-Q29 WeakPolarHBondContact O-CB 3.4Å; M25-Q29 VanDerWaalsContact O-CG 3.3Å; M25-Q29 WeakPolarHBondContact O-CG 3.33Å; M25-Q29 PolarHBondContact O-N 2.91Å; M25-Q29 HydrophobicContact SD-CG 4.43Å; Q29-N31 VanDerWaalsContact C-N 3.28Å; Q29-N31 PolarHBondContact O-N 3.34Å; Q29-L32 PolarHBondContact O-N 3.29Å; Q29-I33 PolarHBondContact O-N 3.39Å
30	G	95.4	Very high	96.9	Very high	23 Å²	23	35.2 Å²	35.2	24%	0.237	19%	0.189	C	C	.	.	H	α-helix	trans	-60.6	-36	177.1	0	0	0	0	0	113.5	G26 L27 V28 P34	G26-G30 PolarHBondContact O-N 2.86Å; G26-G30 VanDerWaalsContact O-N 3.08Å; L27-G30 PolarHBondContact O-N 3.38Å; V28-G30 VanDerWaalsContact C-N 3.32Å; V28-G30 PolarHBondContact O-N 3.37Å; G30-P34 WeakPolarHBondContact O-CD 3.33Å
31	N	97.7	Very high	96.9	Very high	25 Å²	25	32.2 Å²	32.2	13%	0.134	18%	0.175	C	C	.	.	H	α-helix	trans	-84.3	-17.9	178.5	-78.1	-72.8	0	0	0	113.9	L27 V28 Q29 I33 P34 A35 M68 G160 P163	L27-N31 PolarHBondContact O-N 3.45Å; L27-N31 VanDerWaalsContact O-N 3.11Å; L27-N31 PolarHBondContact O-ND2 3.06Å; V28-N31 CarbonylContact O-C 3.54Å; V28-N31 PolarHBondContact O-N 3.15Å; Q29-N31 VanDerWaalsContact C-N 3.28Å; Q29-N31 PolarHBondContact O-N 3.34Å; N31-I33 VanDerWaalsContact C-N 3.3Å; N31-P34 VanDerWaalsContact O-CD 3.27Å; N31-P34 WeakPolarHBondContact O-CD 3.45Å; N31-P34 VanDerWaalsContact O-CG 3.26Å; N31-P34 WeakPolarHBondContact O-CG 3.35Å; N31-A35 WeakPolarHBondContact O-CB 3.39Å; N31-A35 PolarHBondContact O-N 3.2Å; N31-M68 HydrophobicContact CB-CE 4.15Å; N31-M68 HydrophobicContact CB-SD 3.35Å; N31-M68 WeakPolarHBondContact CB-SD 3.44Å; N31-G160 PolarHBondContact OD1-O 3.2Å; N31-P163 HydrophobicContact CB-CB 4.41Å; N31-P163 HydrophobicContact CB-CG 3.98Å; N31-P163 WeakPolarHBondContact O-CB 3.27Å
32	L	98.1	Very high	97	Very high	36 Å²	36	27.5 Å²	27.5	19%	0.188	15%	0.153	C	C	.	.	H	α-helix	trans	-71.3	-26.1	171.3	-69.1	173.9	0	0	0	112.4	V28 Q29 A35 F36 L61 T65 M68	V28-L32 HydrophobicContact CG1-CD1 4.15Å; V28-L32 HydrophobicContact CG1-CG 4.35Å; V28-L32 WeakPolarHBondContact O-CG 3.49Å; V28-L32 PolarHBondContact O-N 3.2Å; Q29-L32 PolarHBondContact O-N 3.29Å; L32-A35 PolarHBondContact O-N 3.44Å; L32-F36 VanDerWaalsContact O-CB 3.27Å; L32-F36 WeakPolarHBondContact O-CB 3.36Å; L32-F36 PolarHBondContact O-N 2.55Å; L32-L61 HydrophobicContact CB-CD2 4.4Å; L32-L61 HydrophobicContact CD2-CD2 3.82Å; L32-T65 WeakPolarHBondContact CD1-OG1 3.26Å; L32-M68 HydrophobicContact CD2-CE 3.68Å; L32-M68 HydrophobicContact CG-CE 4.05Å
33	I	98.1	Very high	97	Very high	62 Å²	62	27.7 Å²	27.7	32%	0.318	15%	0.154	S	C	.	.	H	α-helix	trans	-58.5	-57.5	174.6	-60	173.6	0	0	0	111.4	Q29 N31 A35 F36 A37 V288 F291	Q29-I33 PolarHBondContact O-N 3.39Å; N31-I33 VanDerWaalsContact C-N 3.3Å; I33-A35 VanDerWaalsContact C-N 3.33Å; I33-A35 PolarHBondContact O-N 3.44Å; I33-F36 PolarHBondContact O-N 3.41Å; I33-A37 WeakPolarHBondContact O-CB 3.43Å; I33-A37 PolarHBondContact O-N 3.34Å; I33-V288 HydrophobicContact CD1-CG2 4.25Å; I33-F291 HydrophobicContact CG2-CB 3.88Å
34	P	98.4	Very high	96.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-67.9	-31.6	178.2	28.8	-37.6	0	0	0	112.6	G30 N31 A37 G38 P164 V186 F291	G30-P34 WeakPolarHBondContact O-CD 3.33Å; N31-P34 VanDerWaalsContact O-CD 3.27Å; N31-P34 WeakPolarHBondContact O-CD 3.45Å; N31-P34 VanDerWaalsContact O-CG 3.26Å; N31-P34 WeakPolarHBondContact O-CG 3.35Å; P34-A37 PolarHBondContact O-N 3.03Å; P34-G38 PolarHBondContact O-N 3.02Å; P34-P164 HydrophobicContact CB-CB 4.14Å; P34-P164 HydrophobicContact CB-CG 4.18Å; P34-P164 WeakPolarHBondContact O-CA 3.5Å; P34-P164 WeakPolarHBondContact O-CB 3.17Å; P34-V186 HydrophobicContact CB-CG2 4.07Å; P34-V186 HydrophobicContact CG-CG2 4.49Å; P34-F291 HydrophobicContact CB-CD1 4.12Å; P34-F291 HydrophobicContact CB-CD2 4.05Å; P34-F291 HydrophobicContact CB-CE1 3.61Å; P34-F291 HydrophobicContact CB-CE2 3.61Å; P34-F291 HydrophobicContact CB-CG 4.3Å; P34-F291 HydrophobicContact CB-CZ 3.36Å
35	A	98.6	Very high	96.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-49.1	173.4	0	0	0	0	0	112	N31 L32 I33 A37 G38 A39 M60 P163 G167	N31-A35 WeakPolarHBondContact O-CB 3.39Å; N31-A35 PolarHBondContact O-N 3.2Å; L32-A35 PolarHBondContact O-N 3.44Å; I33-A35 VanDerWaalsContact C-N 3.33Å; I33-A35 PolarHBondContact O-N 3.44Å; A35-A37 PolarHBondContact O-N 2.96Å; A35-G38 PolarHBondContact O-N 3.41Å; A35-A39 PolarHBondContact O-N 2.96Å; A35-A39 VanDerWaalsContact O-N 3.1Å; A35-M60 HydrophobicContact CB-SD 4.07Å; A35-P163 WeakPolarHBondContact CA-O 3.35Å; A35-P163 HydrophobicContact CB-CB 3.95Å; A35-G167 WeakPolarHBondContact O-CA 3.41Å
36	F	98.3	Very high	96.7	Very high	76 Å²	76	28.6 Å²	28.6	33%	0.333	16%	0.162	S	C	.	.	H	α-helix	trans	-60.1	-46.5	175.5	174.7	-98.7	0	0	0	111.3	L32 I33 G38 A39 W40 I57 L61	L32-F36 VanDerWaalsContact O-CB 3.27Å; L32-F36 WeakPolarHBondContact O-CB 3.36Å; L32-F36 PolarHBondContact O-N 2.55Å; I33-F36 PolarHBondContact O-N 3.41Å; F36-G38 VanDerWaalsContact C-N 3.3Å; F36-G38 PolarHBondContact O-N 3.36Å; F36-A39 PolarHBondContact O-N 3.4Å; F36-A39 VanDerWaalsContact O-N 3.17Å; F36-W40 HydrophobicContact CE1-CB 4.26Å; F36-W40 HydrophobicContact CZ-CB 4.43Å; F36-W40 HydrophobicContact CZ-CE3 4.38Å; F36-W40 WeakPolarHBondContact O-CB 2.97Å; F36-W40 PolarHBondContact O-N 2.99Å; F36-I57 HydrophobicContact CD2-CG2 4.15Å; F36-I57 HydrophobicContact CE2-CG2 4.3Å; F36-L61 HydrophobicContact CB-CD2 4.3Å; F36-L61 HydrophobicContact CD2-CD1 4.49Å
37	A	98.1	Very high	96.6	Very high	2 Å²	2	33 Å²	33	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-37	179.4	0	0	0	0	0	112.6	I33 P34 A35 W40 L41 F291 V295	I33-A37 WeakPolarHBondContact O-CB 3.43Å; I33-A37 PolarHBondContact O-N 3.34Å; P34-A37 PolarHBondContact O-N 3.03Å; A35-A37 PolarHBondContact O-N 2.96Å; A37-W40 PolarHBondContact O-N 2.88Å; A37-L41 WeakPolarHBondContact O-CB 3.46Å; A37-L41 VanDerWaalsContact O-CG 3.28Å; A37-L41 WeakPolarHBondContact O-CG 3.39Å; A37-L41 PolarHBondContact O-N 3.34Å; A37-F291 HydrophobicContact CB-CB 4.17Å; A37-F291 HydrophobicContact CB-CD1 3.37Å; A37-F291 HydrophobicContact CB-CE1 4.13Å; A37-F291 HydrophobicContact CB-CG 4.18Å; A37-V295 HydrophobicContact CB-CG2 4.01Å
38	G	98.4	Very high	96.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-45.8	172.5	0	0	0	0	0	112.5	P34 A35 F36 A42 W168	P34-G38 PolarHBondContact O-N 3.02Å; A35-G38 PolarHBondContact O-N 3.41Å; F36-G38 VanDerWaalsContact C-N 3.3Å; F36-G38 PolarHBondContact O-N 3.36Å; G38-A42 PolarHBondContact O-N 3.02Å; G38-W168 WeakPolarHBondContact O-CA 3.16Å
39	A	98.4	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.4	-44	176.9	0	0	0	0	0	112.5	A35 F36 L41 A42 V43 I57 M60 G167 I171	A35-A39 PolarHBondContact O-N 2.96Å; A35-A39 VanDerWaalsContact O-N 3.1Å; F36-A39 PolarHBondContact O-N 3.4Å; F36-A39 VanDerWaalsContact O-N 3.17Å; A39-L41 PolarHBondContact O-N 3Å; A39-A42 WeakPolarHBondContact O-CB 3.43Å; A39-A42 PolarHBondContact O-N 3.24Å; A39-V43 WeakPolarHBondContact O-CG2 3.44Å; A39-V43 PolarHBondContact O-N 3.1Å; A39-I57 HydrophobicContact CB-CG1 4.17Å; A39-M60 HydrophobicContact CB-CE 3.78Å; A39-G167 VanDerWaalsContact CA-C 3.49Å; A39-G167 WeakPolarHBondContact CA-O 3.43Å; A39-G167 VanDerWaalsContact CB-O 3.22Å; A39-G167 WeakPolarHBondContact CB-O 3.47Å; A39-G167 VanDerWaalsContact N-C 3.27Å; A39-G167 PolarHBondContact N-O 3.41Å; A39-I171 HydrophobicContact CB-CG1 4.04Å
40	W	97.3	Very high	95.8	Very high	24 Å²	24	35.4 Å²	35.4	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-48.9	176.5	172.7	-95.7	0	0	0	111.7	F36 A37 A42 V43 V44 F50 V295 S298 L299	F36-W40 HydrophobicContact CE1-CB 4.26Å; F36-W40 HydrophobicContact CZ-CB 4.43Å; F36-W40 HydrophobicContact CZ-CE3 4.38Å; F36-W40 WeakPolarHBondContact O-CB 2.97Å; F36-W40 PolarHBondContact O-N 2.99Å; A37-W40 PolarHBondContact O-N 2.88Å; W40-A42 VanDerWaalsContact C-N 3.31Å; W40-A42 PolarHBondContact O-N 2.93Å; W40-V43 PolarHBondContact O-N 3.44Å; W40-V44 HydrophobicContact CD2-CG2 4.24Å; W40-V44 HydrophobicContact CH2-CG2 4.27Å; W40-V44 HydrophobicContact CZ2-CG2 3.61Å; W40-V44 WeakPolarHBondContact O-CG2 3.46Å; W40-V44 PolarHBondContact O-N 2.93Å; W40-F50 HydrophobicContact CE3-CD2 4.22Å; W40-F50 HydrophobicContact CE3-CE2 4Å; W40-F50 AromaticContact CZ3-CD2 3.66Å; W40-F50 HydrophobicContact CZ3-CD2 3.66Å; W40-F50 AromaticContact CZ3-CE2 3.57Å; W40-F50 HydrophobicContact CZ3-CE2 3.57Å; W40-F50 HydrophobicContact CZ3-CZ 4.4Å; W40-V295 HydrophobicContact CB-CG2 4.5Å; W40-V295 HydrophobicContact CD2-CG1 4.34Å; W40-V295 HydrophobicContact CG-CG1 4.25Å; W40-V295 HydrophobicContact CG-CG2 4.15Å; W40-V295 PolarHBondContact NE1-O 3.24Å; W40-S298 PolarHBondContact NE1-OG 2.85Å; W40-L299 HydrophobicContact CH2-CD2 3.53Å; W40-L299 HydrophobicContact CH2-CG 4.33Å; W40-L299 HydrophobicContact CZ2-CD1 4.47Å; W40-L299 HydrophobicContact CZ2-CD2 3.26Å; W40-L299 HydrophobicContact CZ2-CG 3.62Å
41	L	97.2	Very high	95.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-35.7	177.9	-72.3	179.8	0	0	0	112.2	A37 A39 M45 W168 T178 L182 L243 A294	A37-L41 WeakPolarHBondContact O-CB 3.46Å; A37-L41 VanDerWaalsContact O-CG 3.28Å; A37-L41 WeakPolarHBondContact O-CG 3.39Å; A37-L41 PolarHBondContact O-N 3.34Å; A39-L41 PolarHBondContact O-N 3Å; L41-M45 HydrophobicContact CB-SD 4.34Å; L41-M45 WeakPolarHBondContact O-CB 3.19Å; L41-M45 WeakPolarHBondContact O-CG 3.42Å; L41-M45 PolarHBondContact O-N 2.78Å; L41-W168 HydrophobicContact CB-CE3 4.4Å; L41-W168 HydrophobicContact CB-CZ3 4.15Å; L41-T178 HydrophobicContact CD1-CG2 4.36Å; L41-L182 HydrophobicContact CD1-CD1 3.85Å; L41-L182 HydrophobicContact CD1-CD2 4.11Å; L41-L182 HydrophobicContact CD1-CG 4.49Å; L41-L243 HydrophobicContact CD1-CD1 4.24Å; L41-L243 HydrophobicContact CD2-CD1 4.48Å; L41-L243 HydrophobicContact CD2-CD2 3.68Å; L41-A294 HydrophobicContact CD1-CB 4.23Å
42	A	97.4	Very high	95.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-51.7	171.8	0	0	0	0	0	110.5	G38 A39 W40 V44 M45 T46 W168 I171	G38-A42 PolarHBondContact O-N 3.02Å; A39-A42 WeakPolarHBondContact O-CB 3.43Å; A39-A42 PolarHBondContact O-N 3.24Å; W40-A42 VanDerWaalsContact C-N 3.31Å; W40-A42 PolarHBondContact O-N 2.93Å; A42-V44 PolarHBondContact O-N 3.19Å; A42-M45 PolarHBondContact O-N 3.1Å; A42-T46 WeakPolarHBondContact O-CB 3.5Å; A42-T46 PolarHBondContact O-N 3.4Å; A42-T46 PolarHBondContact O-OG1 3.42Å; A42-W168 HydrophobicContact CB-CB 4.49Å; A42-W168 HydrophobicContact CB-CD2 3.77Å; A42-W168 HydrophobicContact CB-CE3 3.8Å; A42-W168 HydrophobicContact CB-CG 4.11Å; A42-W168 HydrophobicContact CB-CZ3 4.25Å; A42-I171 HydrophobicContact CB-CB 3.78Å; A42-I171 HydrophobicContact CB-CG1 4.22Å; A42-I171 HydrophobicContact CB-CG2 4.1Å
43	V	96.6	Very high	95.3	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.03	22%	0.217	C	C	.	.	H	α-helix	trans	-52.9	-51.9	178.5	172.1	0	0	0	0	111.7	A39 W40 N47 H48 F50 I57 I171	A39-V43 WeakPolarHBondContact O-CG2 3.44Å; A39-V43 PolarHBondContact O-N 3.1Å; W40-V43 PolarHBondContact O-N 3.44Å; V43-N47 PolarHBondContact O-N 3.3Å; V43-H48 HydrophobicContact CG1-CB 4.39Å; V43-H48 WeakPolarHBondContact CG1-O 3.3Å; V43-H48 PolarHBondContact O-N 3.02Å; V43-F50 HydrophobicContact CG1-CB 4.29Å; V43-F50 HydrophobicContact CG1-CD2 4.47Å; V43-I57 HydrophobicContact CG2-CD1 4.38Å; V43-I171 HydrophobicContact CG2-CD1 4.28Å; V43-I171 HydrophobicContact CG2-CG1 4.09Å; V43-I171 HydrophobicContact CG2-CG2 3.86Å
44	V	94.8	Very high	95.3	Very high	12 Å²	12	40.8 Å²	40.8	7%	0.073	22%	0.217	C	C	.	.	H	α-helix	trans	-68.7	-48.6	-175.7	174.1	0	0	0	0	111.9	W40 A42 T46 N47 S298 L302	W40-V44 HydrophobicContact CD2-CG2 4.24Å; W40-V44 HydrophobicContact CH2-CG2 4.27Å; W40-V44 HydrophobicContact CZ2-CG2 3.61Å; W40-V44 WeakPolarHBondContact O-CG2 3.46Å; W40-V44 PolarHBondContact O-N 2.93Å; A42-V44 PolarHBondContact O-N 3.19Å; V44-T46 VanDerWaalsContact C-N 3.31Å; V44-T46 PolarHBondContact O-N 3.07Å; V44-N47 PolarHBondContact O-N 3.28Å; V44-S298 WeakPolarHBondContact CG1-O 3.38Å; V44-L302 HydrophobicContact CG1-CD1 4.35Å; V44-L302 HydrophobicContact CG1-CD2 3.98Å; V44-L302 HydrophobicContact CG1-CG 4.01Å; V44-L302 HydrophobicContact CG2-CD1 4.03Å
45	M	93.9	Very high	95.3	Very high	59 Å²	59	44.7 Å²	44.7	29%	0.291	24%	0.242	S	C	.	.	H	α-helix	trans	-76.7	-19.3	-172.1	-63.8	-179.1	70.1	0	0	113.5	L41 A42 W168 T178 N242 L243	L41-M45 HydrophobicContact CB-SD 4.34Å; L41-M45 WeakPolarHBondContact O-CB 3.19Å; L41-M45 WeakPolarHBondContact O-CG 3.42Å; L41-M45 PolarHBondContact O-N 2.78Å; A42-M45 PolarHBondContact O-N 3.1Å; M45-W168 HydrophobicContact CB-CH2 4.19Å; M45-W168 HydrophobicContact SD-CH2 4.18Å; M45-W168 HydrophobicContact SD-CZ3 4Å; M45-T178 HydrophobicContact CE-CG2 4.43Å; M45-T178 WeakPolarHBondContact CE-OG1 3.48Å; M45-T178 HydrophobicContact SD-CG2 3.79Å; M45-N242 HydrophobicContact CE-CB 3.78Å; M45-L243 HydrophobicContact SD-CD2 3.91Å
46	T	93.8	Very high	95.2	Very high	40 Å²	40	47.8 Å²	47.8	25%	0.245	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	9.1	179.3	65.3	0	0	0	0	112.6	A42 V44 H48 W168 E172	A42-T46 WeakPolarHBondContact O-CB 3.5Å; A42-T46 PolarHBondContact O-N 3.4Å; A42-T46 PolarHBondContact O-OG1 3.42Å; V44-T46 VanDerWaalsContact C-N 3.31Å; V44-T46 PolarHBondContact O-N 3.07Å; T46-H48 VanDerWaalsContact C-N 3.29Å; T46-H48 PolarHBondContact O-N 3.06Å; T46-H48 PolarHBondContact OG1-CD2 2.87Å; T46-H48 PolarHBondContact OG1-NE2 3.45Å; T46-W168 HydrophobicContact CG2-CH2 4.41Å; T46-W168 HydrophobicContact CG2-CZ2 4.13Å; T46-E172 HydrophobicContact CG2-CG 4.21Å; T46-E172 PolarHBondContact OG1-OE2 3.47Å
47	N	91.3	Very high	95.2	Very high	145 Å²	145	44.7 Å²	44.7	78%	0.775	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	33.8	177.4	-57.7	-63.4	0	0	0	114.5	V43 V44	V43-N47 PolarHBondContact O-N 3.3Å; V44-N47 PolarHBondContact O-N 3.28Å
48	H	90.8	Very high	95.3	Very high	72 Å²	72	49.7 Å²	49.7	33%	0.333	27%	0.269	S	S	.	.			trans	-73.5	146.3	170.2	-75.1	-127.4	0	0	0	109.9	V43 T46 F50 I171 E172	V43-H48 HydrophobicContact CG1-CB 4.39Å; V43-H48 WeakPolarHBondContact CG1-O 3.3Å; V43-H48 PolarHBondContact O-N 3.02Å; T46-H48 VanDerWaalsContact C-N 3.29Å; T46-H48 PolarHBondContact O-N 3.06Å; T46-H48 PolarHBondContact OG1-CD2 2.87Å; T46-H48 PolarHBondContact OG1-NE2 3.45Å; H48-F50 PolarHBondContact O-N 3.02Å; H48-I171 HydrophobicContact CB-CG2 4.42Å; H48-E172 IonicContact NE2-OE2 2.73Å; H48-E172 PolarHBondContact NE2-OE2 3.09Å
49	S	90	Very high	95.3	Very high	70 Å²	70	52.2 Å²	52.2	49%	0.49	28%	0.282	S	S	.	.			trans	-69.5	118.6	174.5	165.6	0	0	0	0	110.1	L51 S52 S53	S49-L51 VanDerWaalsContact C-N 3.31Å; S49-L51 PolarHBondContact O-N 3.36Å; S49-S52 WeakPolarHBondContact CB-OG 3.48Å; S49-S52 WeakPolarHBondContact O-CA 3.43Å; S49-S52 WeakPolarHBondContact O-CB 3.38Å; S49-S52 PolarHBondContact O-N 3.18Å; S49-S52 PolarHBondContact O-OG 3.06Å; S49-S53 PolarHBondContact O-N 3.27Å; S49-S53 PolarHBondContact O-OG 3.01Å; S49-S53 VanDerWaalsContact O-OG 3.11Å
50	F	88.6	Confident	95.3	Very high	92 Å²	92	52.2 Å²	52.2	40%	0.404	28%	0.282	S	S	.	.	H	α-helix	trans	-51.3	-48.1	-178.8	175.3	-106	0	0	0	112.7	W40 V43 H48 S52 S53 I54	W40-F50 HydrophobicContact CE3-CD2 4.22Å; W40-F50 HydrophobicContact CE3-CE2 4Å; W40-F50 AromaticContact CZ3-CD2 3.66Å; W40-F50 HydrophobicContact CZ3-CD2 3.66Å; W40-F50 AromaticContact CZ3-CE2 3.57Å; W40-F50 HydrophobicContact CZ3-CE2 3.57Å; W40-F50 HydrophobicContact CZ3-CZ 4.4Å; V43-F50 HydrophobicContact CG1-CB 4.29Å; V43-F50 HydrophobicContact CG1-CD2 4.47Å; H48-F50 PolarHBondContact O-N 3.02Å; F50-S52 VanDerWaalsContact C-N 3.26Å; F50-S52 PolarHBondContact O-N 3.45Å; F50-S53 PolarHBondContact O-N 2.83Å; F50-I54 HydrophobicContact CD1-CD1 4.46Å; F50-I54 HydrophobicContact CE1-CD1 4.01Å; F50-I54 HydrophobicContact CE1-CG1 4.24Å; F50-I54 HydrophobicContact CZ-CD1 4.45Å; F50-I54 HydrophobicContact CZ-CG1 4.28Å; F50-I54 PolarHBondContact O-N 2.92Å
51	L	92.2	Very high	95.4	Very high	132 Å²	132	53 Å²	53	69%	0.691	29%	0.288	S	S	*	.	H	α-helix	trans	-61.4	-36.4	179.8	-67.8	178.1	0	0	0	112.1	S49 S53 I54	S49-L51 VanDerWaalsContact C-N 3.31Å; S49-L51 PolarHBondContact O-N 3.36Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.34Å; L51-I54 HydrophobicContact CD2-CD1 3.92Å
52	S	93.4	Very high	95.4	Very high	65 Å²	65	58.4 Å²	58.4	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-73.6	-20.7	177.2	76.6	0	0	0	0	113.5	S49 F50 Q56	S49-S52 WeakPolarHBondContact CB-OG 3.48Å; S49-S52 WeakPolarHBondContact O-CA 3.43Å; S49-S52 WeakPolarHBondContact O-CB 3.38Å; S49-S52 PolarHBondContact O-N 3.18Å; S49-S52 PolarHBondContact O-OG 3.06Å; F50-S52 VanDerWaalsContact C-N 3.26Å; F50-S52 PolarHBondContact O-N 3.45Å; S52-Q56 PolarHBondContact O-NE2 3.44Å; S52-Q56 PolarHBondContact O-OE1 3.34Å
53	S	96.3	Very high	95.5	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.007	31%	0.312	C	S	.	.	H	α-helix	trans	-91.4	-11.9	180	-55.5	0	0	0	0	113.6	S49 F50 L51 Q56 I57	S49-S53 PolarHBondContact O-N 3.27Å; S49-S53 PolarHBondContact O-OG 3.01Å; S49-S53 VanDerWaalsContact O-OG 3.11Å; F50-S53 PolarHBondContact O-N 2.83Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.34Å; S53-Q56 PolarHBondContact O-N 3.3Å; S53-Q56 PolarHBondContact O-OE1 3.01Å; S53-I57 WeakPolarHBondContact O-CG1 3.41Å; S53-I57 PolarHBondContact O-N 3.39Å
54	I	97.2	Very high	95.6	Very high	61 Å²	61	58.3 Å²	58.3	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-54.4	-47.9	-179.8	-72.2	171.4	0	0	0	112.2	F50 L51 Q56 I57 L58	F50-I54 HydrophobicContact CD1-CD1 4.46Å; F50-I54 HydrophobicContact CE1-CD1 4.01Å; F50-I54 HydrophobicContact CE1-CG1 4.24Å; F50-I54 HydrophobicContact CZ-CD1 4.45Å; F50-I54 HydrophobicContact CZ-CG1 4.28Å; F50-I54 PolarHBondContact O-N 2.92Å; L51-I54 HydrophobicContact CD2-CD1 3.92Å; I54-Q56 VanDerWaalsContact C-N 3.3Å; I54-Q56 PolarHBondContact O-N 3.09Å; I54-I57 PolarHBondContact O-N 3.46Å; I54-L58 HydrophobicContact CG2-CD1 3.8Å; I54-L58 HydrophobicContact CG2-CG 4.17Å; I54-L58 WeakPolarHBondContact O-CG 3.18Å; I54-L58 PolarHBondContact O-N 3.45Å
55	P	98	Very high	95.8	Very high	82 Å²	82	59.3 Å²	59.3	53%	0.532	32%	0.317	S	S	.	.	H	α-helix	trans	-58.2	-40.6	179.3	-25.7	35.7	0	0	0	113.4	L58 L59	P55-L58 PolarHBondContact O-N 2.84Å; P55-L59 VanDerWaalsContact O-CB 3.31Å; P55-L59 WeakPolarHBondContact O-CB 3.34Å; P55-L59 PolarHBondContact O-N 3.11Å
56	Q	98.1	Very high	96	Very high	66 Å²	66	57.7 Å²	57.7	31%	0.308	31%	0.31	S	S	.	.	H	α-helix	trans	-67.3	-43.8	179.5	-62	85.5	-30.8	0	0	110.4	S52 S53 I54 L59 M60 L122 I171	S52-Q56 PolarHBondContact O-NE2 3.44Å; S52-Q56 PolarHBondContact O-OE1 3.34Å; S53-Q56 PolarHBondContact O-N 3.3Å; S53-Q56 PolarHBondContact O-OE1 3.01Å; I54-Q56 VanDerWaalsContact C-N 3.3Å; I54-Q56 PolarHBondContact O-N 3.09Å; Q56-L59 PolarHBondContact O-N 3.21Å; Q56-M60 WeakPolarHBondContact O-CB 3.48Å; Q56-M60 PolarHBondContact O-N 3.45Å; Q56-L122 HydrophobicContact CB-CD2 3.82Å; Q56-L122 HydrophobicContact CG-CD2 4.06Å; Q56-I171 HydrophobicContact CB-CD1 3.81Å
57	I	98.4	Very high	96.3	Very high	10 Å²	10	56.2 Å²	56.2	5%	0.051	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-47.4	175.6	-66.5	170.9	0	0	0	110.2	F36 A39 V43 S53 I54 M60 L61 I171	F36-I57 HydrophobicContact CD2-CG2 4.15Å; F36-I57 HydrophobicContact CE2-CG2 4.3Å; A39-I57 HydrophobicContact CB-CG1 4.17Å; V43-I57 HydrophobicContact CG2-CD1 4.38Å; S53-I57 WeakPolarHBondContact O-CG1 3.41Å; S53-I57 PolarHBondContact O-N 3.39Å; I54-I57 PolarHBondContact O-N 3.46Å; I57-M60 PolarHBondContact O-N 3.06Å; I57-L61 HydrophobicContact CG2-CD1 3.81Å; I57-L61 HydrophobicContact CG2-CG 4.28Å; I57-L61 WeakPolarHBondContact O-CB 3.17Å; I57-L61 VanDerWaalsContact O-CG 3.23Å; I57-L61 WeakPolarHBondContact O-CG 3.36Å; I57-L61 PolarHBondContact O-N 2.86Å; I57-I171 HydrophobicContact CG1-CD1 3.94Å
58	L	98.6	Very high	96.6	Very high	108 Å²	108	50.6 Å²	50.6	57%	0.565	27%	0.27	S	S	*	.	H	α-helix	trans	-64.4	-44.2	-179.8	-69.1	177.9	0	0	0	111.9	I54 P55 L61 F62	I54-L58 HydrophobicContact CG2-CD1 3.8Å; I54-L58 HydrophobicContact CG2-CG 4.17Å; I54-L58 WeakPolarHBondContact O-CG 3.18Å; I54-L58 PolarHBondContact O-N 3.45Å; P55-L58 PolarHBondContact O-N 2.84Å; L58-L61 PolarHBondContact O-N 3.3Å; L58-F62 VanDerWaalsContact O-CB 3.29Å; L58-F62 WeakPolarHBondContact O-CB 3.32Å; L58-F62 PolarHBondContact O-N 2.88Å
59	L	98.7	Very high	97	Very high	53 Å²	53	47.2 Å²	47.2	28%	0.277	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-39.8	177.2	-176	60.7	0	0	0	111.6	P55 Q56 F62 G63 C118 L121 L122	P55-L59 VanDerWaalsContact O-CB 3.31Å; P55-L59 WeakPolarHBondContact O-CB 3.34Å; P55-L59 PolarHBondContact O-N 3.11Å; Q56-L59 PolarHBondContact O-N 3.21Å; L59-F62 PolarHBondContact O-N 3.41Å; L59-G63 PolarHBondContact O-N 3.31Å; L59-C118 HydrophobicContact CD1-CB 3.64Å; L59-C118 HydrophobicContact CG-CB 4.2Å; L59-L121 HydrophobicContact CD2-CB 4.25Å; L59-L122 HydrophobicContact CB-CD2 4.22Å; L59-L122 HydrophobicContact CD2-CD2 3.84Å; L59-L122 HydrophobicContact CD2-CG 3.95Å; L59-L122 HydrophobicContact CG-CD2 4.27Å; L59-L122 HydrophobicContact CG-CG 4.25Å
60	M	98.7	Very high	97.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-47.4	175.1	177.6	-80.9	-63.5	0	0	111.6	A35 A39 Q56 I57 F62 G63 S64 L122 I166 A170	A35-M60 HydrophobicContact CB-SD 4.07Å; A39-M60 HydrophobicContact CB-CE 3.78Å; Q56-M60 WeakPolarHBondContact O-CB 3.48Å; Q56-M60 PolarHBondContact O-N 3.45Å; I57-M60 PolarHBondContact O-N 3.06Å; M60-F62 VanDerWaalsContact C-N 3.33Å; M60-F62 PolarHBondContact O-N 2.86Å; M60-G63 PolarHBondContact O-N 3.13Å; M60-S64 WeakPolarHBondContact O-CB 3.49Å; M60-S64 PolarHBondContact O-N 3.14Å; M60-S64 PolarHBondContact O-OG 3.41Å; M60-L122 HydrophobicContact CB-CD1 3.73Å; M60-L122 HydrophobicContact CG-CD1 4.5Å; M60-I166 HydrophobicContact CG-CG2 3.81Å; M60-I166 HydrophobicContact SD-CG2 4.29Å; M60-A170 HydrophobicContact CB-CB 3.78Å; M60-A170 HydrophobicContact CG-CB 3.59Å
61	L	98.7	Very high	97.9	Very high	39 Å²	39	39.7 Å²	39.7	20%	0.204	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-41.6	178.9	-71.3	172.9	0	0	0	111	L32 F36 I57 L58 T65	L32-L61 HydrophobicContact CB-CD2 4.4Å; L32-L61 HydrophobicContact CD2-CD2 3.82Å; F36-L61 HydrophobicContact CB-CD2 4.3Å; F36-L61 HydrophobicContact CD2-CD1 4.49Å; I57-L61 HydrophobicContact CG2-CD1 3.81Å; I57-L61 HydrophobicContact CG2-CG 4.28Å; I57-L61 WeakPolarHBondContact O-CB 3.17Å; I57-L61 VanDerWaalsContact O-CG 3.23Å; I57-L61 WeakPolarHBondContact O-CG 3.36Å; I57-L61 PolarHBondContact O-N 2.86Å; L58-L61 PolarHBondContact O-N 3.3Å; L61-T65 WeakPolarHBondContact O-CB 3.45Å; L61-T65 PolarHBondContact O-N 3.03Å; L61-T65 PolarHBondContact O-OG1 2.86Å
62	F	98.7	Very high	98.2	Very high	114 Å²	114	33.5 Å²	33.5	50%	0.5	18%	0.181	S	C	.	.	H	α-helix	trans	-65.1	-51.1	176.6	-177.8	-107.8	0	0	0	111.7	L58 L59 M60 S64 T65 L66	L58-F62 VanDerWaalsContact O-CB 3.29Å; L58-F62 WeakPolarHBondContact O-CB 3.32Å; L58-F62 PolarHBondContact O-N 2.88Å; L59-F62 PolarHBondContact O-N 3.41Å; M60-F62 VanDerWaalsContact C-N 3.33Å; M60-F62 PolarHBondContact O-N 2.86Å; F62-S64 PolarHBondContact O-N 3.09Å; F62-T65 WeakPolarHBondContact O-CB 3.16Å; F62-T65 PolarHBondContact O-N 3.38Å; F62-L66 HydrophobicContact CD1-CD1 3.99Å; F62-L66 HydrophobicContact CE1-CD1 3.45Å; F62-L66 VanDerWaalsContact CE1-CD1 3.45Å; F62-L66 HydrophobicContact CE1-CG 4.33Å; F62-L66 HydrophobicContact CE2-CD1 4.32Å; F62-L66 HydrophobicContact CE2-CG 4.43Å; F62-L66 HydrophobicContact CZ-CD1 3.64Å; F62-L66 HydrophobicContact CZ-CD2 4.5Å; F62-L66 HydrophobicContact CZ-CG 4.23Å; F62-L66 WeakPolarHBondContact O-CG 3.41Å; F62-L66 PolarHBondContact O-N 2.96Å
63	G	98.8	Very high	98.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-46.8	178.2	0	0	0	0	0	112.4	L59 M60 T65 L66 I67 G115	L59-G63 PolarHBondContact O-N 3.31Å; M60-G63 PolarHBondContact O-N 3.13Å; G63-T65 PolarHBondContact O-N 3.47Å; G63-L66 PolarHBondContact O-N 3.3Å; G63-I67 WeakPolarHBondContact O-CG1 3.46Å; G63-I67 PolarHBondContact O-N 3.17Å; G63-G115 WeakPolarHBondContact O-CA 3.07Å
64	S	98.7	Very high	98.5	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.028	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-39.1	177.2	-57	0	0	0	0	112.2	M60 F62 L66 I67 M68	M60-S64 WeakPolarHBondContact O-CB 3.49Å; M60-S64 PolarHBondContact O-N 3.14Å; M60-S64 PolarHBondContact O-OG 3.41Å; F62-S64 PolarHBondContact O-N 3.09Å; S64-L66 VanDerWaalsContact C-N 3.35Å; S64-I67 PolarHBondContact O-N 2.87Å; S64-M68 WeakPolarHBondContact O-CB 3.28Å; S64-M68 VanDerWaalsContact O-CE 3.27Å; S64-M68 WeakPolarHBondContact O-CE 3.42Å; S64-M68 VanDerWaalsContact O-CG 3.3Å; S64-M68 WeakPolarHBondContact O-CG 3.38Å; S64-M68 PolarHBondContact O-N 3.25Å
65	T	98.7	Very high	98.5	Very high	32 Å²	32	27.7 Å²	27.7	20%	0.196	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-46.2	174.3	-67.6	0	0	0	0	111.3	V28 L32 L61 F62 G63 G69	V28-T65 HydrophobicContact CG1-CG2 4.01Å; L32-T65 WeakPolarHBondContact CD1-OG1 3.26Å; L61-T65 WeakPolarHBondContact O-CB 3.45Å; L61-T65 PolarHBondContact O-N 3.03Å; L61-T65 PolarHBondContact O-OG1 2.86Å; F62-T65 WeakPolarHBondContact O-CB 3.16Å; F62-T65 PolarHBondContact O-N 3.38Å; G63-T65 PolarHBondContact O-N 3.47Å; T65-G69 PolarHBondContact O-N 3.35Å
66	L	98.7	Very high	98.5	Very high	25 Å²	25	23.9 Å²	23.9	13%	0.131	12%	0.12	C	C	.	.	H	α-helix	trans	-65.5	-45.9	179.3	-71.3	179.7	0	0	0	111.8	F62 G63 S64 G69 G70 M111 V114	F62-L66 HydrophobicContact CD1-CD1 3.99Å; F62-L66 HydrophobicContact CE1-CD1 3.45Å; F62-L66 VanDerWaalsContact CE1-CD1 3.45Å; F62-L66 HydrophobicContact CE1-CG 4.33Å; F62-L66 HydrophobicContact CE2-CD1 4.32Å; F62-L66 HydrophobicContact CE2-CG 4.43Å; F62-L66 HydrophobicContact CZ-CD1 3.64Å; F62-L66 HydrophobicContact CZ-CD2 4.5Å; F62-L66 HydrophobicContact CZ-CG 4.23Å; F62-L66 WeakPolarHBondContact O-CG 3.41Å; F62-L66 PolarHBondContact O-N 2.96Å; G63-L66 PolarHBondContact O-N 3.3Å; S64-L66 VanDerWaalsContact C-N 3.35Å; L66-G69 PolarHBondContact O-N 3.16Å; L66-G70 PolarHBondContact O-N 3.48Å; L66-M111 WeakPolarHBondContact CB-O 3.46Å; L66-M111 HydrophobicContact CD2-CE 4.01Å; L66-M111 HydrophobicContact CD2-CG 4.34Å; L66-V114 HydrophobicContact CD1-CB 4.02Å; L66-V114 HydrophobicContact CD1-CG1 3.59Å
67	I	98.7	Very high	98.4	Very high	10 Å²	10	23.8 Å²	23.8	5%	0.051	12%	0.118	C	C	.	.	H	α-helix	trans	-58.8	-54.8	176.3	-72.6	175	0	0	0	110.9	G63 S64 G69 G70 A71 E116 L119 I134	G63-I67 WeakPolarHBondContact O-CG1 3.46Å; G63-I67 PolarHBondContact O-N 3.17Å; S64-I67 PolarHBondContact O-N 2.87Å; I67-G69 VanDerWaalsContact C-N 3.34Å; I67-G69 PolarHBondContact O-N 3.46Å; I67-G70 PolarHBondContact O-N 2.94Å; I67-A71 VanDerWaalsContact O-CB 3.23Å; I67-A71 WeakPolarHBondContact O-CB 3.42Å; I67-A71 PolarHBondContact O-N 2.97Å; I67-E116 WeakPolarHBondContact CD1-OE2 3.19Å; I67-L119 HydrophobicContact CD1-CD1 3.44Å; I67-L119 VanDerWaalsContact CD1-CD1 3.44Å; I67-L119 HydrophobicContact CD1-CG 4.01Å; I67-I134 HydrophobicContact CD1-CD1 4.46Å; I67-I134 HydrophobicContact CG1-CD1 4.23Å; I67-I134 HydrophobicContact CG2-CD1 3.92Å; I67-I134 HydrophobicContact CG2-CG1 3.52Å
68	M	98.7	Very high	98.4	Very high	27 Å²	27	27.2 Å²	27.2	13%	0.133	13%	0.131	C	C	.	.	H	α-helix	trans	-62.8	-42.3	-177.6	-71	-174.7	-78.4	0	0	111.6	V28 N31 L32 S64 C72 P163	V28-M68 HydrophobicContact CG1-CE 4.08Å; V28-M68 HydrophobicContact CG2-CB 4.02Å; N31-M68 HydrophobicContact CB-CE 4.15Å; N31-M68 HydrophobicContact CB-SD 3.35Å; N31-M68 WeakPolarHBondContact CB-SD 3.44Å; L32-M68 HydrophobicContact CD2-CE 3.68Å; L32-M68 HydrophobicContact CG-CE 4.05Å; S64-M68 WeakPolarHBondContact O-CB 3.28Å; S64-M68 VanDerWaalsContact O-CE 3.27Å; S64-M68 WeakPolarHBondContact O-CE 3.42Å; S64-M68 VanDerWaalsContact O-CG 3.3Å; S64-M68 WeakPolarHBondContact O-CG 3.38Å; S64-M68 PolarHBondContact O-N 3.25Å; M68-C72 VanDerWaalsContact O-CB 3.26Å; M68-C72 WeakPolarHBondContact O-CB 3.46Å; M68-C72 PolarHBondContact O-N 3.48Å; M68-C72 PolarHBondContact O-SG 3.5Å; M68-P163 HydrophobicContact SD-CG 4.38Å
69	G	98.6	Very high	98.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.3	-43.8	179.1	0	0	0	0	0	112.7	T65 L66 I67 C72 A73	T65-G69 PolarHBondContact O-N 3.35Å; L66-G69 PolarHBondContact O-N 3.16Å; I67-G69 VanDerWaalsContact C-N 3.34Å; I67-G69 PolarHBondContact O-N 3.46Å; G69-C72 PolarHBondContact O-N 2.88Å; G69-A73 WeakPolarHBondContact O-CB 3.35Å; G69-A73 PolarHBondContact O-N 3.18Å
70	G	98.7	Very high	98.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.1	-42.3	175.5	0	0	0	0	0	112.5	L66 I67 C72 A73 L74 S108	L66-G70 PolarHBondContact O-N 3.48Å; I67-G70 PolarHBondContact O-N 2.94Å; G70-C72 VanDerWaalsContact C-N 3.35Å; G70-C72 PolarHBondContact O-N 3.21Å; G70-A73 PolarHBondContact O-N 2.89Å; G70-L74 PolarHBondContact O-N 3.38Å; G70-S108 WeakPolarHBondContact O-CB 3.47Å
71	A	98.7	Very high	98.1	Very high	4 Å²	4	24.1 Å²	24.1	3%	0.033	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-38	175.1	0	0	0	0	0	112	I67 L74 N75 M112 Y137 V138	I67-A71 VanDerWaalsContact O-CB 3.23Å; I67-A71 WeakPolarHBondContact O-CB 3.42Å; I67-A71 PolarHBondContact O-N 2.97Å; A71-L74 PolarHBondContact O-N 3.33Å; A71-N75 WeakPolarHBondContact O-CB 3.42Å; A71-N75 PolarHBondContact O-N 3.35Å; A71-M112 HydrophobicContact CB-SD 4.03Å; A71-Y137 HydrophobicContact CB-CD1 3.88Å; A71-Y137 HydrophobicContact CB-CE1 4.46Å; A71-Y137 WeakPolarHBondContact O-CE1 3.26Å; A71-V138 HydrophobicContact CB-CG2 4.09Å
72	C	98.4	Very high	98	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.014	11%	0.106	C	C	.	.	H	α-helix	trans	-66.9	-38.1	173.7	-76.4	0	0	0	0	113	I23 K24 L27 M68 G69 G70 N75 N76	I23-C72 WeakPolarHBondContact O-CB 3.1Å; K24-C72 HydrophobicContact CB-CB 3.99Å; K24-C72 HydrophobicContact CD-CB 3.94Å; K24-C72 HydrophobicContact CG-CB 3.97Å; L27-C72 VanDerWaalsContact CD2-SG 3.55Å; M68-C72 VanDerWaalsContact O-CB 3.26Å; M68-C72 WeakPolarHBondContact O-CB 3.46Å; M68-C72 PolarHBondContact O-N 3.48Å; M68-C72 PolarHBondContact O-SG 3.5Å; G69-C72 PolarHBondContact O-N 2.88Å; G70-C72 VanDerWaalsContact C-N 3.35Å; G70-C72 PolarHBondContact O-N 3.21Å; C72-N75 PolarHBondContact O-N 3.49Å; C72-N76 PolarHBondContact O-N 3.1Å
73	A	98.4	Very high	97.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.2	-42.5	174.8	0	0	0	0	0	111.1	I22 G69 G70 N76 Y77 L104 S108	I22-A73 HydrophobicContact CG2-CB 3.74Å; I22-A73 WeakPolarHBondContact O-CA 3.32Å; G69-A73 WeakPolarHBondContact O-CB 3.35Å; G69-A73 PolarHBondContact O-N 3.18Å; G70-A73 PolarHBondContact O-N 2.89Å; A73-N76 WeakPolarHBondContact O-CB 3.4Å; A73-N76 PolarHBondContact O-N 3.17Å; A73-N76 VanDerWaalsContact O-N 3.14Å; A73-Y77 PolarHBondContact O-N 3.3Å; A73-L104 HydrophobicContact CB-CD1 4.1Å; A73-S108 VanDerWaalsContact C-OG 3.29Å; A73-S108 WeakPolarHBondContact CB-OG 3.28Å
74	L	98.4	Very high	97.8	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-66	-38.9	174.9	-170.7	52.2	0	0	0	111.9	G70 A71 N76 Y77 Y78 L105 S108 F109 M112 V138	G70-L74 PolarHBondContact O-N 3.38Å; A71-L74 PolarHBondContact O-N 3.33Å; L74-N76 VanDerWaalsContact C-N 3.31Å; L74-N76 PolarHBondContact O-N 3.43Å; L74-Y77 HydrophobicContact CD1-CD1 4.12Å; L74-Y77 WeakPolarHBondContact O-CB 2.85Å; L74-Y77 PolarHBondContact O-N 3.23Å; L74-Y78 HydrophobicContact CD1-CD2 4.19Å; L74-Y78 HydrophobicContact CD1-CE2 3.74Å; L74-Y78 HydrophobicContact CD2-CE2 4.34Å; L74-Y78 HydrophobicContact CG-CD2 4.07Å; L74-Y78 HydrophobicContact CG-CE2 3.75Å; L74-Y78 VanDerWaalsContact O-CD2 3.24Å; L74-Y78 WeakPolarHBondContact O-CD2 3.28Å; L74-Y78 PolarHBondContact O-N 3.02Å; L74-L105 HydrophobicContact CD1-CD2 3.74Å; L74-S108 PolarHBondContact N-OG 3.42Å; L74-S108 VanDerWaalsContact N-OG 3.11Å; L74-F109 HydrophobicContact CD2-CE1 4.3Å; L74-F109 HydrophobicContact CD2-CZ 4.11Å; L74-M112 HydrophobicContact CB-CE 4.48Å; L74-M112 HydrophobicContact CD2-CE 3.66Å; L74-V138 HydrophobicContact CD2-CB 4.41Å; L74-V138 HydrophobicContact CD2-CG1 3.49Å; L74-V138 VanDerWaalsContact CD2-CG1 3.49Å; L74-V138 HydrophobicContact CD2-CG2 4.01Å; L74-V138 HydrophobicContact CG-CG1 4.02Å
75	N	97.9	Very high	97.6	Very high	2 Å²	2	27 Å²	27	1%	0.011	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-40.8	171.5	167.2	-105.2	0	0	0	111.6	K24 A71 C72 Y77 Y78 D79 Y137 S142	K24-N75 PolarHBondContact NZ-OD1 3.48Å; A71-N75 WeakPolarHBondContact O-CB 3.42Å; A71-N75 PolarHBondContact O-N 3.35Å; C72-N75 PolarHBondContact O-N 3.49Å; N75-Y77 VanDerWaalsContact C-N 3.3Å; N75-Y77 PolarHBondContact O-N 2.91Å; N75-Y78 PolarHBondContact O-N 3.21Å; N75-D79 VanDerWaalsContact CG-OD2 3.3Å; N75-D79 PolarHBondContact ND2-OD2 3.24Å; N75-D79 VanDerWaalsContact O-CB 3.28Å; N75-D79 WeakPolarHBondContact O-CB 3.36Å; N75-D79 PolarHBondContact O-N 2.81Å; N75-D79 PolarHBondContact OD1-OD2 2.96Å; N75-D79 VanDerWaalsContact OD1-OD2 3.09Å; N75-Y137 HydrophobicContact CB-CD1 4.49Å; N75-Y137 HydrophobicContact CB-CE1 3.55Å; N75-Y137 PolarHBondContact OD1-OH 3.45Å; N75-S142 WeakPolarHBondContact ND2-CB 3.47Å; N75-S142 PolarHBondContact ND2-OG 3.4Å
76	N	96.9	Very high	97.5	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-32.2	174.8	-82.1	-24.1	0	0	0	113	I22 K24 C72 A73 L74 D79 Q80 R92 T94	I22-N76 PolarHBondContact O-ND2 3.11Å; K24-N76 VanDerWaalsContact CE-CG 3.41Å; K24-N76 WeakPolarHBondContact CE-ND2 3.48Å; K24-N76 WeakPolarHBondContact CE-OD1 3.25Å; K24-N76 PolarHBondContact NZ-OD1 3.45Å; K24-N76 VanDerWaalsContact NZ-OD1 3.12Å; C72-N76 PolarHBondContact O-N 3.1Å; A73-N76 WeakPolarHBondContact O-CB 3.4Å; A73-N76 PolarHBondContact O-N 3.17Å; A73-N76 VanDerWaalsContact O-N 3.14Å; L74-N76 VanDerWaalsContact C-N 3.31Å; L74-N76 PolarHBondContact O-N 3.43Å; N76-D79 PolarHBondContact O-N 3.04Å; N76-Q80 WeakPolarHBondContact O-CG 3.36Å; N76-Q80 PolarHBondContact O-N 2.96Å; N76-R92 PolarHBondContact OD1-NH1 3.21Å; N76-T94 HydrophobicContact CB-CG2 3.95Å
77	Y	97.4	Very high	97.3	Very high	64 Å²	64	28.3 Å²	28.3	25%	0.251	13%	0.134	S	C	.	.	H	α-helix	trans	-61.6	-52.7	170.9	170.4	-103.5	0	0	0	110.6	A73 L74 N75 D79 Q80 D101 L104 L105	A73-Y77 PolarHBondContact O-N 3.3Å; L74-Y77 HydrophobicContact CD1-CD1 4.12Å; L74-Y77 WeakPolarHBondContact O-CB 2.85Å; L74-Y77 PolarHBondContact O-N 3.23Å; N75-Y77 VanDerWaalsContact C-N 3.3Å; N75-Y77 PolarHBondContact O-N 2.91Å; Y77-D79 PolarHBondContact O-N 3.49Å; Y77-Q80 WeakPolarHBondContact O-CG 3.3Å; Y77-Q80 PolarHBondContact O-N 3.32Å; Y77-Q80 PolarHBondContact O-OE1 3.04Å; Y77-D101 HydrophobicContact CD2-CB 4.35Å; Y77-D101 HydrophobicContact CE2-CB 3.83Å; Y77-L104 HydrophobicContact CD2-CD2 4.23Å; Y77-L104 HydrophobicContact CG-CD2 4.45Å; Y77-L105 HydrophobicContact CD1-CD2 3.73Å; Y77-L105 HydrophobicContact CD2-CD2 4.31Å; Y77-L105 HydrophobicContact CD2-CG 4.38Å; Y77-L105 HydrophobicContact CE1-CD2 3.8Å; Y77-L105 HydrophobicContact CE2-CD1 4.34Å; Y77-L105 HydrophobicContact CE2-CD2 4.39Å; Y77-L105 HydrophobicContact CE2-CG 4.3Å; Y77-L105 HydrophobicContact CG-CD2 3.99Å
78	Y	96.9	Very high	97	Very high	83 Å²	83	30.3 Å²	30.3	33%	0.325	15%	0.149	S	C	.	.	H	α-helix	trans	-64.8	-20.7	178.4	-75.7	-65.5	0	0	0	114.2	L74 N75 V138 I143 R147	L74-Y78 HydrophobicContact CD1-CD2 4.19Å; L74-Y78 HydrophobicContact CD1-CE2 3.74Å; L74-Y78 HydrophobicContact CD2-CE2 4.34Å; L74-Y78 HydrophobicContact CG-CD2 4.07Å; L74-Y78 HydrophobicContact CG-CE2 3.75Å; L74-Y78 VanDerWaalsContact O-CD2 3.24Å; L74-Y78 WeakPolarHBondContact O-CD2 3.28Å; L74-Y78 PolarHBondContact O-N 3.02Å; N75-Y78 PolarHBondContact O-N 3.21Å; Y78-V138 HydrophobicContact CE2-CG1 4.17Å; Y78-I143 HydrophobicContact CD1-CG1 4.07Å; Y78-I143 HydrophobicContact CD2-CD1 4.33Å; Y78-I143 HydrophobicContact CD2-CG1 3.95Å; Y78-I143 HydrophobicContact CE1-CD1 4.07Å; Y78-I143 HydrophobicContact CE1-CG1 3.92Å; Y78-I143 HydrophobicContact CE2-CD1 3.66Å; Y78-I143 HydrophobicContact CE2-CG1 3.78Å; Y78-I143 HydrophobicContact CG-CG1 4.09Å; Y78-R147 PolarHBondContact O-NH2 3.32Å
79	D	96.8	Very high	96.8	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	3.4	-176.7	-71.7	-26.9	0	0	0	113.8	N75 N76 Y77 D81 I82 D83 K146	N75-D79 VanDerWaalsContact CG-OD2 3.3Å; N75-D79 PolarHBondContact ND2-OD2 3.24Å; N75-D79 VanDerWaalsContact O-CB 3.28Å; N75-D79 WeakPolarHBondContact O-CB 3.36Å; N75-D79 PolarHBondContact O-N 2.81Å; N75-D79 PolarHBondContact OD1-OD2 2.96Å; N75-D79 VanDerWaalsContact OD1-OD2 3.09Å; N76-D79 PolarHBondContact O-N 3.04Å; Y77-D79 PolarHBondContact O-N 3.49Å; D79-D81 VanDerWaalsContact C-N 3.28Å; D79-D81 PolarHBondContact O-N 3.16Å; D79-I82 HydrophobicContact CB-CD1 4.06Å; D79-I82 HydrophobicContact CB-CG1 3.97Å; D79-I82 WeakPolarHBondContact O-CG1 3.29Å; D79-I82 PolarHBondContact O-N 2.98Å; D79-I82 WeakPolarHBondContact OD1-CD1 3.36Å; D79-D83 VanDerWaalsContact O-CB 3.26Å; D79-D83 WeakPolarHBondContact O-CB 3.23Å; D79-D83 PolarHBondContact O-N 2.67Å; D79-K146 IonicContact OD1-NZ 2.6Å; D79-K146 PolarHBondContact OD1-NZ 3.34Å; D79-K146 IonicContact OD2-NZ 3.61Å; D79-K146 PolarHBondContact OD2-NZ 3.47Å
80	Q	97.1	Very high	96.6	Very high	18 Å²	18	35.1 Å²	35.1	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-56.6	-38.7	-175.9	-75.7	173.4	-56.6	0	0	113.4	N76 Y77 R84 T94 D101	N76-Q80 WeakPolarHBondContact O-CG 3.36Å; N76-Q80 PolarHBondContact O-N 2.96Å; Y77-Q80 WeakPolarHBondContact O-CG 3.3Å; Y77-Q80 PolarHBondContact O-N 3.32Å; Y77-Q80 PolarHBondContact O-OE1 3.04Å; Q80-R84 VanDerWaalsContact O-CD 3.3Å; Q80-R84 WeakPolarHBondContact O-CD 3.46Å; Q80-R84 WeakPolarHBondContact O-CG 3.47Å; Q80-R84 PolarHBondContact O-N 3.29Å; Q80-T94 PolarHBondContact NE2-O 2.95Å; Q80-D101 PolarHBondContact NE2-OD1 2.9Å; Q80-D101 PolarHBondContact OE1-OD1 3.42Å
81	D	96.1	Very high	96.4	Very high	76 Å²	76	41.7 Å²	41.7	41%	0.406	21%	0.205	S	C	.	.	H	α-helix	trans	-65.5	-45.1	179.1	63	-34	0	0	0	112.7	D79 R147	D79-D81 VanDerWaalsContact C-N 3.28Å; D79-D81 PolarHBondContact O-N 3.16Å; D81-R147 IonicContact OD1-CZ 3.49Å; D81-R147 IonicContact OD1-NH1 2.62Å; D81-R147 IonicContact OD1-NH2 3.74Å; D81-R147 PolarHBondContact OD1-NH2 3.48Å; D81-R147 IonicContact OD2-CZ 3.46Å; D81-R147 IonicContact OD2-NH1 3.51Å; D81-R147 PolarHBondContact OD2-NH1 3.08Å; D81-R147 IonicContact OD2-NH2 3.32Å; D81-R147 PolarHBondContact OD2-NH2 3.25Å
82	I	96.4	Very high	96.2	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.041	21%	0.211	C	C	.	.	H	α-helix	trans	-79.7	-33.7	-179.5	60.1	173	0	0	0	112	D79 R84 I85 M86 A208 I210	D79-I82 HydrophobicContact CB-CD1 4.06Å; D79-I82 HydrophobicContact CB-CG1 3.97Å; D79-I82 WeakPolarHBondContact O-CG1 3.29Å; D79-I82 PolarHBondContact O-N 2.98Å; D79-I82 WeakPolarHBondContact OD1-CD1 3.36Å; I82-R84 PolarHBondContact O-N 3.48Å; I82-I85 WeakPolarHBondContact O-CG1 3.05Å; I82-I85 PolarHBondContact O-N 3.46Å; I82-M86 WeakPolarHBondContact O-CG 3.44Å; I82-M86 PolarHBondContact O-N 2.97Å; I82-A208 HydrophobicContact CB-CB 4.13Å; I82-A208 HydrophobicContact CG2-CB 4.41Å; I82-I210 HydrophobicContact CD1-CD1 3.79Å; I82-I210 HydrophobicContact CD1-CG1 4.24Å; I82-I210 HydrophobicContact CG2-CD1 4.18Å
83	D	96.7	Very high	96	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-28.8	177.2	-79.2	-24.1	0	0	0	111.4	D79 I85 M86 K89 Q90 R92 V95	D79-D83 VanDerWaalsContact O-CB 3.26Å; D79-D83 WeakPolarHBondContact O-CB 3.23Å; D79-D83 PolarHBondContact O-N 2.67Å; D83-I85 PolarHBondContact O-N 2.85Å; D83-M86 PolarHBondContact O-N 3.45Å; D83-K89 HydrophobicContact CB-CB 3.88Å; D83-K89 CarbonylContact O-C 3.6Å; D83-K89 WeakPolarHBondContact OD1-CB 3.35Å; D83-Q90 PolarHBondContact O-N 3.4Å; D83-R92 IonicContact OD1-CZ 3.75Å; D83-R92 IonicContact OD1-NH1 3.44Å; D83-R92 PolarHBondContact OD1-NH1 2.92Å; D83-R92 WeakPolarHBondContact OD2-CD 3.46Å; D83-R92 IonicContact OD2-CZ 2.71Å; D83-R92 IonicContact OD2-NE 2.8Å; D83-R92 IonicContact OD2-NH1 3.67Å; D83-R92 PolarHBondContact OD2-NH1 3.45Å; D83-V95 HydrophobicContact CB-CG2 3.56Å
84	R	96.3	Very high	95.8	Very high	131 Å²	131	43.5 Å²	43.5	49%	0.494	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.3	174.3	-80.9	165.5	-171.8	-175.2	5.5	113.6	Q80 I82 Q90 V95	Q80-R84 VanDerWaalsContact O-CD 3.3Å; Q80-R84 WeakPolarHBondContact O-CD 3.46Å; Q80-R84 WeakPolarHBondContact O-CG 3.47Å; Q80-R84 PolarHBondContact O-N 3.29Å; I82-R84 PolarHBondContact O-N 3.48Å; R84-Q90 VanDerWaalsContact O-CG 3.26Å; R84-Q90 WeakPolarHBondContact O-CG 3.47Å; R84-Q90 PolarHBondContact O-NE2 3.16Å; R84-V95 HydrophobicContact CB-CG1 4.38Å; R84-V95 HydrophobicContact CG-CG1 3.46Å; R84-V95 VanDerWaalsContact CG-CG1 3.46Å; R84-V95 HydrophobicContact CG-CG2 4.41Å
85	I	95.8	Very high	95.6	Very high	76 Å²	76	44 Å²	44	39%	0.39	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-15.4	-177.7	58.5	178.9	0	0	0	112.8	I82 D83 P87 L207 A208	I82-I85 WeakPolarHBondContact O-CG1 3.05Å; I82-I85 PolarHBondContact O-N 3.46Å; D83-I85 PolarHBondContact O-N 2.85Å; I85-P87 WeakPolarHBondContact O-CD 3.41Å; I85-L207 WeakPolarHBondContact O-CD2 3.37Å; I85-A208 HydrophobicContact CD1-CB 4.2Å; I85-A208 HydrophobicContact CG1-CB 4.29Å
86	M	95.6	Very high	95.3	Very high	7 Å²	7	47.6 Å²	47.6	3%	0.034	24%	0.235	C	C	.	.			trans	-85	114.2	175.9	-68	179	77.4	0	0	111.5	I82 D83 S88 K89 Q90 E204 Y205 A208	I82-M86 WeakPolarHBondContact O-CG 3.44Å; I82-M86 PolarHBondContact O-N 2.97Å; D83-M86 PolarHBondContact O-N 3.45Å; M86-S88 PolarHBondContact O-N 3.48Å; M86-K89 HydrophobicContact CB-CB 4.08Å; M86-K89 HydrophobicContact CB-CG 3.94Å; M86-K89 PolarHBondContact O-N 3.44Å; M86-K89 HydrophobicContact SD-CG 4.41Å; M86-Q90 PolarHBondContact O-N 3.44Å; M86-Q90 VanDerWaalsContact O-N 3.13Å; M86-E204 HydrophobicContact CE-CB 3.69Å; M86-E204 HydrophobicContact CG-CB 4.49Å; M86-Y205 HydrophobicContact CE-CD1 4.02Å; M86-Y205 HydrophobicContact CE-CE1 4.05Å; M86-A208 HydrophobicContact CG-CB 3.77Å; M86-A208 HydrophobicContact SD-CB 3.98Å
87	P	94.4	Very high	94.8	Very high	77 Å²	77	52.2 Å²	52.2	50%	0.5	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-36.4	-173.8	-28.9	36.1	0	0	0	114.5	I85 K89	I85-P87 WeakPolarHBondContact O-CD 3.41Å; P87-K89 PolarHBondContact O-N 3.23Å
88	S	93.3	Very high	94.6	Very high	52 Å²	52	52.1 Å²	52.1	36%	0.364	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-10	179.9	69.9	0	0	0	0	114.5	M86 R201 E204	M86-S88 PolarHBondContact O-N 3.48Å; S88-R201 PolarHBondContact OG-NH1 2.79Å; S88-E204 WeakPolarHBondContact CB-OE2 3.33Å; S88-E204 PolarHBondContact N-OE2 3.4Å; S88-E204 VanDerWaalsContact N-OE2 3.13Å; S88-E204 VanDerWaalsContact OG-CD 3.31Å; S88-E204 PolarHBondContact OG-OE1 3.21Å; S88-E204 PolarHBondContact OG-OE2 2.86Å
89	K	94.4	Very high	94.5	Very high	48 Å²	48	48.9 Å²	48.9	21%	0.209	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-14.9	-172.9	-52.8	-52	-173.2	-177.1	0	113.7	D83 M86 P87 N91 R92	D83-K89 HydrophobicContact CB-CB 3.88Å; D83-K89 CarbonylContact O-C 3.6Å; D83-K89 WeakPolarHBondContact OD1-CB 3.35Å; M86-K89 HydrophobicContact CB-CB 4.08Å; M86-K89 HydrophobicContact CB-CG 3.94Å; M86-K89 PolarHBondContact O-N 3.44Å; M86-K89 HydrophobicContact SD-CG 4.41Å; P87-K89 PolarHBondContact O-N 3.23Å; K89-N91 PolarHBondContact O-N 2.68Å; K89-N91 VanDerWaalsContact O-N 3.09Å; K89-R92 VanDerWaalsContact O-CB 3.28Å; K89-R92 WeakPolarHBondContact O-CB 3.47Å; K89-R92 VanDerWaalsContact O-CG 3.24Å; K89-R92 WeakPolarHBondContact O-CG 3.46Å; K89-R92 PolarHBondContact O-N 3.44Å
90	Q	94.7	Very high	94.4	Very high	81 Å²	81	51.2 Å²	51.2	38%	0.379	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.4	178.3	-78.6	172.7	-22	0	0	113.8	D83 R84 M86 R92 N96	D83-Q90 PolarHBondContact O-N 3.4Å; R84-Q90 VanDerWaalsContact O-CG 3.26Å; R84-Q90 WeakPolarHBondContact O-CG 3.47Å; R84-Q90 PolarHBondContact O-NE2 3.16Å; M86-Q90 PolarHBondContact O-N 3.44Å; M86-Q90 VanDerWaalsContact O-N 3.13Å; Q90-R92 PolarHBondContact O-N 3.21Å; Q90-N96 PolarHBondContact O-ND2 2.83Å; Q90-N96 PolarHBondContact O-OD1 2.91Å
91	N	93.3	Very high	94.4	Very high	137 Å²	137	53.8 Å²	53.8	73%	0.733	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	1.8	178.5	-68.6	-30.2	0	0	0	114.5	K89 N96	K89-N91 PolarHBondContact O-N 2.68Å; K89-N91 VanDerWaalsContact O-N 3.09Å; N91-N96 VanDerWaalsContact CA-ND2 3.31Å; N91-N96 WeakPolarHBondContact CA-ND2 3.39Å; N91-N96 PolarHBondContact O-ND2 3.15Å
92	R	94.6	Very high	94.4	Very high	38 Å²	38	57.6 Å²	57.6	14%	0.143	29%	0.291	C	S	.	.			trans	-63.2	140.9	-179.4	-79.9	177.9	170.3	173	3	111.8	N76 D83 K89 Q90 T94 V95 N96	N76-R92 PolarHBondContact OD1-NH1 3.21Å; D83-R92 IonicContact OD1-CZ 3.75Å; D83-R92 IonicContact OD1-NH1 3.44Å; D83-R92 PolarHBondContact OD1-NH1 2.92Å; D83-R92 WeakPolarHBondContact OD2-CD 3.46Å; D83-R92 IonicContact OD2-CZ 2.71Å; D83-R92 IonicContact OD2-NE 2.8Å; D83-R92 IonicContact OD2-NH1 3.67Å; D83-R92 PolarHBondContact OD2-NH1 3.45Å; K89-R92 VanDerWaalsContact O-CB 3.28Å; K89-R92 WeakPolarHBondContact O-CB 3.47Å; K89-R92 VanDerWaalsContact O-CG 3.24Å; K89-R92 WeakPolarHBondContact O-CG 3.46Å; K89-R92 PolarHBondContact O-N 3.44Å; Q90-R92 PolarHBondContact O-N 3.21Å; R92-T94 PolarHBondContact O-N 3.25Å; R92-T94 VanDerWaalsContact O-N 3.17Å; R92-V95 HydrophobicContact CB-CG2 4.34Å; R92-V95 PolarHBondContact O-N 2.83Å; R92-N96 PolarHBondContact O-N 3.18Å; R92-N96 VanDerWaalsContact O-N 3.15Å; R92-N96 PolarHBondContact O-ND2 3.46Å
93	P	94.6	Very high	94.4	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.032	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.5	176.2	-26.8	34.9	0	0	0	113.6	E18 Q21 I22 V95 R98	E18-P93 HydrophobicContact CB-CB 4.16Å; E18-P93 HydrophobicContact CB-CG 3.74Å; E18-P93 HydrophobicContact CG-CB 4.43Å; E18-P93 HydrophobicContact CG-CG 3.91Å; Q21-P93 HydrophobicContact CB-CG 4.2Å; I22-P93 HydrophobicContact CD1-CB 4.14Å; I22-P93 HydrophobicContact CG1-CB 4.07Å; I22-P93 HydrophobicContact CG1-CG 4.38Å; P93-V95 VanDerWaalsContact C-N 3.29Å; P93-V95 PolarHBondContact O-N 2.7Å; P93-R98 HydrophobicContact CB-CB 3.83Å; P93-R98 HydrophobicContact CB-CG 4.14Å; P93-R98 WeakPolarHBondContact O-CB 3.33Å; P93-R98 PolarHBondContact O-N 3.43Å; P93-R98 VanDerWaalsContact O-N 3.1Å
94	T	94.3	Very high	94.4	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.006	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-18.8	179.1	56.1	0	0	0	0	113.8	I22 N76 Q80 R92 I99 L104	I22-T94 HydrophobicContact CG1-CG2 4.01Å; N76-T94 HydrophobicContact CB-CG2 3.95Å; Q80-T94 PolarHBondContact NE2-O 2.95Å; R92-T94 PolarHBondContact O-N 3.25Å; R92-T94 VanDerWaalsContact O-N 3.17Å; T94-I99 HydrophobicContact CG2-CG2 4.12Å; T94-L104 HydrophobicContact CG2-CD1 4.07Å; T94-L104 HydrophobicContact CG2-CD2 3.63Å
95	V	93.3	Very high	94.5	Very high	16 Å²	16	57.4 Å²	57.4	10%	0.097	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-32.6	176.5	172.3	0	0	0	0	111.4	D83 R84 R92 P93 N97	D83-V95 HydrophobicContact CB-CG2 3.56Å; R84-V95 HydrophobicContact CB-CG1 4.38Å; R84-V95 HydrophobicContact CG-CG1 3.46Å; R84-V95 VanDerWaalsContact CG-CG1 3.46Å; R84-V95 HydrophobicContact CG-CG2 4.41Å; R92-V95 HydrophobicContact CB-CG2 4.34Å; R92-V95 PolarHBondContact O-N 2.83Å; P93-V95 VanDerWaalsContact C-N 3.29Å; P93-V95 PolarHBondContact O-N 2.7Å; V95-N97 VanDerWaalsContact C-N 3.33Å; V95-N97 PolarHBondContact O-N 3.42Å
96	N	92.6	Very high	94.6	Very high	77 Å²	77	59.8 Å²	59.8	41%	0.412	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	29.3	-175.4	-64.7	-47.5	0	0	0	114.1	Q90 N91 R92 R98	Q90-N96 PolarHBondContact O-ND2 2.83Å; Q90-N96 PolarHBondContact O-OD1 2.91Å; N91-N96 VanDerWaalsContact CA-ND2 3.31Å; N91-N96 WeakPolarHBondContact CA-ND2 3.39Å; N91-N96 PolarHBondContact O-ND2 3.15Å; R92-N96 PolarHBondContact O-N 3.18Å; R92-N96 VanDerWaalsContact O-N 3.15Å; R92-N96 PolarHBondContact O-ND2 3.46Å; N96-R98 HydrophobicContact CB-CG 4.31Å; N96-R98 PolarHBondContact O-N 2.92Å
97	N	87	Confident	94.7	Very high	97 Å²	97	61.8 Å²	61.8	52%	0.519	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	27.8	176.7	-57	-40.1	0	0	0	114.5	V95 I99	V95-N97 VanDerWaalsContact C-N 3.33Å; V95-N97 PolarHBondContact O-N 3.42Å; N97-I99 VanDerWaalsContact C-N 3.27Å
98	R	93.2	Very high	94.9	Very high	62 Å²	62	58.1 Å²	58.1	23%	0.234	30%	0.299	C	S	.	.	S	Bend	trans	-76.6	-20.6	177.1	-57.8	-62.8	-64.7	140.2	15.8	111.9	I11 S12 V14 E18 P93 N96	I11-R98 WeakPolarHBondContact CG2-O 3.25Å; S12-R98 PolarHBondContact OG-NH1 2.91Å; S12-R98 PolarHBondContact OG-NH2 3.07Å; V14-R98 WeakPolarHBondContact CG2-O 3.16Å; E18-R98 IonicContact OE1-CZ 3.92Å; E18-R98 IonicContact OE1-NE 2.74Å; E18-R98 PolarHBondContact OE1-NE 3.37Å; E18-R98 IonicContact OE1-NH2 3.16Å; E18-R98 PolarHBondContact OE1-NH2 3.48Å; E18-R98 IonicContact OE2-CZ 3.32Å; E18-R98 IonicContact OE2-NE 3.64Å; E18-R98 IonicContact OE2-NH2 2.68Å; E18-R98 PolarHBondContact OE2-NH2 3.24Å; E18-R98 VanDerWaalsContact OE2-NH2 3.16Å; P93-R98 HydrophobicContact CB-CB 3.83Å; P93-R98 HydrophobicContact CB-CG 4.14Å; P93-R98 WeakPolarHBondContact O-CB 3.33Å; P93-R98 PolarHBondContact O-N 3.43Å; P93-R98 VanDerWaalsContact O-N 3.1Å; N96-R98 HydrophobicContact CB-CG 4.31Å; N96-R98 PolarHBondContact O-N 2.92Å
99	I	94.8	Very high	95.2	Very high	15 Å²	15	61.1 Å²	61.1	8%	0.077	31%	0.305	C	S	.	.	S	Bend	trans	-136.7	138	174.1	-170.5	167.8	0	0	0	108	V14 I22 T94 N97 N103 L104 L107	V14-I99 HydrophobicContact CG2-CB 3.91Å; V14-I99 HydrophobicContact CG2-CD1 4.43Å; V14-I99 HydrophobicContact CG2-CG1 4.33Å; I22-I99 HydrophobicContact CD1-CB 4.48Å; I22-I99 HydrophobicContact CD1-CD1 4.2Å; I22-I99 HydrophobicContact CD1-CG2 4.16Å; T94-I99 HydrophobicContact CG2-CG2 4.12Å; N97-I99 VanDerWaalsContact C-N 3.27Å; I99-N103 HydrophobicContact CD1-CB 4.21Å; I99-N103 HydrophobicContact CG1-CB 3.79Å; I99-L104 HydrophobicContact CD1-CB 4.05Å; I99-L104 HydrophobicContact CD1-CD1 4.29Å; I99-L104 HydrophobicContact CG1-CB 4.23Å; I99-L104 HydrophobicContact CG2-CB 4.3Å; I99-L107 HydrophobicContact CD1-CD2 4.41Å
100	T	94.7	Very high	95.4	Very high	50 Å²	50	60.2 Å²	60.2	31%	0.307	31%	0.31	S	S	.	.			trans	-74.1	152.4	173.1	61.9	0	0	0	0	110.1	I11 Q102 N103 L104	I11-T100 HydrophobicContact CD1-CG2 3.62Å; T100-Q102 PolarHBondContact O-N 3.41Å; T100-N103 PolarHBondContact O-N 2.92Å; T100-N103 VanDerWaalsContact O-N 3.09Å; T100-N103 WeakPolarHBondContact OG1-CB 3.45Å; T100-N103 VanDerWaalsContact OG1-CG 3.26Å; T100-N103 PolarHBondContact OG1-N 3.08Å; T100-N103 PolarHBondContact OG1-ND2 3.41Å; T100-L104 WeakPolarHBondContact O-CB 3.31Å; T100-L104 PolarHBondContact O-N 3.16Å
101	D	96	Very high	95.6	Very high	72 Å²	72	57.7 Å²	57.7	39%	0.385	30%	0.298	S	S	.	.	H	α-helix	trans	-56.9	-39.8	178.1	-69.2	-8.5	0	0	0	112.2	Y77 Q80 N103 L104 L105	Y77-D101 HydrophobicContact CD2-CB 4.35Å; Y77-D101 HydrophobicContact CE2-CB 3.83Å; Q80-D101 PolarHBondContact NE2-OD1 2.9Å; Q80-D101 PolarHBondContact OE1-OD1 3.42Å; D101-N103 PolarHBondContact O-N 2.88Å; D101-L104 PolarHBondContact O-N 3.35Å; D101-L105 WeakPolarHBondContact O-CB 3.21Å; D101-L105 VanDerWaalsContact O-CG 3.27Å; D101-L105 WeakPolarHBondContact O-CG 3.27Å; D101-L105 PolarHBondContact O-N 3.2Å
102	Q	96.7	Very high	95.8	Very high	157 Å²	157	51.7 Å²	51.7	73%	0.734	27%	0.266	S	S	*	.	H	α-helix	trans	-59.6	-46.7	175.5	-68.9	178.5	-16.4	0	0	112.2	T100 L104 L105 L106	T100-Q102 PolarHBondContact O-N 3.41Å; Q102-L104 VanDerWaalsContact C-N 3.35Å; Q102-L105 PolarHBondContact O-N 2.74Å; Q102-L106 WeakPolarHBondContact O-CB 3.36Å; Q102-L106 PolarHBondContact O-N 3.21Å
103	N	96.4	Very high	96	Very high	89 Å²	89	55.3 Å²	55.3	48%	0.476	29%	0.288	S	S	.	.	H	α-helix	trans	-69.6	-34.8	178.8	-73.1	-15.2	0	0	0	111.8	I99 T100 D101 L107	I99-N103 HydrophobicContact CD1-CB 4.21Å; I99-N103 HydrophobicContact CG1-CB 3.79Å; T100-N103 PolarHBondContact O-N 2.92Å; T100-N103 VanDerWaalsContact O-N 3.09Å; T100-N103 WeakPolarHBondContact OG1-CB 3.45Å; T100-N103 VanDerWaalsContact OG1-CG 3.26Å; T100-N103 PolarHBondContact OG1-N 3.08Å; T100-N103 PolarHBondContact OG1-ND2 3.41Å; D101-N103 PolarHBondContact O-N 2.88Å; N103-L107 VanDerWaalsContact O-CB 3.24Å; N103-L107 WeakPolarHBondContact O-CB 2.96Å; N103-L107 PolarHBondContact O-N 3.38Å
104	L	97.1	Very high	96.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.9	-43.3	175.8	-178.3	57.7	0	0	0	111.2	I22 A73 Y77 T94 I99 T100 D101 Q102 S108	I22-L104 HydrophobicContact CG2-CD1 3.67Å; A73-L104 HydrophobicContact CB-CD1 4.1Å; Y77-L104 HydrophobicContact CD2-CD2 4.23Å; Y77-L104 HydrophobicContact CG-CD2 4.45Å; T94-L104 HydrophobicContact CG2-CD1 4.07Å; T94-L104 HydrophobicContact CG2-CD2 3.63Å; I99-L104 HydrophobicContact CD1-CB 4.05Å; I99-L104 HydrophobicContact CD1-CD1 4.29Å; I99-L104 HydrophobicContact CG1-CB 4.23Å; I99-L104 HydrophobicContact CG2-CB 4.3Å; T100-L104 WeakPolarHBondContact O-CB 3.31Å; T100-L104 PolarHBondContact O-N 3.16Å; D101-L104 PolarHBondContact O-N 3.35Å; Q102-L104 VanDerWaalsContact C-N 3.35Å; L104-S108 VanDerWaalsContact O-CB 3.31Å; L104-S108 WeakPolarHBondContact O-CB 3.18Å; L104-S108 PolarHBondContact O-N 3.37Å; L104-S108 PolarHBondContact O-OG 3.48Å
105	L	98.1	Very high	96.5	Very high	48 Å²	48	58.3 Å²	58.3	25%	0.251	31%	0.306	S	S	.	.	H	α-helix	trans	-64	-46.6	174.8	-71	172.6	0	0	0	111.4	L74 Y77 D101 Q102 L107 S108 F109	L74-L105 HydrophobicContact CD1-CD2 3.74Å; Y77-L105 HydrophobicContact CD1-CD2 3.73Å; Y77-L105 HydrophobicContact CD2-CD2 4.31Å; Y77-L105 HydrophobicContact CD2-CG 4.38Å; Y77-L105 HydrophobicContact CE1-CD2 3.8Å; Y77-L105 HydrophobicContact CE2-CD1 4.34Å; Y77-L105 HydrophobicContact CE2-CD2 4.39Å; Y77-L105 HydrophobicContact CE2-CG 4.3Å; Y77-L105 HydrophobicContact CG-CD2 3.99Å; D101-L105 WeakPolarHBondContact O-CB 3.21Å; D101-L105 VanDerWaalsContact O-CG 3.27Å; D101-L105 WeakPolarHBondContact O-CG 3.27Å; D101-L105 PolarHBondContact O-N 3.2Å; Q102-L105 PolarHBondContact O-N 2.74Å; L105-L107 PolarHBondContact O-N 2.79Å; L105-S108 PolarHBondContact O-N 3.03Å; L105-F109 HydrophobicContact CD2-CE2 4.15Å; L105-F109 VanDerWaalsContact O-CD2 3.31Å; L105-F109 WeakPolarHBondContact O-CD2 3.4Å; L105-F109 PolarHBondContact O-N 3.26Å
106	L	98.2	Very high	96.7	Very high	126 Å²	126	58.3 Å²	58.3	66%	0.66	31%	0.305	S	S	*	.	H	α-helix	trans	-60.4	-45.6	177.6	-179	62.9	0	0	0	111.9	Q102 S108 G110	Q102-L106 WeakPolarHBondContact O-CB 3.36Å; Q102-L106 PolarHBondContact O-N 3.21Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-S108 PolarHBondContact O-N 3.2Å; L106-G110 WeakPolarHBondContact O-CA 3.37Å; L106-G110 PolarHBondContact O-N 2.99Å
107	L	98	Very high	97	Very high	49 Å²	49	58.9 Å²	58.9	26%	0.257	31%	0.307	S	S	.	.	H	α-helix	trans	-58.1	-48.1	174.5	177	69.5	0	0	0	110.6	L19 I22 I99 N103 L105 M111	L19-L107 HydrophobicContact CD1-CD1 4.43Å; L19-L107 HydrophobicContact CD1-CD2 3.88Å; I22-L107 HydrophobicContact CG2-CD2 3.89Å; I99-L107 HydrophobicContact CD1-CD2 4.41Å; N103-L107 VanDerWaalsContact O-CB 3.24Å; N103-L107 WeakPolarHBondContact O-CB 2.96Å; N103-L107 PolarHBondContact O-N 3.38Å; L105-L107 PolarHBondContact O-N 2.79Å; L107-M111 HydrophobicContact CD1-CG 4.09Å; L107-M111 HydrophobicContact CD1-SD 3.73Å; L107-M111 HydrophobicContact CG-SD 3.92Å; L107-M111 WeakPolarHBondContact O-CB 3.47Å; L107-M111 WeakPolarHBondContact O-CG 3.46Å; L107-M111 PolarHBondContact O-N 3.16Å
108	S	98.5	Very high	97.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-53	-175.2	-56.8	0	0	0	0	112.3	G70 A73 L74 L104 L105 L106 M112	G70-S108 WeakPolarHBondContact O-CB 3.47Å; A73-S108 VanDerWaalsContact C-OG 3.29Å; A73-S108 WeakPolarHBondContact CB-OG 3.28Å; L74-S108 PolarHBondContact N-OG 3.42Å; L74-S108 VanDerWaalsContact N-OG 3.11Å; L104-S108 VanDerWaalsContact O-CB 3.31Å; L104-S108 WeakPolarHBondContact O-CB 3.18Å; L104-S108 PolarHBondContact O-N 3.37Å; L104-S108 PolarHBondContact O-OG 3.48Å; L105-S108 PolarHBondContact O-N 3.03Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-S108 PolarHBondContact O-N 3.2Å; S108-M112 WeakPolarHBondContact O-CG 3.37Å; S108-M112 PolarHBondContact O-N 2.86Å; S108-M112 VanDerWaalsContact O-N 3.09Å
109	F	98.6	Very high	97.9	Very high	115 Å²	115	51.9 Å²	51.9	50%	0.504	28%	0.275	S	S	.	.	H	α-helix	trans	-67.8	-38.6	178.4	-76.2	-67.7	0	0	0	112.2	L74 L105 M112 L113	L74-F109 HydrophobicContact CD2-CE1 4.3Å; L74-F109 HydrophobicContact CD2-CZ 4.11Å; L105-F109 HydrophobicContact CD2-CE2 4.15Å; L105-F109 VanDerWaalsContact O-CD2 3.31Å; L105-F109 WeakPolarHBondContact O-CD2 3.4Å; L105-F109 PolarHBondContact O-N 3.26Å; F109-M112 HydrophobicContact CD1-CE 3.89Å; F109-M112 HydrophobicContact CE1-CE 4.21Å; F109-M112 HydrophobicContact CG-CE 4.47Å; F109-M112 PolarHBondContact O-N 3.34Å; F109-L113 VanDerWaalsContact O-CB 3.24Å; F109-L113 WeakPolarHBondContact O-CB 3.39Å; F109-L113 PolarHBondContact O-N 3.23Å
110	G	98.7	Very high	98	Very high	29 Å²	29	55.4 Å²	55.4	30%	0.299	29%	0.29	S	S	.	.	H	α-helix	trans	-62.1	-46.3	177	0	0	0	0	0	112.3	L106 L113 V114	L106-G110 WeakPolarHBondContact O-CA 3.37Å; L106-G110 PolarHBondContact O-N 2.99Å; G110-L113 PolarHBondContact O-N 2.92Å; G110-V114 WeakPolarHBondContact O-CG2 3.37Å; G110-V114 PolarHBondContact O-N 3.15Å
111	M	98.8	Very high	98.2	Very high	28 Å²	28	59 Å²	59	14%	0.138	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-48	175.6	-72.6	180	74.6	0	0	111.6	I23 L66 L107 L113 V114 G115	I23-M111 HydrophobicContact CG2-CE 3.87Å; I23-M111 HydrophobicContact CG2-SD 3.86Å; L66-M111 WeakPolarHBondContact CB-O 3.46Å; L66-M111 HydrophobicContact CD2-CE 4.01Å; L66-M111 HydrophobicContact CD2-CG 4.34Å; L107-M111 HydrophobicContact CD1-CG 4.09Å; L107-M111 HydrophobicContact CD1-SD 3.73Å; L107-M111 HydrophobicContact CG-SD 3.92Å; L107-M111 WeakPolarHBondContact O-CB 3.47Å; L107-M111 WeakPolarHBondContact O-CG 3.46Å; L107-M111 PolarHBondContact O-N 3.16Å; M111-L113 PolarHBondContact O-N 3.21Å; M111-V114 PolarHBondContact O-N 3.41Å; M111-G115 PolarHBondContact O-N 3.03Å
112	M	98.8	Very high	98.3	Very high	11 Å²	11	57.2 Å²	57.2	5%	0.054	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-43.3	178.5	-70.2	-173.4	-69	0	0	111.9	A71 L74 S108 F109 G115 E116 I134 V138	A71-M112 HydrophobicContact CB-SD 4.03Å; L74-M112 HydrophobicContact CB-CE 4.48Å; L74-M112 HydrophobicContact CD2-CE 3.66Å; S108-M112 WeakPolarHBondContact O-CG 3.37Å; S108-M112 PolarHBondContact O-N 2.86Å; S108-M112 VanDerWaalsContact O-N 3.09Å; F109-M112 HydrophobicContact CD1-CE 3.89Å; F109-M112 HydrophobicContact CE1-CE 4.21Å; F109-M112 HydrophobicContact CG-CE 4.47Å; F109-M112 PolarHBondContact O-N 3.34Å; M112-G115 PolarHBondContact O-N 3.22Å; M112-E116 WeakPolarHBondContact O-CB 3.4Å; M112-E116 PolarHBondContact O-N 3.12Å; M112-I134 HydrophobicContact CB-CD1 4.07Å; M112-I134 HydrophobicContact CG-CD1 4.28Å; M112-I134 HydrophobicContact CG-CG1 4.42Å; M112-I134 HydrophobicContact SD-CB 4.44Å; M112-I134 HydrophobicContact SD-CD1 4.27Å; M112-I134 HydrophobicContact SD-CG1 4.02Å; M112-I134 HydrophobicContact SD-CG2 3.64Å; M112-V138 HydrophobicContact SD-CG2 4.49Å
113	L	98.8	Very high	98.4	Very high	114 Å²	114	51.2 Å²	51.2	60%	0.597	27%	0.27	S	S	*	.	H	α-helix	trans	-61.5	-48.6	179.3	178.8	64.1	0	0	0	111.9	F109 G110 M111 E116 I117	F109-L113 VanDerWaalsContact O-CB 3.24Å; F109-L113 WeakPolarHBondContact O-CB 3.39Å; F109-L113 PolarHBondContact O-N 3.23Å; G110-L113 PolarHBondContact O-N 2.92Å; M111-L113 PolarHBondContact O-N 3.21Å; L113-E116 PolarHBondContact O-N 3.32Å; L113-I117 HydrophobicContact CD1-CD1 4.44Å; L113-I117 HydrophobicContact CG-CD1 4.27Å; L113-I117 VanDerWaalsContact O-CG1 3.31Å; L113-I117 WeakPolarHBondContact O-CG1 3.32Å; L113-I117 PolarHBondContact O-N 2.98Å
114	V	98.8	Very high	98.5	Very high	70 Å²	70	52.8 Å²	52.8	42%	0.424	28%	0.277	S	S	.	.	H	α-helix	trans	-65.6	-42.2	178.6	176.7	0	0	0	0	110.8	L66 G110 M111 E116 I117 C118	L66-V114 HydrophobicContact CD1-CB 4.02Å; L66-V114 HydrophobicContact CD1-CG1 3.59Å; G110-V114 WeakPolarHBondContact O-CG2 3.37Å; G110-V114 PolarHBondContact O-N 3.15Å; M111-V114 PolarHBondContact O-N 3.41Å; V114-E116 VanDerWaalsContact C-N 3.3Å; V114-E116 PolarHBondContact O-N 2.84Å; V114-I117 PolarHBondContact O-N 3.46Å; V114-C118 PolarHBondContact O-N 3.29Å; V114-C118 PolarHBondContact O-SG 3.41Å
115	G	98.9	Very high	98.6	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-38.3	177.5	0	0	0	0	0	112.9	G63 M111 M112 C118 L119	G63-G115 WeakPolarHBondContact O-CA 3.07Å; M111-G115 PolarHBondContact O-N 3.03Å; M112-G115 PolarHBondContact O-N 3.22Å; G115-C118 WeakPolarHBondContact O-CB 3.27Å; G115-C118 PolarHBondContact O-N 2.9Å; G115-L119 PolarHBondContact O-N 3.47Å; G115-L119 VanDerWaalsContact O-N 3.11Å
116	E	98.8	Very high	98.6	Very high	15 Å²	15	52.7 Å²	52.7	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-67.6	-41.5	176.6	-164.2	55.8	-125.7	0	0	111.8	I67 M112 L113 V114 C118 L119 F120 G127 L131	I67-E116 WeakPolarHBondContact CD1-OE2 3.19Å; M112-E116 WeakPolarHBondContact O-CB 3.4Å; M112-E116 PolarHBondContact O-N 3.12Å; L113-E116 PolarHBondContact O-N 3.32Å; V114-E116 VanDerWaalsContact C-N 3.3Å; V114-E116 PolarHBondContact O-N 2.84Å; E116-C118 VanDerWaalsContact C-N 3.29Å; E116-C118 PolarHBondContact O-N 3.3Å; E116-L119 PolarHBondContact O-N 3.19Å; E116-L119 VanDerWaalsContact O-N 3.15Å; E116-F120 HydrophobicContact CG-CD2 3.84Å; E116-F120 HydrophobicContact CG-CE2 3.69Å; E116-F120 WeakPolarHBondContact O-CD2 3.36Å; E116-F120 PolarHBondContact O-N 3.03Å; E116-F120 WeakPolarHBondContact OE1-CD2 3.41Å; E116-F120 WeakPolarHBondContact OE1-CE2 2.86Å; E116-G127 WeakPolarHBondContact OE1-CA 3.42Å; E116-L131 HydrophobicContact CG-CD2 3.88Å; E116-L131 HydrophobicContact CG-CG 4.27Å; E116-L131 PolarHBondContact OE2-N 3.46Å
117	I	98.8	Very high	98.7	Very high	89 Å²	89	46.7 Å²	46.7	46%	0.456	25%	0.248	S	C	.	.	H	α-helix	trans	-56.7	-45.7	171.1	-69.1	164.8	0	0	0	110.2	L113 V114 L119 F120 L121	L113-I117 HydrophobicContact CD1-CD1 4.44Å; L113-I117 HydrophobicContact CG-CD1 4.27Å; L113-I117 VanDerWaalsContact O-CG1 3.31Å; L113-I117 WeakPolarHBondContact O-CG1 3.32Å; L113-I117 PolarHBondContact O-N 2.98Å; V114-I117 PolarHBondContact O-N 3.46Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 PolarHBondContact O-N 3.44Å; I117-F120 PolarHBondContact O-N 2.7Å; I117-L121 HydrophobicContact CG2-CD1 3.99Å; I117-L121 HydrophobicContact CG2-CG 4.31Å; I117-L121 WeakPolarHBondContact O-CB 3.3Å; I117-L121 VanDerWaalsContact O-CG 3.23Å; I117-L121 WeakPolarHBondContact O-CG 3.22Å; I117-L121 PolarHBondContact O-N 3.48Å
118	C	98.8	Very high	98.7	Very high	13 Å²	13	47.6 Å²	47.6	9%	0.088	26%	0.255	C	S	.	.	H	α-helix	trans	-58.5	-40.6	177	-66.9	0	0	0	0	112.7	L59 V114 G115 E116	L59-C118 HydrophobicContact CD1-CB 3.64Å; L59-C118 HydrophobicContact CG-CB 4.2Å; V114-C118 PolarHBondContact O-N 3.29Å; V114-C118 PolarHBondContact O-SG 3.41Å; G115-C118 WeakPolarHBondContact O-CB 3.27Å; G115-C118 PolarHBondContact O-N 2.9Å; E116-C118 VanDerWaalsContact C-N 3.29Å; E116-C118 PolarHBondContact O-N 3.3Å
119	L	98.8	Very high	98.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-73	-40.4	179.1	-64.5	-166.8	0	0	0	112.6	I67 G115 E116 I117 L121 L122 N123 S126 I166	I67-L119 HydrophobicContact CD1-CD1 3.44Å; I67-L119 VanDerWaalsContact CD1-CD1 3.44Å; I67-L119 HydrophobicContact CD1-CG 4.01Å; G115-L119 PolarHBondContact O-N 3.47Å; G115-L119 VanDerWaalsContact O-N 3.11Å; E116-L119 PolarHBondContact O-N 3.19Å; E116-L119 VanDerWaalsContact O-N 3.15Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 PolarHBondContact O-N 3.44Å; L119-L121 VanDerWaalsContact C-N 3.28Å; L119-L121 PolarHBondContact O-N 2.83Å; L119-L122 HydrophobicContact CD2-CD1 4.12Å; L119-L122 WeakPolarHBondContact O-CB 3.09Å; L119-L122 PolarHBondContact O-N 2.99Å; L119-L122 VanDerWaalsContact O-N 3.1Å; L119-N123 PolarHBondContact O-N 3.41Å; L119-S126 WeakPolarHBondContact O-CB 3.47Å; L119-I166 HydrophobicContact CD1-CD1 4.05Å; L119-I166 HydrophobicContact CD1-CG2 4.06Å; L119-I166 HydrophobicContact CD2-CG2 4.05Å
120	F	98.7	Very high	98.7	Very high	89 Å²	89	42.6 Å²	42.6	39%	0.39	23%	0.234	S	C	.	.	H	α-helix	trans	-66.3	-29	174.6	-83.6	-66.2	0	0	0	113.3	E116 I117 L122 L131	E116-F120 HydrophobicContact CG-CD2 3.84Å; E116-F120 HydrophobicContact CG-CE2 3.69Å; E116-F120 WeakPolarHBondContact O-CD2 3.36Å; E116-F120 PolarHBondContact O-N 3.03Å; E116-F120 WeakPolarHBondContact OE1-CD2 3.41Å; E116-F120 WeakPolarHBondContact OE1-CE2 2.86Å; I117-F120 PolarHBondContact O-N 2.7Å; F120-L122 PolarHBondContact O-N 3.18Å; F120-L131 HydrophobicContact CE2-CD1 4.12Å; F120-L131 HydrophobicContact CE2-CG 4.43Å; F120-L131 HydrophobicContact CZ-CD1 3.94Å
121	L	98.5	Very high	98.7	Very high	126 Å²	126	44.8 Å²	44.8	66%	0.66	24%	0.238	S	C	*	.	H	α-helix	trans	-65.8	-24.7	172.2	-75.8	173.3	0	0	0	112.8	L59 I117 L119	L59-L121 HydrophobicContact CD2-CB 4.25Å; I117-L121 HydrophobicContact CG2-CD1 3.99Å; I117-L121 HydrophobicContact CG2-CG 4.31Å; I117-L121 WeakPolarHBondContact O-CB 3.3Å; I117-L121 VanDerWaalsContact O-CG 3.23Å; I117-L121 WeakPolarHBondContact O-CG 3.22Å; I117-L121 PolarHBondContact O-N 3.48Å; L119-L121 VanDerWaalsContact C-N 3.28Å; L119-L121 PolarHBondContact O-N 2.83Å
122	L	98.3	Very high	98.7	Very high	33 Å²	33	48.6 Å²	48.6	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-76.6	-56.1	172.9	-66.4	165.7	0	0	0	110.7	Q56 L59 M60 L119 F120 A170	Q56-L122 HydrophobicContact CB-CD2 3.82Å; Q56-L122 HydrophobicContact CG-CD2 4.06Å; L59-L122 HydrophobicContact CB-CD2 4.22Å; L59-L122 HydrophobicContact CD2-CD2 3.84Å; L59-L122 HydrophobicContact CD2-CG 3.95Å; L59-L122 HydrophobicContact CG-CD2 4.27Å; L59-L122 HydrophobicContact CG-CG 4.25Å; M60-L122 HydrophobicContact CB-CD1 3.73Å; M60-L122 HydrophobicContact CG-CD1 4.5Å; L119-L122 HydrophobicContact CD2-CD1 4.12Å; L119-L122 WeakPolarHBondContact O-CB 3.09Å; L119-L122 PolarHBondContact O-N 2.99Å; L119-L122 VanDerWaalsContact O-N 3.1Å; F120-L122 PolarHBondContact O-N 3.18Å; L122-A170 HydrophobicContact CD1-CB 3.92Å
123	N	98.4	Very high	98.7	Very high	32 Å²	32	48.7 Å²	48.7	17%	0.171	26%	0.261	C	S	.	.			trans	-175.2	165.2	174.6	50.3	70.5	0	0	0	111.3	L119 P125 S126 G127 V169	L119-N123 PolarHBondContact O-N 3.41Å; N123-P125 WeakPolarHBondContact OD1-CD 3.23Å; N123-S126 PolarHBondContact ND2-OG 3.35Å; N123-S126 PolarHBondContact O-N 3.11Å; N123-S126 WeakPolarHBondContact OD1-CB 3.47Å; N123-S126 PolarHBondContact OD1-N 3.47Å; N123-S126 PolarHBondContact OD1-OG 3.27Å; N123-G127 PolarHBondContact O-N 3.41Å; N123-V169 PolarHBondContact ND2-O 3.08Å; N123-V169 PolarHBondContact OD1-O 3.03Å
124	I	98.5	Very high	98.7	Very high	122 Å²	122	44.5 Å²	44.5	63%	0.626	24%	0.238	S	C	*	.	H	α-helix	trans	-58.1	-47	-180	-62.5	172.7	0	0	0	112.2	S126 G127 V128	I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 3.16Å; I124-G127 PolarHBondContact O-N 3.39Å; I124-V128 HydrophobicContact CG2-CG2 4.08Å; I124-V128 WeakPolarHBondContact O-CG2 3.23Å; I124-V128 PolarHBondContact O-N 3.4Å
125	P	98.6	Very high	98.6	Very high	45 Å²	45	44.4 Å²	44.4	29%	0.292	24%	0.238	S	C	.	.	H	α-helix	trans	-62.2	-35.2	-179.2	-30.7	42.7	0	0	0	114.3	N123 V128 L129 V169 G173	N123-P125 WeakPolarHBondContact OD1-CD 3.23Å; P125-V128 PolarHBondContact O-N 3.34Å; P125-L129 WeakPolarHBondContact O-CB 3.33Å; P125-L129 WeakPolarHBondContact O-CG 3.35Å; P125-L129 PolarHBondContact O-N 3.11Å; P125-V169 HydrophobicContact CB-CB 4.41Å; P125-G173 WeakPolarHBondContact CG-O 3.36Å
126	S	98.8	Very high	98.6	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-47	174.9	-62.5	0	0	0	0	111.3	L119 N123 I124 L129 G130 V169 A170	L119-S126 WeakPolarHBondContact O-CB 3.47Å; N123-S126 PolarHBondContact ND2-OG 3.35Å; N123-S126 PolarHBondContact O-N 3.11Å; N123-S126 WeakPolarHBondContact OD1-CB 3.47Å; N123-S126 PolarHBondContact OD1-N 3.47Å; N123-S126 PolarHBondContact OD1-OG 3.27Å; I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 3.16Å; S126-L129 PolarHBondContact O-N 2.9Å; S126-G130 PolarHBondContact O-N 2.73Å; S126-V169 WeakPolarHBondContact OG-CG2 3.04Å; S126-A170 WeakPolarHBondContact OG-CA 3.33Å; S126-A170 PolarHBondContact OG-N 2.76Å
127	G	98.7	Very high	98.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-45.1	176.1	0	0	0	0	0	112.8	E116 N123 I124 L129 G130 L131	E116-G127 WeakPolarHBondContact OE1-CA 3.42Å; N123-G127 PolarHBondContact O-N 3.41Å; I124-G127 PolarHBondContact O-N 3.39Å; G127-L129 VanDerWaalsContact C-N 3.28Å; G127-L129 PolarHBondContact O-N 3.44Å; G127-G130 CarbonylContact O-C 3.55Å; G127-G130 WeakPolarHBondContact O-CA 3.35Å; G127-G130 PolarHBondContact O-N 3.22Å; G127-L131 PolarHBondContact O-N 2.85Å
128	V	98.7	Very high	98.6	Very high	69 Å²	69	42.3 Å²	42.3	42%	0.418	23%	0.229	S	C	.	.	H	α-helix	trans	-57.1	-41.9	176.4	172.4	0	0	0	0	111.9	I124 P125 L131 M132	I124-V128 HydrophobicContact CG2-CG2 4.08Å; I124-V128 WeakPolarHBondContact O-CG2 3.23Å; I124-V128 PolarHBondContact O-N 3.4Å; P125-V128 PolarHBondContact O-N 3.34Å; V128-L131 PolarHBondContact O-N 3.14Å; V128-M132 HydrophobicContact CG1-SD 4.41Å; V128-M132 VanDerWaalsContact O-CG 3.31Å; V128-M132 WeakPolarHBondContact O-CG 3.41Å; V128-M132 PolarHBondContact O-N 3.11Å
129	L	98.8	Very high	98.5	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.047	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-37	174.6	-72.8	171.2	0	0	0	112.4	P125 S126 G127 M132 G133 V162 L165 I166 V169	P125-L129 WeakPolarHBondContact O-CB 3.33Å; P125-L129 WeakPolarHBondContact O-CG 3.35Å; P125-L129 PolarHBondContact O-N 3.11Å; S126-L129 PolarHBondContact O-N 2.9Å; G127-L129 VanDerWaalsContact C-N 3.28Å; G127-L129 PolarHBondContact O-N 3.44Å; L129-M132 HydrophobicContact CD2-SD 4Å; L129-M132 WeakPolarHBondContact O-CB 3.35Å; L129-M132 PolarHBondContact O-N 3.14Å; L129-G133 PolarHBondContact O-N 3.34Å; L129-V162 HydrophobicContact CB-CG1 4.03Å; L129-V162 HydrophobicContact CD2-CG1 4.47Å; L129-V162 WeakPolarHBondContact O-CG1 3.43Å; L129-L165 HydrophobicContact CD1-CB 3.77Å; L129-L165 HydrophobicContact CD2-CB 4.4Å; L129-L165 HydrophobicContact CD2-CD1 4.08Å; L129-I166 HydrophobicContact CB-CD1 4.4Å; L129-I166 HydrophobicContact CB-CG1 3.68Å; L129-I166 HydrophobicContact CD1-CG1 4.49Å; L129-V169 HydrophobicContact CD1-CB 4.42Å; L129-V169 HydrophobicContact CD1-CG1 4Å; L129-V169 HydrophobicContact CD1-CG2 3.54Å
130	G	98.8	Very high	98.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.9	-53.1	170.1	0	0	0	0	0	112.2	S126 G127 M132 G133 I134	S126-G130 PolarHBondContact O-N 2.73Å; G127-G130 CarbonylContact O-C 3.55Å; G127-G130 WeakPolarHBondContact O-CA 3.35Å; G127-G130 PolarHBondContact O-N 3.22Å; G130-M132 VanDerWaalsContact C-N 3.35Å; G130-M132 PolarHBondContact O-N 3.31Å; G130-G133 WeakPolarHBondContact O-CA 3.2Å; G130-G133 PolarHBondContact O-N 3.37Å; G130-G133 VanDerWaalsContact O-N 3.08Å; G130-I134 WeakPolarHBondContact O-CG1 3.34Å; G130-I134 PolarHBondContact O-N 2.86Å
131	L	98.7	Very high	98.4	Very high	76 Å²	76	48.7 Å²	48.7	40%	0.398	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-42.3	175.1	-68.3	177.2	0	0	0	112.5	E116 F120 G127 V128 G133 I134 V135	E116-L131 HydrophobicContact CG-CD2 3.88Å; E116-L131 HydrophobicContact CG-CG 4.27Å; E116-L131 PolarHBondContact OE2-N 3.46Å; F120-L131 HydrophobicContact CE2-CD1 4.12Å; F120-L131 HydrophobicContact CE2-CG 4.43Å; F120-L131 HydrophobicContact CZ-CD1 3.94Å; G127-L131 PolarHBondContact O-N 2.85Å; V128-L131 PolarHBondContact O-N 3.14Å; L131-G133 VanDerWaalsContact C-N 3.29Å; L131-G133 PolarHBondContact O-N 3.22Å; L131-I134 PolarHBondContact O-N 3.18Å; L131-V135 WeakPolarHBondContact O-CB 3.31Å; L131-V135 WeakPolarHBondContact O-CG2 3.33Å; L131-V135 PolarHBondContact O-N 2.98Å
132	M	98.3	Very high	98.3	Very high	108 Å²	108	42.7 Å²	42.7	53%	0.532	23%	0.226	S	C	.	.	H	α-helix	trans	-59.9	-40.9	174.8	-74.6	176.2	64	0	0	111.7	V128 L129 G130 G136	V128-M132 HydrophobicContact CG1-SD 4.41Å; V128-M132 VanDerWaalsContact O-CG 3.31Å; V128-M132 WeakPolarHBondContact O-CG 3.41Å; V128-M132 PolarHBondContact O-N 3.11Å; L129-M132 HydrophobicContact CD2-SD 4Å; L129-M132 WeakPolarHBondContact O-CB 3.35Å; L129-M132 PolarHBondContact O-N 3.14Å; G130-M132 VanDerWaalsContact C-N 3.35Å; G130-M132 PolarHBondContact O-N 3.31Å; M132-G136 WeakPolarHBondContact O-CA 3.12Å; M132-G136 PolarHBondContact O-N 2.92Å
133	G	98.5	Very high	98.3	Very high	13 Å²	13	44.3 Å²	44.3	13%	0.134	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-48.2	173.5	0	0	0	0	0	112.3	L129 G130 L131 Y137 P159	L129-G133 PolarHBondContact O-N 3.34Å; G130-G133 WeakPolarHBondContact O-CA 3.2Å; G130-G133 PolarHBondContact O-N 3.37Å; G130-G133 VanDerWaalsContact O-N 3.08Å; L131-G133 VanDerWaalsContact C-N 3.29Å; L131-G133 PolarHBondContact O-N 3.22Å; G133-Y137 VanDerWaalsContact O-CB 3.24Å; G133-Y137 WeakPolarHBondContact O-CB 3.27Å; G133-Y137 PolarHBondContact O-N 3.24Å; G133-P159 WeakPolarHBondContact O-CB 3.24Å
134	I	98.7	Very high	98.2	Very high	25 Å²	25	49 Å²	49	13%	0.128	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-57.6	179	-67.6	166.6	0	0	0	111	I67 M112 G130 L131 G136 Y137 V138	I67-I134 HydrophobicContact CD1-CD1 4.46Å; I67-I134 HydrophobicContact CG1-CD1 4.23Å; I67-I134 HydrophobicContact CG2-CD1 3.92Å; I67-I134 HydrophobicContact CG2-CG1 3.52Å; M112-I134 HydrophobicContact CB-CD1 4.07Å; M112-I134 HydrophobicContact CG-CD1 4.28Å; M112-I134 HydrophobicContact CG-CG1 4.42Å; M112-I134 HydrophobicContact SD-CB 4.44Å; M112-I134 HydrophobicContact SD-CD1 4.27Å; M112-I134 HydrophobicContact SD-CG1 4.02Å; M112-I134 HydrophobicContact SD-CG2 3.64Å; G130-I134 WeakPolarHBondContact O-CG1 3.34Å; G130-I134 PolarHBondContact O-N 2.86Å; L131-I134 PolarHBondContact O-N 3.18Å; I134-G136 VanDerWaalsContact C-N 3.33Å; I134-G136 PolarHBondContact O-N 3.27Å; I134-Y137 PolarHBondContact O-N 3.35Å; I134-V138 HydrophobicContact CG2-CG2 4.41Å; I134-V138 WeakPolarHBondContact O-CB 3.36Å; I134-V138 WeakPolarHBondContact O-CG2 3.45Å; I134-V138 PolarHBondContact O-N 2.94Å
135	V	98.4	Very high	98.2	Very high	68 Å²	68	43.2 Å²	43.2	41%	0.412	22%	0.22	S	C	.	.	H	α-helix	trans	-63.7	-42.1	-176.2	174.2	0	0	0	0	110.4	L131 Y137 S139 Y140	L131-V135 WeakPolarHBondContact O-CB 3.31Å; L131-V135 WeakPolarHBondContact O-CG2 3.33Å; L131-V135 PolarHBondContact O-N 2.98Å; V135-Y137 PolarHBondContact O-N 2.96Å; V135-S139 WeakPolarHBondContact O-CA 3.27Å; V135-S139 VanDerWaalsContact O-CB 3.26Å; V135-S139 WeakPolarHBondContact O-CB 3.44Å; V135-S139 PolarHBondContact O-N 3.45Å; V135-Y140 HydrophobicContact CG1-CD2 4.05Å; V135-Y140 HydrophobicContact CG1-CE2 3.86Å; V135-Y140 PolarHBondContact O-N 2.95Å
136	G	98.2	Very high	98.1	Very high	12 Å²	12	41.9 Å²	41.9	12%	0.124	21%	0.21	C	C	.	.	I	π-helix	trans	-59.6	-46.2	175.7	0	0	0	0	0	112.3	M132 I134 Y140 Y141	M132-G136 WeakPolarHBondContact O-CA 3.12Å; M132-G136 PolarHBondContact O-N 2.92Å; I134-G136 VanDerWaalsContact C-N 3.33Å; I134-G136 PolarHBondContact O-N 3.27Å; G136-Y140 WeakPolarHBondContact O-CB 3.5Å; G136-Y141 PolarHBondContact O-N 2.98Å
137	Y	98.5	Very high	98	Very high	39 Å²	39	45.3 Å²	45.3	15%	0.153	22%	0.223	C	C	.	.	I	π-helix	trans	-79.7	-44.4	-175.1	-174.8	-104.6	0	0	0	113.4	A71 N75 G133 I134 V135 Y141 S142	A71-Y137 HydrophobicContact CB-CD1 3.88Å; A71-Y137 HydrophobicContact CB-CE1 4.46Å; A71-Y137 WeakPolarHBondContact O-CE1 3.26Å; N75-Y137 HydrophobicContact CB-CD1 4.49Å; N75-Y137 HydrophobicContact CB-CE1 3.55Å; N75-Y137 PolarHBondContact OD1-OH 3.45Å; G133-Y137 VanDerWaalsContact O-CB 3.24Å; G133-Y137 WeakPolarHBondContact O-CB 3.27Å; G133-Y137 PolarHBondContact O-N 3.24Å; I134-Y137 PolarHBondContact O-N 3.35Å; V135-Y137 PolarHBondContact O-N 2.96Å; Y137-Y141 AromaticContact CD2-CD1 3.74Å; Y137-Y141 HydrophobicContact CD2-CD1 3.74Å; Y137-Y141 HydrophobicContact CD2-CE1 4.36Å; Y137-Y141 AromaticContact CE2-CD1 3.6Å; Y137-Y141 HydrophobicContact CE2-CD1 3.6Å; Y137-Y141 AromaticContact CE2-CE1 3.76Å; Y137-Y141 HydrophobicContact CE2-CE1 3.76Å; Y137-Y141 WeakPolarHBondContact O-CB 3.07Å; Y137-S142 WeakPolarHBondContact O-CB 3.41Å; Y137-S142 PolarHBondContact O-N 3.35Å; Y137-S142 PolarHBondContact O-OG 3.1Å
138	V	98.1	Very high	97.9	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.055	25%	0.252	C	S	.	.	I	π-helix	trans	-77.5	-54.5	-176.6	176.1	0	0	0	0	110	A71 L74 Y78 M112 I134 S142 I143	A71-V138 HydrophobicContact CB-CG2 4.09Å; L74-V138 HydrophobicContact CD2-CB 4.41Å; L74-V138 HydrophobicContact CD2-CG1 3.49Å; L74-V138 VanDerWaalsContact CD2-CG1 3.49Å; L74-V138 HydrophobicContact CD2-CG2 4.01Å; L74-V138 HydrophobicContact CG-CG1 4.02Å; Y78-V138 HydrophobicContact CE2-CG1 4.17Å; M112-V138 HydrophobicContact SD-CG2 4.49Å; I134-V138 HydrophobicContact CG2-CG2 4.41Å; I134-V138 WeakPolarHBondContact O-CB 3.36Å; I134-V138 WeakPolarHBondContact O-CG2 3.45Å; I134-V138 PolarHBondContact O-N 2.94Å; V138-S142 VanDerWaalsContact O-CB 3.28Å; V138-S142 WeakPolarHBondContact O-CB 3.36Å; V138-S142 PolarHBondContact O-N 3.25Å; V138-I143 HydrophobicContact CG1-CD1 4.21Å; V138-I143 WeakPolarHBondContact O-CG1 3.46Å; V138-I143 PolarHBondContact O-N 3.41Å
139	S	97.4	Very high	97.9	Very high	52 Å²	52	49.9 Å²	49.9	36%	0.364	24%	0.242	S	C	.	.	I	π-helix	trans	-81.2	-61.6	-172.5	-49.6	0	0	0	0	111.9	V135 W144	V135-S139 WeakPolarHBondContact O-CA 3.27Å; V135-S139 VanDerWaalsContact O-CB 3.26Å; V135-S139 WeakPolarHBondContact O-CB 3.44Å; V135-S139 PolarHBondContact O-N 3.45Å; S139-W144 PolarHBondContact O-N 3.04Å; S139-W144 VanDerWaalsContact O-N 3.15Å
140	Y	97.9	Very high	97.8	Very high	136 Å²	136	51 Å²	51	53%	0.533	25%	0.248	S	C	.	.	I	π-helix	trans	-71.4	-39.4	-173.6	-73.6	-81.7	0	0	0	112.7	V135 G136 W144 S145	V135-Y140 HydrophobicContact CG1-CD2 4.05Å; V135-Y140 HydrophobicContact CG1-CE2 3.86Å; V135-Y140 PolarHBondContact O-N 2.95Å; G136-Y140 WeakPolarHBondContact O-CB 3.5Å; Y140-W144 HydrophobicContact CD1-CE3 4.15Å; Y140-W144 HydrophobicContact CD1-CZ3 4.32Å; Y140-S145 WeakPolarHBondContact O-CB 3.45Å; Y140-S145 PolarHBondContact O-N 3.45Å; Y140-S145 PolarHBondContact O-OG 3.36Å
141	Y	98.1	Very high	97.7	Very high	48 Å²	48	58.1 Å²	58.1	19%	0.188	28%	0.276	C	S	.	.	I	π-helix	trans	-84.3	-68.4	177.4	175	-106	0	0	0	112.8	G136 Y137 S145 K146 N152	G136-Y141 PolarHBondContact O-N 2.98Å; Y137-Y141 AromaticContact CD2-CD1 3.74Å; Y137-Y141 HydrophobicContact CD2-CD1 3.74Å; Y137-Y141 HydrophobicContact CD2-CE1 4.36Å; Y137-Y141 AromaticContact CE2-CD1 3.6Å; Y137-Y141 HydrophobicContact CE2-CD1 3.6Å; Y137-Y141 AromaticContact CE2-CE1 3.76Å; Y137-Y141 HydrophobicContact CE2-CE1 3.76Å; Y137-Y141 WeakPolarHBondContact O-CB 3.07Å; Y141-S145 WeakPolarHBondContact CA-OG 3.41Å; Y141-S145 PolarHBondContact O-N 2.98Å; Y141-K146 HydrophobicContact CD2-CB 4.43Å; Y141-K146 HydrophobicContact CE1-CD 4.37Å; Y141-K146 HydrophobicContact CE2-CB 4.23Å; Y141-K146 WeakPolarHBondContact O-CB 3.31Å; Y141-K146 PolarHBondContact O-N 2.98Å; Y141-N152 WeakPolarHBondContact CD2-O 3.44Å; Y141-N152 HydrophobicContact CE2-CB 4.39Å
142	S	96.7	Very high	97.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.257	C	S	.	.	I	π-helix	trans	-66.2	-48.5	-166.4	-56.8	0	0	0	0	113.5	N75 Y137 V138	N75-S142 WeakPolarHBondContact ND2-CB 3.47Å; N75-S142 PolarHBondContact ND2-OG 3.4Å; Y137-S142 WeakPolarHBondContact O-CB 3.41Å; Y137-S142 PolarHBondContact O-N 3.35Å; Y137-S142 PolarHBondContact O-OG 3.1Å; V138-S142 VanDerWaalsContact O-CB 3.28Å; V138-S142 WeakPolarHBondContact O-CB 3.36Å; V138-S142 PolarHBondContact O-N 3.25Å
143	I	96.8	Very high	97.6	Very high	68 Å²	68	49.7 Å²	49.7	35%	0.349	23%	0.233	S	C	.	.	I	π-helix	trans	-77.4	-48.2	-177.3	-65.8	165.8	0	0	0	110.5	Y78 V138	Y78-I143 HydrophobicContact CD1-CG1 4.07Å; Y78-I143 HydrophobicContact CD2-CD1 4.33Å; Y78-I143 HydrophobicContact CD2-CG1 3.95Å; Y78-I143 HydrophobicContact CE1-CD1 4.07Å; Y78-I143 HydrophobicContact CE1-CG1 3.92Å; Y78-I143 HydrophobicContact CE2-CD1 3.66Å; Y78-I143 HydrophobicContact CE2-CG1 3.78Å; Y78-I143 HydrophobicContact CG-CG1 4.09Å; V138-I143 HydrophobicContact CG1-CD1 4.21Å; V138-I143 WeakPolarHBondContact O-CG1 3.46Å; V138-I143 PolarHBondContact O-N 3.41Å
144	W	97.7	Very high	97.6	Very high	130 Å²	130	49.6 Å²	49.6	49%	0.492	23%	0.23	S	C	.	.	I	π-helix	trans	-95	-80.3	-171.2	177.6	63.5	0	0	0	113.6	S139 Y140 K146 R147 H148 I155	S139-W144 PolarHBondContact O-N 3.04Å; S139-W144 VanDerWaalsContact O-N 3.15Å; Y140-W144 HydrophobicContact CD1-CE3 4.15Å; Y140-W144 HydrophobicContact CD1-CZ3 4.32Å; W144-K146 VanDerWaalsContact C-N 3.33Å; W144-K146 PolarHBondContact O-N 3.31Å; W144-R147 PolarHBondContact O-N 3.48Å; W144-R147 VanDerWaalsContact O-N 3.12Å; W144-H148 AromaticContact CD1-CD2 3.78Å; W144-H148 PolarHBondContact O-CD2 3.49Å; W144-H148 PolarHBondContact O-N 2.89Å; W144-I155 HydrophobicContact CH2-CD1 4.27Å; W144-I155 HydrophobicContact CZ3-CD1 3.76Å
145	S	97.9	Very high	97.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.233	C	C	.	.	I	π-helix	trans	-65.4	-36.1	-161.2	63.8	0	0	0	0	113.3	Y140 Y141 R147 H148 T149 N152 I155	Y140-S145 WeakPolarHBondContact O-CB 3.45Å; Y140-S145 PolarHBondContact O-N 3.45Å; Y140-S145 PolarHBondContact O-OG 3.36Å; Y141-S145 WeakPolarHBondContact CA-OG 3.41Å; Y141-S145 PolarHBondContact O-N 2.98Å; S145-R147 PolarHBondContact O-N 3.06Å; S145-R147 VanDerWaalsContact O-N 3.15Å; S145-H148 PolarHBondContact O-N 3Å; S145-T149 WeakPolarHBondContact O-CG2 3.43Å; S145-T149 PolarHBondContact O-N 3.31Å; S145-N152 WeakPolarHBondContact O-CB 3.03Å; S145-I155 VanDerWaalsContact CB-CD1 3.45Å; S145-I155 WeakPolarHBondContact OG-CG2 3.21Å
146	K	97.6	Very high	97.6	Very high	17 Å²	17	47.4 Å²	47.4	7%	0.074	22%	0.218	C	C	.	.	H	α-helix	trans	-52	-38	177.5	-175.9	-178.2	178.6	-165.1	0	112.3	D79 Y141 W144 I210 P211	D79-K146 IonicContact OD1-NZ 2.6Å; D79-K146 PolarHBondContact OD1-NZ 3.34Å; D79-K146 IonicContact OD2-NZ 3.61Å; D79-K146 PolarHBondContact OD2-NZ 3.47Å; Y141-K146 HydrophobicContact CD2-CB 4.43Å; Y141-K146 HydrophobicContact CE1-CD 4.37Å; Y141-K146 HydrophobicContact CE2-CB 4.23Å; Y141-K146 WeakPolarHBondContact O-CB 3.31Å; Y141-K146 PolarHBondContact O-N 2.98Å; W144-K146 VanDerWaalsContact C-N 3.33Å; W144-K146 PolarHBondContact O-N 3.31Å; K146-I210 HydrophobicContact CG-CG2 4.47Å; K146-P211 WeakPolarHBondContact O-CD 3.46Å
147	R	96.5	Very high	97.6	Very high	72 Å²	72	46.9 Å²	46.9	27%	0.272	21%	0.212	S	C	.	.	H	α-helix	trans	-94.2	-17	-175.3	-64.7	-177.2	173.3	-106.5	-4.1	113.9	Y78 D81 W144 S145	Y78-R147 PolarHBondContact O-NH2 3.32Å; D81-R147 IonicContact OD1-CZ 3.49Å; D81-R147 IonicContact OD1-NH1 2.62Å; D81-R147 IonicContact OD1-NH2 3.74Å; D81-R147 PolarHBondContact OD1-NH2 3.48Å; D81-R147 IonicContact OD2-CZ 3.46Å; D81-R147 IonicContact OD2-NH1 3.51Å; D81-R147 PolarHBondContact OD2-NH1 3.08Å; D81-R147 IonicContact OD2-NH2 3.32Å; D81-R147 PolarHBondContact OD2-NH2 3.25Å; W144-R147 PolarHBondContact O-N 3.48Å; W144-R147 VanDerWaalsContact O-N 3.12Å; S145-R147 PolarHBondContact O-N 3.06Å; S145-R147 VanDerWaalsContact O-N 3.15Å
148	H	96.8	Very high	97.6	Very high	133 Å²	133	50.2 Å²	50.2	62%	0.616	23%	0.228	S	C	*	.	H	α-helix	trans	-120.7	-16.1	-167.3	-62.6	-57.1	0	0	0	115.5	W144 S145	W144-H148 AromaticContact CD1-CD2 3.78Å; W144-H148 PolarHBondContact O-CD2 3.49Å; W144-H148 PolarHBondContact O-N 2.89Å; S145-H148 PolarHBondContact O-N 3Å
149	T	97.8	Very high	97.6	Very high	33 Å²	33	50.4 Å²	50.4	20%	0.202	23%	0.229	C	C	.	.			trans	-148.6	148.1	-173.3	179.7	0	0	0	0	114.5	S145 W151 N152 I155	S145-T149 WeakPolarHBondContact O-CG2 3.43Å; S145-T149 PolarHBondContact O-N 3.31Å; T149-W151 HydrophobicContact CG2-CB 4.08Å; T149-W151 PolarHBondContact O-N 3.07Å; T149-W151 PolarHBondContact OG1-N 3.34Å; T149-W151 VanDerWaalsContact OG1-N 3.13Å; T149-N152 WeakPolarHBondContact O-CB 3.48Å; T149-N152 VanDerWaalsContact O-CG 3.28Å; T149-N152 PolarHBondContact O-N 3.28Å; T149-N152 VanDerWaalsContact O-N 3.15Å; T149-N152 PolarHBondContact O-ND2 2.64Å; T149-I155 HydrophobicContact CG2-CD1 4.16Å
150	T	97.1	Very high	97.6	Very high	31 Å²	31	48.5 Å²	48.5	19%	0.19	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-10.8	170.4	58	0	0	0	0	113.6	N152 P211 V216	T150-N152 PolarHBondContact O-N 2.87Å; T150-P211 VanDerWaalsContact CA-O 3.26Å; T150-P211 WeakPolarHBondContact CA-O 3.46Å; T150-P211 HydrophobicContact CG2-CB 4.44Å; T150-V216 HydrophobicContact CG2-CB 3.78Å; T150-V216 HydrophobicContact CG2-CG1 3.93Å; T150-V216 HydrophobicContact CG2-CG2 3.9Å
151	W	96.8	Very high	97.6	Very high	151 Å²	151	42 Å²	42	57%	0.572	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-3.9	172.4	-71.6	102.7	0	0	0	113.6	T149 T153 V154 I155	T149-W151 HydrophobicContact CG2-CB 4.08Å; T149-W151 PolarHBondContact O-N 3.07Å; T149-W151 PolarHBondContact OG1-N 3.34Å; T149-W151 VanDerWaalsContact OG1-N 3.13Å; W151-T153 PolarHBondContact O-N 3.28Å; W151-V154 HydrophobicContact CE3-CB 4.03Å; W151-V154 HydrophobicContact CE3-CG1 4.39Å; W151-V154 HydrophobicContact CE3-CG2 3.87Å; W151-V154 HydrophobicContact CZ3-CG2 4.14Å; W151-V154 PolarHBondContact O-N 2.74Å; W151-I155 HydrophobicContact CB-CD1 3.94Å; W151-I155 HydrophobicContact CB-CG1 4.44Å; W151-I155 PolarHBondContact O-N 3.44Å
152	N	97.6	Very high	97.6	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-44.7	-42.7	-179.5	54.5	37.1	0	0	0	114.2	Y141 S145 T149 T150 I155 G156 P211	Y141-N152 WeakPolarHBondContact CD2-O 3.44Å; Y141-N152 HydrophobicContact CE2-CB 4.39Å; S145-N152 WeakPolarHBondContact O-CB 3.03Å; T149-N152 WeakPolarHBondContact O-CB 3.48Å; T149-N152 VanDerWaalsContact O-CG 3.28Å; T149-N152 PolarHBondContact O-N 3.28Å; T149-N152 VanDerWaalsContact O-N 3.15Å; T149-N152 PolarHBondContact O-ND2 2.64Å; T150-N152 PolarHBondContact O-N 2.87Å; N152-I155 PolarHBondContact O-N 3.48Å; N152-G156 PolarHBondContact O-N 3.46Å; N152-P211 PolarHBondContact ND2-O 3.25Å; N152-P211 VanDerWaalsContact ND2-O 3.13Å
153	T	97.6	Very high	97.7	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-41.8	-176	-58.7	0	0	0	0	110.8	W151 S157 P191 F194 Y195	W151-T153 PolarHBondContact O-N 3.28Å; T153-S157 PolarHBondContact O-N 2.91Å; T153-S157 PolarHBondContact O-OG 3.24Å; T153-P191 HydrophobicContact CG2-CB 4.25Å; T153-F194 HydrophobicContact CG2-CB 3.59Å; T153-F194 HydrophobicContact CG2-CD2 4.29Å; T153-F194 HydrophobicContact CG2-CG 4.38Å; T153-Y195 HydrophobicContact CG2-CD1 4.12Å; T153-Y195 HydrophobicContact CG2-CE1 3.82Å
154	V	98.1	Very high	97.8	Very high	12 Å²	12	37.3 Å²	37.3	7%	0.073	17%	0.172	C	C	.	.	H	α-helix	trans	-71.8	-43.3	179.1	-178.8	0	0	0	0	110.3	W151 G156 S157 F158 F187 P191 W229	W151-V154 HydrophobicContact CE3-CB 4.03Å; W151-V154 HydrophobicContact CE3-CG1 4.39Å; W151-V154 HydrophobicContact CE3-CG2 3.87Å; W151-V154 HydrophobicContact CZ3-CG2 4.14Å; W151-V154 PolarHBondContact O-N 2.74Å; V154-G156 PolarHBondContact O-N 2.85Å; V154-S157 WeakPolarHBondContact O-CB 3.37Å; V154-S157 PolarHBondContact O-N 3.46Å; V154-F158 WeakPolarHBondContact O-CD2 3.33Å; V154-F187 HydrophobicContact CG1-CZ 4.08Å; V154-P191 HydrophobicContact CG2-CG 4.49Å; V154-W229 HydrophobicContact CB-CZ2 4.31Å; V154-W229 HydrophobicContact CG1-CH2 4Å; V154-W229 HydrophobicContact CG1-CZ2 3.7Å; V154-W229 HydrophobicContact CG2-CZ2 3.64Å
155	I	98.3	Very high	97.8	Very high	38 Å²	38	31.8 Å²	31.8	20%	0.195	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-45.1	177.3	-67.1	164.9	0	0	0	110.5	W144 S145 T149 W151 N152 S157 F158 P159	W144-I155 HydrophobicContact CH2-CD1 4.27Å; W144-I155 HydrophobicContact CZ3-CD1 3.76Å; S145-I155 VanDerWaalsContact CB-CD1 3.45Å; S145-I155 WeakPolarHBondContact OG-CG2 3.21Å; T149-I155 HydrophobicContact CG2-CD1 4.16Å; W151-I155 HydrophobicContact CB-CD1 3.94Å; W151-I155 HydrophobicContact CB-CG1 4.44Å; W151-I155 PolarHBondContact O-N 3.44Å; N152-I155 PolarHBondContact O-N 3.48Å; I155-S157 PolarHBondContact O-N 3.38Å; I155-F158 PolarHBondContact O-N 2.84Å; I155-P159 WeakPolarHBondContact O-CD 3.45Å
156	G	98	Very high	97.9	Very high	9 Å²	9	32.3 Å²	32.3	9%	0.093	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-20.4	174.9	0	0	0	0	0	114.1	N152 V154 F158 P159 G160	N152-G156 PolarHBondContact O-N 3.46Å; V154-G156 PolarHBondContact O-N 2.85Å; G156-F158 VanDerWaalsContact C-N 3.33Å; G156-P159 WeakPolarHBondContact O-CD 3.46Å; G156-P159 WeakPolarHBondContact O-CG 3.43Å; G156-G160 PolarHBondContact O-N 2.85Å
157	S	98.2	Very high	97.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.9	-27.2	177.8	-60	0	0	0	0	112.7	T153 V154 I155 G160 A161 Q190 P191	T153-S157 PolarHBondContact O-N 2.91Å; T153-S157 PolarHBondContact O-OG 3.24Å; V154-S157 WeakPolarHBondContact O-CB 3.37Å; V154-S157 PolarHBondContact O-N 3.46Å; I155-S157 PolarHBondContact O-N 3.38Å; S157-G160 PolarHBondContact O-N 2.93Å; S157-A161 VanDerWaalsContact O-CB 3.24Å; S157-A161 WeakPolarHBondContact O-CB 3.33Å; S157-A161 PolarHBondContact O-N 3.43Å; S157-Q190 PolarHBondContact O-NE2 3.17Å; S157-Q190 VanDerWaalsContact OG-CB 3.27Å; S157-Q190 WeakPolarHBondContact OG-CB 3.43Å; S157-P191 VanDerWaalsContact OG-CD 3.3Å; S157-P191 WeakPolarHBondContact OG-CD 3.46Å; S157-P191 WeakPolarHBondContact OG-CG 3.47Å
158	F	98.3	Very high	98	Very high	109 Å²	109	28.5 Å²	28.5	48%	0.478	14%	0.14	S	C	.	.	H	α-helix	trans	-58.7	-62.4	175.4	-79.3	-85.6	0	0	0	112.6	V154 I155 G156 G160 A161 V162 F183 F187	V154-F158 WeakPolarHBondContact O-CD2 3.33Å; I155-F158 PolarHBondContact O-N 2.84Å; G156-F158 VanDerWaalsContact C-N 3.33Å; F158-G160 VanDerWaalsContact C-N 3.25Å; F158-G160 PolarHBondContact O-N 3.37Å; F158-A161 PolarHBondContact O-N 2.82Å; F158-A161 VanDerWaalsContact O-N 3.08Å; F158-V162 PolarHBondContact O-N 2.88Å; F158-F183 HydrophobicContact CD1-CZ 4.06Å; F158-F187 HydrophobicContact CD1-CD2 4.41Å; F158-F187 HydrophobicContact CD1-CE2 4.01Å; F158-F187 HydrophobicContact CD2-CD2 4.45Å; F158-F187 AromaticContact CD2-CE2 3.51Å; F158-F187 HydrophobicContact CD2-CE2 3.51Å; F158-F187 HydrophobicContact CD2-CZ 4.15Å; F158-F187 AromaticContact CE1-CE2 3.99Å; F158-F187 HydrophobicContact CE1-CE2 3.99Å; F158-F187 HydrophobicContact CE1-CZ 4.2Å; F158-F187 AromaticContact CE2-CE2 3.49Å; F158-F187 HydrophobicContact CE2-CE2 3.49Å; F158-F187 VanDerWaalsContact CE2-CE2 3.49Å; F158-F187 AromaticContact CE2-CZ 3.63Å; F158-F187 HydrophobicContact CE2-CZ 3.63Å; F158-F187 HydrophobicContact CG-CD2 4.32Å; F158-F187 AromaticContact CG-CE2 3.77Å; F158-F187 HydrophobicContact CG-CE2 3.77Å; F158-F187 AromaticContact CZ-CE2 3.74Å; F158-F187 HydrophobicContact CZ-CE2 3.74Å; F158-F187 AromaticContact CZ-CZ 3.66Å; F158-F187 HydrophobicContact CZ-CZ 3.66Å
159	P	98	Very high	98.1	Very high	13 Å²	13	22.2 Å²	22.2	8%	0.084	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-33.3	178.5	27.6	-36.8	0	0	0	112	G133 I155 G156 A161 V162	G133-P159 WeakPolarHBondContact O-CB 3.24Å; I155-P159 WeakPolarHBondContact O-CD 3.45Å; G156-P159 WeakPolarHBondContact O-CD 3.46Å; G156-P159 WeakPolarHBondContact O-CG 3.43Å; P159-A161 PolarHBondContact O-N 3.05Å; P159-V162 WeakPolarHBondContact O-CB 3.5Å; P159-V162 PolarHBondContact O-N 2.86Å
160	G	97.3	Very high	98.2	Very high	13 Å²	13	20.8 Å²	20.8	13%	0.134	10%	0.103	C	C	.	.	H	α-helix	trans	-67.1	-18.6	176.2	0	0	0	0	0	114.4	N31 G156 S157 F158 P163 V186	N31-G160 PolarHBondContact OD1-O 3.2Å; G156-G160 PolarHBondContact O-N 2.85Å; S157-G160 PolarHBondContact O-N 2.93Å; F158-G160 VanDerWaalsContact C-N 3.25Å; F158-G160 PolarHBondContact O-N 3.37Å; G160-P163 WeakPolarHBondContact O-CD 3.4Å; G160-V186 WeakPolarHBondContact O-CG1 3Å
161	A	98.5	Very high	98.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-95.9	-7.1	178.8	0	0	0	0	0	113.8	S157 F158 P159 P164 F183 V186 F187	S157-A161 VanDerWaalsContact O-CB 3.24Å; S157-A161 WeakPolarHBondContact O-CB 3.33Å; S157-A161 PolarHBondContact O-N 3.43Å; F158-A161 PolarHBondContact O-N 2.82Å; F158-A161 VanDerWaalsContact O-N 3.08Å; P159-A161 PolarHBondContact O-N 3.05Å; A161-P164 VanDerWaalsContact O-CD 3.23Å; A161-P164 WeakPolarHBondContact O-CD 3.31Å; A161-P164 WeakPolarHBondContact O-CG 3.17Å; A161-F183 VanDerWaalsContact C-CD2 3.41Å; A161-F183 HydrophobicContact CB-CD2 3.6Å; A161-F183 HydrophobicContact CB-CE1 4.42Å; A161-F183 HydrophobicContact CB-CE2 3.48Å; A161-F183 VanDerWaalsContact CB-CE2 3.48Å; A161-F183 HydrophobicContact CB-CG 4.12Å; A161-F183 HydrophobicContact CB-CZ 3.9Å; A161-F183 WeakPolarHBondContact O-CD2 3.14Å; A161-V186 HydrophobicContact CB-CB 4.03Å; A161-V186 HydrophobicContact CB-CG1 4.09Å; A161-F187 HydrophobicContact CB-CB 3.73Å
162	V	98.5	Very high	98.2	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.042	8%	0.083	C	C	.	.			trans	-63.3	-34.6	177	175	0	0	0	0	115	L129 F158 P159 L165 I166 F183	L129-V162 HydrophobicContact CB-CG1 4.03Å; L129-V162 HydrophobicContact CD2-CG1 4.47Å; L129-V162 WeakPolarHBondContact O-CG1 3.43Å; F158-V162 PolarHBondContact O-N 2.88Å; P159-V162 WeakPolarHBondContact O-CB 3.5Å; P159-V162 PolarHBondContact O-N 2.86Å; V162-L165 WeakPolarHBondContact O-CA 3.29Å; V162-L165 VanDerWaalsContact O-CB 3.27Å; V162-L165 WeakPolarHBondContact O-CB 3.23Å; V162-L165 PolarHBondContact O-N 3.11Å; V162-I166 HydrophobicContact CG1-CD1 3.61Å; V162-I166 HydrophobicContact CG1-CG1 3.74Å; V162-I166 PolarHBondContact O-N 2.93Å; V162-F183 HydrophobicContact CG2-CE2 4.37Å
163	P	98.6	Very high	98.2	Very high	9 Å²	9	16.8 Å²	16.8	6%	0.058	10%	0.096	C	C	.	.	H	α-helix	trans	-49.8	-47.1	-174.6	-28.4	34.9	0	0	0	116.5	N31 A35 M68 G160 L165 I166 G167	N31-P163 HydrophobicContact CB-CB 4.41Å; N31-P163 HydrophobicContact CB-CG 3.98Å; N31-P163 WeakPolarHBondContact O-CB 3.27Å; A35-P163 WeakPolarHBondContact CA-O 3.35Å; A35-P163 HydrophobicContact CB-CB 3.95Å; M68-P163 HydrophobicContact SD-CG 4.38Å; G160-P163 WeakPolarHBondContact O-CD 3.4Å; P163-L165 VanDerWaalsContact C-N 3.28Å; P163-L165 PolarHBondContact O-N 3.06Å; P163-I166 PolarHBondContact O-N 3.24Å; P163-G167 PolarHBondContact O-N 3.48Å
164	P	98.6	Very high	98.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.9	-28.4	174.8	24.4	-34.3	0	0	0	114	P34 A161 W168 L182 V186	P34-P164 HydrophobicContact CB-CB 4.14Å; P34-P164 HydrophobicContact CB-CG 4.18Å; P34-P164 WeakPolarHBondContact O-CA 3.5Å; P34-P164 WeakPolarHBondContact O-CB 3.17Å; A161-P164 VanDerWaalsContact O-CD 3.23Å; A161-P164 WeakPolarHBondContact O-CD 3.31Å; A161-P164 WeakPolarHBondContact O-CG 3.17Å; P164-W168 PolarHBondContact O-N 3.49Å; P164-W168 VanDerWaalsContact O-N 3.08Å; P164-L182 HydrophobicContact CB-CB 3.75Å; P164-L182 HydrophobicContact CB-CD1 4.37Å; P164-L182 HydrophobicContact CG-CB 4.27Å; P164-V186 HydrophobicContact CG-CG2 4.1Å
165	L	98.6	Very high	98.2	Very high	15 Å²	15	26 Å²	26	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-66.7	-49.1	172.1	-63.5	177	0	0	0	110.5	L129 V162 P163 G167 W168 V169 A179 F183	L129-L165 HydrophobicContact CD1-CB 3.77Å; L129-L165 HydrophobicContact CD2-CB 4.4Å; L129-L165 HydrophobicContact CD2-CD1 4.08Å; V162-L165 WeakPolarHBondContact O-CA 3.29Å; V162-L165 VanDerWaalsContact O-CB 3.27Å; V162-L165 WeakPolarHBondContact O-CB 3.23Å; V162-L165 PolarHBondContact O-N 3.11Å; P163-L165 VanDerWaalsContact C-N 3.28Å; P163-L165 PolarHBondContact O-N 3.06Å; L165-G167 VanDerWaalsContact C-N 3.25Å; L165-G167 PolarHBondContact O-N 3.13Å; L165-W168 PolarHBondContact O-N 3.36Å; L165-W168 VanDerWaalsContact O-N 3.16Å; L165-V169 WeakPolarHBondContact O-CG2 3.17Å; L165-V169 PolarHBondContact O-N 3.49Å; L165-A179 VanDerWaalsContact CD2-C 3.41Å; L165-A179 HydrophobicContact CD2-CB 3.74Å; L165-A179 VanDerWaalsContact CD2-O 3.23Å; L165-A179 WeakPolarHBondContact CD2-O 3.08Å; L165-F183 HydrophobicContact CD1-CB 4.09Å; L165-F183 HydrophobicContact CD1-CD2 3.38Å; L165-F183 HydrophobicContact CD1-CE2 4.1Å; L165-F183 HydrophobicContact CD1-CG 3.94Å; L165-F183 HydrophobicContact CD2-CB 3.85Å; L165-F183 HydrophobicContact CG-CB 3.82Å; L165-F183 HydrophobicContact CG-CD2 3.88Å; L165-F183 HydrophobicContact CG-CG 4.21Å
166	I	98.7	Very high	98.1	Very high	11 Å²	11	25.6 Å²	25.6	6%	0.056	14%	0.14	C	C	.	.	H	α-helix	trans	-55.7	-46.2	176.2	-69.1	172.1	0	0	0	109.8	M60 L119 L129 V162 P163 W168 V169 A170	M60-I166 HydrophobicContact CG-CG2 3.81Å; M60-I166 HydrophobicContact SD-CG2 4.29Å; L119-I166 HydrophobicContact CD1-CD1 4.05Å; L119-I166 HydrophobicContact CD1-CG2 4.06Å; L119-I166 HydrophobicContact CD2-CG2 4.05Å; L129-I166 HydrophobicContact CB-CD1 4.4Å; L129-I166 HydrophobicContact CB-CG1 3.68Å; L129-I166 HydrophobicContact CD1-CG1 4.49Å; V162-I166 HydrophobicContact CG1-CD1 3.61Å; V162-I166 HydrophobicContact CG1-CG1 3.74Å; V162-I166 PolarHBondContact O-N 2.93Å; P163-I166 PolarHBondContact O-N 3.24Å; I166-W168 PolarHBondContact O-N 3.36Å; I166-V169 PolarHBondContact O-N 2.58Å; I166-A170 WeakPolarHBondContact O-CB 3.45Å; I166-A170 PolarHBondContact O-N 2.9Å
167	G	98.7	Very high	98.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-51.3	-53.5	175.2	0	0	0	0	0	112.7	A35 A39 P163 L165	A35-G167 WeakPolarHBondContact O-CA 3.41Å; A39-G167 VanDerWaalsContact CA-C 3.49Å; A39-G167 WeakPolarHBondContact CA-O 3.43Å; A39-G167 VanDerWaalsContact CB-O 3.22Å; A39-G167 WeakPolarHBondContact CB-O 3.47Å; A39-G167 VanDerWaalsContact N-C 3.27Å; A39-G167 PolarHBondContact N-O 3.41Å; P163-G167 PolarHBondContact O-N 3.48Å; L165-G167 VanDerWaalsContact C-N 3.25Å; L165-G167 PolarHBondContact O-N 3.13Å
168	W	98.7	Very high	98.1	Very high	9 Å²	9	30.3 Å²	30.3	3%	0.034	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-52.5	179.8	180	-77.8	0	0	0	112.6	G38 L41 A42 M45 T46 P164 L165 I166 A170 I171 E172 Q174 S176 T178 A179	G38-W168 WeakPolarHBondContact O-CA 3.16Å; L41-W168 HydrophobicContact CB-CE3 4.4Å; L41-W168 HydrophobicContact CB-CZ3 4.15Å; A42-W168 HydrophobicContact CB-CB 4.49Å; A42-W168 HydrophobicContact CB-CD2 3.77Å; A42-W168 HydrophobicContact CB-CE3 3.8Å; A42-W168 HydrophobicContact CB-CG 4.11Å; A42-W168 HydrophobicContact CB-CZ3 4.25Å; M45-W168 HydrophobicContact CB-CH2 4.19Å; M45-W168 HydrophobicContact SD-CH2 4.18Å; M45-W168 HydrophobicContact SD-CZ3 4Å; T46-W168 HydrophobicContact CG2-CH2 4.41Å; T46-W168 HydrophobicContact CG2-CZ2 4.13Å; P164-W168 PolarHBondContact O-N 3.49Å; P164-W168 VanDerWaalsContact O-N 3.08Å; L165-W168 PolarHBondContact O-N 3.36Å; L165-W168 VanDerWaalsContact O-N 3.16Å; I166-W168 PolarHBondContact O-N 3.36Å; W168-A170 PolarHBondContact O-N 3.23Å; W168-I171 PolarHBondContact O-N 2.96Å; W168-I171 VanDerWaalsContact O-N 3.17Å; W168-E172 PolarHBondContact O-N 2.75Å; W168-E172 VanDerWaalsContact O-N 3.09Å; W168-Q174 PolarHBondContact NE1-O 2.93Å; W168-Q174 VanDerWaalsContact NE1-O 3.13Å; W168-S176 VanDerWaalsContact CE2-CB 3.5Å; W168-S176 WeakPolarHBondContact CH2-OG 3.45Å; W168-S176 WeakPolarHBondContact CZ2-OG 3.37Å; W168-S176 PolarHBondContact NE1-OG 2.9Å; W168-T178 HydrophobicContact CE3-CG2 4.07Å; W168-T178 HydrophobicContact CH2-CG2 4.26Å; W168-T178 HydrophobicContact CZ3-CG2 3.55Å; W168-A179 HydrophobicContact CB-CB 3.71Å; W168-A179 HydrophobicContact CD2-CB 3.95Å; W168-A179 HydrophobicContact CG-CB 3.54Å
169	V	98.6	Very high	98.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.7	-21	-174.3	-57.2	0	0	0	0	112.9	N123 P125 S126 L129 L165 I166 I171 G173 I175	N123-V169 PolarHBondContact ND2-O 3.08Å; N123-V169 PolarHBondContact OD1-O 3.03Å; P125-V169 HydrophobicContact CB-CB 4.41Å; S126-V169 WeakPolarHBondContact OG-CG2 3.04Å; L129-V169 HydrophobicContact CD1-CB 4.42Å; L129-V169 HydrophobicContact CD1-CG1 4Å; L129-V169 HydrophobicContact CD1-CG2 3.54Å; L165-V169 WeakPolarHBondContact O-CG2 3.17Å; L165-V169 PolarHBondContact O-N 3.49Å; I166-V169 PolarHBondContact O-N 2.58Å; V169-I171 PolarHBondContact O-N 3.49Å; V169-G173 VanDerWaalsContact O-CA 3.25Å; V169-G173 WeakPolarHBondContact O-CA 3.21Å; V169-G173 PolarHBondContact O-N 2.79Å; V169-I175 HydrophobicContact CG1-CG1 3.78Å
170	A	98.5	Very high	98.1	Very high	4 Å²	4	28 Å²	28	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-26.2	173.7	0	0	0	0	0	112.6	M60 L122 S126 I166 W168	M60-A170 HydrophobicContact CB-CB 3.78Å; M60-A170 HydrophobicContact CG-CB 3.59Å; L122-A170 HydrophobicContact CD1-CB 3.92Å; S126-A170 WeakPolarHBondContact OG-CA 3.33Å; S126-A170 PolarHBondContact OG-N 2.76Å; I166-A170 WeakPolarHBondContact O-CB 3.45Å; I166-A170 PolarHBondContact O-N 2.9Å; W168-A170 PolarHBondContact O-N 3.23Å
171	I	98.2	Very high	98.2	Very high	18 Å²	18	27.4 Å²	27.4	9%	0.092	15%	0.148	C	C	.	.	H	α-helix	trans	-97.9	-52.1	178	-54	-54.7	0	0	0	110.5	A39 A42 V43 H48 Q56 I57 W168 V169	A39-I171 HydrophobicContact CB-CG1 4.04Å; A42-I171 HydrophobicContact CB-CB 3.78Å; A42-I171 HydrophobicContact CB-CG1 4.22Å; A42-I171 HydrophobicContact CB-CG2 4.1Å; V43-I171 HydrophobicContact CG2-CD1 4.28Å; V43-I171 HydrophobicContact CG2-CG1 4.09Å; V43-I171 HydrophobicContact CG2-CG2 3.86Å; H48-I171 HydrophobicContact CB-CG2 4.42Å; Q56-I171 HydrophobicContact CB-CD1 3.81Å; I57-I171 HydrophobicContact CG1-CD1 3.94Å; W168-I171 PolarHBondContact O-N 2.96Å; W168-I171 VanDerWaalsContact O-N 3.17Å; V169-I171 PolarHBondContact O-N 3.49Å
172	E	97.1	Very high	98.2	Very high	53 Å²	53	27.4 Å²	27.4	25%	0.248	15%	0.148	C	C	.	.	H	α-helix	trans	-92.2	-17.8	-168	-176.2	52.1	-159.1	0	0	113.5	T46 H48 W168 Q174	T46-E172 HydrophobicContact CG2-CG 4.21Å; T46-E172 PolarHBondContact OG1-OE2 3.47Å; H48-E172 IonicContact NE2-OE2 2.73Å; H48-E172 PolarHBondContact NE2-OE2 3.09Å; W168-E172 PolarHBondContact O-N 2.75Å; W168-E172 VanDerWaalsContact O-N 3.09Å; E172-Q174 HydrophobicContact CG-CG 3.75Å; E172-Q174 PolarHBondContact O-N 2.89Å; E172-Q174 VanDerWaalsContact O-N 3.14Å; E172-Q174 PolarHBondContact OE1-NE2 3.42Å
173	G	97.2	Very high	98.2	Very high	28 Å²	28	28.6 Å²	28.6	29%	0.289	15%	0.153	S	C	.	.	S	Bend	trans	70.5	2.5	-179.6	0	0	0	0	0	115.2	P125 V169	P125-G173 WeakPolarHBondContact CG-O 3.36Å; V169-G173 VanDerWaalsContact O-CA 3.25Å; V169-G173 WeakPolarHBondContact O-CA 3.21Å; V169-G173 PolarHBondContact O-N 2.79Å
174	Q	97.4	Very high	98.2	Very high	120 Å²	120	30.6 Å²	30.6	56%	0.561	16%	0.163	S	C	*	.	S	Bend	trans	-145.3	151.7	177.6	54.7	179	-6.8	0	0	111.6	W168 E172	W168-Q174 PolarHBondContact NE1-O 2.93Å; W168-Q174 VanDerWaalsContact NE1-O 3.13Å; E172-Q174 HydrophobicContact CG-CG 3.75Å; E172-Q174 PolarHBondContact O-N 2.89Å; E172-Q174 VanDerWaalsContact O-N 3.14Å; E172-Q174 PolarHBondContact OE1-NE2 3.42Å
175	I	97.8	Very high	98.2	Very high	90 Å²	90	30.6 Å²	30.6	46%	0.462	16%	0.163	S	C	.	.			trans	-78.5	129.1	178.8	-63	175.1	0	0	0	109.4	V169 A179 I180	V169-I175 HydrophobicContact CG1-CG1 3.78Å; I175-A179 HydrophobicContact CG2-CB 4.46Å; I175-I180 HydrophobicContact CG2-CD1 3.85Å; I175-I180 HydrophobicContact CG2-CG1 3.6Å
176	S	97.2	Very high	98.2	Very high	29 Å²	29	30 Å²	30	20%	0.203	16%	0.16	C	C	.	.			trans	-106.7	168	173.3	75.8	0	0	0	0	112.4	W168 T178 A179 I180	W168-S176 VanDerWaalsContact CE2-CB 3.5Å; W168-S176 WeakPolarHBondContact CH2-OG 3.45Å; W168-S176 WeakPolarHBondContact CZ2-OG 3.37Å; W168-S176 PolarHBondContact NE1-OG 2.9Å; S176-T178 PolarHBondContact O-N 3.48Å; S176-T178 PolarHBondContact OG-N 2.9Å; S176-A179 WeakPolarHBondContact O-CB 3.49Å; S176-A179 PolarHBondContact O-N 2.91Å; S176-A179 PolarHBondContact OG-N 3.4Å; S176-I180 WeakPolarHBondContact O-CG1 3.25Å; S176-I180 PolarHBondContact O-N 3.34Å
177	L	97.8	Very high	98.2	Very high	101 Å²	101	30.5 Å²	30.5	53%	0.529	16%	0.161	S	C	.	.	H	α-helix	trans	-59.4	-37.3	170.4	-177.6	61.3	0	0	0	111.8	I180 A181	L177-I180 PolarHBondContact O-N 2.97Å; L177-A181 WeakPolarHBondContact O-CB 3.33Å; L177-A181 PolarHBondContact O-N 3.41Å
178	T	97.4	Very high	98.2	Very high	8 Å²	8	30.6 Å²	30.6	5%	0.049	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-48.3	174.3	-58.5	0	0	0	0	110.8	L41 M45 W168 S176 I180 A181 L182 L240	L41-T178 HydrophobicContact CD1-CG2 4.36Å; M45-T178 HydrophobicContact CE-CG2 4.43Å; M45-T178 WeakPolarHBondContact CE-OG1 3.48Å; M45-T178 HydrophobicContact SD-CG2 3.79Å; W168-T178 HydrophobicContact CE3-CG2 4.07Å; W168-T178 HydrophobicContact CH2-CG2 4.26Å; W168-T178 HydrophobicContact CZ3-CG2 3.55Å; S176-T178 PolarHBondContact O-N 3.48Å; S176-T178 PolarHBondContact OG-N 2.9Å; T178-I180 VanDerWaalsContact C-N 3.33Å; T178-I180 PolarHBondContact O-N 2.85Å; T178-A181 PolarHBondContact O-N 3.25Å; T178-A181 VanDerWaalsContact O-N 3.15Å; T178-L182 HydrophobicContact CG2-CD1 4.47Å; T178-L182 WeakPolarHBondContact O-CG 3.5Å; T178-L182 PolarHBondContact O-N 3.17Å; T178-L240 HydrophobicContact CG2-CD2 3.71Å
179	A	98.2	Very high	98.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-45.4	178.4	0	0	0	0	0	111.3	L165 W168 I175 S176 A181 L182 F183	L165-A179 VanDerWaalsContact CD2-C 3.41Å; L165-A179 HydrophobicContact CD2-CB 3.74Å; L165-A179 VanDerWaalsContact CD2-O 3.23Å; L165-A179 WeakPolarHBondContact CD2-O 3.08Å; W168-A179 HydrophobicContact CB-CB 3.71Å; W168-A179 HydrophobicContact CD2-CB 3.95Å; W168-A179 HydrophobicContact CG-CB 3.54Å; I175-A179 HydrophobicContact CG2-CB 4.46Å; S176-A179 WeakPolarHBondContact O-CB 3.49Å; S176-A179 PolarHBondContact O-N 2.91Å; S176-A179 PolarHBondContact OG-N 3.4Å; A179-A181 VanDerWaalsContact C-N 3.33Å; A179-A181 PolarHBondContact O-N 2.88Å; A179-L182 PolarHBondContact O-N 3.44Å; A179-F183 PolarHBondContact O-N 2.9Å
180	I	98.6	Very high	98.2	Very high	74 Å²	74	31.4 Å²	31.4	38%	0.379	17%	0.166	S	C	.	.	H	α-helix	trans	-61.2	-41.9	176.1	-66.6	167.1	0	0	0	111	I175 S176 L177 T178 F183 L184	I175-I180 HydrophobicContact CG2-CD1 3.85Å; I175-I180 HydrophobicContact CG2-CG1 3.6Å; S176-I180 WeakPolarHBondContact O-CG1 3.25Å; S176-I180 PolarHBondContact O-N 3.34Å; L177-I180 PolarHBondContact O-N 2.97Å; T178-I180 VanDerWaalsContact C-N 3.33Å; T178-I180 PolarHBondContact O-N 2.85Å; I180-F183 WeakPolarHBondContact O-CB 3.35Å; I180-F183 PolarHBondContact O-N 3.42Å; I180-L184 HydrophobicContact CG2-CD1 4.06Å; I180-L184 HydrophobicContact CG2-CG 4.3Å; I180-L184 VanDerWaalsContact O-CG 3.28Å; I180-L184 WeakPolarHBondContact O-CG 3.35Å; I180-L184 PolarHBondContact O-N 3.08Å
181	A	98.6	Very high	98.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-42.2	178.2	0	0	0	0	0	112	L177 T178 A179 F183 L184 V185 V236 L239 L240	L177-A181 WeakPolarHBondContact O-CB 3.33Å; L177-A181 PolarHBondContact O-N 3.41Å; T178-A181 PolarHBondContact O-N 3.25Å; T178-A181 VanDerWaalsContact O-N 3.15Å; A179-A181 VanDerWaalsContact C-N 3.33Å; A179-A181 PolarHBondContact O-N 2.88Å; A181-F183 PolarHBondContact O-N 3.29Å; A181-L184 PolarHBondContact O-N 3.15Å; A181-V185 WeakPolarHBondContact O-CG2 3.3Å; A181-V185 PolarHBondContact O-N 2.95Å; A181-V236 WeakPolarHBondContact O-CG1 3.31Å; A181-L239 HydrophobicContact CB-CB 3.66Å; A181-L239 HydrophobicContact CB-CD1 4.3Å; A181-L240 HydrophobicContact CB-CD1 4.32Å; A181-L240 HydrophobicContact CB-CD2 3.73Å; A181-L240 HydrophobicContact CB-CG 3.73Å
182	L	98.6	Very high	98.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-41.3	174.4	-60.5	174	0	0	0	111.9	L41 P164 T178 A179 V185 V186 L240 F290 F291	L41-L182 HydrophobicContact CD1-CD1 3.85Å; L41-L182 HydrophobicContact CD1-CD2 4.11Å; L41-L182 HydrophobicContact CD1-CG 4.49Å; P164-L182 HydrophobicContact CB-CB 3.75Å; P164-L182 HydrophobicContact CB-CD1 4.37Å; P164-L182 HydrophobicContact CG-CB 4.27Å; T178-L182 HydrophobicContact CG2-CD1 4.47Å; T178-L182 WeakPolarHBondContact O-CG 3.5Å; T178-L182 PolarHBondContact O-N 3.17Å; A179-L182 PolarHBondContact O-N 3.44Å; L182-V185 PolarHBondContact O-N 3.37Å; L182-V186 PolarHBondContact O-N 2.95Å; L182-L240 HydrophobicContact CD2-CD1 4.11Å; L182-L240 HydrophobicContact CD2-CD2 4.3Å; L182-F290 HydrophobicContact CD2-CE1 4.29Å; L182-F291 HydrophobicContact CB-CE1 4.35Å; L182-F291 HydrophobicContact CD2-CE1 3.87Å; L182-F291 HydrophobicContact CG-CE1 4.5Å
183	F	98.7	Very high	98.2	Very high	31 Å²	31	28.7 Å²	28.7	14%	0.136	15%	0.152	C	C	.	.	H	α-helix	trans	-56	-50.2	170.9	173	-84.8	0	0	0	111	F158 A161 V162 L165 A179 I180 A181 V185 V186 F187	F158-F183 HydrophobicContact CD1-CZ 4.06Å; A161-F183 VanDerWaalsContact C-CD2 3.41Å; A161-F183 HydrophobicContact CB-CD2 3.6Å; A161-F183 HydrophobicContact CB-CE1 4.42Å; A161-F183 HydrophobicContact CB-CE2 3.48Å; A161-F183 VanDerWaalsContact CB-CE2 3.48Å; A161-F183 HydrophobicContact CB-CG 4.12Å; A161-F183 HydrophobicContact CB-CZ 3.9Å; A161-F183 WeakPolarHBondContact O-CD2 3.14Å; V162-F183 HydrophobicContact CG2-CE2 4.37Å; L165-F183 HydrophobicContact CD1-CB 4.09Å; L165-F183 HydrophobicContact CD1-CD2 3.38Å; L165-F183 HydrophobicContact CD1-CE2 4.1Å; L165-F183 HydrophobicContact CD1-CG 3.94Å; L165-F183 HydrophobicContact CD2-CB 3.85Å; L165-F183 HydrophobicContact CG-CB 3.82Å; L165-F183 HydrophobicContact CG-CD2 3.88Å; L165-F183 HydrophobicContact CG-CG 4.21Å; A179-F183 PolarHBondContact O-N 2.9Å; I180-F183 WeakPolarHBondContact O-CB 3.35Å; I180-F183 PolarHBondContact O-N 3.42Å; A181-F183 PolarHBondContact O-N 3.29Å; F183-V185 VanDerWaalsContact C-N 3.29Å; F183-V185 PolarHBondContact O-N 3.36Å; F183-V186 PolarHBondContact O-N 3.15Å; F183-F187 HydrophobicContact CD1-CB 4.31Å; F183-F187 HydrophobicContact CE1-CB 4Å; F183-F187 HydrophobicContact CE1-CD2 4.46Å; F183-F187 HydrophobicContact CE1-CG 4.2Å; F183-F187 HydrophobicContact CZ-CB 4.45Å; F183-F187 HydrophobicContact CZ-CD2 4.42Å; F183-F187 VanDerWaalsContact O-CB 3.23Å; F183-F187 WeakPolarHBondContact O-CB 3.46Å; F183-F187 PolarHBondContact O-N 2.95Å
184	L	98.8	Very high	98.3	Very high	52 Å²	52	30.1 Å²	30.1	27%	0.272	15%	0.15	S	C	.	.	H	α-helix	trans	-61.8	-36	-178.8	-72.4	173.9	0	0	0	112.3	I180 A181 F187 C188 V236 L239	I180-L184 HydrophobicContact CG2-CD1 4.06Å; I180-L184 HydrophobicContact CG2-CG 4.3Å; I180-L184 VanDerWaalsContact O-CG 3.28Å; I180-L184 WeakPolarHBondContact O-CG 3.35Å; I180-L184 PolarHBondContact O-N 3.08Å; A181-L184 PolarHBondContact O-N 3.15Å; L184-F187 PolarHBondContact O-N 3.39Å; L184-C188 WeakPolarHBondContact O-CB 3.44Å; L184-C188 PolarHBondContact O-N 2.92Å; L184-C188 PolarHBondContact O-SG 2.92Å; L184-V236 HydrophobicContact CB-CG1 3.75Å; L184-V236 HydrophobicContact CB-CG2 4.31Å; L184-L239 HydrophobicContact CD1-CD1 3.88Å
185	V	98.8	Very high	98.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-53.2	174	172.4	0	0	0	0	110.4	A181 L182 F183 F187 C188 W189 L233 V236 Y286 F290	A181-V185 WeakPolarHBondContact O-CG2 3.3Å; A181-V185 PolarHBondContact O-N 2.95Å; L182-V185 PolarHBondContact O-N 3.37Å; F183-V185 VanDerWaalsContact C-N 3.29Å; F183-V185 PolarHBondContact O-N 3.36Å; V185-F187 VanDerWaalsContact C-N 3.32Å; V185-F187 PolarHBondContact O-N 3.13Å; V185-C188 PolarHBondContact O-N 3.21Å; V185-W189 WeakPolarHBondContact O-CB 3.32Å; V185-W189 PolarHBondContact O-N 2.96Å; V185-L233 HydrophobicContact CB-CD1 4.42Å; V185-L233 HydrophobicContact CG1-CD1 4.31Å; V185-L233 HydrophobicContact CG2-CD1 4.4Å; V185-V236 HydrophobicContact CG2-CB 4.33Å; V185-V236 HydrophobicContact CG2-CG1 3.58Å; V185-Y286 HydrophobicContact CG1-CE1 4.05Å; V185-F290 HydrophobicContact CB-CE1 4.2Å; V185-F290 HydrophobicContact CB-CZ 4.23Å; V185-F290 HydrophobicContact CG1-CD1 3.9Å; V185-F290 HydrophobicContact CG1-CD2 4.26Å; V185-F290 HydrophobicContact CG1-CE1 3.81Å; V185-F290 HydrophobicContact CG1-CE2 4.15Å; V185-F290 HydrophobicContact CG1-CG 4.15Å; V185-F290 HydrophobicContact CG1-CZ 3.95Å; V185-F290 HydrophobicContact CG2-CE1 3.84Å; V185-F290 HydrophobicContact CG2-CE2 4.01Å; V185-F290 HydrophobicContact CG2-CZ 3.43Å; V185-F290 VanDerWaalsContact CG2-CZ 3.43Å
186	V	98.7	Very high	98.3	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.012	10%	0.103	C	C	.	.	H	α-helix	trans	-65.7	-38.4	-179.6	-177.4	0	0	0	0	111.1	P34 G160 A161 P164 L182 F183 Q190 L287 F291	P34-V186 HydrophobicContact CB-CG2 4.07Å; P34-V186 HydrophobicContact CG-CG2 4.49Å; G160-V186 WeakPolarHBondContact O-CG1 3Å; A161-V186 HydrophobicContact CB-CB 4.03Å; A161-V186 HydrophobicContact CB-CG1 4.09Å; P164-V186 HydrophobicContact CG-CG2 4.1Å; L182-V186 PolarHBondContact O-N 2.95Å; F183-V186 PolarHBondContact O-N 3.15Å; V186-Q190 HydrophobicContact CG1-CG 4.38Å; V186-Q190 WeakPolarHBondContact O-CB 3.39Å; V186-Q190 WeakPolarHBondContact O-CG 3.44Å; V186-Q190 PolarHBondContact O-N 3.49Å; V186-Q190 PolarHBondContact O-NE2 2.83Å; V186-L287 HydrophobicContact CG2-CD1 4.36Å; V186-F291 HydrophobicContact CG2-CE2 3.69Å; V186-F291 HydrophobicContact CG2-CZ 3.58Å
187	F	98.7	Very high	98.3	Very high	21 Å²	21	20.5 Å²	20.5	9%	0.092	10%	0.101	C	C	.	.	H	α-helix	trans	-63.9	-46.7	178.5	178.1	-104.2	0	0	0	112.3	V154 F158 A161 F183 L184 V185 P191 W229	V154-F187 HydrophobicContact CG1-CZ 4.08Å; F158-F187 HydrophobicContact CD1-CD2 4.41Å; F158-F187 HydrophobicContact CD1-CE2 4.01Å; F158-F187 HydrophobicContact CD2-CD2 4.45Å; F158-F187 AromaticContact CD2-CE2 3.51Å; F158-F187 HydrophobicContact CD2-CE2 3.51Å; F158-F187 HydrophobicContact CD2-CZ 4.15Å; F158-F187 AromaticContact CE1-CE2 3.99Å; F158-F187 HydrophobicContact CE1-CE2 3.99Å; F158-F187 HydrophobicContact CE1-CZ 4.2Å; F158-F187 AromaticContact CE2-CE2 3.49Å; F158-F187 HydrophobicContact CE2-CE2 3.49Å; F158-F187 VanDerWaalsContact CE2-CE2 3.49Å; F158-F187 AromaticContact CE2-CZ 3.63Å; F158-F187 HydrophobicContact CE2-CZ 3.63Å; F158-F187 HydrophobicContact CG-CD2 4.32Å; F158-F187 AromaticContact CG-CE2 3.77Å; F158-F187 HydrophobicContact CG-CE2 3.77Å; F158-F187 AromaticContact CZ-CE2 3.74Å; F158-F187 HydrophobicContact CZ-CE2 3.74Å; F158-F187 AromaticContact CZ-CZ 3.66Å; F158-F187 HydrophobicContact CZ-CZ 3.66Å; A161-F187 HydrophobicContact CB-CB 3.73Å; F183-F187 HydrophobicContact CD1-CB 4.31Å; F183-F187 HydrophobicContact CE1-CB 4Å; F183-F187 HydrophobicContact CE1-CD2 4.46Å; F183-F187 HydrophobicContact CE1-CG 4.2Å; F183-F187 HydrophobicContact CZ-CB 4.45Å; F183-F187 HydrophobicContact CZ-CD2 4.42Å; F183-F187 VanDerWaalsContact O-CB 3.23Å; F183-F187 WeakPolarHBondContact O-CB 3.46Å; F183-F187 PolarHBondContact O-N 2.95Å; L184-F187 PolarHBondContact O-N 3.39Å; V185-F187 VanDerWaalsContact C-N 3.32Å; V185-F187 PolarHBondContact O-N 3.13Å; F187-P191 WeakPolarHBondContact O-CD 3.37Å; F187-W229 HydrophobicContact CD1-CH2 4.44Å; F187-W229 HydrophobicContact CD1-CZ3 4.06Å; F187-W229 AromaticContact CE1-CH2 3.53Å; F187-W229 HydrophobicContact CE1-CH2 3.53Å; F187-W229 AromaticContact CE1-CZ3 3.53Å; F187-W229 HydrophobicContact CE1-CZ3 3.53Å; F187-W229 AromaticContact CZ-CH2 3.84Å; F187-W229 HydrophobicContact CZ-CH2 3.84Å; F187-W229 HydrophobicContact CZ-CZ3 4.28Å
188	C	98.7	Very high	98.3	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.014	8%	0.076	C	C	.	.	H	α-helix	trans	-76.8	-30.7	-179.7	-60.2	0	0	0	0	112.2	L184 V185 I192 W229 L233	L184-C188 WeakPolarHBondContact O-CB 3.44Å; L184-C188 PolarHBondContact O-N 2.92Å; L184-C188 PolarHBondContact O-SG 2.92Å; V185-C188 PolarHBondContact O-N 3.21Å; C188-I192 WeakPolarHBondContact O-CD1 3.37Å; C188-W229 HydrophobicContact CB-CE3 4.15Å; C188-L233 HydrophobicContact CB-CB 3.86Å; C188-L233 HydrophobicContact CB-CD1 4.05Å; C188-L233 HydrophobicContact CB-CG 4.45Å
189	W	98.7	Very high	98.2	Very high	17 Å²	17	16 Å²	16	6%	0.064	8%	0.077	C	C	.	.	H	α-helix	trans	-65.4	-43.1	175.7	168.4	89.6	0	0	0	112.4	V185 I192 H193 W258 S283 Y286 L287	V185-W189 WeakPolarHBondContact O-CB 3.32Å; V185-W189 PolarHBondContact O-N 2.96Å; W189-I192 PolarHBondContact O-N 3.27Å; W189-H193 HydrophobicContact CD2-CB 4.31Å; W189-H193 HydrophobicContact CH2-CB 4.03Å; W189-H193 AromaticContact CH2-CD2 3.86Å; W189-H193 AromaticContact CH2-CG 3.66Å; W189-H193 AromaticContact CH2-ND1 3.89Å; W189-H193 HydrophobicContact CZ2-CB 3.81Å; W189-H193 AromaticContact CZ2-CG 3.61Å; W189-H193 AromaticContact CZ2-ND1 3.55Å; W189-H193 HydrophobicContact CZ3-CB 4.41Å; W189-H193 PolarHBondContact O-N 3.11Å; W189-W258 AromaticContact CD1-CH2 3.52Å; W189-W258 AromaticContact CD1-CZ3 3.57Å; W189-W258 HydrophobicContact CG-CH2 4.29Å; W189-W258 HydrophobicContact CG-CZ3 4.39Å; W189-S283 PolarHBondContact NE1-O 2.96Å; W189-Y286 AromaticContact CD1-CD1 3.39Å; W189-Y286 HydrophobicContact CG-CD1 4.29Å; W189-Y286 AromaticContact NE1-CD1 3.96Å; W189-L287 HydrophobicContact CD2-CD1 4.05Å; W189-L287 HydrophobicContact CE3-CD1 4.1Å; W189-L287 HydrophobicContact CH2-CD2 3.93Å; W189-L287 HydrophobicContact CZ2-CB 4.04Å; W189-L287 HydrophobicContact CZ2-CD2 4.11Å; W189-L287 HydrophobicContact CZ2-CG 4.46Å; W189-L287 HydrophobicContact CZ3-CD1 4.4Å; W189-L287 HydrophobicContact CZ3-CD2 4.23Å
190	Q	98.4	Very high	98.1	Very high	10 Å²	10	19.7 Å²	19.7	5%	0.047	9%	0.093	C	C	.	.	H	α-helix	trans	-58.6	-46.7	-172.8	-89.5	-179.5	88.3	0	0	114.2	S157 V186 I192 H193 F194	S157-Q190 PolarHBondContact O-NE2 3.17Å; S157-Q190 VanDerWaalsContact OG-CB 3.27Å; S157-Q190 WeakPolarHBondContact OG-CB 3.43Å; V186-Q190 HydrophobicContact CG1-CG 4.38Å; V186-Q190 WeakPolarHBondContact O-CB 3.39Å; V186-Q190 WeakPolarHBondContact O-CG 3.44Å; V186-Q190 PolarHBondContact O-N 3.49Å; V186-Q190 PolarHBondContact O-NE2 2.83Å; Q190-I192 VanDerWaalsContact C-N 3.26Å; Q190-I192 PolarHBondContact O-N 3.31Å; Q190-H193 WeakPolarHBondContact O-CB 3.36Å; Q190-H193 PolarHBondContact O-N 2.8Å; Q190-F194 HydrophobicContact CB-CD2 4.11Å; Q190-F194 HydrophobicContact CB-CE2 4.09Å; Q190-F194 HydrophobicContact CG-CD2 4.45Å; Q190-F194 HydrophobicContact CG-CE2 3.95Å; Q190-F194 WeakPolarHBondContact O-CB 3.37Å; Q190-F194 WeakPolarHBondContact O-CD2 3.44Å; Q190-F194 PolarHBondContact O-N 3Å
191	P	98.5	Very high	97.9	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.2	-39.8	177.8	-28.5	35.4	0	0	0	113	T153 V154 S157 F187 Y195 W229	T153-P191 HydrophobicContact CG2-CB 4.25Å; V154-P191 HydrophobicContact CG2-CG 4.49Å; S157-P191 VanDerWaalsContact OG-CD 3.3Å; S157-P191 WeakPolarHBondContact OG-CD 3.46Å; S157-P191 WeakPolarHBondContact OG-CG 3.47Å; F187-P191 WeakPolarHBondContact O-CD 3.37Å; P191-Y195 HydrophobicContact CB-CD2 4.4Å; P191-Y195 HydrophobicContact CB-CE2 4.06Å; P191-Y195 WeakPolarHBondContact O-CB 3.23Å; P191-Y195 WeakPolarHBondContact O-CD2 3.26Å; P191-Y195 PolarHBondContact O-N 2.92Å; P191-W229 VanDerWaalsContact CB-CD1 3.47Å; P191-W229 HydrophobicContact CB-CD2 4.01Å; P191-W229 HydrophobicContact CB-CG 3.83Å; P191-W229 HydrophobicContact CG-CD2 3.92Å; P191-W229 HydrophobicContact CG-CE3 4.4Å; P191-W229 HydrophobicContact CG-CG 4.25Å; P191-W229 HydrophobicContact CG-CZ2 4.11Å
192	I	98.3	Very high	97.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.9	-46.4	179	-48.6	157.3	0	0	0	109.7	C188 W189 Q190 A196 M226 W229 L230 L233 W258 M279	C188-I192 WeakPolarHBondContact O-CD1 3.37Å; W189-I192 PolarHBondContact O-N 3.27Å; Q190-I192 VanDerWaalsContact C-N 3.26Å; Q190-I192 PolarHBondContact O-N 3.31Å; I192-A196 WeakPolarHBondContact O-CB 3.42Å; I192-A196 PolarHBondContact O-N 3.02Å; I192-M226 HydrophobicContact CG2-CB 4.2Å; I192-M226 HydrophobicContact CG2-CE 3.78Å; I192-M226 HydrophobicContact CG2-CG 4.34Å; I192-W229 HydrophobicContact CD1-CB 3.89Å; I192-W229 HydrophobicContact CG1-CB 3.51Å; I192-L230 HydrophobicContact CD1-CB 4.49Å; I192-L230 HydrophobicContact CD1-CD2 3.74Å; I192-L230 HydrophobicContact CD1-CG 3.75Å; I192-L230 HydrophobicContact CG1-CG 4.41Å; I192-L233 HydrophobicContact CD1-CD2 4.43Å; I192-W258 HydrophobicContact CB-CH2 3.53Å; I192-W258 HydrophobicContact CB-CZ2 3.68Å; I192-W258 HydrophobicContact CB-CZ3 4.34Å; I192-W258 HydrophobicContact CD1-CE3 4.28Å; I192-W258 HydrophobicContact CD1-CH2 3.73Å; I192-W258 HydrophobicContact CD1-CZ2 4.4Å; I192-W258 HydrophobicContact CD1-CZ3 3.65Å; I192-W258 HydrophobicContact CG1-CH2 4.26Å; I192-W258 HydrophobicContact CG2-CH2 3.59Å; I192-W258 HydrophobicContact CG2-CZ2 3.18Å; I192-W258 HydrophobicContact CG2-CZ3 4.41Å; I192-M279 HydrophobicContact CG2-CE 4.18Å
193	H	98.1	Very high	97.5	Very high	18 Å²	18	29.6 Å²	29.6	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-56.4	-52.7	176.1	175.2	78.2	0	0	0	112.2	W189 Q190 A196 L197 F280 S283	W189-H193 HydrophobicContact CD2-CB 4.31Å; W189-H193 HydrophobicContact CH2-CB 4.03Å; W189-H193 AromaticContact CH2-CD2 3.86Å; W189-H193 AromaticContact CH2-CG 3.66Å; W189-H193 AromaticContact CH2-ND1 3.89Å; W189-H193 HydrophobicContact CZ2-CB 3.81Å; W189-H193 AromaticContact CZ2-CG 3.61Å; W189-H193 AromaticContact CZ2-ND1 3.55Å; W189-H193 HydrophobicContact CZ3-CB 4.41Å; W189-H193 PolarHBondContact O-N 3.11Å; Q190-H193 WeakPolarHBondContact O-CB 3.36Å; Q190-H193 PolarHBondContact O-N 2.8Å; H193-A196 WeakPolarHBondContact O-CB 3.35Å; H193-A196 PolarHBondContact O-N 3.23Å; H193-L197 PolarHBondContact O-N 3.23Å; H193-L197 VanDerWaalsContact O-N 3.13Å; H193-F280 AromaticContact CE1-CD2 3.67Å; H193-F280 AromaticContact CE1-CE2 3.08Å; H193-F280 WeakPolarHBondContact CE1-CE2 3.27Å; H193-F280 AromaticContact CE1-CZ 3.69Å; H193-F280 AromaticContact ND1-CD2 3.81Å; H193-F280 AromaticContact ND1-CE2 3.7Å; H193-F280 AromaticContact NE2-CE2 3.5Å; H193-S283 PolarHBondContact ND1-OG 3.15Å
194	F	97.9	Very high	97.4	Very high	57 Å²	57	29.9 Å²	29.9	25%	0.25	14%	0.139	C	C	.	.	H	α-helix	trans	-72.9	-33.4	-176.9	-73.5	-56.1	0	0	0	113.1	T153 Q190 A196 L197 A198	T153-F194 HydrophobicContact CG2-CB 3.59Å; T153-F194 HydrophobicContact CG2-CD2 4.29Å; T153-F194 HydrophobicContact CG2-CG 4.38Å; Q190-F194 HydrophobicContact CB-CD2 4.11Å; Q190-F194 HydrophobicContact CB-CE2 4.09Å; Q190-F194 HydrophobicContact CG-CD2 4.45Å; Q190-F194 HydrophobicContact CG-CE2 3.95Å; Q190-F194 WeakPolarHBondContact O-CB 3.37Å; Q190-F194 WeakPolarHBondContact O-CD2 3.44Å; Q190-F194 PolarHBondContact O-N 3Å; F194-A196 VanDerWaalsContact C-N 3.34Å; F194-L197 PolarHBondContact O-N 2.92Å; F194-A198 WeakPolarHBondContact O-CB 3.45Å; F194-A198 PolarHBondContact O-N 3.13Å
195	Y	98.4	Very high	97.2	Very high	6 Å²	6	29.3 Å²	29.3	2%	0.024	13%	0.134	C	C	.	.	H	α-helix	trans	-64.9	-38.9	172.2	-71.7	-26.7	0	0	0	112.2	T153 P191 L197 A198 I199 L213 T222 M226	T153-Y195 HydrophobicContact CG2-CD1 4.12Å; T153-Y195 HydrophobicContact CG2-CE1 3.82Å; P191-Y195 HydrophobicContact CB-CD2 4.4Å; P191-Y195 HydrophobicContact CB-CE2 4.06Å; P191-Y195 WeakPolarHBondContact O-CB 3.23Å; P191-Y195 WeakPolarHBondContact O-CD2 3.26Å; P191-Y195 PolarHBondContact O-N 2.92Å; Y195-L197 VanDerWaalsContact C-N 3.34Å; Y195-L197 PolarHBondContact O-N 2.94Å; Y195-A198 PolarHBondContact O-N 3.47Å; Y195-I199 WeakPolarHBondContact O-CG1 3.38Å; Y195-I199 PolarHBondContact O-N 3.44Å; Y195-L213 HydrophobicContact CD1-CB 4.2Å; Y195-L213 HydrophobicContact CD1-CD2 4.35Å; Y195-L213 HydrophobicContact CE1-CB 3.72Å; Y195-L213 HydrophobicContact CE1-CD2 3.8Å; Y195-L213 HydrophobicContact CE1-CG 4.42Å; Y195-L213 HydrophobicContact CE2-CD2 4.02Å; Y195-T222 HydrophobicContact CD1-CG2 4.23Å; Y195-T222 HydrophobicContact CD2-CG2 4.44Å; Y195-T222 HydrophobicContact CG-CG2 3.87Å; Y195-M226 HydrophobicContact CD2-CG 3.86Å; Y195-M226 HydrophobicContact CG-CG 4.26Å
196	A	97.9	Very high	97.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-44.3	173.3	0	0	0	0	0	111.4	I192 H193 F194 I199 K200 M226 M279 F280	I192-A196 WeakPolarHBondContact O-CB 3.42Å; I192-A196 PolarHBondContact O-N 3.02Å; H193-A196 WeakPolarHBondContact O-CB 3.35Å; H193-A196 PolarHBondContact O-N 3.23Å; F194-A196 VanDerWaalsContact C-N 3.34Å; A196-I199 PolarHBondContact O-N 2.93Å; A196-K200 WeakPolarHBondContact O-CG 3.47Å; A196-K200 PolarHBondContact O-N 3.45Å; A196-M226 HydrophobicContact CB-CE 3.95Å; A196-M279 HydrophobicContact CB-CB 3.99Å; A196-F280 HydrophobicContact CB-CB 3.92Å
197	L	96.7	Very high	97	Very high	32 Å²	32	36 Å²	36	17%	0.168	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-40.7	174	-176.7	60.6	0	0	0	112.5	H193 F194 Y195 I199 K200 R201 F280	H193-L197 PolarHBondContact O-N 3.23Å; H193-L197 VanDerWaalsContact O-N 3.13Å; F194-L197 PolarHBondContact O-N 2.92Å; Y195-L197 VanDerWaalsContact C-N 3.34Å; Y195-L197 PolarHBondContact O-N 2.94Å; L197-I199 VanDerWaalsContact C-N 3.33Å; L197-I199 PolarHBondContact O-N 2.68Å; L197-K200 WeakPolarHBondContact O-CB 3.4Å; L197-K200 PolarHBondContact O-N 3.43Å; L197-R201 HydrophobicContact CD1-CG 4.36Å; L197-R201 PolarHBondContact O-N 2.83Å; L197-F280 HydrophobicContact CB-CD2 4.01Å; L197-F280 HydrophobicContact CB-CE2 3.96Å; L197-F280 HydrophobicContact CD1-CE2 4.18Å; L197-F280 HydrophobicContact CD1-CZ 4.48Å; L197-F280 HydrophobicContact CD2-CE2 4.38Å; L197-F280 HydrophobicContact CG-CE2 4.4Å
198	A	97.3	Very high	96.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.6	-31.4	-178.5	0	0	0	0	0	113	F194 Y195 R201 K202 Y205 M212 P214	F194-A198 WeakPolarHBondContact O-CB 3.45Å; F194-A198 PolarHBondContact O-N 3.13Å; Y195-A198 PolarHBondContact O-N 3.47Å; A198-R201 CarbonylContact O-C 3.6Å; A198-K202 VanDerWaalsContact O-CA 3.22Å; A198-K202 WeakPolarHBondContact O-CA 3.35Å; A198-K202 PolarHBondContact O-N 3.01Å; A198-Y205 HydrophobicContact CB-CD2 4.46Å; A198-Y205 HydrophobicContact CB-CE2 4.21Å; A198-M212 HydrophobicContact CB-CB 4.34Å; A198-M212 HydrophobicContact CB-CE 3.49Å; A198-M212 VanDerWaalsContact CB-CE 3.49Å; A198-M212 HydrophobicContact CB-CG 4.5Å; A198-P214 VanDerWaalsContact C-CG 3.47Å; A198-P214 HydrophobicContact CB-CG 3.47Å; A198-P214 VanDerWaalsContact CB-CG 3.47Å; A198-P214 WeakPolarHBondContact O-CG 3.3Å
199	I	96.6	Very high	96.8	Very high	14 Å²	14	41.9 Å²	41.9	7%	0.072	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-44.9	171.3	-68.4	160	0	0	0	109.9	Y195 A196 L197 R201 K202 P214 F219 T222 M226 W275 A276	Y195-I199 WeakPolarHBondContact O-CG1 3.38Å; Y195-I199 PolarHBondContact O-N 3.44Å; A196-I199 PolarHBondContact O-N 2.93Å; L197-I199 VanDerWaalsContact C-N 3.33Å; L197-I199 PolarHBondContact O-N 2.68Å; I199-R201 VanDerWaalsContact C-N 3.29Å; I199-R201 PolarHBondContact O-N 3.48Å; I199-K202 WeakPolarHBondContact O-CB 3.4Å; I199-K202 PolarHBondContact O-N 3.17Å; I199-P214 HydrophobicContact CG1-CB 3.87Å; I199-P214 HydrophobicContact CG1-CG 4.18Å; I199-F219 HydrophobicContact CD1-CD2 3.82Å; I199-F219 HydrophobicContact CD1-CE2 3.88Å; I199-F219 HydrophobicContact CG1-CD2 4.16Å; I199-F219 HydrophobicContact CG2-CD2 3.98Å; I199-F219 HydrophobicContact CG2-CE2 4.27Å; I199-T222 HydrophobicContact CD1-CG2 3.93Å; I199-T222 HydrophobicContact CG1-CG2 4.08Å; I199-M226 HydrophobicContact CD1-SD 4.03Å; I199-W275 HydrophobicContact CD1-CZ3 4Å; I199-A276 HydrophobicContact CB-CB 3.78Å; I199-A276 HydrophobicContact CD1-CB 4.27Å; I199-A276 HydrophobicContact CG2-CB 3.6Å
200	K	94.6	Very high	96.7	Very high	78 Å²	78	41.4 Å²	41.4	34%	0.339	21%	0.207	S	C	.	.	H	α-helix	trans	-65.9	-31	179.9	-64.7	174.6	65.4	175.8	0	113.5	A196 L197 T273 A276 T277	A196-K200 WeakPolarHBondContact O-CG 3.47Å; A196-K200 PolarHBondContact O-N 3.45Å; L197-K200 WeakPolarHBondContact O-CB 3.4Å; L197-K200 PolarHBondContact O-N 3.43Å; K200-T273 HydrophobicContact CG-CG2 4.49Å; K200-A276 HydrophobicContact CG-CB 4.06Å; K200-T277 WeakPolarHBondContact CD-OG1 3.45Å; K200-T277 WeakPolarHBondContact CE-OG1 3.37Å; K200-T277 PolarHBondContact NZ-OG1 3.24Å
201	R	94.1	Very high	96.6	Very high	68 Å²	68	42 Å²	42	26%	0.257	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	22.4	-176	-66.6	178.3	170.2	-114.7	-5.1	112.4	S88 L197 A198 I199 D203 E204 Y205	S88-R201 PolarHBondContact OG-NH1 2.79Å; L197-R201 HydrophobicContact CD1-CG 4.36Å; L197-R201 PolarHBondContact O-N 2.83Å; A198-R201 CarbonylContact O-C 3.6Å; I199-R201 VanDerWaalsContact C-N 3.29Å; I199-R201 PolarHBondContact O-N 3.48Å; R201-D203 PolarHBondContact O-N 3.28Å; R201-E204 IonicContact CZ-OE1 3.2Å; R201-E204 IonicContact NH1-OE1 3.92Å; R201-E204 PolarHBondContact NH1-OE1 3.31Å; R201-E204 PolarHBondContact O-N 3.46Å; R201-Y205 HydrophobicContact CB-CD2 3.93Å; R201-Y205 HydrophobicContact CB-CE2 3.66Å; R201-Y205 WeakPolarHBondContact O-CD2 3.37Å; R201-Y205 PolarHBondContact O-N 3.33Å; R201-Y205 VanDerWaalsContact O-N 3.07Å
202	K	95.5	Very high	96.6	Very high	87 Å²	87	42.5 Å²	42.5	38%	0.378	21%	0.214	S	C	.	.	H	α-helix	trans	-52.8	-44.6	-173.3	-178.3	-167.4	167.5	-158.9	0	111.8	A198 I199 Y205 A206 P214 S215	A198-K202 VanDerWaalsContact O-CA 3.22Å; A198-K202 WeakPolarHBondContact O-CA 3.35Å; A198-K202 PolarHBondContact O-N 3.01Å; I199-K202 WeakPolarHBondContact O-CB 3.4Å; I199-K202 PolarHBondContact O-N 3.17Å; K202-Y205 PolarHBondContact O-N 3.17Å; K202-A206 WeakPolarHBondContact O-CB 3.24Å; K202-A206 PolarHBondContact O-N 3.38Å; K202-P214 WeakPolarHBondContact CE-O 3.35Å; K202-S215 PolarHBondContact O-OG 3.18Å
203	D	94.7	Very high	96.6	Very high	127 Å²	127	42.9 Å²	42.9	68%	0.679	22%	0.216	S	C	*	.	H	α-helix	trans	-71.9	-37.4	-175.4	-57.2	-27.9	0	0	0	111.8	R201 Y205 A206 L207	R201-D203 PolarHBondContact O-N 3.28Å; D203-Y205 VanDerWaalsContact C-N 3.35Å; D203-Y205 PolarHBondContact O-N 3.47Å; D203-A206 PolarHBondContact O-N 3.46Å; D203-L207 WeakPolarHBondContact O-CB 3.45Å; D203-L207 PolarHBondContact O-N 2.98Å
204	E	95.3	Very high	96.5	Very high	37 Å²	37	42.1 Å²	42.1	17%	0.173	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-41.5	172.9	-62.5	-169.1	-106.2	0	0	111.4	M86 S88 R201 L207 A208	M86-E204 HydrophobicContact CE-CB 3.69Å; M86-E204 HydrophobicContact CG-CB 4.49Å; S88-E204 WeakPolarHBondContact CB-OE2 3.33Å; S88-E204 PolarHBondContact N-OE2 3.4Å; S88-E204 VanDerWaalsContact N-OE2 3.13Å; S88-E204 VanDerWaalsContact OG-CD 3.31Å; S88-E204 PolarHBondContact OG-OE1 3.21Å; S88-E204 PolarHBondContact OG-OE2 2.86Å; R201-E204 IonicContact CZ-OE1 3.2Å; R201-E204 IonicContact NH1-OE1 3.92Å; R201-E204 PolarHBondContact NH1-OE1 3.31Å; R201-E204 PolarHBondContact O-N 3.46Å; E204-L207 PolarHBondContact O-N 3.02Å; E204-A208 PolarHBondContact O-N 3.37Å; E204-A208 VanDerWaalsContact O-N 3.13Å
205	Y	96.2	Very high	96.4	Very high	39 Å²	39	40.9 Å²	40.9	15%	0.153	21%	0.212	C	C	.	.	H	α-helix	trans	-67.4	-37.2	176.3	-71.3	-60.6	0	0	0	112.4	M86 A198 R201 K202 D203 A208 N209 I210 M212	M86-Y205 HydrophobicContact CE-CD1 4.02Å; M86-Y205 HydrophobicContact CE-CE1 4.05Å; A198-Y205 HydrophobicContact CB-CD2 4.46Å; A198-Y205 HydrophobicContact CB-CE2 4.21Å; R201-Y205 HydrophobicContact CB-CD2 3.93Å; R201-Y205 HydrophobicContact CB-CE2 3.66Å; R201-Y205 WeakPolarHBondContact O-CD2 3.37Å; R201-Y205 PolarHBondContact O-N 3.33Å; R201-Y205 VanDerWaalsContact O-N 3.07Å; K202-Y205 PolarHBondContact O-N 3.17Å; D203-Y205 VanDerWaalsContact C-N 3.35Å; D203-Y205 PolarHBondContact O-N 3.47Å; Y205-A208 PolarHBondContact O-N 3.15Å; Y205-N209 PolarHBondContact O-N 2.85Å; Y205-I210 HydrophobicContact CD1-CB 4.1Å; Y205-I210 HydrophobicContact CD1-CG2 4.06Å; Y205-I210 PolarHBondContact O-N 3.49Å; Y205-M212 HydrophobicContact CD1-CG 3.6Å; Y205-M212 HydrophobicContact CD2-CB 4.34Å; Y205-M212 HydrophobicContact CD2-CG 3.69Å; Y205-M212 HydrophobicContact CE1-CG 4.04Å; Y205-M212 HydrophobicContact CE1-SD 4.49Å; Y205-M212 HydrophobicContact CE2-CG 4.14Å; Y205-M212 HydrophobicContact CG-CB 4.23Å; Y205-M212 HydrophobicContact CG-CG 3.41Å; Y205-M212 VanDerWaalsContact CG-CG 3.41Å
206	A	95.9	Very high	96.3	Very high	47 Å²	47	44.4 Å²	44.4	39%	0.388	23%	0.233	S	C	.	.	H	α-helix	trans	-66.1	-43.2	175.8	0	0	0	0	0	111.5	K202 D203 A208 N209	K202-A206 WeakPolarHBondContact O-CB 3.24Å; K202-A206 PolarHBondContact O-N 3.38Å; D203-A206 PolarHBondContact O-N 3.46Å; A206-A208 PolarHBondContact O-N 2.75Å; A206-N209 PolarHBondContact O-N 3.21Å
207	L	96.3	Very high	96.2	Very high	97 Å²	97	50.6 Å²	50.6	51%	0.508	26%	0.26	S	S	.	.	H	α-helix	trans	-57.6	-39.7	175.1	-174.6	73.5	0	0	0	111.7	I85 D203 E204 N209	I85-L207 WeakPolarHBondContact O-CD2 3.37Å; D203-L207 WeakPolarHBondContact O-CB 3.45Å; D203-L207 PolarHBondContact O-N 2.98Å; E204-L207 PolarHBondContact O-N 3.02Å; L207-N209 VanDerWaalsContact C-N 3.27Å; L207-N209 PolarHBondContact O-N 3.02Å
208	A	96.6	Very high	96.1	Very high	6 Å²	6	50.1 Å²	50.1	5%	0.05	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	6.2	178	0	0	0	0	0	114.9	I82 I85 M86 E204 Y205 A206 I210	I82-A208 HydrophobicContact CB-CB 4.13Å; I82-A208 HydrophobicContact CG2-CB 4.41Å; I85-A208 HydrophobicContact CD1-CB 4.2Å; I85-A208 HydrophobicContact CG1-CB 4.29Å; M86-A208 HydrophobicContact CG-CB 3.77Å; M86-A208 HydrophobicContact SD-CB 3.98Å; E204-A208 PolarHBondContact O-N 3.37Å; E204-A208 VanDerWaalsContact O-N 3.13Å; Y205-A208 PolarHBondContact O-N 3.15Å; A206-A208 PolarHBondContact O-N 2.75Å; A208-I210 HydrophobicContact CB-CG1 3.92Å; A208-I210 PolarHBondContact O-N 2.83Å
209	N	96.3	Very high	96	Very high	139 Å²	139	51.4 Å²	51.4	74%	0.743	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	27.6	-173.8	-63.9	-57.5	0	0	0	113.8	Y205 A206 L207 P211	Y205-N209 PolarHBondContact O-N 2.85Å; A206-N209 PolarHBondContact O-N 3.21Å; L207-N209 VanDerWaalsContact C-N 3.27Å; L207-N209 PolarHBondContact O-N 3.02Å; N209-P211 WeakPolarHBondContact O-CD 3.46Å
210	I	96.9	Very high	95.8	Very high	8 Å²	8	58.3 Å²	58.3	4%	0.041	30%	0.298	C	S	.	.			trans	-82	122	176.3	-62	-58.2	0	0	0	108.2	I82 K146 Y205 A208 M212	I82-I210 HydrophobicContact CD1-CD1 3.79Å; I82-I210 HydrophobicContact CD1-CG1 4.24Å; I82-I210 HydrophobicContact CG2-CD1 4.18Å; K146-I210 HydrophobicContact CG-CG2 4.47Å; Y205-I210 HydrophobicContact CD1-CB 4.1Å; Y205-I210 HydrophobicContact CD1-CG2 4.06Å; Y205-I210 PolarHBondContact O-N 3.49Å; A208-I210 HydrophobicContact CB-CG1 3.92Å; A208-I210 PolarHBondContact O-N 2.83Å; I210-M212 HydrophobicContact CG2-CG 3.9Å; I210-M212 HydrophobicContact CG2-SD 4.1Å; I210-M212 PolarHBondContact O-N 3.01Å
211	P	97.1	Very high	95.9	Very high	23 Å²	23	59.6 Å²	59.6	15%	0.149	30%	0.301	C	S	.	.			trans	-74.5	59.7	-176.6	31.5	-37.8	0	0	0	112.3	K146 T150 N152 N209 V216	K146-P211 WeakPolarHBondContact O-CD 3.46Å; T150-P211 VanDerWaalsContact CA-O 3.26Å; T150-P211 WeakPolarHBondContact CA-O 3.46Å; T150-P211 HydrophobicContact CG2-CB 4.44Å; N152-P211 PolarHBondContact ND2-O 3.25Å; N152-P211 VanDerWaalsContact ND2-O 3.13Å; N209-P211 WeakPolarHBondContact O-CD 3.46Å; P211-V216 HydrophobicContact CB-CG2 3.99Å
212	M	97.5	Very high	96	Very high	10 Å²	10	56.4 Å²	56.4	5%	0.049	29%	0.289	C	S	.	.			trans	-68.4	138.9	170.8	-68.2	-53.3	-74.2	0	0	110.1	A198 Y205 I210 P214 S215 V216	A198-M212 HydrophobicContact CB-CB 4.34Å; A198-M212 HydrophobicContact CB-CE 3.49Å; A198-M212 VanDerWaalsContact CB-CE 3.49Å; A198-M212 HydrophobicContact CB-CG 4.5Å; Y205-M212 HydrophobicContact CD1-CG 3.6Å; Y205-M212 HydrophobicContact CD2-CB 4.34Å; Y205-M212 HydrophobicContact CD2-CG 3.69Å; Y205-M212 HydrophobicContact CE1-CG 4.04Å; Y205-M212 HydrophobicContact CE1-SD 4.49Å; Y205-M212 HydrophobicContact CE2-CG 4.14Å; Y205-M212 HydrophobicContact CG-CB 4.23Å; Y205-M212 HydrophobicContact CG-CG 3.41Å; Y205-M212 VanDerWaalsContact CG-CG 3.41Å; I210-M212 HydrophobicContact CG2-CG 3.9Å; I210-M212 HydrophobicContact CG2-SD 4.1Å; I210-M212 PolarHBondContact O-N 3.01Å; M212-P214 HydrophobicContact CB-CG 4.49Å; M212-S215 WeakPolarHBondContact O-CA 3.48Å; M212-S215 WeakPolarHBondContact O-CB 3.27Å; M212-S215 PolarHBondContact O-N 3.31Å; M212-V216 PolarHBondContact O-N 3.38Å
213	L	97.8	Very high	96	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-48.7	-46.8	-178.4	-173.4	66.6	0	0	0	114	Y195 S215 V216 K217 R221 T222 S225	Y195-L213 HydrophobicContact CD1-CB 4.2Å; Y195-L213 HydrophobicContact CD1-CD2 4.35Å; Y195-L213 HydrophobicContact CE1-CB 3.72Å; Y195-L213 HydrophobicContact CE1-CD2 3.8Å; Y195-L213 HydrophobicContact CE1-CG 4.42Å; Y195-L213 HydrophobicContact CE2-CD2 4.02Å; L213-S215 VanDerWaalsContact C-N 3.34Å; L213-S215 PolarHBondContact O-N 3.02Å; L213-V216 PolarHBondContact O-N 3.29Å; L213-K217 HydrophobicContact CD1-CB 3.96Å; L213-K217 HydrophobicContact CD1-CG 3.86Å; L213-K217 WeakPolarHBondContact O-CA 3.37Å; L213-K217 WeakPolarHBondContact O-CB 3.43Å; L213-K217 PolarHBondContact O-N 3.15Å; L213-R221 HydrophobicContact CD1-CG 4.29Å; L213-T222 HydrophobicContact CD2-CG2 4.33Å; L213-S225 WeakPolarHBondContact CD2-OG 3.46Å
214	P	96.5	Very high	96	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.013	27%	0.267	C	S	.	.	H	α-helix	trans	-69.3	-27.6	177.3	24.5	-33.5	0	0	0	114.2	A198 I199 K202 M212 G218 T222	A198-P214 VanDerWaalsContact C-CG 3.47Å; A198-P214 HydrophobicContact CB-CG 3.47Å; A198-P214 VanDerWaalsContact CB-CG 3.47Å; A198-P214 WeakPolarHBondContact O-CG 3.3Å; I199-P214 HydrophobicContact CG1-CB 3.87Å; I199-P214 HydrophobicContact CG1-CG 4.18Å; K202-P214 WeakPolarHBondContact CE-O 3.35Å; M212-P214 HydrophobicContact CB-CG 4.49Å; P214-G218 WeakPolarHBondContact O-CA 3.39Å; P214-G218 PolarHBondContact O-N 3.12Å; P214-T222 WeakPolarHBondContact CA-OG1 3.34Å; P214-T222 HydrophobicContact CB-CG2 4.21Å; P214-T222 WeakPolarHBondContact CB-OG1 3.5Å; P214-T222 HydrophobicContact CG-CG2 4.31Å; P214-T222 VanDerWaalsContact N-OG1 3.16Å
215	S	95.4	Very high	96.1	Very high	31 Å²	31	50.4 Å²	50.4	22%	0.217	26%	0.262	C	S	.	.	H	α-helix	trans	-73.4	-35.8	176.6	-54.5	0	0	0	0	111.5	K202 M212 L213	K202-S215 PolarHBondContact O-OG 3.18Å; M212-S215 WeakPolarHBondContact O-CA 3.48Å; M212-S215 WeakPolarHBondContact O-CB 3.27Å; M212-S215 PolarHBondContact O-N 3.31Å; L213-S215 VanDerWaalsContact C-N 3.34Å; L213-S215 PolarHBondContact O-N 3.02Å
216	V	96.9	Very high	96.2	Very high	79 Å²	79	48.6 Å²	48.6	48%	0.479	25%	0.254	S	S	.	.	H	α-helix	trans	-92.9	-43	-176.9	-180	0	0	0	0	113.4	T150 P211 M212 L213	T150-V216 HydrophobicContact CG2-CB 3.78Å; T150-V216 HydrophobicContact CG2-CG1 3.93Å; T150-V216 HydrophobicContact CG2-CG2 3.9Å; P211-V216 HydrophobicContact CB-CG2 3.99Å; M212-V216 PolarHBondContact O-N 3.38Å; L213-V216 PolarHBondContact O-N 3.29Å
217	K	96.6	Very high	96.3	Very high	130 Å²	130	48.3 Å²	48.3	57%	0.565	25%	0.245	S	C	*	.	H	α-helix	trans	-113.7	0.1	-172.2	-58.4	-65	-176	-178.2	0	113.5	L213 R221	L213-K217 HydrophobicContact CD1-CB 3.96Å; L213-K217 HydrophobicContact CD1-CG 3.86Å; L213-K217 WeakPolarHBondContact O-CA 3.37Å; L213-K217 WeakPolarHBondContact O-CB 3.43Å; L213-K217 PolarHBondContact O-N 3.15Å; K217-R221 HydrophobicContact CB-CB 3.84Å; K217-R221 HydrophobicContact CB-CG 3.78Å; K217-R221 HydrophobicContact CG-CG 4.44Å; K217-R221 WeakPolarHBondContact O-CB 3.21Å
218	G	94.8	Very high	96.4	Very high	23 Å²	23	47.6 Å²	47.6	24%	0.237	24%	0.241	C	C	.	.	H	α-helix	trans	76.6	174.9	175.3	0	0	0	0	0	115	P214 T222	P214-G218 WeakPolarHBondContact O-CA 3.39Å; P214-G218 PolarHBondContact O-N 3.12Å; G218-T222 PolarHBondContact O-N 3.39Å; G218-T222 PolarHBondContact O-OG1 3.23Å
219	F	94	Very high	96.5	Very high	26 Å²	26	48.8 Å²	48.8	11%	0.114	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-46.6	-175.1	177.7	-103.3	0	0	0	113	I199 R221 T222 R223 T265 Q272 W275	I199-F219 HydrophobicContact CD1-CD2 3.82Å; I199-F219 HydrophobicContact CD1-CE2 3.88Å; I199-F219 HydrophobicContact CG1-CD2 4.16Å; I199-F219 HydrophobicContact CG2-CD2 3.98Å; I199-F219 HydrophobicContact CG2-CE2 4.27Å; F219-R221 PolarHBondContact O-N 2.92Å; F219-T222 PolarHBondContact O-N 2.87Å; F219-R223 WeakPolarHBondContact O-CB 3.21Å; F219-R223 PolarHBondContact O-N 2.75Å; F219-T265 HydrophobicContact CE1-CG2 4.19Å; F219-T265 HydrophobicContact CZ-CG2 4.22Å; F219-Q272 HydrophobicContact CD1-CG 3.9Å; F219-Q272 HydrophobicContact CD2-CB 3.97Å; F219-Q272 HydrophobicContact CD2-CG 4.08Å; F219-Q272 HydrophobicContact CE1-CG 3.86Å; F219-Q272 HydrophobicContact CE2-CB 3.83Å; F219-Q272 HydrophobicContact CE2-CG 4.03Å; F219-Q272 HydrophobicContact CG-CB 4.39Å; F219-Q272 VanDerWaalsContact CG-CD 3.49Å; F219-Q272 HydrophobicContact CG-CG 4.01Å; F219-Q272 HydrophobicContact CZ-CB 4.14Å; F219-Q272 HydrophobicContact CZ-CG 3.94Å; F219-W275 AromaticContact CE2-CE3 3.55Å; F219-W275 HydrophobicContact CE2-CE3 3.55Å; F219-W275 AromaticContact CE2-CZ3 3.63Å; F219-W275 HydrophobicContact CE2-CZ3 3.63Å; F219-W275 HydrophobicContact CZ-CD2 4.26Å; F219-W275 AromaticContact CZ-CE3 3.62Å; F219-W275 HydrophobicContact CZ-CE3 3.62Å; F219-W275 AromaticContact CZ-CZ3 3.85Å; F219-W275 HydrophobicContact CZ-CZ3 3.85Å
220	K	93.5	Very high	96.6	Very high	159 Å²	159	42.2 Å²	42.2	69%	0.691	21%	0.209	S	C	*	.	H	α-helix	trans	-57.7	-47.5	-176.3	-174.1	-179.9	178.8	-177.5	0	111.9	V224	K220-V224 WeakPolarHBondContact O-CG2 3.33Å; K220-V224 PolarHBondContact O-N 3.42Å; K220-V224 VanDerWaalsContact O-N 3.15Å
221	R	95.6	Very high	96.6	Very high	106 Å²	106	46.5 Å²	46.5	40%	0.4	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-41	178.5	178.8	62.9	-172.2	98.6	-1.9	111.8	L213 K217 F219 V224 S225	L213-R221 HydrophobicContact CD1-CG 4.29Å; K217-R221 HydrophobicContact CB-CB 3.84Å; K217-R221 HydrophobicContact CB-CG 3.78Å; K217-R221 HydrophobicContact CG-CG 4.44Å; K217-R221 WeakPolarHBondContact O-CB 3.21Å; F219-R221 PolarHBondContact O-N 2.92Å; R221-V224 PolarHBondContact O-N 3.09Å; R221-S225 PolarHBondContact NH1-OG 3.01Å; R221-S225 PolarHBondContact O-N 3.41Å
222	T	96.9	Very high	96.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-45.7	179	-55.5	0	0	0	0	111.2	Y195 I199 L213 P214 G218 F219 V224 S225 M226	Y195-T222 HydrophobicContact CD1-CG2 4.23Å; Y195-T222 HydrophobicContact CD2-CG2 4.44Å; Y195-T222 HydrophobicContact CG-CG2 3.87Å; I199-T222 HydrophobicContact CD1-CG2 3.93Å; I199-T222 HydrophobicContact CG1-CG2 4.08Å; L213-T222 HydrophobicContact CD2-CG2 4.33Å; P214-T222 WeakPolarHBondContact CA-OG1 3.34Å; P214-T222 HydrophobicContact CB-CG2 4.21Å; P214-T222 WeakPolarHBondContact CB-OG1 3.5Å; P214-T222 HydrophobicContact CG-CG2 4.31Å; P214-T222 VanDerWaalsContact N-OG1 3.16Å; G218-T222 PolarHBondContact O-N 3.39Å; G218-T222 PolarHBondContact O-OG1 3.23Å; F219-T222 PolarHBondContact O-N 2.87Å; T222-V224 VanDerWaalsContact C-N 3.34Å; T222-V224 PolarHBondContact O-N 2.86Å; T222-S225 WeakPolarHBondContact O-CB 3.49Å; T222-S225 PolarHBondContact O-N 3.38Å; T222-S225 VanDerWaalsContact O-N 3.12Å; T222-M226 HydrophobicContact CG2-SD 4.39Å; T222-M226 WeakPolarHBondContact O-CG 3.46Å; T222-M226 PolarHBondContact O-N 3.46Å
223	R	94.5	Very high	96.8	Very high	50 Å²	50	48.7 Å²	48.7	19%	0.189	24%	0.24	C	C	.	.	H	α-helix	trans	-58.3	-44.2	174.7	-172.8	-175.5	69.5	-179.2	3.6	111.9	F219 S225 M226 F227 T265 W275	F219-R223 WeakPolarHBondContact O-CB 3.21Å; F219-R223 PolarHBondContact O-N 2.75Å; R223-S225 VanDerWaalsContact C-N 3.34Å; R223-S225 PolarHBondContact O-N 2.9Å; R223-M226 WeakPolarHBondContact O-CB 3.46Å; R223-M226 PolarHBondContact O-N 3.45Å; R223-F227 HydrophobicContact CG-CD2 4Å; R223-F227 HydrophobicContact CG-CE2 3.9Å; R223-F227 VanDerWaalsContact O-CD2 3.31Å; R223-F227 WeakPolarHBondContact O-CD2 3.21Å; R223-F227 PolarHBondContact O-N 2.85Å; R223-T265 PolarHBondContact NH1-O 2.92Å; R223-W275 HydrophobicContact CB-CH2 4.41Å; R223-W275 HydrophobicContact CG-CH2 3.82Å; R223-W275 HydrophobicContact CG-CZ2 4.15Å
224	V	96.1	Very high	96.8	Very high	66 Å²	66	50.6 Å²	50.6	40%	0.4	25%	0.25	S	S	.	.	H	α-helix	trans	-60.2	-43.5	175	171.4	0	0	0	0	111.1	K220 R221 T222 M226 F227 I228	K220-V224 WeakPolarHBondContact O-CG2 3.33Å; K220-V224 PolarHBondContact O-N 3.42Å; K220-V224 VanDerWaalsContact O-N 3.15Å; R221-V224 PolarHBondContact O-N 3.09Å; T222-V224 VanDerWaalsContact C-N 3.34Å; T222-V224 PolarHBondContact O-N 2.86Å; V224-M226 PolarHBondContact O-N 3.42Å; V224-F227 PolarHBondContact O-N 2.74Å; V224-I228 HydrophobicContact CG1-CD1 3.96Å; V224-I228 HydrophobicContact CG1-CG1 4.49Å; V224-I228 WeakPolarHBondContact O-CG1 3.47Å; V224-I228 PolarHBondContact O-N 2.58Å
225	S	97.7	Very high	96.9	Very high	9 Å²	9	53.7 Å²	53.7	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-43.7	174.2	-68	0	0	0	0	112.4	L213 R221 T222 R223 F227 I228 W229	L213-S225 WeakPolarHBondContact CD2-OG 3.46Å; R221-S225 PolarHBondContact NH1-OG 3.01Å; R221-S225 PolarHBondContact O-N 3.41Å; T222-S225 WeakPolarHBondContact O-CB 3.49Å; T222-S225 PolarHBondContact O-N 3.38Å; T222-S225 VanDerWaalsContact O-N 3.12Å; R223-S225 VanDerWaalsContact C-N 3.34Å; R223-S225 PolarHBondContact O-N 2.9Å; S225-F227 VanDerWaalsContact C-N 3.27Å; S225-F227 PolarHBondContact O-N 3.48Å; S225-I228 PolarHBondContact O-N 3.04Å; S225-W229 PolarHBondContact O-N 2.89Å
226	M	97.9	Very high	97	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-42.2	176.4	-68.1	171.9	73.9	0	0	111.3	I192 Y195 A196 I199 T222 R223 V224 W229 L230 W275 M279	I192-M226 HydrophobicContact CG2-CB 4.2Å; I192-M226 HydrophobicContact CG2-CE 3.78Å; I192-M226 HydrophobicContact CG2-CG 4.34Å; Y195-M226 HydrophobicContact CD2-CG 3.86Å; Y195-M226 HydrophobicContact CG-CG 4.26Å; A196-M226 HydrophobicContact CB-CE 3.95Å; I199-M226 HydrophobicContact CD1-SD 4.03Å; T222-M226 HydrophobicContact CG2-SD 4.39Å; T222-M226 WeakPolarHBondContact O-CG 3.46Å; T222-M226 PolarHBondContact O-N 3.46Å; R223-M226 WeakPolarHBondContact O-CB 3.46Å; R223-M226 PolarHBondContact O-N 3.45Å; V224-M226 PolarHBondContact O-N 3.42Å; M226-W229 PolarHBondContact O-N 3.48Å; M226-L230 WeakPolarHBondContact O-CG 3.46Å; M226-L230 PolarHBondContact O-N 2.88Å; M226-W275 HydrophobicContact CE-CH2 3.79Å; M226-W275 HydrophobicContact CE-CZ3 4.11Å; M226-W275 HydrophobicContact SD-CH2 3.75Å; M226-W275 HydrophobicContact SD-CZ3 3.96Å; M226-M279 HydrophobicContact CE-CB 4.01Å; M226-M279 HydrophobicContact CE-CE 3.83Å; M226-M279 HydrophobicContact CE-CG 4.15Å
227	F	97.3	Very high	97.1	Very high	41 Å²	41	48.8 Å²	48.8	18%	0.18	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-42.4	175	-87.6	-69.7	0	0	0	113.5	R223 V224 S225 W229 L230 I231 I259 G262 L263	R223-F227 HydrophobicContact CG-CD2 4Å; R223-F227 HydrophobicContact CG-CE2 3.9Å; R223-F227 VanDerWaalsContact O-CD2 3.31Å; R223-F227 WeakPolarHBondContact O-CD2 3.21Å; R223-F227 PolarHBondContact O-N 2.85Å; V224-F227 PolarHBondContact O-N 2.74Å; S225-F227 VanDerWaalsContact C-N 3.27Å; S225-F227 PolarHBondContact O-N 3.48Å; F227-W229 VanDerWaalsContact C-N 3.27Å; F227-W229 PolarHBondContact O-N 3.36Å; F227-L230 HydrophobicContact CD1-CD1 4.24Å; F227-L230 WeakPolarHBondContact O-CB 3.22Å; F227-L230 PolarHBondContact O-N 3.41Å; F227-L230 VanDerWaalsContact O-N 3.16Å; F227-I231 WeakPolarHBondContact O-CG1 3.19Å; F227-I231 PolarHBondContact O-N 3.39Å; F227-I259 HydrophobicContact CE1-CG2 4.49Å; F227-G262 VanDerWaalsContact CZ-O 3.25Å; F227-G262 WeakPolarHBondContact CZ-O 3.22Å; F227-L263 HydrophobicContact CE1-CD2 3.67Å; F227-L263 HydrophobicContact CE1-CG 3.79Å; F227-L263 HydrophobicContact CZ-CB 4.42Å; F227-L263 HydrophobicContact CZ-CD2 3.5Å; F227-L263 VanDerWaalsContact CZ-CD2 3.5Å; F227-L263 HydrophobicContact CZ-CG 3.75Å
228	I	98.1	Very high	97.1	Very high	83 Å²	83	47.6 Å²	47.6	43%	0.426	24%	0.238	S	C	.	.	H	α-helix	trans	-56.6	-46.8	175.8	-69.5	164.8	0	0	0	109.9	V224 S225 L230 I231 I232	V224-I228 HydrophobicContact CG1-CD1 3.96Å; V224-I228 HydrophobicContact CG1-CG1 4.49Å; V224-I228 WeakPolarHBondContact O-CG1 3.47Å; V224-I228 PolarHBondContact O-N 2.58Å; S225-I228 PolarHBondContact O-N 3.04Å; I228-L230 PolarHBondContact O-N 3.09Å; I228-I231 PolarHBondContact O-N 3.14Å; I228-I232 HydrophobicContact CG2-CD1 3.8Å; I228-I232 VanDerWaalsContact O-CG1 3.3Å; I228-I232 WeakPolarHBondContact O-CG1 3.26Å; I228-I232 PolarHBondContact O-N 3.42Å
229	W	98.6	Very high	97.3	Very high	31 Å²	31	49.6 Å²	49.6	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-36.4	177.3	-73.6	114.5	0	0	0	113.5	V154 F187 C188 P191 I192 S225 M226 F227 I232 L233	V154-W229 HydrophobicContact CB-CZ2 4.31Å; V154-W229 HydrophobicContact CG1-CH2 4Å; V154-W229 HydrophobicContact CG1-CZ2 3.7Å; V154-W229 HydrophobicContact CG2-CZ2 3.64Å; F187-W229 HydrophobicContact CD1-CH2 4.44Å; F187-W229 HydrophobicContact CD1-CZ3 4.06Å; F187-W229 AromaticContact CE1-CH2 3.53Å; F187-W229 HydrophobicContact CE1-CH2 3.53Å; F187-W229 AromaticContact CE1-CZ3 3.53Å; F187-W229 HydrophobicContact CE1-CZ3 3.53Å; F187-W229 AromaticContact CZ-CH2 3.84Å; F187-W229 HydrophobicContact CZ-CH2 3.84Å; F187-W229 HydrophobicContact CZ-CZ3 4.28Å; C188-W229 HydrophobicContact CB-CE3 4.15Å; P191-W229 VanDerWaalsContact CB-CD1 3.47Å; P191-W229 HydrophobicContact CB-CD2 4.01Å; P191-W229 HydrophobicContact CB-CG 3.83Å; P191-W229 HydrophobicContact CG-CD2 3.92Å; P191-W229 HydrophobicContact CG-CE3 4.4Å; P191-W229 HydrophobicContact CG-CG 4.25Å; P191-W229 HydrophobicContact CG-CZ2 4.11Å; I192-W229 HydrophobicContact CD1-CB 3.89Å; I192-W229 HydrophobicContact CG1-CB 3.51Å; S225-W229 PolarHBondContact O-N 2.89Å; M226-W229 PolarHBondContact O-N 3.48Å; F227-W229 VanDerWaalsContact C-N 3.27Å; F227-W229 PolarHBondContact O-N 3.36Å; W229-I232 HydrophobicContact CE3-CD1 4.11Å; W229-I232 HydrophobicContact CZ3-CD1 4.29Å; W229-I232 PolarHBondContact O-N 3.49Å; W229-L233 VanDerWaalsContact O-CB 3.29Å; W229-L233 WeakPolarHBondContact O-CB 3.3Å; W229-L233 PolarHBondContact O-N 3.45Å
230	L	98.3	Very high	97.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-41.4	172.9	-77.8	167.2	0	0	0	112.3	I192 M226 F227 I228 L233 L234 W258 I259 M279	I192-L230 HydrophobicContact CD1-CB 4.49Å; I192-L230 HydrophobicContact CD1-CD2 3.74Å; I192-L230 HydrophobicContact CD1-CG 3.75Å; I192-L230 HydrophobicContact CG1-CG 4.41Å; M226-L230 WeakPolarHBondContact O-CG 3.46Å; M226-L230 PolarHBondContact O-N 2.88Å; F227-L230 HydrophobicContact CD1-CD1 4.24Å; F227-L230 WeakPolarHBondContact O-CB 3.22Å; F227-L230 PolarHBondContact O-N 3.41Å; F227-L230 VanDerWaalsContact O-N 3.16Å; I228-L230 PolarHBondContact O-N 3.09Å; L230-L233 PolarHBondContact O-N 2.9Å; L230-L234 PolarHBondContact O-N 2.87Å; L230-W258 HydrophobicContact CD2-CB 3.85Å; L230-W258 HydrophobicContact CD2-CD2 3.55Å; L230-W258 HydrophobicContact CD2-CE3 3.48Å; L230-W258 VanDerWaalsContact CD2-CE3 3.48Å; L230-W258 HydrophobicContact CD2-CG 3.72Å; L230-W258 HydrophobicContact CD2-CZ3 4.19Å; L230-I259 HydrophobicContact CB-CD1 4.49Å; L230-I259 HydrophobicContact CB-CG1 3.86Å; L230-I259 HydrophobicContact CD1-CG1 4.22Å; L230-I259 HydrophobicContact CD2-CG1 4.25Å; L230-I259 HydrophobicContact CG-CG1 4.35Å; L230-M279 HydrophobicContact CD1-CE 4.19Å
231	I	98.4	Very high	97.6	Very high	98 Å²	98	44.8 Å²	44.8	50%	0.503	23%	0.226	S	C	.	.	H	α-helix	trans	-68	-38.2	177.1	-64	-58.4	0	0	0	111.2	F227 I228 L233 L234 P235 I259	F227-I231 WeakPolarHBondContact O-CG1 3.19Å; F227-I231 PolarHBondContact O-N 3.39Å; I228-I231 PolarHBondContact O-N 3.14Å; I231-L233 VanDerWaalsContact C-N 3.34Å; I231-L234 WeakPolarHBondContact O-CB 3.36Å; I231-L234 PolarHBondContact O-N 2.85Å; I231-P235 WeakPolarHBondContact O-CD 3.45Å; I231-I259 HydrophobicContact CD1-CD1 4.36Å
232	I	98.5	Very high	97.4	Very high	78 Å²	78	45 Å²	45	40%	0.4	24%	0.235	S	C	.	.	H	α-helix	trans	-67.3	-36.1	174.4	-65	166.5	0	0	0	111.3	I228 W229 L234 P235 V236	I228-I232 HydrophobicContact CG2-CD1 3.8Å; I228-I232 VanDerWaalsContact O-CG1 3.3Å; I228-I232 WeakPolarHBondContact O-CG1 3.26Å; I228-I232 PolarHBondContact O-N 3.42Å; W229-I232 HydrophobicContact CE3-CD1 4.11Å; W229-I232 HydrophobicContact CZ3-CD1 4.29Å; W229-I232 PolarHBondContact O-N 3.49Å; I232-L234 VanDerWaalsContact C-N 3.34Å; I232-P235 VanDerWaalsContact O-CD 3.3Å; I232-P235 WeakPolarHBondContact O-CD 3.34Å; I232-V236 WeakPolarHBondContact O-CG2 3.08Å
233	L	98.7	Very high	97.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.8	-30.8	177.3	179.1	60	0	0	0	112.4	V185 C188 I192 W229 L230 I231 V236 P237 N255 W258 Y286	V185-L233 HydrophobicContact CB-CD1 4.42Å; V185-L233 HydrophobicContact CG1-CD1 4.31Å; V185-L233 HydrophobicContact CG2-CD1 4.4Å; C188-L233 HydrophobicContact CB-CB 3.86Å; C188-L233 HydrophobicContact CB-CD1 4.05Å; C188-L233 HydrophobicContact CB-CG 4.45Å; I192-L233 HydrophobicContact CD1-CD2 4.43Å; W229-L233 VanDerWaalsContact O-CB 3.29Å; W229-L233 WeakPolarHBondContact O-CB 3.3Å; W229-L233 PolarHBondContact O-N 3.45Å; L230-L233 PolarHBondContact O-N 2.9Å; I231-L233 VanDerWaalsContact C-N 3.34Å; L233-V236 HydrophobicContact CD1-CB 4.46Å; L233-V236 HydrophobicContact CD1-CG2 4.43Å; L233-V236 WeakPolarHBondContact O-CB 3.2Å; L233-V236 WeakPolarHBondContact O-CG2 3.28Å; L233-V236 PolarHBondContact O-N 3.01Å; L233-V236 VanDerWaalsContact O-N 3.1Å; L233-P237 WeakPolarHBondContact O-CD 3.48Å; L233-N255 WeakPolarHBondContact CD2-OD1 3.42Å; L233-N255 WeakPolarHBondContact CG-OD1 3.31Å; L233-N255 PolarHBondContact O-ND2 3.34Å; L233-W258 HydrophobicContact CD2-CE3 4.27Å; L233-W258 HydrophobicContact CD2-CZ3 4.01Å; L233-Y286 HydrophobicContact CD2-CE1 4.37Å; L233-Y286 HydrophobicContact CD2-CE2 4.27Å
234	L	98.4	Very high	97.3	Very high	49 Å²	49	44.4 Å²	44.4	26%	0.257	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-48.2	-175	-173.6	64.9	0	0	0	114.8	L230 I231 I232 P237 T252 N255 L256 I259	L230-L234 PolarHBondContact O-N 2.87Å; I231-L234 WeakPolarHBondContact O-CB 3.36Å; I231-L234 PolarHBondContact O-N 2.85Å; I232-L234 VanDerWaalsContact C-N 3.34Å; L234-P237 WeakPolarHBondContact O-CD 3.44Å; L234-T252 HydrophobicContact CD1-CG2 4.3Å; L234-N255 HydrophobicContact CD1-CB 3.74Å; L234-L256 HydrophobicContact CD1-CD2 3.97Å; L234-L256 HydrophobicContact CD1-CG 4.26Å; L234-I259 HydrophobicContact CD1-CD1 4.19Å; L234-I259 HydrophobicContact CD2-CD1 4.4Å
235	P	98.1	Very high	97.3	Very high	66 Å²	66	46.1 Å²	46.1	43%	0.429	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.9	178.9	31.7	-38.6	0	0	0	114.5	I231 I232 P237 L238	I231-P235 WeakPolarHBondContact O-CD 3.45Å; I232-P235 VanDerWaalsContact O-CD 3.3Å; I232-P235 WeakPolarHBondContact O-CD 3.34Å; P235-P237 VanDerWaalsContact C-CD 3.49Å; P235-L238 HydrophobicContact CB-CD1 4.27Å; P235-L238 WeakPolarHBondContact O-CB 3.23Å; P235-L238 WeakPolarHBondContact O-CG 3.39Å; P235-L238 PolarHBondContact O-N 3.03Å
236	V	98.5	Very high	97.2	Very high	8 Å²	8	50.2 Å²	50.2	5%	0.048	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-58.8	-39.9	-172.9	-175.7	0	0	0	0	113.3	A181 L184 V185 I232 L233 L238 L239	A181-V236 WeakPolarHBondContact O-CG1 3.31Å; L184-V236 HydrophobicContact CB-CG1 3.75Å; L184-V236 HydrophobicContact CB-CG2 4.31Å; V185-V236 HydrophobicContact CG2-CB 4.33Å; V185-V236 HydrophobicContact CG2-CG1 3.58Å; I232-V236 WeakPolarHBondContact O-CG2 3.08Å; L233-V236 HydrophobicContact CD1-CB 4.46Å; L233-V236 HydrophobicContact CD1-CG2 4.43Å; L233-V236 WeakPolarHBondContact O-CB 3.2Å; L233-V236 WeakPolarHBondContact O-CG2 3.28Å; L233-V236 PolarHBondContact O-N 3.01Å; L233-V236 VanDerWaalsContact O-N 3.1Å; V236-L238 PolarHBondContact O-N 2.83Å; V236-L238 VanDerWaalsContact O-N 3.1Å; V236-L239 WeakPolarHBondContact O-CB 3.46Å; V236-L239 PolarHBondContact O-N 3.15Å
237	P	98.2	Very high	97.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-56.6	-24.7	174.7	-26.9	36	0	0	0	114.7	L233 L234 P235 L239 L240 A251 F290	L233-P237 WeakPolarHBondContact O-CD 3.48Å; L234-P237 WeakPolarHBondContact O-CD 3.44Å; P235-P237 VanDerWaalsContact C-CD 3.49Å; P237-L239 PolarHBondContact O-N 3.22Å; P237-L240 WeakPolarHBondContact O-CA 3.39Å; P237-L240 WeakPolarHBondContact O-CB 3.38Å; P237-L240 PolarHBondContact O-N 3.12Å; P237-A251 HydrophobicContact CB-CB 3.79Å; P237-A251 HydrophobicContact CG-CB 3.88Å; P237-F290 HydrophobicContact CG-CE2 4.39Å
238	L	98	Very high	97.1	Very high	104 Å²	104	48.9 Å²	48.9	55%	0.545	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-64.4	-28.6	176.7	-59.3	172.8	0	0	0	112.2	P235 V236 L240 I241 V248	P235-L238 HydrophobicContact CB-CD1 4.27Å; P235-L238 WeakPolarHBondContact O-CB 3.23Å; P235-L238 WeakPolarHBondContact O-CG 3.39Å; P235-L238 PolarHBondContact O-N 3.03Å; V236-L238 PolarHBondContact O-N 2.83Å; V236-L238 VanDerWaalsContact O-N 3.1Å; L238-L240 PolarHBondContact O-N 3.44Å; L238-I241 WeakPolarHBondContact O-CB 3.42Å; L238-I241 PolarHBondContact O-N 3.29Å; L238-V248 HydrophobicContact CD2-CG1 3.78Å
239	L	98	Very high	97.1	Very high	65 Å²	65	48.5 Å²	48.5	34%	0.34	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-69.2	-12.8	174.3	-56.4	178.9	0	0	0	112.5	A181 L184 V236 P237	A181-L239 HydrophobicContact CB-CB 3.66Å; A181-L239 HydrophobicContact CB-CD1 4.3Å; L184-L239 HydrophobicContact CD1-CD1 3.88Å; V236-L239 WeakPolarHBondContact O-CB 3.46Å; V236-L239 PolarHBondContact O-N 3.15Å; P237-L239 PolarHBondContact O-N 3.22Å
240	L	97	Very high	97.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-105.5	24.4	177.3	-63.9	167	0	0	0	111.8	T178 A181 L182 P237 L238 N242 L243 F247 F290	T178-L240 HydrophobicContact CG2-CD2 3.71Å; A181-L240 HydrophobicContact CB-CD1 4.32Å; A181-L240 HydrophobicContact CB-CD2 3.73Å; A181-L240 HydrophobicContact CB-CG 3.73Å; L182-L240 HydrophobicContact CD2-CD1 4.11Å; L182-L240 HydrophobicContact CD2-CD2 4.3Å; P237-L240 WeakPolarHBondContact O-CA 3.39Å; P237-L240 WeakPolarHBondContact O-CB 3.38Å; P237-L240 PolarHBondContact O-N 3.12Å; L238-L240 PolarHBondContact O-N 3.44Å; L240-N242 PolarHBondContact O-N 3.19Å; L240-N242 VanDerWaalsContact O-N 3.07Å; L240-L243 HydrophobicContact CB-CD1 4.19Å; L240-L243 HydrophobicContact CB-CG 4.47Å; L240-L243 HydrophobicContact CD2-CD1 4.34Å; L240-L243 WeakPolarHBondContact O-CB 3.4Å; L240-L243 PolarHBondContact O-N 2.7Å; L240-F247 HydrophobicContact CB-CD1 4.11Å; L240-F247 HydrophobicContact CB-CE1 3.67Å; L240-F247 HydrophobicContact CD1-CE1 3.66Å; L240-F247 HydrophobicContact CD1-CZ 3.96Å; L240-F247 HydrophobicContact CG-CE1 4.31Å; L240-F290 HydrophobicContact CD1-CE1 4.28Å; L240-F290 HydrophobicContact CD1-CZ 3.77Å
241	I	96.1	Very high	97.1	Very high	85 Å²	85	50.7 Å²	50.7	44%	0.436	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.3	-23.9	178.3	-170.8	60.3	0	0	0	113.3	L238 L243 G244 V245 V248	L238-I241 WeakPolarHBondContact O-CB 3.42Å; L238-I241 PolarHBondContact O-N 3.29Å; I241-L243 PolarHBondContact O-N 3.46Å; I241-G244 WeakPolarHBondContact O-CA 3.36Å; I241-G244 PolarHBondContact O-N 2.9Å; I241-V245 HydrophobicContact CD1-CG2 4.26Å; I241-V248 HydrophobicContact CB-CG2 4.4Å; I241-V248 HydrophobicContact CD1-CG2 3.79Å
242	N	93	Very high	97.1	Very high	111 Å²	111	47.8 Å²	47.8	59%	0.594	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-65.4	-16.3	174.5	-63.7	-23.6	0	0	0	113.4	M45 L240	M45-N242 HydrophobicContact CE-CB 3.78Å; L240-N242 PolarHBondContact O-N 3.19Å; L240-N242 VanDerWaalsContact O-N 3.07Å
243	L	94.6	Very high	97.1	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-81.6	0	168.8	-59.2	-178.6	0	0	0	112.6	L41 M45 L240 I241 F247 A294 V297	L41-L243 HydrophobicContact CD1-CD1 4.24Å; L41-L243 HydrophobicContact CD2-CD1 4.48Å; L41-L243 HydrophobicContact CD2-CD2 3.68Å; M45-L243 HydrophobicContact SD-CD2 3.91Å; L240-L243 HydrophobicContact CB-CD1 4.19Å; L240-L243 HydrophobicContact CB-CG 4.47Å; L240-L243 HydrophobicContact CD2-CD1 4.34Å; L240-L243 WeakPolarHBondContact O-CB 3.4Å; L240-L243 PolarHBondContact O-N 2.7Å; I241-L243 PolarHBondContact O-N 3.46Å; L243-F247 HydrophobicContact CB-CB 3.86Å; L243-F247 HydrophobicContact CB-CD1 3.93Å; L243-F247 HydrophobicContact CB-CD2 4.44Å; L243-F247 HydrophobicContact CB-CG 3.8Å; L243-F247 HydrophobicContact CD1-CD1 3.93Å; L243-F247 HydrophobicContact CD1-CD2 4.07Å; L243-F247 HydrophobicContact CD1-CE1 3.89Å; L243-F247 HydrophobicContact CD1-CE2 4.06Å; L243-F247 HydrophobicContact CD1-CG 4.03Å; L243-F247 HydrophobicContact CD1-CZ 3.96Å; L243-F247 HydrophobicContact CG-CD1 4.5Å; L243-A294 HydrophobicContact CD1-CB 4.26Å; L243-V297 WeakPolarHBondContact O-CG1 3.49Å
244	G	94.5	Very high	97.1	Very high	30 Å²	30	49.9 Å²	49.9	31%	0.309	29%	0.286	S	S	.	.			trans	94.7	158.3	177.5	0	0	0	0	0	114.3	I241 V246 F247 V248	I241-G244 WeakPolarHBondContact O-CA 3.36Å; I241-G244 PolarHBondContact O-N 2.9Å; G244-V246 PolarHBondContact O-N 3.06Å; G244-F247 PolarHBondContact O-N 3.07Å; G244-V248 PolarHBondContact O-N 3.19Å
245	V	95.2	Very high	97.1	Very high	103 Å²	103	47.6 Å²	47.6	62%	0.624	27%	0.274	S	S	*	.	H	α-helix	trans	-59.6	-35.4	-177.5	178.1	0	0	0	0	111.8	I241 F247 V248 V249	I241-V245 HydrophobicContact CD1-CG2 4.26Å; V245-F247 PolarHBondContact O-N 3.45Å; V245-V248 PolarHBondContact O-N 2.93Å; V245-V249 HydrophobicContact CG1-CG2 4.12Å; V245-V249 VanDerWaalsContact O-CG2 3.32Å; V245-V249 WeakPolarHBondContact O-CG2 3.09Å; V245-V249 PolarHBondContact O-N 2.9Å
246	V	95.5	Very high	97.1	Very high	95 Å²	95	48.4 Å²	48.4	58%	0.576	27%	0.274	S	S	*	.	H	α-helix	trans	-60.2	-46.3	178.2	177.7	0	0	0	0	111.2	G244 V249 L250	G244-V246 PolarHBondContact O-N 3.06Å; V246-V249 PolarHBondContact O-N 3.06Å; V246-L250 HydrophobicContact CG1-CD1 3.9Å; V246-L250 WeakPolarHBondContact O-CB 3.36Å; V246-L250 WeakPolarHBondContact O-CG 3.26Å; V246-L250 PolarHBondContact O-N 3.41Å
247	F	96.7	Very high	97.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-50.5	176.1	175.1	-93.2	0	0	0	110.9	L240 L243 G244 V245 V249 L250 A251 F290 L293 A294 V297	L240-F247 HydrophobicContact CB-CD1 4.11Å; L240-F247 HydrophobicContact CB-CE1 3.67Å; L240-F247 HydrophobicContact CD1-CE1 3.66Å; L240-F247 HydrophobicContact CD1-CZ 3.96Å; L240-F247 HydrophobicContact CG-CE1 4.31Å; L243-F247 HydrophobicContact CB-CB 3.86Å; L243-F247 HydrophobicContact CB-CD1 3.93Å; L243-F247 HydrophobicContact CB-CD2 4.44Å; L243-F247 HydrophobicContact CB-CG 3.8Å; L243-F247 HydrophobicContact CD1-CD1 3.93Å; L243-F247 HydrophobicContact CD1-CD2 4.07Å; L243-F247 HydrophobicContact CD1-CE1 3.89Å; L243-F247 HydrophobicContact CD1-CE2 4.06Å; L243-F247 HydrophobicContact CD1-CG 4.03Å; L243-F247 HydrophobicContact CD1-CZ 3.96Å; L243-F247 HydrophobicContact CG-CD1 4.5Å; G244-F247 PolarHBondContact O-N 3.07Å; V245-F247 PolarHBondContact O-N 3.45Å; F247-V249 VanDerWaalsContact C-N 3.34Å; F247-V249 PolarHBondContact O-N 2.92Å; F247-L250 PolarHBondContact O-N 3.03Å; F247-A251 HydrophobicContact CE1-CB 4.17Å; F247-A251 HydrophobicContact CZ-CB 4.24Å; F247-A251 VanDerWaalsContact O-CB 3.26Å; F247-A251 WeakPolarHBondContact O-CB 3.24Å; F247-A251 PolarHBondContact O-N 3.26Å; F247-F290 HydrophobicContact CE1-CZ 4.28Å; F247-F290 HydrophobicContact CZ-CE1 4.07Å; F247-F290 HydrophobicContact CZ-CE2 4.04Å; F247-F290 AromaticContact CZ-CZ 3.65Å; F247-F290 HydrophobicContact CZ-CZ 3.65Å; F247-L293 HydrophobicContact CD2-CD2 3.85Å; F247-L293 HydrophobicContact CD2-CG 3.75Å; F247-L293 HydrophobicContact CE2-CB 4.4Å; F247-L293 HydrophobicContact CE2-CD2 3.95Å; F247-L293 HydrophobicContact CE2-CG 3.98Å; F247-A294 HydrophobicContact CD2-CB 4.46Å; F247-A294 VanDerWaalsContact CE2-CA 3.47Å; F247-A294 HydrophobicContact CE2-CB 3.64Å; F247-A294 HydrophobicContact CZ-CB 4.18Å; F247-V297 HydrophobicContact CB-CB 4.39Å; F247-V297 HydrophobicContact CB-CG1 4.09Å; F247-V297 HydrophobicContact CB-CG2 4.36Å
248	V	97.8	Very high	97.1	Very high	13 Å²	13	49.4 Å²	49.4	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-44.1	-178	175.3	0	0	0	0	111.5	L238 I241 G244 V245 T252	L238-V248 HydrophobicContact CD2-CG1 3.78Å; I241-V248 HydrophobicContact CB-CG2 4.4Å; I241-V248 HydrophobicContact CD1-CG2 3.79Å; G244-V248 PolarHBondContact O-N 3.19Å; V245-V248 PolarHBondContact O-N 2.93Å; V248-T252 WeakPolarHBondContact O-CB 3.36Å; V248-T252 PolarHBondContact O-N 2.86Å; V248-T252 PolarHBondContact O-OG1 3.28Å
249	V	98	Very high	97.1	Very high	75 Å²	75	45.5 Å²	45.5	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-50.5	177.7	169.4	0	0	0	0	110.9	V245 V246 F247 T252 L253	V245-V249 HydrophobicContact CG1-CG2 4.12Å; V245-V249 VanDerWaalsContact O-CG2 3.32Å; V245-V249 WeakPolarHBondContact O-CG2 3.09Å; V245-V249 PolarHBondContact O-N 2.9Å; V246-V249 PolarHBondContact O-N 3.06Å; F247-V249 VanDerWaalsContact C-N 3.34Å; F247-V249 PolarHBondContact O-N 2.92Å; V249-T252 PolarHBondContact O-N 2.6Å; V249-L253 HydrophobicContact CG1-CD1 4.08Å; V249-L253 HydrophobicContact CG1-CG 4.48Å; V249-L253 WeakPolarHBondContact O-CG 3.37Å; V249-L253 PolarHBondContact O-N 3.44Å
250	L	98.2	Very high	97	Very high	79 Å²	79	45.1 Å²	45.1	41%	0.414	27%	0.272	S	S	.	.	H	α-helix	trans	-65.5	-42.1	-177.9	-69.7	174.7	0	0	0	112.3	V246 F247 T252 L253 L254 L293	V246-L250 HydrophobicContact CG1-CD1 3.9Å; V246-L250 WeakPolarHBondContact O-CB 3.36Å; V246-L250 WeakPolarHBondContact O-CG 3.26Å; V246-L250 PolarHBondContact O-N 3.41Å; F247-L250 PolarHBondContact O-N 3.03Å; L250-T252 VanDerWaalsContact C-N 3.34Å; L250-T252 PolarHBondContact O-N 2.71Å; L250-L253 PolarHBondContact O-N 2.96Å; L250-L254 PolarHBondContact O-N 3.46Å; L250-L293 HydrophobicContact CB-CD1 4.28Å; L250-L293 HydrophobicContact CB-CD2 3.58Å; L250-L293 HydrophobicContact CD1-CD1 3.6Å; L250-L293 HydrophobicContact CD1-CD2 4.46Å
251	A	98.4	Very high	97	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-38	174.4	0	0	0	0	0	112.2	P237 F247 L254 N255 F290	P237-A251 HydrophobicContact CB-CB 3.79Å; P237-A251 HydrophobicContact CG-CB 3.88Å; F247-A251 HydrophobicContact CE1-CB 4.17Å; F247-A251 HydrophobicContact CZ-CB 4.24Å; F247-A251 VanDerWaalsContact O-CB 3.26Å; F247-A251 WeakPolarHBondContact O-CB 3.24Å; F247-A251 PolarHBondContact O-N 3.26Å; A251-L254 WeakPolarHBondContact O-CB 3.34Å; A251-L254 PolarHBondContact O-N 3.11Å; A251-N255 PolarHBondContact O-N 3Å; A251-F290 HydrophobicContact CB-CD2 4.19Å; A251-F290 HydrophobicContact CB-CE2 3.83Å
252	T	98.4	Very high	96.9	Very high	37 Å²	37	42.8 Å²	42.8	23%	0.227	26%	0.26	C	S	.	.	H	α-helix	trans	-67.9	-40.9	175.6	-58.3	0	0	0	0	111.5	L234 V248 V249 L250 L254 N255 L256	L234-T252 HydrophobicContact CD1-CG2 4.3Å; V248-T252 WeakPolarHBondContact O-CB 3.36Å; V248-T252 PolarHBondContact O-N 2.86Å; V248-T252 PolarHBondContact O-OG1 3.28Å; V249-T252 PolarHBondContact O-N 2.6Å; L250-T252 VanDerWaalsContact C-N 3.34Å; L250-T252 PolarHBondContact O-N 2.71Å; T252-L254 VanDerWaalsContact C-N 3.27Å; T252-L254 PolarHBondContact O-N 2.89Å; T252-N255 WeakPolarHBondContact O-CB 3.24Å; T252-N255 PolarHBondContact O-N 3.14Å; T252-N255 VanDerWaalsContact O-N 3.14Å; T252-L256 HydrophobicContact CG2-CD1 4.19Å; T252-L256 HydrophobicContact CG2-CG 4.39Å; T252-L256 WeakPolarHBondContact O-CG 3.38Å; T252-L256 PolarHBondContact O-N 2.96Å
253	L	98.5	Very high	96.9	Very high	101 Å²	101	41.1 Å²	41.1	53%	0.529	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-37.2	174	-72	173.7	0	0	0	111.9	V249 L250 L256 G257	V249-L253 HydrophobicContact CG1-CD1 4.08Å; V249-L253 HydrophobicContact CG1-CG 4.48Å; V249-L253 WeakPolarHBondContact O-CG 3.37Å; V249-L253 PolarHBondContact O-N 3.44Å; L250-L253 PolarHBondContact O-N 2.96Å; L253-L256 PolarHBondContact O-N 3.13Å; L253-G257 PolarHBondContact O-N 3.31Å
254	L	98.4	Very high	96.6	Very high	20 Å²	20	45.1 Å²	45.1	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-40.5	173.2	-169.5	67.9	0	0	0	111.6	L250 A251 T252 W258 Y282 Y286 I289 F290	L250-L254 PolarHBondContact O-N 3.46Å; A251-L254 WeakPolarHBondContact O-CB 3.34Å; A251-L254 PolarHBondContact O-N 3.11Å; T252-L254 VanDerWaalsContact C-N 3.27Å; T252-L254 PolarHBondContact O-N 2.89Å; L254-W258 PolarHBondContact O-N 2.64Å; L254-Y282 HydrophobicContact CD1-CE1 4.31Å; L254-Y282 PolarHBondContact O-OH 2.91Å; L254-Y286 HydrophobicContact CB-CE2 4.29Å; L254-Y286 HydrophobicContact CD1-CD2 4.31Å; L254-Y286 HydrophobicContact CD2-CD2 3.58Å; L254-Y286 HydrophobicContact CD2-CE2 3.66Å; L254-Y286 HydrophobicContact CD2-CG 4.01Å; L254-Y286 HydrophobicContact CG-CD2 3.47Å; L254-Y286 VanDerWaalsContact CG-CD2 3.47Å; L254-Y286 HydrophobicContact CG-CE2 3.65Å; L254-Y286 HydrophobicContact CG-CG 4.28Å; L254-I289 HydrophobicContact CD1-CD1 4.44Å; L254-I289 HydrophobicContact CD1-CG2 4.24Å; L254-I289 HydrophobicContact CD2-CB 4.29Å; L254-I289 HydrophobicContact CD2-CG2 4.04Å; L254-F290 HydrophobicContact CD2-CB 4.09Å
255	N	98.6	Very high	95.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-47.6	172.1	-77	-21.3	0	0	0	112.4	L233 L234 A251 T252 G257 W258 I259 Y286	L233-N255 WeakPolarHBondContact CD2-OD1 3.42Å; L233-N255 WeakPolarHBondContact CG-OD1 3.31Å; L233-N255 PolarHBondContact O-ND2 3.34Å; L234-N255 HydrophobicContact CD1-CB 3.74Å; A251-N255 PolarHBondContact O-N 3Å; T252-N255 WeakPolarHBondContact O-CB 3.24Å; T252-N255 PolarHBondContact O-N 3.14Å; T252-N255 VanDerWaalsContact O-N 3.14Å; N255-G257 VanDerWaalsContact C-N 3.34Å; N255-G257 PolarHBondContact O-N 3.28Å; N255-W258 PolarHBondContact O-N 2.9Å; N255-I259 WeakPolarHBondContact O-CG1 3.28Å; N255-I259 PolarHBondContact O-N 3.3Å; N255-Y286 WeakPolarHBondContact OD1-CE2 3.35Å; N255-Y286 PolarHBondContact OD1-OH 3.39Å
256	L	98.4	Very high	94.2	Very high	84 Å²	84	46.5 Å²	46.5	44%	0.44	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-38.8	-179.2	-69.5	174.1	0	0	0	112.1	L234 T252 L253 W258 I259 A260	L234-L256 HydrophobicContact CD1-CD2 3.97Å; L234-L256 HydrophobicContact CD1-CG 4.26Å; T252-L256 HydrophobicContact CG2-CD1 4.19Å; T252-L256 HydrophobicContact CG2-CG 4.39Å; T252-L256 WeakPolarHBondContact O-CG 3.38Å; T252-L256 PolarHBondContact O-N 2.96Å; L253-L256 PolarHBondContact O-N 3.13Å; L256-W258 VanDerWaalsContact C-N 3.31Å; L256-W258 PolarHBondContact O-N 3.48Å; L256-I259 PolarHBondContact O-N 2.62Å; L256-A260 WeakPolarHBondContact O-CB 3.43Å; L256-A260 PolarHBondContact O-N 2.87Å
257	G	98.2	Very high	93	Very high	29 Å²	29	50.4 Å²	50.4	30%	0.299	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-40	174	0	0	0	0	0	112.3	L253 N255 A260 L261	L253-G257 PolarHBondContact O-N 3.31Å; N255-G257 VanDerWaalsContact C-N 3.34Å; N255-G257 PolarHBondContact O-N 3.28Å; G257-A260 PolarHBondContact O-N 3.09Å; G257-L261 PolarHBondContact O-N 2.92Å
258	W	98	Very high	91.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-39.2	176.7	-154.3	2.9	0	0	0	112.4	W189 I192 L230 L233 L254 N255 L256 L261 G262 M279 Y282 Y286	W189-W258 AromaticContact CD1-CH2 3.52Å; W189-W258 AromaticContact CD1-CZ3 3.57Å; W189-W258 HydrophobicContact CG-CH2 4.29Å; W189-W258 HydrophobicContact CG-CZ3 4.39Å; I192-W258 HydrophobicContact CB-CH2 3.53Å; I192-W258 HydrophobicContact CB-CZ2 3.68Å; I192-W258 HydrophobicContact CB-CZ3 4.34Å; I192-W258 HydrophobicContact CD1-CE3 4.28Å; I192-W258 HydrophobicContact CD1-CH2 3.73Å; I192-W258 HydrophobicContact CD1-CZ2 4.4Å; I192-W258 HydrophobicContact CD1-CZ3 3.65Å; I192-W258 HydrophobicContact CG1-CH2 4.26Å; I192-W258 HydrophobicContact CG2-CH2 3.59Å; I192-W258 HydrophobicContact CG2-CZ2 3.18Å; I192-W258 HydrophobicContact CG2-CZ3 4.41Å; L230-W258 HydrophobicContact CD2-CB 3.85Å; L230-W258 HydrophobicContact CD2-CD2 3.55Å; L230-W258 HydrophobicContact CD2-CE3 3.48Å; L230-W258 VanDerWaalsContact CD2-CE3 3.48Å; L230-W258 HydrophobicContact CD2-CG 3.72Å; L230-W258 HydrophobicContact CD2-CZ3 4.19Å; L233-W258 HydrophobicContact CD2-CE3 4.27Å; L233-W258 HydrophobicContact CD2-CZ3 4.01Å; L254-W258 PolarHBondContact O-N 2.64Å; N255-W258 PolarHBondContact O-N 2.9Å; L256-W258 VanDerWaalsContact C-N 3.31Å; L256-W258 PolarHBondContact O-N 3.48Å; W258-L261 PolarHBondContact O-N 3.38Å; W258-G262 PolarHBondContact O-N 3.07Å; W258-M279 VanDerWaalsContact NE1-CE 3.3Å; W258-M279 PolarHBondContact NE1-O 2.8Å; W258-Y282 HydrophobicContact CB-CD1 3.7Å; W258-Y282 HydrophobicContact CB-CE1 3.35Å; W258-Y282 AromaticContact CD1-CD1 3.39Å; W258-Y282 AromaticContact CD1-CG 3.71Å; W258-Y282 AromaticContact CD2-CD1 3.74Å; W258-Y282 HydrophobicContact CD2-CD1 3.74Å; W258-Y282 HydrophobicContact CD2-CE1 4.13Å; W258-Y282 AromaticContact CG-CD1 3.32Å; W258-Y282 HydrophobicContact CG-CD1 3.32Å; W258-Y282 AromaticContact CG-CE1 3.55Å; W258-Y282 HydrophobicContact CG-CE1 3.55Å; W258-Y282 HydrophobicContact CG-CG 4.09Å; W258-Y282 PolarHBondContact N-OH 3.49Å; W258-Y282 AromaticContact NE1-CD1 3.81Å; W258-Y286 AromaticContact CE3-CD2 3.84Å; W258-Y286 HydrophobicContact CE3-CD2 3.84Å; W258-Y286 HydrophobicContact CE3-CE2 4.27Å; W258-Y286 HydrophobicContact CE3-CG 4.23Å; W258-Y286 HydrophobicContact CZ3-CD2 4.27Å; W258-Y286 HydrophobicContact CZ3-CG 4.26Å
259	I	97.8	Very high	89.8	Confident	22 Å²	22	67.2 Å²	67.2	11%	0.113	36%	0.355	C	S	.	.	H	α-helix	trans	-61	-47.2	173.5	-69.6	166.2	0	0	0	110.6	F227 L230 I231 L234 N255 L256 L261 G262 L263	F227-I259 HydrophobicContact CE1-CG2 4.49Å; L230-I259 HydrophobicContact CB-CD1 4.49Å; L230-I259 HydrophobicContact CB-CG1 3.86Å; L230-I259 HydrophobicContact CD1-CG1 4.22Å; L230-I259 HydrophobicContact CD2-CG1 4.25Å; L230-I259 HydrophobicContact CG-CG1 4.35Å; I231-I259 HydrophobicContact CD1-CD1 4.36Å; L234-I259 HydrophobicContact CD1-CD1 4.19Å; L234-I259 HydrophobicContact CD2-CD1 4.4Å; N255-I259 WeakPolarHBondContact O-CG1 3.28Å; N255-I259 PolarHBondContact O-N 3.3Å; L256-I259 PolarHBondContact O-N 2.62Å; I259-L261 VanDerWaalsContact C-N 3.33Å; I259-L261 PolarHBondContact O-N 2.82Å; I259-G262 WeakPolarHBondContact O-CA 3.19Å; I259-G262 PolarHBondContact O-N 2.98Å; I259-L263 HydrophobicContact CG2-CD1 4.08Å; I259-L263 WeakPolarHBondContact O-CG 3.41Å; I259-L263 PolarHBondContact O-N 2.91Å
260	A	96.6	Very high	88.8	Confident	57 Å²	57	65.3 Å²	65.3	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-58.5	-44.7	178	0	0	0	0	0	111.6	L256 G257 G262 L263	L256-A260 WeakPolarHBondContact O-CB 3.43Å; L256-A260 PolarHBondContact O-N 2.87Å; G257-A260 PolarHBondContact O-N 3.09Å; A260-G262 VanDerWaalsContact C-N 3.33Å; A260-G262 PolarHBondContact O-N 3.13Å; A260-L263 PolarHBondContact O-N 3.26Å
261	L	95.5	Very high	88.4	Confident	34 Å²	34	66.1 Å²	66.1	18%	0.178	35%	0.349	C	S	.	.	H	α-helix	trans	-60.7	-42.5	173.1	178.7	61	0	0	0	111.8	G257 W258 I259 L263 T264 W275 Q278 M279 Y282	G257-L261 PolarHBondContact O-N 2.92Å; W258-L261 PolarHBondContact O-N 3.38Å; I259-L261 VanDerWaalsContact C-N 3.33Å; I259-L261 PolarHBondContact O-N 2.82Å; L261-L263 PolarHBondContact O-N 3.07Å; L261-T264 HydrophobicContact CD1-CG2 4.43Å; L261-T264 WeakPolarHBondContact O-CB 3.46Å; L261-T264 WeakPolarHBondContact O-CG2 3.41Å; L261-T264 PolarHBondContact O-N 3.28Å; L261-T264 VanDerWaalsContact O-N 3.15Å; L261-T264 PolarHBondContact O-OG1 2.86Å; L261-W275 PolarHBondContact O-NE1 3.27Å; L261-Q278 HydrophobicContact CD1-CB 4.12Å; L261-Q278 HydrophobicContact CD2-CB 4.13Å; L261-M279 HydrophobicContact CB-SD 4.25Å; L261-M279 HydrophobicContact CD2-SD 3.88Å; L261-M279 HydrophobicContact CG-SD 3.73Å; L261-Y282 HydrophobicContact CD2-CD2 3.9Å; L261-Y282 HydrophobicContact CD2-CG 4.11Å
262	G	93.8	Very high	88.1	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-56.4	-33.9	176.6	0	0	0	0	0	113.1	F227 W258 I259 A260 T264 W275	F227-G262 VanDerWaalsContact CZ-O 3.25Å; F227-G262 WeakPolarHBondContact CZ-O 3.22Å; W258-G262 PolarHBondContact O-N 3.07Å; I259-G262 WeakPolarHBondContact O-CA 3.19Å; I259-G262 PolarHBondContact O-N 2.98Å; A260-G262 VanDerWaalsContact C-N 3.33Å; A260-G262 PolarHBondContact O-N 3.13Å; G262-T264 VanDerWaalsContact C-N 3.34Å; G262-W275 PolarHBondContact O-NE1 2.55Å
263	L	93.4	Very high	87.8	Confident	77 Å²	77	72 Å²	72	40%	0.403	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.1	-177.7	-67.1	167.9	0	0	0	113.6	F227 I259 A260 L261 T265 F266	F227-L263 HydrophobicContact CE1-CD2 3.67Å; F227-L263 HydrophobicContact CE1-CG 3.79Å; F227-L263 HydrophobicContact CZ-CB 4.42Å; F227-L263 HydrophobicContact CZ-CD2 3.5Å; F227-L263 VanDerWaalsContact CZ-CD2 3.5Å; F227-L263 HydrophobicContact CZ-CG 3.75Å; I259-L263 HydrophobicContact CG2-CD1 4.08Å; I259-L263 WeakPolarHBondContact O-CG 3.41Å; I259-L263 PolarHBondContact O-N 2.91Å; A260-L263 PolarHBondContact O-N 3.26Å; L261-L263 PolarHBondContact O-N 3.07Å; L263-T265 PolarHBondContact O-N 3.12Å; L263-T265 VanDerWaalsContact O-N 3.16Å; L263-F266 HydrophobicContact CB-CE2 4.02Å; L263-F266 HydrophobicContact CB-CZ 4.43Å; L263-F266 HydrophobicContact CD2-CE2 4.12Å; L263-F266 HydrophobicContact CD2-CZ 3.69Å; L263-F266 WeakPolarHBondContact O-CD2 3.32Å; L263-F266 WeakPolarHBondContact O-CE2 3.43Å
264	T	88	Confident	87.6	Confident	89 Å²	89	73.4 Å²	73.4	55%	0.546	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.3	-176	56.7	0	0	0	0	114.7	L261 G262	L261-T264 HydrophobicContact CD1-CG2 4.43Å; L261-T264 WeakPolarHBondContact O-CB 3.46Å; L261-T264 WeakPolarHBondContact O-CG2 3.41Å; L261-T264 PolarHBondContact O-N 3.28Å; L261-T264 VanDerWaalsContact O-N 3.15Å; L261-T264 PolarHBondContact O-OG1 2.86Å; G262-T264 VanDerWaalsContact C-N 3.34Å
265	T	76.1	Confident	87.4	Confident	11 Å²	11	72.6 Å²	72.6	7%	0.067	38%	0.377	C	S	.	.			trans	-105.7	82.5	-174.9	-67.7	0	0	0	0	111.8	F219 R223 L263 S270 W275	F219-T265 HydrophobicContact CE1-CG2 4.19Å; F219-T265 HydrophobicContact CZ-CG2 4.22Å; R223-T265 PolarHBondContact NH1-O 2.92Å; L263-T265 PolarHBondContact O-N 3.12Å; L263-T265 VanDerWaalsContact O-N 3.16Å; T265-S270 WeakPolarHBondContact CG2-OG 3.37Å; T265-W275 WeakPolarHBondContact OG1-CB 3.18Å
266	F	64.5	Low	87.3	Confident	152 Å²	152	72.6 Å²	72.6	67%	0.667	38%	0.377	S	S	*	.			trans	-109.3	-16.7	169.2	-70.7	-71.3	0	0	0	114.3	L263	L263-F266 HydrophobicContact CB-CE2 4.02Å; L263-F266 HydrophobicContact CB-CZ 4.43Å; L263-F266 HydrophobicContact CD2-CE2 4.12Å; L263-F266 HydrophobicContact CD2-CZ 3.69Å; L263-F266 WeakPolarHBondContact O-CD2 3.32Å; L263-F266 WeakPolarHBondContact O-CE2 3.43Å
267	K	68.9	Low	87.2	Confident	177 Å²	177	70.3 Å²	70.3	77%	0.77	37%	0.366	S	S	*	.	S	Bend	trans	-82.4	138.8	-175.3	-64.1	-175.9	179.7	-178.9	0	111.5	N269 S270	K267-N269 PolarHBondContact O-N 3.15Å; K267-N269 VanDerWaalsContact O-N 3.11Å; K267-S270 WeakPolarHBondContact O-CB 3.36Å; K267-S270 PolarHBondContact O-N 3.41Å; K267-S270 VanDerWaalsContact O-N 3.14Å; K267-S270 PolarHBondContact O-OG 2.97Å; K267-S270 VanDerWaalsContact O-OG 3.11Å
268	K	61.5	Low	87.2	Confident	209 Å²	209	72.8 Å²	72.8	91%	0.909	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.9	-178.2	-165.4	175.9	179.1	-177.3	0	113.9
269	N	67.5	Low	87.2	Confident	157 Å²	157	72.9 Å²	72.9	84%	0.84	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	16.7	-176.9	-61.4	-10.1	0	0	0	113.7	K267	K267-N269 PolarHBondContact O-N 3.15Å; K267-N269 VanDerWaalsContact O-N 3.11Å
270	S	76.8	Confident	87.2	Confident	34 Å²	34	73.5 Å²	73.5	24%	0.238	37%	0.372	C	S	.	.			trans	-68.6	136	177	59.7	0	0	0	0	111.3	T265 K267 Q272	T265-S270 WeakPolarHBondContact CG2-OG 3.37Å; K267-S270 WeakPolarHBondContact O-CB 3.36Å; K267-S270 PolarHBondContact O-N 3.41Å; K267-S270 VanDerWaalsContact O-N 3.14Å; K267-S270 PolarHBondContact O-OG 2.97Å; K267-S270 VanDerWaalsContact O-OG 3.11Å; S270-Q272 PolarHBondContact O-N 3.46Å
271	D	89.2	Confident	87.2	Confident	97 Å²	97	74.9 Å²	74.9	52%	0.519	37%	0.371	S	S	.	.			trans	-66.3	102.7	167.4	-178.6	-13.3	0	0	0	110.2	T273 K274 W275	D271-T273 VanDerWaalsContact C-N 3.27Å; D271-T273 PolarHBondContact O-N 3.35Å; D271-T273 WeakPolarHBondContact OD1-CA 3.18Å; D271-T273 WeakPolarHBondContact OD1-CB 2.84Å; D271-T273 PolarHBondContact OD1-N 2.74Å; D271-K274 HydrophobicContact CB-CB 3.84Å; D271-K274 VanDerWaalsContact CG-CB 3.44Å; D271-K274 PolarHBondContact O-N 3.48Å; D271-K274 PolarHBondContact OD1-N 3.21Å; D271-K274 WeakPolarHBondContact OD2-CB 3.42Å; D271-W275 PolarHBondContact O-N 2.94Å; D271-W275 VanDerWaalsContact O-N 3.09Å
272	Q	91.9	Very high	87.4	Confident	86 Å²	86	75.9 Å²	75.9	40%	0.402	37%	0.373	S	S	.	.	H	α-helix	trans	-64.4	-33.2	-179.5	-63.8	177.7	3.4	0	0	112	F219 S270 A276	F219-Q272 HydrophobicContact CD1-CG 3.9Å; F219-Q272 HydrophobicContact CD2-CB 3.97Å; F219-Q272 HydrophobicContact CD2-CG 4.08Å; F219-Q272 HydrophobicContact CE1-CG 3.86Å; F219-Q272 HydrophobicContact CE2-CB 3.83Å; F219-Q272 HydrophobicContact CE2-CG 4.03Å; F219-Q272 HydrophobicContact CG-CB 4.39Å; F219-Q272 VanDerWaalsContact CG-CD 3.49Å; F219-Q272 HydrophobicContact CG-CG 4.01Å; F219-Q272 HydrophobicContact CZ-CB 4.14Å; F219-Q272 HydrophobicContact CZ-CG 3.94Å; S270-Q272 PolarHBondContact O-N 3.46Å; Q272-A276 VanDerWaalsContact O-CB 3.25Å; Q272-A276 WeakPolarHBondContact O-CB 3.49Å; Q272-A276 PolarHBondContact O-N 2.94Å
273	T	92.6	Very high	87.6	Confident	75 Å²	75	75.8 Å²	75.8	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-71.8	-40.6	-179.9	-59.3	0	0	0	0	110.7	K200 D271 A276 T277	K200-T273 HydrophobicContact CG-CG2 4.49Å; D271-T273 VanDerWaalsContact C-N 3.27Å; D271-T273 PolarHBondContact O-N 3.35Å; D271-T273 WeakPolarHBondContact OD1-CA 3.18Å; D271-T273 WeakPolarHBondContact OD1-CB 2.84Å; D271-T273 PolarHBondContact OD1-N 2.74Å; T273-A276 PolarHBondContact O-N 3.25Å; T273-T277 WeakPolarHBondContact O-CB 3.47Å; T273-T277 PolarHBondContact O-N 2.87Å; T273-T277 PolarHBondContact O-OG1 3.44Å
274	K	94.1	Very high	87.8	Confident	129 Å²	129	76 Å²	76	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-62.5	-48.7	173	-177.9	175.2	-178.8	177.2	0	111.4	D271 A276 T277 Q278	D271-K274 HydrophobicContact CB-CB 3.84Å; D271-K274 VanDerWaalsContact CG-CB 3.44Å; D271-K274 PolarHBondContact O-N 3.48Å; D271-K274 PolarHBondContact OD1-N 3.21Å; D271-K274 WeakPolarHBondContact OD2-CB 3.42Å; K274-A276 PolarHBondContact O-N 3.32Å; K274-T277 WeakPolarHBondContact O-CB 3.18Å; K274-T277 PolarHBondContact O-N 2.68Å; K274-T277 VanDerWaalsContact O-N 3.17Å; K274-Q278 WeakPolarHBondContact O-CG 3.5Å; K274-Q278 PolarHBondContact O-N 3.32Å
275	W	94.9	Very high	88.3	Confident	4 Å²	4	75.9 Å²	75.9	2%	0.015	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-46.3	176.7	175.6	81.9	0	0	0	111.9	I199 F219 R223 M226 L261 G262 T265 D271 T277 Q278 M279	I199-W275 HydrophobicContact CD1-CZ3 4Å; F219-W275 AromaticContact CE2-CE3 3.55Å; F219-W275 HydrophobicContact CE2-CE3 3.55Å; F219-W275 AromaticContact CE2-CZ3 3.63Å; F219-W275 HydrophobicContact CE2-CZ3 3.63Å; F219-W275 HydrophobicContact CZ-CD2 4.26Å; F219-W275 AromaticContact CZ-CE3 3.62Å; F219-W275 HydrophobicContact CZ-CE3 3.62Å; F219-W275 AromaticContact CZ-CZ3 3.85Å; F219-W275 HydrophobicContact CZ-CZ3 3.85Å; R223-W275 HydrophobicContact CB-CH2 4.41Å; R223-W275 HydrophobicContact CG-CH2 3.82Å; R223-W275 HydrophobicContact CG-CZ2 4.15Å; M226-W275 HydrophobicContact CE-CH2 3.79Å; M226-W275 HydrophobicContact CE-CZ3 4.11Å; M226-W275 HydrophobicContact SD-CH2 3.75Å; M226-W275 HydrophobicContact SD-CZ3 3.96Å; L261-W275 PolarHBondContact O-NE1 3.27Å; G262-W275 PolarHBondContact O-NE1 2.55Å; T265-W275 WeakPolarHBondContact OG1-CB 3.18Å; D271-W275 PolarHBondContact O-N 2.94Å; D271-W275 VanDerWaalsContact O-N 3.09Å; W275-T277 VanDerWaalsContact C-N 3.26Å; W275-T277 PolarHBondContact O-N 3.48Å; W275-Q278 PolarHBondContact O-N 2.89Å; W275-Q278 VanDerWaalsContact O-N 3.14Å; W275-M279 HydrophobicContact CD2-CG 3.91Å; W275-M279 HydrophobicContact CE3-CG 4.15Å; W275-M279 HydrophobicContact CH2-CE 4.48Å; W275-M279 HydrophobicContact CH2-CG 3.86Å; W275-M279 HydrophobicContact CZ2-CE 4.18Å; W275-M279 HydrophobicContact CZ2-CG 3.6Å; W275-M279 HydrophobicContact CZ2-SD 3.96Å; W275-M279 HydrophobicContact CZ3-CG 4.12Å; W275-M279 WeakPolarHBondContact O-CG 3.31Å; W275-M279 PolarHBondContact O-N 3.17Å
276	A	96.2	Very high	89.3	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62.9	-34.7	177.3	0	0	0	0	0	112	I199 K200 Q272 T273 K274 M279 F280	I199-A276 HydrophobicContact CB-CB 3.78Å; I199-A276 HydrophobicContact CD1-CB 4.27Å; I199-A276 HydrophobicContact CG2-CB 3.6Å; K200-A276 HydrophobicContact CG-CB 4.06Å; Q272-A276 VanDerWaalsContact O-CB 3.25Å; Q272-A276 WeakPolarHBondContact O-CB 3.49Å; Q272-A276 PolarHBondContact O-N 2.94Å; T273-A276 PolarHBondContact O-N 3.25Å; K274-A276 PolarHBondContact O-N 3.32Å; A276-M279 PolarHBondContact O-N 3.46Å; A276-F280 VanDerWaalsContact O-CB 3.3Å; A276-F280 WeakPolarHBondContact O-CB 3.33Å; A276-F280 PolarHBondContact O-N 3.21Å
277	T	96.6	Very high	90.9	Very high	37 Å²	37	68.9 Å²	68.9	23%	0.227	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-41.9	173.7	-61.4	0	0	0	0	112	K200 T273 K274 W275 F280 I281	K200-T277 WeakPolarHBondContact CD-OG1 3.45Å; K200-T277 WeakPolarHBondContact CE-OG1 3.37Å; K200-T277 PolarHBondContact NZ-OG1 3.24Å; T273-T277 WeakPolarHBondContact O-CB 3.47Å; T273-T277 PolarHBondContact O-N 2.87Å; T273-T277 PolarHBondContact O-OG1 3.44Å; K274-T277 WeakPolarHBondContact O-CB 3.18Å; K274-T277 PolarHBondContact O-N 2.68Å; K274-T277 VanDerWaalsContact O-N 3.17Å; W275-T277 VanDerWaalsContact C-N 3.26Å; W275-T277 PolarHBondContact O-N 3.48Å; T277-F280 PolarHBondContact O-N 3.21Å; T277-I281 HydrophobicContact CG2-CD1 3.84Å; T277-I281 HydrophobicContact CG2-CG1 4.46Å; T277-I281 VanDerWaalsContact O-CG1 3.32Å; T277-I281 WeakPolarHBondContact O-CG1 3.41Å; T277-I281 PolarHBondContact O-N 2.69Å
278	Q	97	Very high	92.3	Very high	81 Å²	81	63.6 Å²	63.6	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-64.2	-45.1	174.7	-67.7	173.3	-39.5	0	0	111.4	L261 K274 W275 F280 I281 Y282	L261-Q278 HydrophobicContact CD1-CB 4.12Å; L261-Q278 HydrophobicContact CD2-CB 4.13Å; K274-Q278 WeakPolarHBondContact O-CG 3.5Å; K274-Q278 PolarHBondContact O-N 3.32Å; W275-Q278 PolarHBondContact O-N 2.89Å; W275-Q278 VanDerWaalsContact O-N 3.14Å; Q278-F280 VanDerWaalsContact C-N 3.28Å; Q278-F280 PolarHBondContact O-N 3.4Å; Q278-I281 PolarHBondContact O-N 2.83Å; Q278-Y282 WeakPolarHBondContact O-CB 3.44Å; Q278-Y282 PolarHBondContact O-N 3.37Å
279	M	97.7	Very high	94.1	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-40.7	175.3	-69.7	-61.8	-73.8	0	0	112	I192 A196 M226 L230 W258 L261 W275 A276 S283	I192-M279 HydrophobicContact CG2-CE 4.18Å; A196-M279 HydrophobicContact CB-CB 3.99Å; M226-M279 HydrophobicContact CE-CB 4.01Å; M226-M279 HydrophobicContact CE-CE 3.83Å; M226-M279 HydrophobicContact CE-CG 4.15Å; L230-M279 HydrophobicContact CD1-CE 4.19Å; W258-M279 VanDerWaalsContact NE1-CE 3.3Å; W258-M279 PolarHBondContact NE1-O 2.8Å; L261-M279 HydrophobicContact CB-SD 4.25Å; L261-M279 HydrophobicContact CD2-SD 3.88Å; L261-M279 HydrophobicContact CG-SD 3.73Å; W275-M279 HydrophobicContact CD2-CG 3.91Å; W275-M279 HydrophobicContact CE3-CG 4.15Å; W275-M279 HydrophobicContact CH2-CE 4.48Å; W275-M279 HydrophobicContact CH2-CG 3.86Å; W275-M279 HydrophobicContact CZ2-CE 4.18Å; W275-M279 HydrophobicContact CZ2-CG 3.6Å; W275-M279 HydrophobicContact CZ2-SD 3.96Å; W275-M279 HydrophobicContact CZ3-CG 4.12Å; W275-M279 WeakPolarHBondContact O-CG 3.31Å; W275-M279 PolarHBondContact O-N 3.17Å; A276-M279 PolarHBondContact O-N 3.46Å; M279-S283 WeakPolarHBondContact O-CB 3.4Å; M279-S283 PolarHBondContact O-N 3.17Å
280	F	97.9	Very high	95.6	Very high	35 Å²	35	50.2 Å²	50.2	15%	0.154	26%	0.258	C	S	.	.	H	α-helix	trans	-66.9	-47.2	177	-179.1	-98.8	0	0	0	112.1	H193 A196 L197 A276 T277 Q278 Y282 S283 L284	H193-F280 AromaticContact CE1-CD2 3.67Å; H193-F280 AromaticContact CE1-CE2 3.08Å; H193-F280 WeakPolarHBondContact CE1-CE2 3.27Å; H193-F280 AromaticContact CE1-CZ 3.69Å; H193-F280 AromaticContact ND1-CD2 3.81Å; H193-F280 AromaticContact ND1-CE2 3.7Å; H193-F280 AromaticContact NE2-CE2 3.5Å; A196-F280 HydrophobicContact CB-CB 3.92Å; L197-F280 HydrophobicContact CB-CD2 4.01Å; L197-F280 HydrophobicContact CB-CE2 3.96Å; L197-F280 HydrophobicContact CD1-CE2 4.18Å; L197-F280 HydrophobicContact CD1-CZ 4.48Å; L197-F280 HydrophobicContact CD2-CE2 4.38Å; L197-F280 HydrophobicContact CG-CE2 4.4Å; A276-F280 VanDerWaalsContact O-CB 3.3Å; A276-F280 WeakPolarHBondContact O-CB 3.33Å; A276-F280 PolarHBondContact O-N 3.21Å; T277-F280 PolarHBondContact O-N 3.21Å; Q278-F280 VanDerWaalsContact C-N 3.28Å; Q278-F280 PolarHBondContact O-N 3.4Å; F280-Y282 VanDerWaalsContact C-N 3.33Å; F280-Y282 PolarHBondContact O-N 3.23Å; F280-S283 WeakPolarHBondContact O-CB 3.26Å; F280-S283 PolarHBondContact O-N 3.13Å; F280-S283 PolarHBondContact O-OG 3.3Å; F280-L284 HydrophobicContact CD1-CD1 4.13Å; F280-L284 HydrophobicContact CE1-CD1 3.62Å; F280-L284 HydrophobicContact CE1-CG 4.28Å; F280-L284 HydrophobicContact CZ-CD1 4.15Å; F280-L284 HydrophobicContact CZ-CG 4.46Å; F280-L284 PolarHBondContact O-N 3.39Å; F280-L284 VanDerWaalsContact O-N 3.11Å
281	I	98.2	Very high	96.6	Very high	87 Å²	87	48.7 Å²	48.7	45%	0.446	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-42.1	177.6	-68.2	167	0	0	0	110.7	T277 Q278 S283 L284 N285	T277-I281 HydrophobicContact CG2-CD1 3.84Å; T277-I281 HydrophobicContact CG2-CG1 4.46Å; T277-I281 VanDerWaalsContact O-CG1 3.32Å; T277-I281 WeakPolarHBondContact O-CG1 3.41Å; T277-I281 PolarHBondContact O-N 2.69Å; Q278-I281 PolarHBondContact O-N 2.83Å; I281-S283 VanDerWaalsContact C-N 3.28Å; I281-S283 PolarHBondContact O-N 3.09Å; I281-L284 PolarHBondContact O-N 2.91Å; I281-N285 PolarHBondContact O-N 3.32Å; I281-N285 PolarHBondContact O-ND2 3.19Å
282	Y	98.5	Very high	97	Very high	54 Å²	54	47.2 Å²	47.2	21%	0.212	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-46	174.2	-164.5	-74.3	0	0	0	110.5	L254 W258 L261 Q278 F280 L284 N285 Y286	L254-Y282 HydrophobicContact CD1-CE1 4.31Å; L254-Y282 PolarHBondContact O-OH 2.91Å; W258-Y282 HydrophobicContact CB-CD1 3.7Å; W258-Y282 HydrophobicContact CB-CE1 3.35Å; W258-Y282 AromaticContact CD1-CD1 3.39Å; W258-Y282 AromaticContact CD1-CG 3.71Å; W258-Y282 AromaticContact CD2-CD1 3.74Å; W258-Y282 HydrophobicContact CD2-CD1 3.74Å; W258-Y282 HydrophobicContact CD2-CE1 4.13Å; W258-Y282 AromaticContact CG-CD1 3.32Å; W258-Y282 HydrophobicContact CG-CD1 3.32Å; W258-Y282 AromaticContact CG-CE1 3.55Å; W258-Y282 HydrophobicContact CG-CE1 3.55Å; W258-Y282 HydrophobicContact CG-CG 4.09Å; W258-Y282 PolarHBondContact N-OH 3.49Å; W258-Y282 AromaticContact NE1-CD1 3.81Å; L261-Y282 HydrophobicContact CD2-CD2 3.9Å; L261-Y282 HydrophobicContact CD2-CG 4.11Å; Q278-Y282 WeakPolarHBondContact O-CB 3.44Å; Q278-Y282 PolarHBondContact O-N 3.37Å; F280-Y282 VanDerWaalsContact C-N 3.33Å; F280-Y282 PolarHBondContact O-N 3.23Å; Y282-L284 VanDerWaalsContact C-N 3.33Å; Y282-L284 PolarHBondContact O-N 3.12Å; Y282-N285 PolarHBondContact O-N 3.36Å; Y282-Y286 HydrophobicContact CE1-CD2 4.14Å; Y282-Y286 VanDerWaalsContact O-CB 3.31Å; Y282-Y286 WeakPolarHBondContact O-CB 3.49Å; Y282-Y286 PolarHBondContact O-N 3.48Å
283	S	98.2	Very high	97.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-37.8	180	76.6	0	0	0	0	113.6	W189 H193 M279 F280 I281 Y286 L287	W189-S283 PolarHBondContact NE1-O 2.96Å; H193-S283 PolarHBondContact ND1-OG 3.15Å; M279-S283 WeakPolarHBondContact O-CB 3.4Å; M279-S283 PolarHBondContact O-N 3.17Å; F280-S283 WeakPolarHBondContact O-CB 3.26Å; F280-S283 PolarHBondContact O-N 3.13Å; F280-S283 PolarHBondContact O-OG 3.3Å; I281-S283 VanDerWaalsContact C-N 3.28Å; I281-S283 PolarHBondContact O-N 3.09Å; S283-Y286 WeakPolarHBondContact O-CB 3.24Å; S283-Y286 PolarHBondContact O-N 3.23Å; S283-L287 PolarHBondContact O-N 3.29Å; S283-L287 VanDerWaalsContact O-N 3.16Å
284	L	97.2	Very high	97.4	Very high	81 Å²	81	40.9 Å²	40.9	42%	0.424	21%	0.208	S	C	.	.	H	α-helix	trans	-64	-46.7	176.2	-70.9	173.3	0	0	0	111	F280 I281 Y282 L287 V288	F280-L284 HydrophobicContact CD1-CD1 4.13Å; F280-L284 HydrophobicContact CE1-CD1 3.62Å; F280-L284 HydrophobicContact CE1-CG 4.28Å; F280-L284 HydrophobicContact CZ-CD1 4.15Å; F280-L284 HydrophobicContact CZ-CG 4.46Å; F280-L284 PolarHBondContact O-N 3.39Å; F280-L284 VanDerWaalsContact O-N 3.11Å; I281-L284 PolarHBondContact O-N 2.91Å; Y282-L284 VanDerWaalsContact C-N 3.33Å; Y282-L284 PolarHBondContact O-N 3.12Å; L284-L287 PolarHBondContact O-N 3.48Å; L284-V288 PolarHBondContact O-N 2.9Å
285	N	98.3	Very high	97.5	Very high	86 Å²	86	36 Å²	36	46%	0.46	19%	0.188	S	C	.	.	H	α-helix	trans	-67.1	-37.9	177.1	-70.4	-72.1	0	0	0	111.7	I281 Y282 L287 V288 I289	I281-N285 PolarHBondContact O-N 3.32Å; I281-N285 PolarHBondContact O-ND2 3.19Å; Y282-N285 PolarHBondContact O-N 3.36Å; N285-L287 VanDerWaalsContact C-N 3.32Å; N285-L287 PolarHBondContact O-N 3.41Å; N285-V288 PolarHBondContact O-N 2.89Å; N285-I289 HydrophobicContact CB-CD1 4.13Å; N285-I289 VanDerWaalsContact O-CB 3.28Å; N285-I289 WeakPolarHBondContact O-CB 3.38Å; N285-I289 WeakPolarHBondContact O-CD1 3.32Å; N285-I289 WeakPolarHBondContact O-CG1 3.45Å; N285-I289 PolarHBondContact O-N 2.88Å
286	Y	98.6	Very high	97.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-53.1	-51.9	176.3	177.6	-75.8	0	0	0	110.3	V185 W189 L233 L254 N255 W258 Y282 S283 V288 I289 F290	V185-Y286 HydrophobicContact CG1-CE1 4.05Å; W189-Y286 AromaticContact CD1-CD1 3.39Å; W189-Y286 HydrophobicContact CG-CD1 4.29Å; W189-Y286 AromaticContact NE1-CD1 3.96Å; L233-Y286 HydrophobicContact CD2-CE1 4.37Å; L233-Y286 HydrophobicContact CD2-CE2 4.27Å; L254-Y286 HydrophobicContact CB-CE2 4.29Å; L254-Y286 HydrophobicContact CD1-CD2 4.31Å; L254-Y286 HydrophobicContact CD2-CD2 3.58Å; L254-Y286 HydrophobicContact CD2-CE2 3.66Å; L254-Y286 HydrophobicContact CD2-CG 4.01Å; L254-Y286 HydrophobicContact CG-CD2 3.47Å; L254-Y286 VanDerWaalsContact CG-CD2 3.47Å; L254-Y286 HydrophobicContact CG-CE2 3.65Å; L254-Y286 HydrophobicContact CG-CG 4.28Å; N255-Y286 WeakPolarHBondContact OD1-CE2 3.35Å; N255-Y286 PolarHBondContact OD1-OH 3.39Å; W258-Y286 AromaticContact CE3-CD2 3.84Å; W258-Y286 HydrophobicContact CE3-CD2 3.84Å; W258-Y286 HydrophobicContact CE3-CE2 4.27Å; W258-Y286 HydrophobicContact CE3-CG 4.23Å; W258-Y286 HydrophobicContact CZ3-CD2 4.27Å; W258-Y286 HydrophobicContact CZ3-CG 4.26Å; Y282-Y286 HydrophobicContact CE1-CD2 4.14Å; Y282-Y286 VanDerWaalsContact O-CB 3.31Å; Y282-Y286 WeakPolarHBondContact O-CB 3.49Å; Y282-Y286 PolarHBondContact O-N 3.48Å; S283-Y286 WeakPolarHBondContact O-CB 3.24Å; S283-Y286 PolarHBondContact O-N 3.23Å; Y286-V288 PolarHBondContact O-N 3.27Å; Y286-I289 PolarHBondContact O-N 3.01Å; Y286-F290 HydrophobicContact CD1-CB 4.45Å; Y286-F290 HydrophobicContact CE1-CB 4.12Å; Y286-F290 HydrophobicContact CE1-CD2 4.2Å; Y286-F290 HydrophobicContact CE1-CG 4.29Å; Y286-F290 AromaticContact CZ-CD2 3.99Å; Y286-F290 WeakPolarHBondContact O-CB 3.19Å; Y286-F290 PolarHBondContact O-N 3.27Å; Y286-F290 WeakPolarHBondContact OH-CD2 2.98Å
287	L	98	Very high	97.4	Very high	16 Å²	16	40.6 Å²	40.6	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-47.8	-176.1	-168.5	74.4	0	0	0	110.8	V186 W189 S283 L284 N285 F291	V186-L287 HydrophobicContact CG2-CD1 4.36Å; W189-L287 HydrophobicContact CD2-CD1 4.05Å; W189-L287 HydrophobicContact CE3-CD1 4.1Å; W189-L287 HydrophobicContact CH2-CD2 3.93Å; W189-L287 HydrophobicContact CZ2-CB 4.04Å; W189-L287 HydrophobicContact CZ2-CD2 4.11Å; W189-L287 HydrophobicContact CZ2-CG 4.46Å; W189-L287 HydrophobicContact CZ3-CD1 4.4Å; W189-L287 HydrophobicContact CZ3-CD2 4.23Å; S283-L287 PolarHBondContact O-N 3.29Å; S283-L287 VanDerWaalsContact O-N 3.16Å; L284-L287 PolarHBondContact O-N 3.48Å; N285-L287 VanDerWaalsContact C-N 3.32Å; N285-L287 PolarHBondContact O-N 3.41Å; L287-F291 HydrophobicContact CD1-CD2 3.96Å; L287-F291 HydrophobicContact CD1-CE2 3.7Å; L287-F291 HydrophobicContact CG-CD2 4.25Å; L287-F291 HydrophobicContact CG-CE2 4.46Å; L287-F291 WeakPolarHBondContact O-CD2 3.26Å; L287-F291 PolarHBondContact O-N 3.25Å
288	V	97.9	Very high	97.1	Very high	67 Å²	67	38.9 Å²	38.9	41%	0.406	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-51.5	179	177.5	0	0	0	0	111	I33 L284 N285 Y286 F290 F291 V292	I33-V288 HydrophobicContact CD1-CG2 4.25Å; L284-V288 PolarHBondContact O-N 2.9Å; N285-V288 PolarHBondContact O-N 2.89Å; Y286-V288 PolarHBondContact O-N 3.27Å; V288-F290 PolarHBondContact O-N 3.09Å; V288-F291 PolarHBondContact O-N 3.31Å; V288-V292 HydrophobicContact CG1-CG2 4.11Å; V288-V292 VanDerWaalsContact O-CB 3.27Å; V288-V292 WeakPolarHBondContact O-CB 3.3Å; V288-V292 WeakPolarHBondContact O-CG2 3.13Å; V288-V292 PolarHBondContact O-N 2.87Å
289	I	98.4	Very high	96.7	Very high	85 Å²	85	38.6 Å²	38.6	44%	0.436	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-45.2	-177.5	-68	166.5	0	0	0	110.7	L254 N285 Y286 F291 L293	L254-I289 HydrophobicContact CD1-CD1 4.44Å; L254-I289 HydrophobicContact CD1-CG2 4.24Å; L254-I289 HydrophobicContact CD2-CB 4.29Å; L254-I289 HydrophobicContact CD2-CG2 4.04Å; N285-I289 HydrophobicContact CB-CD1 4.13Å; N285-I289 VanDerWaalsContact O-CB 3.28Å; N285-I289 WeakPolarHBondContact O-CB 3.38Å; N285-I289 WeakPolarHBondContact O-CD1 3.32Å; N285-I289 WeakPolarHBondContact O-CG1 3.45Å; N285-I289 PolarHBondContact O-N 2.88Å; Y286-I289 PolarHBondContact O-N 3.01Å; I289-F291 PolarHBondContact O-N 3.38Å; I289-L293 WeakPolarHBondContact O-CB 3.28Å; I289-L293 PolarHBondContact O-N 3.45Å
290	F	98.6	Very high	96	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-49.7	-178.8	-175.3	-81.9	0	0	0	111.7	L182 V185 P237 L240 F247 A251 L254 Y286 V288 L293 A294	L182-F290 HydrophobicContact CD2-CE1 4.29Å; V185-F290 HydrophobicContact CB-CE1 4.2Å; V185-F290 HydrophobicContact CB-CZ 4.23Å; V185-F290 HydrophobicContact CG1-CD1 3.9Å; V185-F290 HydrophobicContact CG1-CD2 4.26Å; V185-F290 HydrophobicContact CG1-CE1 3.81Å; V185-F290 HydrophobicContact CG1-CE2 4.15Å; V185-F290 HydrophobicContact CG1-CG 4.15Å; V185-F290 HydrophobicContact CG1-CZ 3.95Å; V185-F290 HydrophobicContact CG2-CE1 3.84Å; V185-F290 HydrophobicContact CG2-CE2 4.01Å; V185-F290 HydrophobicContact CG2-CZ 3.43Å; V185-F290 VanDerWaalsContact CG2-CZ 3.43Å; P237-F290 HydrophobicContact CG-CE2 4.39Å; L240-F290 HydrophobicContact CD1-CE1 4.28Å; L240-F290 HydrophobicContact CD1-CZ 3.77Å; F247-F290 HydrophobicContact CE1-CZ 4.28Å; F247-F290 HydrophobicContact CZ-CE1 4.07Å; F247-F290 HydrophobicContact CZ-CE2 4.04Å; F247-F290 AromaticContact CZ-CZ 3.65Å; F247-F290 HydrophobicContact CZ-CZ 3.65Å; A251-F290 HydrophobicContact CB-CD2 4.19Å; A251-F290 HydrophobicContact CB-CE2 3.83Å; L254-F290 HydrophobicContact CD2-CB 4.09Å; Y286-F290 HydrophobicContact CD1-CB 4.45Å; Y286-F290 HydrophobicContact CE1-CB 4.12Å; Y286-F290 HydrophobicContact CE1-CD2 4.2Å; Y286-F290 HydrophobicContact CE1-CG 4.29Å; Y286-F290 AromaticContact CZ-CD2 3.99Å; Y286-F290 WeakPolarHBondContact O-CB 3.19Å; Y286-F290 PolarHBondContact O-N 3.27Å; Y286-F290 WeakPolarHBondContact OH-CD2 2.98Å; V288-F290 PolarHBondContact O-N 3.09Å; F290-L293 PolarHBondContact O-N 3.1Å; F290-A294 PolarHBondContact O-N 2.82Å
291	F	98.1	Very high	94.9	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-76.4	-34.3	-176.8	-79.4	-74.5	0	0	0	112.9	I33 P34 A37 L182 V186 L287 V288 I289 L293 A294 V295	I33-F291 HydrophobicContact CG2-CB 3.88Å; P34-F291 HydrophobicContact CB-CD1 4.12Å; P34-F291 HydrophobicContact CB-CD2 4.05Å; P34-F291 HydrophobicContact CB-CE1 3.61Å; P34-F291 HydrophobicContact CB-CE2 3.61Å; P34-F291 HydrophobicContact CB-CG 4.3Å; P34-F291 HydrophobicContact CB-CZ 3.36Å; A37-F291 HydrophobicContact CB-CB 4.17Å; A37-F291 HydrophobicContact CB-CD1 3.37Å; A37-F291 HydrophobicContact CB-CE1 4.13Å; A37-F291 HydrophobicContact CB-CG 4.18Å; L182-F291 HydrophobicContact CB-CE1 4.35Å; L182-F291 HydrophobicContact CD2-CE1 3.87Å; L182-F291 HydrophobicContact CG-CE1 4.5Å; V186-F291 HydrophobicContact CG2-CE2 3.69Å; V186-F291 HydrophobicContact CG2-CZ 3.58Å; L287-F291 HydrophobicContact CD1-CD2 3.96Å; L287-F291 HydrophobicContact CD1-CE2 3.7Å; L287-F291 HydrophobicContact CG-CD2 4.25Å; L287-F291 HydrophobicContact CG-CE2 4.46Å; L287-F291 WeakPolarHBondContact O-CD2 3.26Å; L287-F291 PolarHBondContact O-N 3.25Å; V288-F291 PolarHBondContact O-N 3.31Å; I289-F291 PolarHBondContact O-N 3.38Å; F291-L293 VanDerWaalsContact C-N 3.35Å; F291-A294 PolarHBondContact O-N 3.34Å; F291-V295 WeakPolarHBondContact O-CG2 3.37Å; F291-V295 PolarHBondContact O-N 3.32Å; F291-V295 VanDerWaalsContact O-N 3.09Å
292	V	97.3	Very high	93.5	Very high	66 Å²	66	46.9 Å²	46.9	40%	0.4	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-43.4	170.6	168.4	0	0	0	0	110.6	V288 A294 V295 I296	V288-V292 HydrophobicContact CG1-CG2 4.11Å; V288-V292 VanDerWaalsContact O-CB 3.27Å; V288-V292 WeakPolarHBondContact O-CB 3.3Å; V288-V292 WeakPolarHBondContact O-CG2 3.13Å; V288-V292 PolarHBondContact O-N 2.87Å; V292-A294 VanDerWaalsContact C-N 3.32Å; V292-A294 PolarHBondContact O-N 2.79Å; V292-V295 PolarHBondContact O-N 3.16Å; V292-I296 HydrophobicContact CG1-CD1 3.53Å; V292-I296 HydrophobicContact CG1-CG1 4.2Å; V292-I296 WeakPolarHBondContact O-CB 3.41Å; V292-I296 VanDerWaalsContact O-CG1 3.32Å; V292-I296 WeakPolarHBondContact O-CG1 3.24Å; V292-I296 PolarHBondContact O-N 3.02Å
293	L	97.2	Very high	91.8	Very high	27 Å²	27	53.7 Å²	53.7	14%	0.141	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-43.5	175.5	178.4	70	0	0	0	111.3	F247 L250 I289 F290 F291 V295 I296 V297	F247-L293 HydrophobicContact CD2-CD2 3.85Å; F247-L293 HydrophobicContact CD2-CG 3.75Å; F247-L293 HydrophobicContact CE2-CB 4.4Å; F247-L293 HydrophobicContact CE2-CD2 3.95Å; F247-L293 HydrophobicContact CE2-CG 3.98Å; L250-L293 HydrophobicContact CB-CD1 4.28Å; L250-L293 HydrophobicContact CB-CD2 3.58Å; L250-L293 HydrophobicContact CD1-CD1 3.6Å; L250-L293 HydrophobicContact CD1-CD2 4.46Å; I289-L293 WeakPolarHBondContact O-CB 3.28Å; I289-L293 PolarHBondContact O-N 3.45Å; F290-L293 PolarHBondContact O-N 3.1Å; F291-L293 VanDerWaalsContact C-N 3.35Å; L293-V295 VanDerWaalsContact C-N 3.34Å; L293-V295 PolarHBondContact O-N 2.93Å; L293-I296 PolarHBondContact O-N 3Å; L293-V297 HydrophobicContact CD1-CG2 3.74Å; L293-V297 HydrophobicContact CG-CG2 4.24Å; L293-V297 WeakPolarHBondContact O-CB 3.48Å; L293-V297 WeakPolarHBondContact O-CG2 3.43Å; L293-V297 PolarHBondContact O-N 2.93Å
294	A	97.3	Very high	91.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-43.4	178.6	0	0	0	0	0	111.9	L41 L243 F247 F290 F291 V292 S298	L41-A294 HydrophobicContact CD1-CB 4.23Å; L243-A294 HydrophobicContact CD1-CB 4.26Å; F247-A294 HydrophobicContact CD2-CB 4.46Å; F247-A294 VanDerWaalsContact CE2-CA 3.47Å; F247-A294 HydrophobicContact CE2-CB 3.64Å; F247-A294 HydrophobicContact CZ-CB 4.18Å; F290-A294 PolarHBondContact O-N 2.82Å; F291-A294 PolarHBondContact O-N 3.34Å; V292-A294 VanDerWaalsContact C-N 3.32Å; V292-A294 PolarHBondContact O-N 2.79Å; A294-S298 WeakPolarHBondContact O-CB 3.31Å; A294-S298 PolarHBondContact O-N 2.73Å
295	V	95.9	Very high	91.2	Very high	26 Å²	26	55.1 Å²	55.1	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-67.3	-46.1	177	170.7	0	0	0	0	111.7	A37 W40 F291 V292 L293 S298 L299	A37-V295 HydrophobicContact CB-CG2 4.01Å; W40-V295 HydrophobicContact CB-CG2 4.5Å; W40-V295 HydrophobicContact CD2-CG1 4.34Å; W40-V295 HydrophobicContact CG-CG1 4.25Å; W40-V295 HydrophobicContact CG-CG2 4.15Å; W40-V295 PolarHBondContact NE1-O 3.24Å; F291-V295 WeakPolarHBondContact O-CG2 3.37Å; F291-V295 PolarHBondContact O-N 3.32Å; F291-V295 VanDerWaalsContact O-N 3.09Å; V292-V295 PolarHBondContact O-N 3.16Å; L293-V295 VanDerWaalsContact C-N 3.34Å; L293-V295 PolarHBondContact O-N 2.93Å; V295-S298 PolarHBondContact O-N 3.15Å; V295-S298 PolarHBondContact O-OG 2.78Å; V295-S298 VanDerWaalsContact O-OG 3.1Å; V295-L299 PolarHBondContact O-N 3.36Å
296	I	95.3	Very high	90.8	Very high	88 Å²	88	53.4 Å²	53.4	45%	0.451	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-45.8	-177.5	-70.4	174.9	0	0	0	111.3	V292 L293 S298 L299 L300	V292-I296 HydrophobicContact CG1-CD1 3.53Å; V292-I296 HydrophobicContact CG1-CG1 4.2Å; V292-I296 WeakPolarHBondContact O-CB 3.41Å; V292-I296 VanDerWaalsContact O-CG1 3.32Å; V292-I296 WeakPolarHBondContact O-CG1 3.24Å; V292-I296 PolarHBondContact O-N 3.02Å; L293-I296 PolarHBondContact O-N 3Å; I296-S298 VanDerWaalsContact C-N 3.28Å; I296-S298 PolarHBondContact O-N 3.3Å; I296-L299 WeakPolarHBondContact O-CB 3.37Å; I296-L299 PolarHBondContact O-N 2.75Å; I296-L299 VanDerWaalsContact O-N 3.11Å; I296-L300 PolarHBondContact O-N 2.69Å
297	V	93.5	Very high	90.3	Very high	13 Å²	13	56.5 Å²	56.5	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-66.2	-34.9	-178.5	177.1	0	0	0	0	110.9	L243 F247 L293 L299 L300 T301	L243-V297 WeakPolarHBondContact O-CG1 3.49Å; F247-V297 HydrophobicContact CB-CB 4.39Å; F247-V297 HydrophobicContact CB-CG1 4.09Å; F247-V297 HydrophobicContact CB-CG2 4.36Å; L293-V297 HydrophobicContact CD1-CG2 3.74Å; L293-V297 HydrophobicContact CG-CG2 4.24Å; L293-V297 WeakPolarHBondContact O-CB 3.48Å; L293-V297 WeakPolarHBondContact O-CG2 3.43Å; L293-V297 PolarHBondContact O-N 2.93Å; V297-L299 VanDerWaalsContact C-N 3.26Å; V297-L299 PolarHBondContact O-N 3.27Å; V297-L300 WeakPolarHBondContact O-CB 3.22Å; V297-L300 PolarHBondContact O-N 2.89Å; V297-L300 VanDerWaalsContact O-N 3.11Å; V297-T301 PolarHBondContact O-N 2.81Å
298	S	91.1	Very high	89.8	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.007	32%	0.321	C	S	.	.	H	α-helix	trans	-71.3	-19.5	175.7	86.4	0	0	0	0	113.4	W40 V44 A294 V295 I296 L300 T301	W40-S298 PolarHBondContact NE1-OG 2.85Å; V44-S298 WeakPolarHBondContact CG1-O 3.38Å; A294-S298 WeakPolarHBondContact O-CB 3.31Å; A294-S298 PolarHBondContact O-N 2.73Å; V295-S298 PolarHBondContact O-N 3.15Å; V295-S298 PolarHBondContact O-OG 2.78Å; V295-S298 VanDerWaalsContact O-OG 3.1Å; I296-S298 VanDerWaalsContact C-N 3.28Å; I296-S298 PolarHBondContact O-N 3.3Å; S298-L300 VanDerWaalsContact C-N 3.33Å; S298-T301 WeakPolarHBondContact CA-OG1 3.36Å; S298-T301 PolarHBondContact O-OG1 3.44Å
299	L	88	Confident	89.3	Confident	75 Å²	75	58.5 Å²	58.5	39%	0.393	32%	0.315	S	S	.	.	H	α-helix	trans	-69.5	-35.4	169	-75.6	164.7	0	0	0	111.2	W40 V295 I296 V297 T301 L302	W40-L299 HydrophobicContact CH2-CD2 3.53Å; W40-L299 HydrophobicContact CH2-CG 4.33Å; W40-L299 HydrophobicContact CZ2-CD1 4.47Å; W40-L299 HydrophobicContact CZ2-CD2 3.26Å; W40-L299 HydrophobicContact CZ2-CG 3.62Å; V295-L299 PolarHBondContact O-N 3.36Å; I296-L299 WeakPolarHBondContact O-CB 3.37Å; I296-L299 PolarHBondContact O-N 2.75Å; I296-L299 VanDerWaalsContact O-N 3.11Å; V297-L299 VanDerWaalsContact C-N 3.26Å; V297-L299 PolarHBondContact O-N 3.27Å; L299-T301 PolarHBondContact O-N 2.78Å; L299-L302 HydrophobicContact CD2-CD1 4.28Å; L299-L302 WeakPolarHBondContact O-CB 3.46Å; L299-L302 PolarHBondContact O-N 3.01Å; L299-L302 VanDerWaalsContact O-N 3.14Å
300	L	83.5	Confident	88.6	Confident	110 Å²	110	56.6 Å²	56.6	58%	0.576	31%	0.306	S	S	*	.	H	α-helix	trans	-67.8	-22.8	178.5	-58.6	175.7	0	0	0	112.3	I296 V297 S298 L302	I296-L300 PolarHBondContact O-N 2.69Å; V297-L300 WeakPolarHBondContact O-CB 3.22Å; V297-L300 PolarHBondContact O-N 2.89Å; V297-L300 VanDerWaalsContact O-N 3.11Å; S298-L300 VanDerWaalsContact C-N 3.33Å; L300-L302 VanDerWaalsContact C-N 3.3Å
301	T	73.1	Confident	87.9	Confident	87 Å²	87	61 Å²	61	53%	0.534	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-7.3	175.1	56.1	0	0	0	0	113.7	V297 S298 L299	V297-T301 PolarHBondContact O-N 2.81Å; S298-T301 WeakPolarHBondContact CA-OG1 3.36Å; S298-T301 PolarHBondContact O-OG1 3.44Å; L299-T301 PolarHBondContact O-N 2.78Å
302	L	68.8	Low	87	Confident	101 Å²	101	65.9 Å²	65.9	53%	0.529	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.1	175.8	-69.6	171.7	0	0	0	113.5	V44 L299 L300	V44-L302 HydrophobicContact CG1-CD1 4.35Å; V44-L302 HydrophobicContact CG1-CD2 3.98Å; V44-L302 HydrophobicContact CG1-CG 4.01Å; V44-L302 HydrophobicContact CG2-CD1 4.03Å; L299-L302 HydrophobicContact CD2-CD1 4.28Å; L299-L302 WeakPolarHBondContact O-CB 3.46Å; L299-L302 PolarHBondContact O-N 3.01Å; L299-L302 VanDerWaalsContact O-N 3.14Å; L300-L302 VanDerWaalsContact C-N 3.3Å
303	I	63.3	Low	86.1	Confident	197 Å²	197	65.9 Å²	65.9	100%	1.01	35%	0.352	S	S	*	.			trans	-97.8	0	179.8	-56.1	173.7	0	0	0	108.7

Retrieved 303 of 303 residues in 60.7 ms (Link to these results)

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