A0A087XRP8_POEFO Loading...

Alpha-1,3-glucosyltransferase

Dolichyl pyrophosphate Man9GlcNAc2 alpha-1,3-glucosyltransferase that operates in the biosynthetic pathway of dolichol-linked oligosaccharides, the glycan precursors employed in protein asparagine (N)-glycosylation. The assembly of dolichol-linked oligosaccharides begins on the cytosolic side of the endoplasmic reticulum membrane and finishes in its lumen. The sequential addition of sugars to dolichol pyrophosphate produces dolichol-linked oligosaccharides containing fourteen sugars, including two GlcNAcs, nine mannoses and three glucoses. Once assembled, the oligosaccharide is transferred from the lipid to nascent proteins by oligosaccharyltransferases. In the lumen of the endoplasmic reticulum, adds the first glucose residue from dolichyl phosphate glucose (Dol-P-Glc) onto the lipid-linked oligosaccharide intermediate Man(9)GlcNAc(2)-PP-Dol to produce Glc(1)Man(9)GlcNAc(2)-PP-Dol. Glc(1)Man(9)GlcNAc(2)-PP-Dol is a substrate for ALG8, the following enzyme in the biosynthetic pathway.

AlphaFold DB , UniProt , Accession A0A087XRP8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 505 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	61.8	Low	89.4	Confident	209 Å²	209	81.9 Å²	81.9	100%	1.03	42%	0.423	S	S	*	.				0	-51.5	0	-71.3	173.7	174	0	0	112.3	T3 W4 S5	M1-T3 PolarHBondContact O-N 3.46Å; M1-W4 PolarHBondContact O-N 3.47Å; M1-S5 PolarHBondContact O-N 3.35Å; M1-S5 VanDerWaalsContact O-N 3.17Å
2	Q	75.5	Confident	90.1	Very high	153 Å²	153	85.3 Å²	85.3	72%	0.715	44%	0.441	S	S	*	.	H	α-helix	trans	-56.7	-42.8	-177.6	-164.5	176.1	12.7	0	0	114.9	W4 S5 L6	Q2-W4 PolarHBondContact O-N 3.17Å; Q2-S5 WeakPolarHBondContact O-CB 3.32Å; Q2-S5 PolarHBondContact O-N 3.26Å; Q2-L6 WeakPolarHBondContact O-CG 3.24Å; Q2-L6 PolarHBondContact O-N 2.92Å; Q2-L6 VanDerWaalsContact O-N 3.1Å
3	T	85.1	Confident	90.7	Very high	48 Å²	48	84.2 Å²	84.2	29%	0.294	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-43.8	178.7	-47.4	0	0	0	0	112.8	M1 S5 L6 V7 A140 V144	M1-T3 PolarHBondContact O-N 3.46Å; T3-S5 VanDerWaalsContact C-N 3.32Å; T3-S5 PolarHBondContact O-N 3.49Å; T3-L6 PolarHBondContact O-N 2.99Å; T3-V7 WeakPolarHBondContact O-CG2 3.49Å; T3-V7 PolarHBondContact O-N 2.9Å; T3-A140 HydrophobicContact CG2-CB 3.92Å; T3-V144 HydrophobicContact CG2-CG2 4.27Å
4	W	90.8	Very high	91.2	Very high	150 Å²	150	78.2 Å²	78.2	57%	0.568	41%	0.405	S	S	*	.	H	α-helix	trans	-67.6	-33.6	179.5	-72.8	113	0	0	0	112.3	M1 Q2 V7 S8 L133	M1-W4 PolarHBondContact O-N 3.47Å; Q2-W4 PolarHBondContact O-N 3.17Å; W4-V7 PolarHBondContact O-N 3.1Å; W4-S8 WeakPolarHBondContact O-CB 3.46Å; W4-S8 PolarHBondContact O-N 3.19Å; W4-S8 PolarHBondContact O-OG 3.32Å; W4-L133 HydrophobicContact CH2-CD1 3.6Å; W4-L133 HydrophobicContact CZ2-CD1 4.29Å; W4-L133 HydrophobicContact CZ3-CD1 3.76Å
5	S	92.8	Very high	91.6	Very high	68 Å²	68	75.5 Å²	75.5	48%	0.476	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-45.3	171.3	-169.4	0	0	0	0	111.3	M1 Q2 T3 S8 I9	M1-S5 PolarHBondContact O-N 3.35Å; M1-S5 VanDerWaalsContact O-N 3.17Å; Q2-S5 WeakPolarHBondContact O-CB 3.32Å; Q2-S5 PolarHBondContact O-N 3.26Å; T3-S5 VanDerWaalsContact C-N 3.32Å; T3-S5 PolarHBondContact O-N 3.49Å; S5-S8 PolarHBondContact O-N 3.34Å; S5-I9 VanDerWaalsContact O-CG1 3.3Å; S5-I9 WeakPolarHBondContact O-CG1 3.48Å; S5-I9 PolarHBondContact O-N 3.47Å
6	L	94	Very high	92.1	Very high	65 Å²	65	78.3 Å²	78.3	34%	0.34	41%	0.408	S	S	.	.	H	α-helix	trans	-64.8	-42.8	177.8	-68.9	173.5	0	0	0	111.9	Q2 T3 S8 I9 S10 V144	Q2-L6 WeakPolarHBondContact O-CG 3.24Å; Q2-L6 PolarHBondContact O-N 2.92Å; Q2-L6 VanDerWaalsContact O-N 3.1Å; T3-L6 PolarHBondContact O-N 2.99Å; L6-S8 VanDerWaalsContact C-N 3.32Å; L6-S8 PolarHBondContact O-N 3.47Å; L6-I9 PolarHBondContact O-N 3.32Å; L6-S10 PolarHBondContact O-N 3.21Å; L6-S10 PolarHBondContact O-OG 3.32Å; L6-S10 VanDerWaalsContact O-OG 3.11Å; L6-V144 HydrophobicContact CB-CG1 4.03Å; L6-V144 HydrophobicContact CB-CG2 4.16Å
7	V	96.3	Very high	92.4	Very high	5 Å²	5	76.2 Å²	76.2	3%	0.03	40%	0.4	C	S	.	.	H	α-helix	trans	-58	-46.1	173.8	171.6	0	0	0	0	111	T3 W4 I9 S10 V11 V129 L133 V144 L147	T3-V7 WeakPolarHBondContact O-CG2 3.49Å; T3-V7 PolarHBondContact O-N 2.9Å; W4-V7 PolarHBondContact O-N 3.1Å; V7-I9 PolarHBondContact O-N 2.93Å; V7-S10 WeakPolarHBondContact O-CB 3.27Å; V7-S10 PolarHBondContact O-N 3.02Å; V7-V11 HydrophobicContact CG1-CG2 4.43Å; V7-V11 WeakPolarHBondContact O-CG2 3.45Å; V7-V11 PolarHBondContact O-N 2.88Å; V7-V129 HydrophobicContact CG1-CG1 3.93Å; V7-V129 HydrophobicContact CG1-CG2 4.4Å; V7-L133 HydrophobicContact CG2-CD2 4.19Å; V7-V144 HydrophobicContact CG2-CG2 3.88Å; V7-L147 HydrophobicContact CG1-CD1 4.09Å; V7-L147 HydrophobicContact CG2-CD1 4.18Å
8	S	96.2	Very high	92.7	Very high	64 Å²	64	72.1 Å²	72.1	45%	0.448	38%	0.378	S	S	.	.	H	α-helix	trans	-62.4	-43.7	-179.6	-55.7	0	0	0	0	111.4	W4 S5 L6 S10 V11 L12	W4-S8 WeakPolarHBondContact O-CB 3.46Å; W4-S8 PolarHBondContact O-N 3.19Å; W4-S8 PolarHBondContact O-OG 3.32Å; S5-S8 PolarHBondContact O-N 3.34Å; L6-S8 VanDerWaalsContact C-N 3.32Å; L6-S8 PolarHBondContact O-N 3.47Å; S8-S10 VanDerWaalsContact C-N 3.34Å; S8-S10 PolarHBondContact O-N 3.01Å; S8-V11 PolarHBondContact O-N 2.74Å; S8-L12 WeakPolarHBondContact O-CB 3.29Å; S8-L12 VanDerWaalsContact O-CG 3.29Å; S8-L12 WeakPolarHBondContact O-CG 3.4Å; S8-L12 PolarHBondContact O-N 2.91Å
9	I	96.4	Very high	93	Very high	98 Å²	98	72.5 Å²	72.5	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-61.2	-43.8	174.9	-67.4	164.3	0	0	0	110.8	S5 L6 V7 V11 L12 L13	S5-I9 VanDerWaalsContact O-CG1 3.3Å; S5-I9 WeakPolarHBondContact O-CG1 3.48Å; S5-I9 PolarHBondContact O-N 3.47Å; L6-I9 PolarHBondContact O-N 3.32Å; V7-I9 PolarHBondContact O-N 2.93Å; I9-V11 PolarHBondContact O-N 2.91Å; I9-L12 PolarHBondContact O-N 3.16Å; I9-L13 WeakPolarHBondContact O-CB 3.39Å; I9-L13 PolarHBondContact O-N 3.23Å
10	S	96.6	Very high	93.3	Very high	7 Å²	7	70.7 Å²	70.7	5%	0.049	37%	0.374	C	S	.	.	H	α-helix	trans	-61.6	-42.5	177.2	-64.4	0	0	0	0	112.6	L6 V7 S8 A14 V144	L6-S10 PolarHBondContact O-N 3.21Å; L6-S10 PolarHBondContact O-OG 3.32Å; L6-S10 VanDerWaalsContact O-OG 3.11Å; V7-S10 WeakPolarHBondContact O-CB 3.27Å; V7-S10 PolarHBondContact O-N 3.02Å; S8-S10 VanDerWaalsContact C-N 3.34Å; S8-S10 PolarHBondContact O-N 3.01Å; S10-A14 VanDerWaalsContact O-CB 3.26Å; S10-A14 WeakPolarHBondContact O-CB 3.4Å; S10-A14 PolarHBondContact O-N 3.45Å; S10-V144 WeakPolarHBondContact OG-CG1 3.48Å
11	V	98	Very high	93.5	Very high	34 Å²	34	67.6 Å²	67.6	21%	0.206	36%	0.358	C	S	.	.	H	α-helix	trans	-65.6	-45.4	176.6	171.1	0	0	0	0	111	V7 S8 I9 L13 A14 V15 I125 V129 L151	V7-V11 HydrophobicContact CG1-CG2 4.43Å; V7-V11 WeakPolarHBondContact O-CG2 3.45Å; V7-V11 PolarHBondContact O-N 2.88Å; S8-V11 PolarHBondContact O-N 2.74Å; I9-V11 PolarHBondContact O-N 2.91Å; V11-L13 PolarHBondContact O-N 3.2Å; V11-A14 WeakPolarHBondContact O-CB 3.48Å; V11-A14 PolarHBondContact O-N 3.47Å; V11-V15 HydrophobicContact CG1-CG2 4.49Å; V11-V15 WeakPolarHBondContact O-CG2 3.3Å; V11-V15 PolarHBondContact O-N 2.77Å; V11-I125 HydrophobicContact CG1-CG2 3.96Å; V11-I125 HydrophobicContact CG2-CG2 4.11Å; V11-V129 HydrophobicContact CG2-CG2 3.85Å; V11-L151 HydrophobicContact CG2-CD1 4.04Å
12	L	97.9	Very high	95.2	Very high	122 Å²	122	57.9 Å²	57.9	64%	0.639	31%	0.31	S	S	*	.	H	α-helix	trans	-61.5	-43.6	177.9	-72.2	171.5	0	0	0	111.8	S8 I9 A14 V15 L16	S8-L12 WeakPolarHBondContact O-CB 3.29Å; S8-L12 VanDerWaalsContact O-CG 3.29Å; S8-L12 WeakPolarHBondContact O-CG 3.4Å; S8-L12 PolarHBondContact O-N 2.91Å; I9-L12 PolarHBondContact O-N 3.16Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.11Å; L12-V15 PolarHBondContact O-N 3.03Å; L12-L16 WeakPolarHBondContact O-CB 3.32Å; L12-L16 PolarHBondContact O-N 2.94Å
13	L	97.3	Very high	96.2	Very high	72 Å²	72	56.2 Å²	56.2	38%	0.377	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-43.1	175	179.3	59.9	0	0	0	111.4	I9 V11 V15 L16 V17 L148 L152	I9-L13 WeakPolarHBondContact O-CB 3.39Å; I9-L13 PolarHBondContact O-N 3.23Å; V11-L13 PolarHBondContact O-N 3.2Å; L13-V15 PolarHBondContact O-N 2.86Å; L13-L16 PolarHBondContact O-N 3Å; L13-V17 HydrophobicContact CD1-CG2 4.35Å; L13-V17 WeakPolarHBondContact O-CG2 3.25Å; L13-V17 PolarHBondContact O-N 3.21Å; L13-L148 HydrophobicContact CD2-CD1 4.14Å; L13-L152 HydrophobicContact CD2-CD1 4.42Å
14	A	97.7	Very high	96.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-40.2	178.1	0	0	0	0	0	113	S10 V11 L12 R18 L151 L152	S10-A14 VanDerWaalsContact O-CB 3.26Å; S10-A14 WeakPolarHBondContact O-CB 3.4Å; S10-A14 PolarHBondContact O-N 3.45Å; V11-A14 WeakPolarHBondContact O-CB 3.48Å; V11-A14 PolarHBondContact O-N 3.47Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.11Å; A14-R18 WeakPolarHBondContact O-CD 3.41Å; A14-R18 VanDerWaalsContact O-CG 3.25Å; A14-R18 WeakPolarHBondContact O-CG 3.44Å; A14-R18 PolarHBondContact O-N 3.48Å; A14-R18 VanDerWaalsContact O-N 3.16Å; A14-R18 PolarHBondContact O-NH1 2.9Å; A14-L151 HydrophobicContact CB-CB 3.64Å; A14-L151 HydrophobicContact CB-CD1 3.89Å; A14-L151 HydrophobicContact CB-CG 4.34Å; A14-L152 HydrophobicContact CB-CD2 4.46Å
15	V	98.3	Very high	97	Very high	37 Å²	37	51 Å²	51	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-42.4	173.6	170.2	0	0	0	0	110.8	V11 L12 L13 V17 R18 W19 L117 I125	V11-V15 HydrophobicContact CG1-CG2 4.49Å; V11-V15 WeakPolarHBondContact O-CG2 3.3Å; V11-V15 PolarHBondContact O-N 2.77Å; L12-V15 PolarHBondContact O-N 3.03Å; L13-V15 PolarHBondContact O-N 2.86Å; V15-V17 PolarHBondContact O-N 3.16Å; V15-R18 WeakPolarHBondContact O-CB 3.42Å; V15-R18 PolarHBondContact O-N 3.42Å; V15-W19 WeakPolarHBondContact O-CB 3.26Å; V15-W19 PolarHBondContact O-N 3.43Å; V15-L117 HydrophobicContact CG1-CD1 4.05Å; V15-L117 HydrophobicContact CG2-CD1 4.45Å; V15-I125 HydrophobicContact CG2-CD1 4.06Å
16	L	98.1	Very high	97.2	Very high	120 Å²	120	48.8 Å²	48.8	63%	0.628	27%	0.272	S	S	*	.	H	α-helix	trans	-60.2	-45.4	177.9	-177.9	66.8	0	0	0	111.7	L12 L13 W19 G20	L12-L16 WeakPolarHBondContact O-CB 3.32Å; L12-L16 PolarHBondContact O-N 2.94Å; L13-L16 PolarHBondContact O-N 3Å; L16-W19 PolarHBondContact O-N 3.06Å; L16-G20 PolarHBondContact O-N 3.2Å
17	V	98	Very high	97.4	Very high	44 Å²	44	46.2 Å²	46.2	27%	0.267	26%	0.259	S	S	.	.	H	α-helix	trans	-63.8	-44.8	178	172.4	0	0	0	0	111.1	L13 V15 W19 G20 V21 L152 I157 T393	L13-V17 HydrophobicContact CD1-CG2 4.35Å; L13-V17 WeakPolarHBondContact O-CG2 3.25Å; L13-V17 PolarHBondContact O-N 3.21Å; V15-V17 PolarHBondContact O-N 3.16Å; V17-W19 VanDerWaalsContact C-N 3.34Å; V17-W19 PolarHBondContact O-N 3.29Å; V17-G20 PolarHBondContact O-N 3.07Å; V17-V21 WeakPolarHBondContact O-CG2 3.42Å; V17-V21 PolarHBondContact O-N 3.42Å; V17-L152 HydrophobicContact CB-CD2 4.03Å; V17-L152 HydrophobicContact CG1-CD2 4.29Å; V17-L152 HydrophobicContact CG2-CD2 3.85Å; V17-I157 HydrophobicContact CG1-CD1 4.11Å; V17-T393 HydrophobicContact CG1-CG2 4.44Å
18	R	98.3	Very high	97.4	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-57.3	-46.9	175.1	-76.2	163.2	171.2	65.9	4.2	112.2	A14 V15 V21 S22 D120 L151 I157 Y161	A14-R18 WeakPolarHBondContact O-CD 3.41Å; A14-R18 VanDerWaalsContact O-CG 3.25Å; A14-R18 WeakPolarHBondContact O-CG 3.44Å; A14-R18 PolarHBondContact O-N 3.48Å; A14-R18 VanDerWaalsContact O-N 3.16Å; A14-R18 PolarHBondContact O-NH1 2.9Å; V15-R18 WeakPolarHBondContact O-CB 3.42Å; V15-R18 PolarHBondContact O-N 3.42Å; R18-V21 PolarHBondContact O-N 3Å; R18-S22 PolarHBondContact O-N 3.44Å; R18-D120 VanDerWaalsContact CD-OD2 3.3Å; R18-D120 WeakPolarHBondContact CD-OD2 3.48Å; R18-D120 IonicContact CZ-OD2 2.74Å; R18-D120 IonicContact NE-OD2 3.94Å; R18-D120 PolarHBondContact NE-OD2 3.28Å; R18-D120 IonicContact NH2-OD2 2.93Å; R18-L151 VanDerWaalsContact CZ-O 3.23Å; R18-L151 PolarHBondContact NH1-O 2.96Å; R18-L151 PolarHBondContact NH2-O 2.93Å; R18-I157 HydrophobicContact CG-CD1 4.35Å; R18-I157 HydrophobicContact CG-CG1 4.04Å; R18-I157 HydrophobicContact CG-CG2 4.12Å; R18-Y161 HydrophobicContact CB-CD1 3.8Å; R18-Y161 HydrophobicContact CB-CD2 3.92Å; R18-Y161 HydrophobicContact CB-CE1 3.71Å; R18-Y161 HydrophobicContact CB-CE2 3.84Å; R18-Y161 HydrophobicContact CB-CG 3.89Å; R18-Y161 WeakPolarHBondContact CD-OH 3.43Å; R18-Y161 HydrophobicContact CG-CD1 4.47Å; R18-Y161 HydrophobicContact CG-CD2 3.71Å; R18-Y161 HydrophobicContact CG-CE1 4.25Å; R18-Y161 HydrophobicContact CG-CE2 3.45Å; R18-Y161 VanDerWaalsContact CG-CE2 3.45Å; R18-Y161 HydrophobicContact CG-CG 4.21Å
19	W	98.1	Very high	97.4	Very high	80 Å²	80	44.5 Å²	44.5	30%	0.303	25%	0.25	S	S	.	.	H	α-helix	trans	-66.5	-38	178.2	-160.8	-106.9	0	0	0	112	V15 L16 V17 V21 S22 L23 L110 R113 L117	V15-W19 WeakPolarHBondContact O-CB 3.26Å; V15-W19 PolarHBondContact O-N 3.43Å; L16-W19 PolarHBondContact O-N 3.06Å; V17-W19 VanDerWaalsContact C-N 3.34Å; V17-W19 PolarHBondContact O-N 3.29Å; W19-V21 VanDerWaalsContact C-N 3.31Å; W19-V21 PolarHBondContact O-N 2.98Å; W19-S22 PolarHBondContact O-N 3.5Å; W19-S22 VanDerWaalsContact O-N 3.12Å; W19-S22 PolarHBondContact O-OG 2.96Å; W19-L23 PolarHBondContact O-N 3.13Å; W19-L110 HydrophobicContact CH2-CD1 3.74Å; W19-L110 HydrophobicContact CZ2-CD1 3.63Å; W19-R113 HydrophobicContact CZ3-CB 4.36Å; W19-L117 HydrophobicContact CE3-CD2 3.81Å; W19-L117 HydrophobicContact CZ3-CB 4.44Å; W19-L117 HydrophobicContact CZ3-CD2 3.91Å
20	G	98.1	Very high	97.3	Very high	36 Å²	36	42.4 Å²	42.4	37%	0.371	25%	0.252	S	S	.	.	H	α-helix	trans	-59.6	-39.8	173.4	0	0	0	0	0	112.9	L16 V17 N24	L16-G20 PolarHBondContact O-N 3.2Å; V17-G20 PolarHBondContact O-N 3.07Å; G20-N24 PolarHBondContact O-ND2 2.94Å
21	V	98.3	Very high	97.2	Very high	6 Å²	6	46.8 Å²	46.8	4%	0.036	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-39.1	174	175.3	0	0	0	0	111.3	V17 R18 W19 L23 N24 I157 L158 P389	V17-V21 WeakPolarHBondContact O-CG2 3.42Å; V17-V21 PolarHBondContact O-N 3.42Å; R18-V21 PolarHBondContact O-N 3Å; W19-V21 VanDerWaalsContact C-N 3.31Å; W19-V21 PolarHBondContact O-N 2.98Å; V21-L23 PolarHBondContact O-N 3.45Å; V21-L23 VanDerWaalsContact O-N 3.12Å; V21-N24 WeakPolarHBondContact O-CB 3.45Å; V21-N24 PolarHBondContact O-N 2.92Å; V21-N24 PolarHBondContact O-ND2 3.4Å; V21-I157 HydrophobicContact CB-CG2 4.12Å; V21-I157 HydrophobicContact CG1-CG2 4.45Å; V21-I157 HydrophobicContact CG2-CG2 3.78Å; V21-L158 HydrophobicContact CG1-CD2 4.12Å; V21-L158 HydrophobicContact CG2-CD2 4.44Å; V21-P389 HydrophobicContact CB-CB 4.41Å; V21-P389 HydrophobicContact CG1-CB 4.14Å; V21-P389 HydrophobicContact CG2-CB 3.9Å
22	S	97.1	Very high	96.9	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.028	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-21.2	-176	87.9	0	0	0	0	115.2	R18 W19 N24 R113 Y161	R18-S22 PolarHBondContact O-N 3.44Å; W19-S22 PolarHBondContact O-N 3.5Å; W19-S22 VanDerWaalsContact O-N 3.12Å; W19-S22 PolarHBondContact O-OG 2.96Å; S22-N24 PolarHBondContact O-N 3.35Å; S22-R113 PolarHBondContact O-NE 2.96Å; S22-R113 VanDerWaalsContact O-NE 3.08Å; S22-Y161 VanDerWaalsContact CA-O 3.24Å; S22-Y161 WeakPolarHBondContact CA-O 3.46Å
23	L	96.6	Very high	96.5	Very high	118 Å²	118	48.9 Å²	48.9	62%	0.618	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.6	175.3	-58.3	179	0	0	0	112.9	W19 V21 K109	W19-L23 PolarHBondContact O-N 3.13Å; V21-L23 PolarHBondContact O-N 3.45Å; V21-L23 VanDerWaalsContact O-N 3.12Å; L23-K109 PolarHBondContact O-NZ 3.5Å
24	N	96.8	Very high	96.2	Very high	46 Å²	46	49.2 Å²	49.2	25%	0.246	29%	0.292	C	S	.	.	S	Bend	trans	-79.3	177	-177.2	-60.7	-86.8	0	0	0	112.2	G20 V21 S22 K109 R113 L386 P389	G20-N24 PolarHBondContact O-ND2 2.94Å; V21-N24 WeakPolarHBondContact O-CB 3.45Å; V21-N24 PolarHBondContact O-N 2.92Å; V21-N24 PolarHBondContact O-ND2 3.4Å; S22-N24 PolarHBondContact O-N 3.35Å; N24-K109 WeakPolarHBondContact O-CE 3.4Å; N24-K109 PolarHBondContact O-NZ 3.07Å; N24-R113 PolarHBondContact O-NH2 3.5Å; N24-L386 HydrophobicContact CB-CD2 3.72Å; N24-P389 HydrophobicContact CB-CG 4.2Å
25	S	96.9	Very high	96	Very high	44 Å²	44	51.1 Å²	51.1	31%	0.308	30%	0.301	S	S	.	.			trans	-56.2	170	176	-176.9	0	0	0	0	112.8	R113 D384 L386	S25-R113 PolarHBondContact O-NH2 3.23Å; S25-D384 WeakPolarHBondContact CB-O 3.46Å; S25-D384 PolarHBondContact OG-O 2.92Å; S25-L386 WeakPolarHBondContact O-CD2 3.42Å
26	Y	97.2	Very high	95.9	Very high	21 Å²	21	49.6 Å²	49.6	8%	0.082	29%	0.293	C	S	.	.			trans	-132.3	171	178.9	49.3	-99.2	0	0	0	111.1	G28 A29 Y38 E104 K109 G162	Y26-G28 PolarHBondContact O-N 3.38Å; Y26-G28 VanDerWaalsContact O-N 3.16Å; Y26-A29 HydrophobicContact CD1-CB 4.49Å; Y26-A29 HydrophobicContact CD2-CB 3.74Å; Y26-A29 HydrophobicContact CE1-CB 4.26Å; Y26-A29 VanDerWaalsContact CE2-CA 3.47Å; Y26-A29 HydrophobicContact CE2-CB 3.47Å; Y26-A29 VanDerWaalsContact CE2-CB 3.47Å; Y26-A29 HydrophobicContact CG-CB 4.24Å; Y26-A29 PolarHBondContact O-N 2.9Å; Y26-Y38 HydrophobicContact CD1-CD2 4.25Å; Y26-Y38 HydrophobicContact CD1-CE2 4.42Å; Y26-Y38 HydrophobicContact CD2-CD1 4.01Å; Y26-Y38 AromaticContact CD2-CD2 3.93Å; Y26-Y38 HydrophobicContact CD2-CD2 3.93Å; Y26-Y38 AromaticContact CD2-CG 3.55Å; Y26-Y38 HydrophobicContact CD2-CG 3.55Å; Y26-Y38 AromaticContact CE2-CD1 3.83Å; Y26-Y38 HydrophobicContact CE2-CD1 3.83Å; Y26-Y38 HydrophobicContact CE2-CD2 4.41Å; Y26-Y38 HydrophobicContact CE2-CE1 4.33Å; Y26-Y38 AromaticContact CE2-CG 3.87Å; Y26-Y38 HydrophobicContact CE2-CG 3.87Å; Y26-Y38 AromaticContact CG-CD2 3.85Å; Y26-Y38 HydrophobicContact CG-CD2 3.85Å; Y26-Y38 HydrophobicContact CG-CE2 4.47Å; Y26-Y38 AromaticContact CG-CG 3.98Å; Y26-Y38 HydrophobicContact CG-CG 3.98Å; Y26-E104 PolarHBondContact OH-OE1 3.08Å; Y26-K109 HydrophobicContact CD1-CD 4.15Å; Y26-K109 HydrophobicContact CD1-CG 4.16Å; Y26-K109 HydrophobicContact CE1-CB 4.49Å; Y26-K109 HydrophobicContact CE1-CD 3.96Å; Y26-K109 HydrophobicContact CE1-CG 4.03Å; Y26-G162 WeakPolarHBondContact CA-O 3.04Å
27	S	97.1	Very high	95.8	Very high	11 Å²	11	45.2 Å²	45.2	8%	0.077	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	119.2	179.9	-165.1	0	0	0	0	112.1	H163 D384	S27-H163 VanDerWaalsContact CB-CE1 3.45Å; S27-H163 WeakPolarHBondContact CB-CE1 3.3Å; S27-H163 WeakPolarHBondContact CB-ND1 3.47Å; S27-H163 WeakPolarHBondContact CB-O 3.11Å; S27-H163 PolarHBondContact N-O 3.14Å; S27-H163 VanDerWaalsContact N-O 3.09Å; S27-H163 PolarHBondContact OG-CE1 3.33Å; S27-H163 PolarHBondContact OG-ND1 3.39Å; S27-D384 WeakPolarHBondContact CA-OD1 3.36Å; S27-D384 PolarHBondContact OG-OD1 3.46Å
28	G	96.1	Very high	95.7	Very high	5 Å²	5	43.3 Å²	43.3	5%	0.052	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	8.6	176.8	0	0	0	0	0	116.1	Y26 G30 K31 F35	Y26-G28 PolarHBondContact O-N 3.38Å; Y26-G28 VanDerWaalsContact O-N 3.16Å; G28-G30 PolarHBondContact O-N 3.2Å; G28-K31 WeakPolarHBondContact O-CB 3.47Å; G28-K31 PolarHBondContact O-N 3.46Å; G28-K31 VanDerWaalsContact O-N 3.11Å; G28-F35 WeakPolarHBondContact O-CD1 3.26Å
29	A	96.4	Very high	95.7	Very high	28 Å²	28	43.4 Å²	43.4	23%	0.231	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	125.4	178.9	0	0	0	0	0	112.1	Y26 K31 E104	Y26-A29 HydrophobicContact CD1-CB 4.49Å; Y26-A29 HydrophobicContact CD2-CB 3.74Å; Y26-A29 HydrophobicContact CE1-CB 4.26Å; Y26-A29 VanDerWaalsContact CE2-CA 3.47Å; Y26-A29 HydrophobicContact CE2-CB 3.47Å; Y26-A29 VanDerWaalsContact CE2-CB 3.47Å; Y26-A29 HydrophobicContact CG-CB 4.24Å; Y26-A29 PolarHBondContact O-N 2.9Å; A29-K31 VanDerWaalsContact C-N 3.28Å; A29-K31 PolarHBondContact O-N 3.48Å; A29-E104 WeakPolarHBondContact CA-OE1 3.37Å
30	G	95.1	Very high	95.7	Very high	53 Å²	53	39.8 Å²	39.8	55%	0.546	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	26.5	-179.8	0	0	0	0	0	115.2	G28 P32 E104	G28-G30 PolarHBondContact O-N 3.2Å; G30-P32 VanDerWaalsContact C-CD 3.45Å; G30-P32 WeakPolarHBondContact O-CD 3.37Å; G30-E104 PolarHBondContact N-OE1 2.93Å; G30-E104 PolarHBondContact N-OE2 3.04Å
31	K	94.1	Very high	95.7	Very high	100 Å²	100	38.3 Å²	38.3	44%	0.435	23%	0.229	S	C	.	.			trans	-120	68.4	-177.5	-65.1	178.2	-175	176.4	0	112.9	G28 A29 F35 K383	G28-K31 WeakPolarHBondContact O-CB 3.47Å; G28-K31 PolarHBondContact O-N 3.46Å; G28-K31 VanDerWaalsContact O-N 3.11Å; A29-K31 VanDerWaalsContact C-N 3.28Å; A29-K31 PolarHBondContact O-N 3.48Å; K31-F35 VanDerWaalsContact O-CA 3.23Å; K31-F35 WeakPolarHBondContact O-CA 3.36Å; K31-F35 PolarHBondContact O-N 2.65Å; K31-K383 PolarHBondContact NZ-O 3.41Å
32	P	91.9	Very high	95.7	Very high	95 Å²	95	38 Å²	38	62%	0.617	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	160.2	173.3	30	-36.1	0	0	0	111.8	G30 F35	G30-P32 VanDerWaalsContact C-CD 3.45Å; G30-P32 WeakPolarHBondContact O-CD 3.37Å; P32-F35 HydrophobicContact CB-CE2 4.23Å; P32-F35 HydrophobicContact CB-CZ 4.01Å
33	P	89.2	Confident	95.7	Very high	104 Å²	104	37.9 Å²	37.9	68%	0.675	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	cis	-87.6	-19	0.8	33.2	-34	0	0	0	114	F35	P33-F35 WeakPolarHBondContact O-CD2 3.4Å
34	M	90.3	Very high	95.8	Very high	79 Å²	79	32.8 Å²	32.8	39%	0.389	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-19.8	-172.4	-71.3	-64	-67.4	0	0	114.1	G36 N66 Y67 W68	M34-G36 PolarHBondContact O-N 2.96Å; M34-N66 WeakPolarHBondContact CE-O 3.49Å; M34-Y67 HydrophobicContact CE-CD2 4.35Å; M34-Y67 HydrophobicContact SD-CD2 3.61Å; M34-Y67 HydrophobicContact SD-CE2 3.97Å; M34-W68 PolarHBondContact O-NE1 3.21Å
35	F	94.6	Very high	95.9	Very high	40 Å²	40	30.6 Å²	30.6	18%	0.175	19%	0.187	C	C	.	.			trans	55	-134.4	-176	-55.6	-95.3	0	0	0	111.9	G28 K31 P32 P33 E39 E104	G28-F35 WeakPolarHBondContact O-CD1 3.26Å; K31-F35 VanDerWaalsContact O-CA 3.23Å; K31-F35 WeakPolarHBondContact O-CA 3.36Å; K31-F35 PolarHBondContact O-N 2.65Å; P32-F35 HydrophobicContact CB-CE2 4.23Å; P32-F35 HydrophobicContact CB-CZ 4.01Å; P33-F35 WeakPolarHBondContact O-CD2 3.4Å; F35-E39 HydrophobicContact CB-CB 3.6Å; F35-E39 HydrophobicContact CB-CG 4.08Å; F35-E39 HydrophobicContact CD2-CG 4.19Å; F35-E39 HydrophobicContact CG-CB 4.28Å; F35-E39 HydrophobicContact CG-CG 4.38Å; F35-E104 HydrophobicContact CE1-CG 4.29Å
36	G	95.1	Very high	96	Very high	5 Å²	5	28.5 Å²	28.5	5%	0.052	17%	0.173	C	C	.	.			trans	-154	-161.2	-173.9	0	0	0	0	0	112	M34 Y38 E39 A40	M34-G36 PolarHBondContact O-N 2.96Å; G36-Y38 PolarHBondContact O-N 2.9Å; G36-Y38 VanDerWaalsContact O-N 3.09Å; G36-E39 WeakPolarHBondContact O-CB 3.5Å; G36-E39 PolarHBondContact O-N 2.86Å; G36-A40 PolarHBondContact O-N 2.96Å
37	D	95.8	Very high	96	Very high	29 Å²	29	27.7 Å²	27.7	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-26.5	-172	-74.8	2.1	0	0	0	113.4	A40 Q41 H163 Q165 K346	D37-A40 WeakPolarHBondContact O-CB 3.3Å; D37-A40 PolarHBondContact O-N 2.89Å; D37-Q41 WeakPolarHBondContact O-CG 3.36Å; D37-Q41 PolarHBondContact O-N 3.43Å; D37-Q41 VanDerWaalsContact O-N 3.16Å; D37-H163 IonicContact OD2-CD2 3.5Å; D37-H163 IonicContact OD2-CE1 3.93Å; D37-H163 IonicContact OD2-NE2 3.7Å; D37-H163 PolarHBondContact OD2-NE2 3.1Å; D37-Q165 PolarHBondContact OD2-NE2 3.4Å; D37-K346 IonicContact OD2-NZ 3.61Å; D37-K346 PolarHBondContact OD2-NZ 3.49Å
38	Y	97.7	Very high	96.1	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-46.3	172.3	-178.4	-85.4	0	0	0	112	Y26 G36 A40 Q41 R42 H108 K109 M112 F164	Y26-Y38 HydrophobicContact CD1-CD2 4.25Å; Y26-Y38 HydrophobicContact CD1-CE2 4.42Å; Y26-Y38 HydrophobicContact CD2-CD1 4.01Å; Y26-Y38 AromaticContact CD2-CD2 3.93Å; Y26-Y38 HydrophobicContact CD2-CD2 3.93Å; Y26-Y38 AromaticContact CD2-CG 3.55Å; Y26-Y38 HydrophobicContact CD2-CG 3.55Å; Y26-Y38 AromaticContact CE2-CD1 3.83Å; Y26-Y38 HydrophobicContact CE2-CD1 3.83Å; Y26-Y38 HydrophobicContact CE2-CD2 4.41Å; Y26-Y38 HydrophobicContact CE2-CE1 4.33Å; Y26-Y38 AromaticContact CE2-CG 3.87Å; Y26-Y38 HydrophobicContact CE2-CG 3.87Å; Y26-Y38 AromaticContact CG-CD2 3.85Å; Y26-Y38 HydrophobicContact CG-CD2 3.85Å; Y26-Y38 HydrophobicContact CG-CE2 4.47Å; Y26-Y38 AromaticContact CG-CG 3.98Å; Y26-Y38 HydrophobicContact CG-CG 3.98Å; G36-Y38 PolarHBondContact O-N 2.9Å; G36-Y38 VanDerWaalsContact O-N 3.09Å; Y38-A40 VanDerWaalsContact C-N 3.33Å; Y38-Q41 PolarHBondContact O-N 3Å; Y38-R42 PolarHBondContact O-N 3.07Å; Y38-R42 VanDerWaalsContact O-N 3.1Å; Y38-H108 AromaticContact CE1-CE1 3.64Å; Y38-H108 AromaticContact CE1-ND1 3.74Å; Y38-H108 AromaticContact CZ-CE1 3.79Å; Y38-H108 AromaticContact CZ-ND1 3.8Å; Y38-H108 VanDerWaalsContact OH-C 3.26Å; Y38-H108 PolarHBondContact OH-CE1 3.34Å; Y38-H108 VanDerWaalsContact OH-CE1 3.25Å; Y38-H108 PolarHBondContact OH-ND1 2.96Å; Y38-H108 PolarHBondContact OH-O 2.97Å; Y38-H108 VanDerWaalsContact OH-O 3.14Å; Y38-K109 VanDerWaalsContact OH-CA 3.27Å; Y38-K109 WeakPolarHBondContact OH-CA 3.41Å; Y38-K109 PolarHBondContact OH-N 3.36Å; Y38-M112 HydrophobicContact CE2-CB 3.51Å; Y38-M112 HydrophobicContact CE2-CE 4.47Å; Y38-M112 HydrophobicContact CE2-CG 3.88Å; Y38-M112 VanDerWaalsContact OH-CG 3.29Å; Y38-M112 WeakPolarHBondContact OH-CG 3.39Å; Y38-F164 HydrophobicContact CD2-CB 4Å; Y38-F164 AromaticContact CD2-CD1 3.8Å; Y38-F164 HydrophobicContact CD2-CD1 3.8Å; Y38-F164 AromaticContact CD2-CD2 3.74Å; Y38-F164 HydrophobicContact CD2-CD2 3.74Å; Y38-F164 HydrophobicContact CD2-CE1 4.24Å; Y38-F164 HydrophobicContact CD2-CE2 4.2Å; Y38-F164 AromaticContact CD2-CG 3.53Å; Y38-F164 HydrophobicContact CD2-CG 3.53Å; Y38-F164 HydrophobicContact CD2-CZ 4.44Å; Y38-F164 HydrophobicContact CE2-CD2 4.1Å; Y38-F164 HydrophobicContact CE2-CE2 4.2Å; Y38-F164 HydrophobicContact CE2-CG 4.33Å; Y38-F164 HydrophobicContact CE2-CZ 4.49Å; Y38-F164 HydrophobicContact CG-CD1 4.34Å; Y38-F164 HydrophobicContact CG-CG 4.36Å
39	E	98.1	Very high	96.2	Very high	4 Å²	4	30 Å²	30	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-68.9	-34.4	178.2	178.3	56.3	-161.6	0	0	111.3	F35 G36 Q41 R42 H43 Y67 G102	F35-E39 HydrophobicContact CB-CB 3.6Å; F35-E39 HydrophobicContact CB-CG 4.08Å; F35-E39 HydrophobicContact CD2-CG 4.19Å; F35-E39 HydrophobicContact CG-CB 4.28Å; F35-E39 HydrophobicContact CG-CG 4.38Å; G36-E39 WeakPolarHBondContact O-CB 3.5Å; G36-E39 PolarHBondContact O-N 2.86Å; E39-Q41 VanDerWaalsContact C-N 3.35Å; E39-Q41 PolarHBondContact O-N 2.96Å; E39-R42 VanDerWaalsContact CD-NE 3.25Å; E39-R42 PolarHBondContact O-N 3.3Å; E39-R42 IonicContact OE1-CZ 3.75Å; E39-R42 VanDerWaalsContact OE1-CZ 3.24Å; E39-R42 IonicContact OE1-NE 2.64Å; E39-R42 PolarHBondContact OE1-NE 2.9Å; E39-R42 IonicContact OE1-NH2 2.73Å; E39-R42 PolarHBondContact OE1-NH2 2.7Å; E39-R42 WeakPolarHBondContact OE2-CD 3.32Å; E39-R42 IonicContact OE2-CZ 3.64Å; E39-R42 IonicContact OE2-NE 3.56Å; E39-R42 PolarHBondContact OE2-NE 3.02Å; E39-H43 VanDerWaalsContact O-CB 3.31Å; E39-H43 WeakPolarHBondContact O-CB 3.45Å; E39-H43 PolarHBondContact O-N 3.28Å; E39-Y67 HydrophobicContact CG-CE1 4.42Å; E39-Y67 PolarHBondContact OE1-OH 3.38Å; E39-G102 VanDerWaalsContact CD-N 3.25Å; E39-G102 PolarHBondContact OE1-N 3.31Å; E39-G102 PolarHBondContact OE2-N 3Å
40	A	97.4	Very high	96.2	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.033	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-48.3	174.4	0	0	0	0	0	111.8	G36 D37 Y38 H43 W44 W68	G36-A40 PolarHBondContact O-N 2.96Å; D37-A40 WeakPolarHBondContact O-CB 3.3Å; D37-A40 PolarHBondContact O-N 2.89Å; Y38-A40 VanDerWaalsContact C-N 3.33Å; A40-H43 PolarHBondContact O-N 2.86Å; A40-W44 PolarHBondContact O-N 3.47Å; A40-W44 PolarHBondContact O-NE1 3.44Å; A40-W68 HydrophobicContact CB-CB 3.97Å; A40-W68 HydrophobicContact CB-CD2 3.51Å; A40-W68 HydrophobicContact CB-CE3 3.44Å; A40-W68 VanDerWaalsContact CB-CE3 3.44Å; A40-W68 HydrophobicContact CB-CG 3.77Å; A40-W68 HydrophobicContact CB-CZ3 4.08Å
41	Q	98	Very high	96.4	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.019	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-40.3	178.4	-60.8	-59.4	-32.3	0	0	112.2	D37 Y38 E39 W44 Q45 M112 F164 Y166	D37-Q41 WeakPolarHBondContact O-CG 3.36Å; D37-Q41 PolarHBondContact O-N 3.43Å; D37-Q41 VanDerWaalsContact O-N 3.16Å; Y38-Q41 PolarHBondContact O-N 3Å; E39-Q41 VanDerWaalsContact C-N 3.35Å; E39-Q41 PolarHBondContact O-N 2.96Å; Q41-W44 PolarHBondContact O-N 2.86Å; Q41-W44 VanDerWaalsContact OE1-CZ3 3.31Å; Q41-Q45 WeakPolarHBondContact O-CG 3.32Å; Q41-Q45 PolarHBondContact O-N 3.26Å; Q41-M112 HydrophobicContact CB-CE 3.94Å; Q41-F164 HydrophobicContact CB-CD1 4.28Å; Q41-F164 HydrophobicContact CB-CE1 3.71Å; Q41-F164 HydrophobicContact CG-CD1 4Å; Q41-F164 HydrophobicContact CG-CE1 3.77Å; Q41-Y166 HydrophobicContact CB-CE2 4.25Å; Q41-Y166 HydrophobicContact CG-CD2 4.27Å; Q41-Y166 HydrophobicContact CG-CE2 4.04Å
42	R	98.1	Very high	96.5	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-46.3	175	-174.5	-143.3	64.1	72.2	2.3	111	Y38 E39 W44 Q45 E46 W94 S100 H108 M112	Y38-R42 PolarHBondContact O-N 3.07Å; Y38-R42 VanDerWaalsContact O-N 3.1Å; E39-R42 VanDerWaalsContact CD-NE 3.25Å; E39-R42 PolarHBondContact O-N 3.3Å; E39-R42 IonicContact OE1-CZ 3.75Å; E39-R42 VanDerWaalsContact OE1-CZ 3.24Å; E39-R42 IonicContact OE1-NE 2.64Å; E39-R42 PolarHBondContact OE1-NE 2.9Å; E39-R42 IonicContact OE1-NH2 2.73Å; E39-R42 PolarHBondContact OE1-NH2 2.7Å; E39-R42 WeakPolarHBondContact OE2-CD 3.32Å; E39-R42 IonicContact OE2-CZ 3.64Å; E39-R42 IonicContact OE2-NE 3.56Å; E39-R42 PolarHBondContact OE2-NE 3.02Å; R42-W44 VanDerWaalsContact C-N 3.28Å; R42-W44 PolarHBondContact O-N 3.41Å; R42-Q45 WeakPolarHBondContact O-CA 3.29Å; R42-Q45 VanDerWaalsContact O-CB 3.29Å; R42-Q45 WeakPolarHBondContact O-CB 3.31Å; R42-Q45 PolarHBondContact O-N 3.31Å; R42-E46 IonicContact CZ-OE2 3.98Å; R42-E46 VanDerWaalsContact CZ-OE2 3.31Å; R42-E46 IonicContact NH1-OE2 3.41Å; R42-E46 PolarHBondContact NH1-OE2 2.96Å; R42-E46 IonicContact NH2-OE2 2.77Å; R42-E46 PolarHBondContact NH2-OE2 2.88Å; R42-E46 PolarHBondContact O-N 3.02Å; R42-W94 PolarHBondContact NH1-O 3.34Å; R42-S100 PolarHBondContact NE-O 3.39Å; R42-S100 PolarHBondContact NH1-O 3.29Å; R42-S100 PolarHBondContact NH1-OG 2.92Å; R42-S100 PolarHBondContact NH2-O 3.31Å; R42-H108 VanDerWaalsContact CG-CE1 3.48Å; R42-H108 WeakPolarHBondContact CG-CE1 3.23Å; R42-M112 HydrophobicContact CB-CE 4.03Å
43	H	98.1	Very high	96.5	Very high	1 Å²	1	25 Å²	25	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-36.4	179.3	-172.7	51.7	0	0	0	111.9	E39 A40 Q45 E46 V47 Y67 W68	E39-H43 VanDerWaalsContact O-CB 3.31Å; E39-H43 WeakPolarHBondContact O-CB 3.45Å; E39-H43 PolarHBondContact O-N 3.28Å; A40-H43 PolarHBondContact O-N 2.86Å; H43-Q45 VanDerWaalsContact C-N 3.28Å; H43-Q45 PolarHBondContact O-N 3.01Å; H43-E46 IonicContact CE1-OE2 3.06Å; H43-E46 IonicContact ND1-OE2 2.9Å; H43-E46 PolarHBondContact ND1-OE2 3.09Å; H43-E46 WeakPolarHBondContact O-CB 3.5Å; H43-E46 PolarHBondContact O-N 2.96Å; H43-V47 WeakPolarHBondContact NE2-CG2 3.2Å; H43-V47 WeakPolarHBondContact O-CB 3.4Å; H43-V47 WeakPolarHBondContact O-CG2 3.46Å; H43-V47 PolarHBondContact O-N 2.97Å; H43-Y67 PolarHBondContact CD2-O 3.47Å; H43-Y67 PolarHBondContact NE2-O 3.19Å; H43-W68 HydrophobicContact CB-CB 4.43Å
44	W	98.3	Very high	96.7	Very high	11 Å²	11	25.2 Å²	25.2	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-34.6	172.2	-61.1	-9.6	0	0	0	112.7	A40 Q41 R42 T48 W68 G69 L70 Y72 T76	A40-W44 PolarHBondContact O-N 3.47Å; A40-W44 PolarHBondContact O-NE1 3.44Å; Q41-W44 PolarHBondContact O-N 2.86Å; Q41-W44 VanDerWaalsContact OE1-CZ3 3.31Å; R42-W44 VanDerWaalsContact C-N 3.28Å; R42-W44 PolarHBondContact O-N 3.41Å; W44-T48 WeakPolarHBondContact O-CB 3.39Å; W44-T48 WeakPolarHBondContact O-CG2 3.36Å; W44-T48 PolarHBondContact O-N 3.11Å; W44-T48 PolarHBondContact O-OG1 3.14Å; W44-W68 VanDerWaalsContact CD1-O 3.31Å; W44-W68 PolarHBondContact NE1-O 3.28Å; W44-G69 PolarHBondContact NE1-O 2.96Å; W44-L70 HydrophobicContact CB-CD1 3.9Å; W44-L70 HydrophobicContact CD2-CD1 4.34Å; W44-L70 HydrophobicContact CD2-CG 4.24Å; W44-L70 HydrophobicContact CG-CD1 3.84Å; W44-L70 HydrophobicContact CG-CG 4.13Å; W44-Y72 AromaticContact CH2-CD1 3.95Å; W44-Y72 HydrophobicContact CH2-CD1 3.95Å; W44-Y72 AromaticContact CH2-CD2 3.92Å; W44-Y72 HydrophobicContact CH2-CD2 3.92Å; W44-Y72 AromaticContact CH2-CE1 3.99Å; W44-Y72 HydrophobicContact CH2-CE1 3.99Å; W44-Y72 AromaticContact CH2-CE2 3.97Å; W44-Y72 HydrophobicContact CH2-CE2 3.97Å; W44-Y72 AromaticContact CH2-CG 3.89Å; W44-Y72 HydrophobicContact CH2-CG 3.89Å; W44-Y72 AromaticContact CH2-CZ 3.98Å; W44-Y72 AromaticContact CZ3-CD2 3.83Å; W44-Y72 HydrophobicContact CZ3-CD2 3.83Å; W44-Y72 HydrophobicContact CZ3-CE2 4.04Å; W44-Y72 HydrophobicContact CZ3-CG 4.1Å; W44-T76 HydrophobicContact CE3-CG2 3.95Å; W44-T76 HydrophobicContact CZ3-CG2 3.81Å
45	Q	98.6	Very high	97	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-46.7	173.3	-66.5	174.9	10.9	0	0	111.2	Q41 R42 H43 T48 Y49 S80 C83 A84 V95 M112	Q41-Q45 WeakPolarHBondContact O-CG 3.32Å; Q41-Q45 PolarHBondContact O-N 3.26Å; R42-Q45 WeakPolarHBondContact O-CA 3.29Å; R42-Q45 VanDerWaalsContact O-CB 3.29Å; R42-Q45 WeakPolarHBondContact O-CB 3.31Å; R42-Q45 PolarHBondContact O-N 3.31Å; H43-Q45 VanDerWaalsContact C-N 3.28Å; H43-Q45 PolarHBondContact O-N 3.01Å; Q45-T48 PolarHBondContact O-OG1 3.27Å; Q45-Y49 VanDerWaalsContact O-CB 3.27Å; Q45-Y49 WeakPolarHBondContact O-CB 3.49Å; Q45-Y49 PolarHBondContact O-N 2.96Å; Q45-S80 WeakPolarHBondContact CG-O 3.3Å; Q45-C83 HydrophobicContact CG-CB 4.2Å; Q45-A84 HydrophobicContact CB-CB 3.66Å; Q45-A84 HydrophobicContact CG-CB 4.3Å; Q45-A84 WeakPolarHBondContact O-CB 3.46Å; Q45-V95 HydrophobicContact CB-CG1 4.1Å; Q45-M112 PolarHBondContact NE2-SD 3.1Å
46	E	98.4	Very high	97.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55.7	-52.6	173.8	176.6	-166.7	171.2	0	0	111.9	R42 H43 Y49 N50 L97 H98 S100	R42-E46 IonicContact CZ-OE2 3.98Å; R42-E46 VanDerWaalsContact CZ-OE2 3.31Å; R42-E46 IonicContact NH1-OE2 3.41Å; R42-E46 PolarHBondContact NH1-OE2 2.96Å; R42-E46 IonicContact NH2-OE2 2.77Å; R42-E46 PolarHBondContact NH2-OE2 2.88Å; R42-E46 PolarHBondContact O-N 3.02Å; H43-E46 IonicContact CE1-OE2 3.06Å; H43-E46 IonicContact ND1-OE2 2.9Å; H43-E46 PolarHBondContact ND1-OE2 3.09Å; H43-E46 WeakPolarHBondContact O-CB 3.5Å; H43-E46 PolarHBondContact O-N 2.96Å; E46-Y49 PolarHBondContact O-N 3.04Å; E46-N50 PolarHBondContact O-N 2.76Å; E46-N50 VanDerWaalsContact O-N 3.09Å; E46-N50 PolarHBondContact O-ND2 3.03Å; E46-L97 HydrophobicContact CG-CD1 4.22Å; E46-L97 WeakPolarHBondContact OE1-CA 3.34Å; E46-H98 PolarHBondContact OE1-N 3.11Å; E46-S100 VanDerWaalsContact CD-OG 3.28Å; E46-S100 PolarHBondContact OE2-OG 3.18Å
47	V	98.1	Very high	97.2	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.018	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-49.2	-178.1	164.8	0	0	0	0	111.2	H43 Y49 L51	H43-V47 WeakPolarHBondContact NE2-CG2 3.2Å; H43-V47 WeakPolarHBondContact O-CB 3.4Å; H43-V47 WeakPolarHBondContact O-CG2 3.46Å; H43-V47 PolarHBondContact O-N 2.97Å; V47-Y49 VanDerWaalsContact C-N 3.31Å; V47-Y49 PolarHBondContact O-N 2.81Å; V47-L51 HydrophobicContact CG1-CD1 4.22Å; V47-L51 WeakPolarHBondContact O-CB 3.37Å; V47-L51 PolarHBondContact O-N 3Å
48	T	98	Very high	97.2	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.012	12%	0.116	C	C	.	.	H	α-helix	trans	-68.8	-31.6	-175.1	54.1	0	0	0	0	112.6	W44 Q45 W56 L70 A77 W81	W44-T48 WeakPolarHBondContact O-CB 3.39Å; W44-T48 WeakPolarHBondContact O-CG2 3.36Å; W44-T48 PolarHBondContact O-N 3.11Å; W44-T48 PolarHBondContact O-OG1 3.14Å; Q45-T48 PolarHBondContact O-OG1 3.27Å; T48-W56 HydrophobicContact CG2-CD2 3.93Å; T48-W56 HydrophobicContact CG2-CE3 4.05Å; T48-W56 HydrophobicContact CG2-CG 4.47Å; T48-W56 HydrophobicContact CG2-CH2 4.24Å; T48-W56 HydrophobicContact CG2-CZ2 4.13Å; T48-W56 HydrophobicContact CG2-CZ3 4.21Å; T48-W56 WeakPolarHBondContact O-CZ2 3.46Å; T48-L70 HydrophobicContact CG2-CD1 3.98Å; T48-A77 HydrophobicContact CG2-CB 4.26Å; T48-W81 VanDerWaalsContact O-CD1 3.25Å; T48-W81 VanDerWaalsContact OG1-CA 3.31Å; T48-W81 WeakPolarHBondContact OG1-CA 3.34Å; T48-W81 PolarHBondContact OG1-N 3.38Å
49	Y	98.1	Very high	97.1	Very high	62 Å²	62	28.2 Å²	28.2	24%	0.243	14%	0.141	C	C	.	.	H	α-helix	trans	-74.5	-45.5	178	-174.1	-104.6	0	0	0	113.3	Q45 E46 V47 A84 Y85 N88 V95	Q45-Y49 VanDerWaalsContact O-CB 3.27Å; Q45-Y49 WeakPolarHBondContact O-CB 3.49Å; Q45-Y49 PolarHBondContact O-N 2.96Å; E46-Y49 PolarHBondContact O-N 3.04Å; V47-Y49 VanDerWaalsContact C-N 3.31Å; V47-Y49 PolarHBondContact O-N 2.81Å; Y49-A84 HydrophobicContact CD2-CB 4.26Å; Y49-A84 HydrophobicContact CG-CB 4.24Å; Y49-Y85 HydrophobicContact CD2-CD1 4.45Å; Y49-Y85 AromaticContact CD2-CD2 3.81Å; Y49-Y85 HydrophobicContact CD2-CD2 3.81Å; Y49-Y85 HydrophobicContact CD2-CE1 4.49Å; Y49-Y85 AromaticContact CD2-CE2 3.75Å; Y49-Y85 HydrophobicContact CD2-CE2 3.75Å; Y49-Y85 HydrophobicContact CD2-CG 4.14Å; Y49-Y85 AromaticContact CE2-CD1 3.82Å; Y49-Y85 HydrophobicContact CE2-CD1 3.82Å; Y49-Y85 HydrophobicContact CE2-CD2 4.01Å; Y49-Y85 AromaticContact CE2-CE1 3.84Å; Y49-Y85 HydrophobicContact CE2-CE1 3.84Å; Y49-Y85 AromaticContact CE2-CE2 3.93Å; Y49-Y85 HydrophobicContact CE2-CE2 3.93Å; Y49-Y85 AromaticContact CE2-CG 3.93Å; Y49-Y85 HydrophobicContact CE2-CG 3.93Å; Y49-Y85 AromaticContact CE2-CZ 3.91Å; Y49-N88 HydrophobicContact CE1-CB 3.99Å; Y49-N88 HydrophobicContact CE2-CB 4.04Å; Y49-N88 VanDerWaalsContact CZ-CG 3.49Å; Y49-N88 PolarHBondContact OH-ND2 3.47Å; Y49-V95 HydrophobicContact CD1-CG2 4.1Å; Y49-V95 HydrophobicContact CE1-CG2 4.47Å
50	N	98.2	Very high	96.9	Very high	64 Å²	64	30.1 Å²	30.1	34%	0.342	15%	0.153	S	C	.	.	H	α-helix	trans	-91.5	-28.1	-169.7	-66	-79.3	0	0	0	114	E46 V95 L97	E46-N50 PolarHBondContact O-N 2.76Å; E46-N50 VanDerWaalsContact O-N 3.09Å; E46-N50 PolarHBondContact O-ND2 3.03Å; N50-V95 PolarHBondContact ND2-O 3.37Å; N50-L97 HydrophobicContact CB-CB 4.11Å; N50-L97 HydrophobicContact CB-CD1 4.09Å; N50-L97 HydrophobicContact CB-CD2 4.29Å; N50-L97 HydrophobicContact CB-CG 4.39Å
51	L	97.8	Very high	96.7	Very high	14 Å²	14	35.1 Å²	35.1	7%	0.073	19%	0.188	C	C	.	.	S	Bend	trans	-102	147.2	-172	-55	-172.9	0	0	0	112.1	V47 Q55 W56 D62 N63 L97	V47-L51 HydrophobicContact CG1-CD1 4.22Å; V47-L51 WeakPolarHBondContact O-CB 3.37Å; V47-L51 PolarHBondContact O-N 3Å; L51-Q55 HydrophobicContact CB-CB 4.29Å; L51-Q55 HydrophobicContact CD1-CB 4.49Å; L51-W56 PolarHBondContact O-NE1 3.49Å; L51-D62 HydrophobicContact CD1-CB 4.28Å; L51-D62 HydrophobicContact CD2-CB 3.76Å; L51-N63 HydrophobicContact CD1-CB 3.71Å; L51-L97 HydrophobicContact CD2-CD1 4.12Å; L51-L97 HydrophobicContact CD2-CD2 3.94Å; L51-L97 HydrophobicContact CG-CD1 4.43Å
52	P	96	Very high	96.6	Very high	62 Å²	62	37.2 Å²	37.2	40%	0.403	20%	0.199	S	C	.	.			trans	-63.6	150.5	171.7	28.6	-34.3	0	0	0	110.4	Q54 Q55	P52-Q54 PolarHBondContact O-N 3.38Å; P52-Q55 HydrophobicContact CG-CB 4.44Å; P52-Q55 HydrophobicContact CG-CG 3.88Å; P52-Q55 WeakPolarHBondContact O-CB 3.23Å; P52-Q55 PolarHBondContact O-N 2.96Å
53	L	93.6	Very high	96.5	Very high	33 Å²	33	37.3 Å²	37.3	17%	0.173	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-53.5	-33.6	-172.7	-175.7	142.3	0	0	0	113.7	Q55 W56 Y78 P248 F249	L53-Q55 PolarHBondContact O-N 3.5Å; L53-Q55 VanDerWaalsContact O-N 3.16Å; L53-W56 HydrophobicContact CD1-CH2 4.35Å; L53-W56 HydrophobicContact CD1-CZ3 4.23Å; L53-W56 HydrophobicContact CG-CD2 4.43Å; L53-W56 HydrophobicContact CG-CE3 4.31Å; L53-W56 HydrophobicContact CG-CZ3 4.47Å; L53-W56 PolarHBondContact O-N 2.92Å; L53-Y78 HydrophobicContact CD1-CE1 4.45Å; L53-P248 HydrophobicContact CD1-CB 3.4Å; L53-P248 VanDerWaalsContact CD1-CB 3.4Å; L53-P248 HydrophobicContact CD1-CG 3.99Å; L53-P248 HydrophobicContact CD2-CB 3.82Å; L53-P248 HydrophobicContact CG-CB 4.28Å; L53-F249 HydrophobicContact CD1-CE2 4.32Å; L53-F249 HydrophobicContact CD1-CZ 4.09Å; L53-F249 HydrophobicContact CD2-CD1 3.71Å; L53-F249 HydrophobicContact CD2-CD2 4.47Å; L53-F249 HydrophobicContact CD2-CE1 3.42Å; L53-F249 VanDerWaalsContact CD2-CE1 3.42Å; L53-F249 HydrophobicContact CD2-CE2 4.22Å; L53-F249 HydrophobicContact CD2-CG 4.23Å; L53-F249 HydrophobicContact CD2-CZ 3.7Å; L53-F249 HydrophobicContact CG-CE1 3.95Å; L53-F249 HydrophobicContact CG-CE2 4.48Å; L53-F249 HydrophobicContact CG-CZ 3.83Å
54	Q	93.6	Very high	96.3	Very high	108 Å²	108	39.9 Å²	39.9	51%	0.505	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-65.4	-15.9	179.4	-63.7	78.5	10.3	0	0	113.6	P52 F58 Q255	P52-Q54 PolarHBondContact O-N 3.38Å; Q54-F58 WeakPolarHBondContact O-CD2 3.43Å; Q54-Q255 PolarHBondContact O-NE2 3.4Å
55	Q	95.9	Very high	96	Very high	57 Å²	57	40.2 Å²	40.2	27%	0.266	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-102.4	-11.7	-178.3	-62.8	-176.7	16.6	0	0	113.5	L51 P52 L53 Y57 F58 T60 N63	L51-Q55 HydrophobicContact CB-CB 4.29Å; L51-Q55 HydrophobicContact CD1-CB 4.49Å; P52-Q55 HydrophobicContact CG-CB 4.44Å; P52-Q55 HydrophobicContact CG-CG 3.88Å; P52-Q55 WeakPolarHBondContact O-CB 3.23Å; P52-Q55 PolarHBondContact O-N 2.96Å; L53-Q55 PolarHBondContact O-N 3.5Å; L53-Q55 VanDerWaalsContact O-N 3.16Å; Q55-Y57 PolarHBondContact O-N 2.87Å; Q55-Y57 VanDerWaalsContact O-N 3.15Å; Q55-F58 PolarHBondContact O-N 3.4Å; Q55-T60 HydrophobicContact CB-CG2 4.18Å; Q55-T60 HydrophobicContact CG-CG2 4.04Å; Q55-N63 PolarHBondContact O-ND2 2.87Å
56	W	97	Very high	95.7	Very high	10 Å²	10	46.5 Å²	46.5	4%	0.038	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-34.8	-173.7	-68.7	1.2	0	0	0	113.6	T48 L51 L53 N63 A77 Y78 W81 F249	T48-W56 HydrophobicContact CG2-CD2 3.93Å; T48-W56 HydrophobicContact CG2-CE3 4.05Å; T48-W56 HydrophobicContact CG2-CG 4.47Å; T48-W56 HydrophobicContact CG2-CH2 4.24Å; T48-W56 HydrophobicContact CG2-CZ2 4.13Å; T48-W56 HydrophobicContact CG2-CZ3 4.21Å; T48-W56 WeakPolarHBondContact O-CZ2 3.46Å; L51-W56 PolarHBondContact O-NE1 3.49Å; L53-W56 HydrophobicContact CD1-CH2 4.35Å; L53-W56 HydrophobicContact CD1-CZ3 4.23Å; L53-W56 HydrophobicContact CG-CD2 4.43Å; L53-W56 HydrophobicContact CG-CE3 4.31Å; L53-W56 HydrophobicContact CG-CZ3 4.47Å; L53-W56 PolarHBondContact O-N 2.92Å; W56-N63 PolarHBondContact O-ND2 3.17Å; W56-N63 VanDerWaalsContact O-ND2 3.1Å; W56-A77 HydrophobicContact CE3-CB 3.7Å; W56-A77 HydrophobicContact CZ3-CB 3.65Å; W56-Y78 HydrophobicContact CH2-CD1 4.23Å; W56-Y78 HydrophobicContact CH2-CE1 4.45Å; W56-Y78 AromaticContact CZ3-CD1 3.99Å; W56-Y78 HydrophobicContact CZ3-CD1 3.99Å; W56-Y78 HydrophobicContact CZ3-CE1 4.03Å; W56-W81 HydrophobicContact CH2-CB 4.35Å; W56-W81 HydrophobicContact CH2-CG 4.35Å; W56-F249 HydrophobicContact CE3-CZ 4.28Å
57	Y	96.5	Very high	95.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	7.9	-177.1	-66.4	-92.1	0	0	0	113.7	Q55 L65 L70 Y72 F249 Q258 V259 R262	Q55-Y57 PolarHBondContact O-N 2.87Å; Q55-Y57 VanDerWaalsContact O-N 3.15Å; Y57-L65 WeakPolarHBondContact O-CD1 3.16Å; Y57-L70 HydrophobicContact CD1-CB 4.37Å; Y57-L70 HydrophobicContact CD1-CD2 4.17Å; Y57-L70 VanDerWaalsContact CD1-O 3.31Å; Y57-L70 WeakPolarHBondContact CD1-O 3.49Å; Y57-L70 HydrophobicContact CE1-CB 4.27Å; Y57-L70 HydrophobicContact CE1-CD2 3.29Å; Y57-L70 HydrophobicContact CE1-CG 4.39Å; Y57-L70 HydrophobicContact CE2-CD2 4.06Å; Y57-L70 WeakPolarHBondContact OH-CD2 3.11Å; Y57-Y72 WeakPolarHBondContact CE1-O 3.36Å; Y57-Y72 PolarHBondContact OH-O 3.4Å; Y57-F249 AromaticContact CD2-CE1 3.89Å; Y57-F249 HydrophobicContact CD2-CE1 3.89Å; Y57-F249 HydrophobicContact CD2-CZ 4.3Å; Y57-F249 AromaticContact CE2-CE1 3.82Å; Y57-F249 HydrophobicContact CE2-CE1 3.82Å; Y57-F249 AromaticContact CE2-CZ 3.77Å; Y57-F249 HydrophobicContact CE2-CZ 3.77Å; Y57-Q258 VanDerWaalsContact O-CG 3.28Å; Y57-Q258 WeakPolarHBondContact O-CG 3.31Å; Y57-Q258 PolarHBondContact O-NE2 3.4Å; Y57-V259 HydrophobicContact CD1-CG1 4.41Å; Y57-V259 HydrophobicContact CD1-CG2 4.2Å; Y57-V259 HydrophobicContact CD2-CG2 3.6Å; Y57-V259 HydrophobicContact CE1-CG1 4.02Å; Y57-V259 HydrophobicContact CE1-CG2 4.42Å; Y57-V259 HydrophobicContact CE2-CG1 4.38Å; Y57-V259 HydrophobicContact CE2-CG2 3.87Å; Y57-V259 HydrophobicContact CG-CG2 3.76Å; Y57-R262 HydrophobicContact CD1-CB 4.1Å; Y57-R262 HydrophobicContact CD1-CG 4.19Å
58	F	95.9	Very high	95.3	Very high	53 Å²	53	50.6 Å²	50.6	23%	0.232	27%	0.265	C	S	.	.	S	Bend	trans	-114.3	145.3	-175.9	-75.5	-97.9	0	0	0	111.1	Q54 Q55 T60 N63 Q255 Q258	Q54-F58 WeakPolarHBondContact O-CD2 3.43Å; Q55-F58 PolarHBondContact O-N 3.4Å; F58-T60 HydrophobicContact CB-CG2 4.26Å; F58-T60 PolarHBondContact O-N 3Å; F58-N63 PolarHBondContact O-ND2 3.46Å; F58-Q255 HydrophobicContact CE2-CG 4.37Å; F58-Q255 VanDerWaalsContact CE2-OE1 3.3Å; F58-Q258 HydrophobicContact CD1-CG 4.06Å; F58-Q258 HydrophobicContact CD2-CB 4.47Å; F58-Q258 HydrophobicContact CD2-CG 3.91Å; F58-Q258 HydrophobicContact CE1-CB 3.89Å; F58-Q258 HydrophobicContact CE1-CG 3.76Å; F58-Q258 HydrophobicContact CE2-CB 3.63Å; F58-Q258 HydrophobicContact CE2-CG 3.55Å; F58-Q258 HydrophobicContact CG-CG 4.15Å; F58-Q258 HydrophobicContact CZ-CB 3.31Å; F58-Q258 HydrophobicContact CZ-CG 3.51Å
59	N	95.4	Very high	95.2	Very high	100 Å²	100	50.6 Å²	50.6	54%	0.535	27%	0.265	S	S	.	.			trans	-75.2	122.3	170.6	-158.8	61.8	0	0	0	108.7	N63 D64 L65	N59-N63 WeakPolarHBondContact CA-O 3.45Å; N59-N63 PolarHBondContact OD1-O 3.4Å; N59-D64 WeakPolarHBondContact OD1-CA 3.34Å; N59-L65 HydrophobicContact CB-CD1 4.01Å; N59-L65 HydrophobicContact CB-CG 4.01Å; N59-L65 PolarHBondContact OD1-N 3.32Å
60	T	94.9	Very high	95	Very high	44 Å²	44	47.8 Å²	47.8	27%	0.27	25%	0.254	S	S	.	.			trans	-137.4	-178.4	-177.9	67.8	0	0	0	0	110.3	Q55 F58 D62 N63	Q55-T60 HydrophobicContact CB-CG2 4.18Å; Q55-T60 HydrophobicContact CG-CG2 4.04Å; F58-T60 HydrophobicContact CB-CG2 4.26Å; F58-T60 PolarHBondContact O-N 3Å; T60-D62 PolarHBondContact O-N 2.81Å; T60-D62 PolarHBondContact OG1-N 3.42Å; T60-N63 PolarHBondContact N-O 3.41Å; T60-N63 WeakPolarHBondContact OG1-CB 3.37Å; T60-N63 PolarHBondContact OG1-N 3.28Å
61	S	93.2	Very high	94.8	Very high	109 Å²	109	46.3 Å²	46.3	76%	0.762	25%	0.247	S	C	*	.	S	Bend	trans	-58.3	-31.1	168.8	43.6	0	0	0	0	112.6
62	D	94.6	Very high	94.7	Very high	48 Å²	48	47.7 Å²	47.7	26%	0.257	25%	0.251	S	S	.	.	S	Bend	trans	-107.9	-11.8	-170.7	-60.1	-71.8	0	0	0	113.8	L51 T60 L97 H98	L51-D62 HydrophobicContact CD1-CB 4.28Å; L51-D62 HydrophobicContact CD2-CB 3.76Å; T60-D62 PolarHBondContact O-N 2.81Å; T60-D62 PolarHBondContact OG1-N 3.42Å; D62-L97 HydrophobicContact CB-CD2 4.38Å; D62-H98 IonicContact OD1-CD2 2.8Å; D62-H98 IonicContact OD1-CE1 3.31Å; D62-H98 PolarHBondContact OD1-CE1 3.23Å; D62-H98 IonicContact OD1-NE2 3.73Å; D62-H98 PolarHBondContact OD1-NE2 3.16Å
63	N	95.8	Very high	94.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.233	C	C	.	.			trans	-129.6	105.8	177.2	-170.9	12.7	0	0	0	110.5	L51 Q55 W56 F58 N59 T60	L51-N63 HydrophobicContact CD1-CB 3.71Å; Q55-N63 PolarHBondContact O-ND2 2.87Å; W56-N63 PolarHBondContact O-ND2 3.17Å; W56-N63 VanDerWaalsContact O-ND2 3.1Å; F58-N63 PolarHBondContact O-ND2 3.46Å; N59-N63 WeakPolarHBondContact CA-O 3.45Å; N59-N63 PolarHBondContact OD1-O 3.4Å; T60-N63 PolarHBondContact N-O 3.41Å; T60-N63 WeakPolarHBondContact OG1-CB 3.37Å; T60-N63 PolarHBondContact OG1-N 3.28Å
64	D	93.9	Very high	95	Very high	55 Å²	55	43.3 Å²	43.3	29%	0.294	23%	0.225	S	C	.	.			trans	-92	107.4	173.9	176.7	10.1	0	0	0	109.5	N59 N66 Y67	N59-D64 WeakPolarHBondContact OD1-CA 3.34Å; D64-N66 PolarHBondContact O-N 2.99Å; D64-N66 VanDerWaalsContact O-N 3.11Å; D64-N66 VanDerWaalsContact OD1-CB 3.32Å; D64-N66 WeakPolarHBondContact OD1-CB 3.49Å; D64-N66 PolarHBondContact OD1-N 2.89Å; D64-N66 PolarHBondContact OD1-ND2 3.45Å; D64-N66 VanDerWaalsContact OD1-ND2 3.16Å; D64-Y67 PolarHBondContact O-N 3.1Å
65	L	92.7	Very high	95.2	Very high	19 Å²	19	39.9 Å²	39.9	10%	0.099	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-11.1	-178	-66.4	-175.1	0	0	0	114.1	Y57 N59 G69 R262	Y57-L65 WeakPolarHBondContact O-CD1 3.16Å; N59-L65 HydrophobicContact CB-CD1 4.01Å; N59-L65 HydrophobicContact CB-CG 4.01Å; N59-L65 PolarHBondContact OD1-N 3.32Å; L65-G69 PolarHBondContact O-N 2.7Å; L65-R262 PolarHBondContact O-NH2 3.5Å
66	N	91.9	Very high	95.3	Very high	132 Å²	132	37.2 Å²	37.2	71%	0.706	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-20.8	171.7	-57.2	-59.2	0	0	0	112.2	M34 D64 W68	M34-N66 WeakPolarHBondContact CE-O 3.49Å; D64-N66 PolarHBondContact O-N 2.99Å; D64-N66 VanDerWaalsContact O-N 3.11Å; D64-N66 VanDerWaalsContact OD1-CB 3.32Å; D64-N66 WeakPolarHBondContact OD1-CB 3.49Å; D64-N66 PolarHBondContact OD1-N 2.89Å; D64-N66 PolarHBondContact OD1-ND2 3.45Å; D64-N66 VanDerWaalsContact OD1-ND2 3.16Å; N66-W68 PolarHBondContact O-N 2.97Å
67	Y	94.2	Very high	95.4	Very high	21 Å²	21	36.7 Å²	36.7	8%	0.082	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	81	173.2	-167.1	-95.1	0	0	0	109.8	M34 E39 H43 D64 G69 R101 G102	M34-Y67 HydrophobicContact CE-CD2 4.35Å; M34-Y67 HydrophobicContact SD-CD2 3.61Å; M34-Y67 HydrophobicContact SD-CE2 3.97Å; E39-Y67 HydrophobicContact CG-CE1 4.42Å; E39-Y67 PolarHBondContact OE1-OH 3.38Å; H43-Y67 PolarHBondContact CD2-O 3.47Å; H43-Y67 PolarHBondContact NE2-O 3.19Å; D64-Y67 PolarHBondContact O-N 3.1Å; Y67-G69 PolarHBondContact O-N 3.37Å; Y67-R101 HydrophobicContact CD1-CG 4.37Å; Y67-R101 HydrophobicContact CE1-CB 4.05Å; Y67-R101 HydrophobicContact CE1-CG 3.8Å; Y67-G102 PolarHBondContact OH-N 3.21Å
68	W	95.1	Very high	95.5	Very high	68 Å²	68	39.2 Å²	39.2	26%	0.258	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	45.5	177.8	-60.7	117.1	0	0	0	115.4	M34 A40 H43 W44 N66	M34-W68 PolarHBondContact O-NE1 3.21Å; A40-W68 HydrophobicContact CB-CB 3.97Å; A40-W68 HydrophobicContact CB-CD2 3.51Å; A40-W68 HydrophobicContact CB-CE3 3.44Å; A40-W68 VanDerWaalsContact CB-CE3 3.44Å; A40-W68 HydrophobicContact CB-CG 3.77Å; A40-W68 HydrophobicContact CB-CZ3 4.08Å; H43-W68 HydrophobicContact CB-CB 4.43Å; W44-W68 VanDerWaalsContact CD1-O 3.31Å; W44-W68 PolarHBondContact NE1-O 3.28Å; N66-W68 PolarHBondContact O-N 2.97Å
69	G	94.6	Very high	95.6	Very high	3 Å²	3	38 Å²	38	3%	0.031	20%	0.2	C	C	.	.			trans	-54.4	152	173.9	0	0	0	0	0	113	W44 L65 Y67 D71	W44-G69 PolarHBondContact NE1-O 2.96Å; L65-G69 PolarHBondContact O-N 2.7Å; Y67-G69 PolarHBondContact O-N 3.37Å; G69-D71 PolarHBondContact O-N 2.85Å
70	L	95.3	Very high	95.8	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	18%	0.175	C	C	.	.			trans	-72.4	115.2	-174.4	-152.1	139	0	0	0	110.9	W44 T48 Y57 Y72 A77	W44-L70 HydrophobicContact CB-CD1 3.9Å; W44-L70 HydrophobicContact CD2-CD1 4.34Å; W44-L70 HydrophobicContact CD2-CG 4.24Å; W44-L70 HydrophobicContact CG-CD1 3.84Å; W44-L70 HydrophobicContact CG-CG 4.13Å; T48-L70 HydrophobicContact CG2-CD1 3.98Å; Y57-L70 HydrophobicContact CD1-CB 4.37Å; Y57-L70 HydrophobicContact CD1-CD2 4.17Å; Y57-L70 VanDerWaalsContact CD1-O 3.31Å; Y57-L70 WeakPolarHBondContact CD1-O 3.49Å; Y57-L70 HydrophobicContact CE1-CB 4.27Å; Y57-L70 HydrophobicContact CE1-CD2 3.29Å; Y57-L70 HydrophobicContact CE1-CG 4.39Å; Y57-L70 HydrophobicContact CE2-CD2 4.06Å; Y57-L70 WeakPolarHBondContact OH-CD2 3.11Å; L70-Y72 WeakPolarHBondContact CD2-O 3.17Å; L70-A77 HydrophobicContact CD1-CB 4.08Å; L70-A77 HydrophobicContact CD2-CB 3.91Å
71	D	92.7	Very high	95.9	Very high	34 Å²	34	36.1 Å²	36.1	18%	0.182	18%	0.181	C	C	.	.			trans	-112.2	0.4	-171.1	-73.4	-17.7	0	0	0	113.4	G69 Q201 R262 R268	G69-D71 PolarHBondContact O-N 2.85Å; D71-Q201 PolarHBondContact O-NE2 3.38Å; D71-R262 IonicContact OD1-CZ 2.73Å; D71-R262 IonicContact OD1-NE 2.97Å; D71-R262 PolarHBondContact OD1-NE 3.07Å; D71-R262 IonicContact OD1-NH2 3.75Å; D71-R262 PolarHBondContact OD1-NH2 2.71Å; D71-R262 IonicContact OD2-NH2 2.64Å; D71-R268 IonicContact OD2-NH2 3.64Å
72	Y	96.6	Very high	96.2	Very high	43 Å²	43	36.1 Å²	36.1	17%	0.169	17%	0.172	C	C	.	.	S	Bend	trans	-107.4	155.6	-175.6	-74.2	15.6	0	0	0	111.1	W44 Y57 L70 T76 K200	W44-Y72 AromaticContact CH2-CD1 3.95Å; W44-Y72 HydrophobicContact CH2-CD1 3.95Å; W44-Y72 AromaticContact CH2-CD2 3.92Å; W44-Y72 HydrophobicContact CH2-CD2 3.92Å; W44-Y72 AromaticContact CH2-CE1 3.99Å; W44-Y72 HydrophobicContact CH2-CE1 3.99Å; W44-Y72 AromaticContact CH2-CE2 3.97Å; W44-Y72 HydrophobicContact CH2-CE2 3.97Å; W44-Y72 AromaticContact CH2-CG 3.89Å; W44-Y72 HydrophobicContact CH2-CG 3.89Å; W44-Y72 AromaticContact CH2-CZ 3.98Å; W44-Y72 AromaticContact CZ3-CD2 3.83Å; W44-Y72 HydrophobicContact CZ3-CD2 3.83Å; W44-Y72 HydrophobicContact CZ3-CE2 4.04Å; W44-Y72 HydrophobicContact CZ3-CG 4.1Å; Y57-Y72 WeakPolarHBondContact CE1-O 3.36Å; Y57-Y72 PolarHBondContact OH-O 3.4Å; L70-Y72 WeakPolarHBondContact CD2-O 3.17Å; Y72-T76 HydrophobicContact CD2-CG2 3.79Å; Y72-T76 HydrophobicContact CG-CG2 4.21Å; Y72-K200 HydrophobicContact CD2-CG 4.36Å; Y72-K200 HydrophobicContact CE2-CD 4.26Å; Y72-K200 HydrophobicContact CE2-CG 4.11Å; Y72-K200 WeakPolarHBondContact OH-CE 3.48Å; Y72-K200 PolarHBondContact OH-NZ 3.08Å
73	P	97.6	Very high	96.4	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.019	16%	0.163	C	C	.	.			trans	-64.6	166.4	179.8	11.5	-15.1	0	0	0	113.9	L75 T76 L197 N198 Y199 Q201 I263	P73-L75 PolarHBondContact O-N 2.87Å; P73-T76 PolarHBondContact O-N 3.44Å; P73-L197 VanDerWaalsContact CG-O 3.27Å; P73-L197 WeakPolarHBondContact CG-O 3.21Å; P73-N198 CarbonylContact C-O 3.58Å; P73-N198 WeakPolarHBondContact CB-O 3.41Å; P73-N198 WeakPolarHBondContact CG-O 3.35Å; P73-Y199 WeakPolarHBondContact CD-O 3.48Å; P73-Q201 HydrophobicContact CG-CB 4.47Å; P73-I263 HydrophobicContact CB-CD1 3.72Å; P73-I263 HydrophobicContact CB-CG1 4.35Å; P73-I263 HydrophobicContact CG-CD1 4.38Å
74	P	97.8	Very high	96.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-52.8	-31.9	-166.5	-33.6	38	0	0	0	116.3	T76 A77 Y78 C245 W246 F249 V259	P74-T76 VanDerWaalsContact C-N 3.27Å; P74-T76 PolarHBondContact O-N 3.28Å; P74-A77 WeakPolarHBondContact O-CB 3.42Å; P74-A77 PolarHBondContact O-N 3.16Å; P74-Y78 HydrophobicContact CB-CE2 3.9Å; P74-Y78 VanDerWaalsContact O-CD2 3.23Å; P74-Y78 WeakPolarHBondContact O-CD2 3.36Å; P74-Y78 PolarHBondContact O-N 2.91Å; P74-C245 WeakPolarHBondContact CB-O 3.4Å; P74-W246 HydrophobicContact CG-CD2 3.98Å; P74-W246 HydrophobicContact CG-CE3 4.31Å; P74-W246 HydrophobicContact CG-CG 4.36Å; P74-W246 HydrophobicContact CG-CZ2 4.27Å; P74-F249 HydrophobicContact CB-CD2 4.38Å; P74-F249 HydrophobicContact CB-CE2 3.84Å; P74-F249 HydrophobicContact CG-CD2 4.07Å; P74-F249 HydrophobicContact CG-CE2 3.88Å; P74-V259 HydrophobicContact CG-CG1 4.41Å
75	L	98.3	Very high	96.7	Very high	35 Å²	35	36.5 Å²	36.5	18%	0.183	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-30.7	-178.7	-168.6	60.6	0	0	0	112.2	P73 Y78 H79 F173 L195 N198 Y199	P73-L75 PolarHBondContact O-N 2.87Å; L75-Y78 HydrophobicContact CD1-CD2 4.38Å; L75-H79 WeakPolarHBondContact O-CB 3.38Å; L75-H79 PolarHBondContact O-N 3.18Å; L75-H79 VanDerWaalsContact O-N 3.08Å; L75-F173 HydrophobicContact CD2-CE2 4.26Å; L75-L195 HydrophobicContact CD2-CB 4.1Å; L75-L195 HydrophobicContact CD2-CD2 3.95Å; L75-L195 WeakPolarHBondContact CD2-O 3.49Å; L75-N198 HydrophobicContact CB-CB 4.12Å; L75-N198 WeakPolarHBondContact CB-O 3.5Å; L75-N198 PolarHBondContact N-O 3.37Å; L75-N198 VanDerWaalsContact N-O 3.14Å; L75-Y199 HydrophobicContact CB-CD2 4.46Å; L75-Y199 HydrophobicContact CD2-CD2 4.31Å; L75-Y199 HydrophobicContact CG-CD2 4.1Å
76	T	98.4	Very high	97	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-67	-43.1	170.2	-74.2	0	0	0	0	110.9	W44 Y72 P73 P74 Y78 H79 S80 Y199	W44-T76 HydrophobicContact CE3-CG2 3.95Å; W44-T76 HydrophobicContact CZ3-CG2 3.81Å; Y72-T76 HydrophobicContact CD2-CG2 3.79Å; Y72-T76 HydrophobicContact CG-CG2 4.21Å; P73-T76 PolarHBondContact O-N 3.44Å; P74-T76 VanDerWaalsContact C-N 3.27Å; P74-T76 PolarHBondContact O-N 3.28Å; T76-Y78 VanDerWaalsContact C-N 3.32Å; T76-Y78 PolarHBondContact O-N 3.27Å; T76-H79 WeakPolarHBondContact O-CB 3.37Å; T76-H79 PolarHBondContact O-N 3.22Å; T76-H79 VanDerWaalsContact O-N 3.12Å; T76-S80 PolarHBondContact O-N 3.15Å; T76-S80 PolarHBondContact O-OG 2.87Å; T76-Y199 PolarHBondContact OG1-O 3.41Å
77	A	98.1	Very high	97.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.6	-42.2	178.5	0	0	0	0	0	111.6	T48 W56 L70 P74 H79 S80 W81	T48-A77 HydrophobicContact CG2-CB 4.26Å; W56-A77 HydrophobicContact CE3-CB 3.7Å; W56-A77 HydrophobicContact CZ3-CB 3.65Å; L70-A77 HydrophobicContact CD1-CB 4.08Å; L70-A77 HydrophobicContact CD2-CB 3.91Å; P74-A77 WeakPolarHBondContact O-CB 3.42Å; P74-A77 PolarHBondContact O-N 3.16Å; A77-H79 VanDerWaalsContact C-N 3.33Å; A77-H79 PolarHBondContact O-N 3.38Å; A77-S80 PolarHBondContact O-N 2.95Å; A77-W81 VanDerWaalsContact O-CB 3.3Å; A77-W81 WeakPolarHBondContact O-CB 3.42Å; A77-W81 PolarHBondContact O-N 3.34Å
78	Y	98.4	Very high	97.5	Very high	53 Å²	53	33.7 Å²	33.7	21%	0.208	16%	0.156	C	C	.	.	H	α-helix	trans	-66.4	-33.7	174.8	-54.4	-39	0	0	0	113.2	L53 W56 P74 L75 T76 W81 L82 C245 P248 F249	L53-Y78 HydrophobicContact CD1-CE1 4.45Å; W56-Y78 HydrophobicContact CH2-CD1 4.23Å; W56-Y78 HydrophobicContact CH2-CE1 4.45Å; W56-Y78 AromaticContact CZ3-CD1 3.99Å; W56-Y78 HydrophobicContact CZ3-CD1 3.99Å; W56-Y78 HydrophobicContact CZ3-CE1 4.03Å; P74-Y78 HydrophobicContact CB-CE2 3.9Å; P74-Y78 VanDerWaalsContact O-CD2 3.23Å; P74-Y78 WeakPolarHBondContact O-CD2 3.36Å; P74-Y78 PolarHBondContact O-N 2.91Å; L75-Y78 HydrophobicContact CD1-CD2 4.38Å; T76-Y78 VanDerWaalsContact C-N 3.32Å; T76-Y78 PolarHBondContact O-N 3.27Å; Y78-W81 WeakPolarHBondContact O-CB 3.48Å; Y78-L82 PolarHBondContact O-N 3.46Å; Y78-C245 VanDerWaalsContact CE2-O 3.26Å; Y78-C245 WeakPolarHBondContact CE2-O 3.28Å; Y78-C245 PolarHBondContact OH-O 3.46Å; Y78-P248 WeakPolarHBondContact OH-CD 3.49Å; Y78-P248 WeakPolarHBondContact OH-CG 3.47Å; Y78-F249 WeakPolarHBondContact OH-CE2 3.43Å
79	H	98.6	Very high	97.6	Very high	27 Å²	27	36.8 Å²	36.8	13%	0.125	18%	0.177	C	C	.	.	H	α-helix	trans	-67.7	-45.4	173.6	174	-141.1	0	0	0	111.5	L75 T76 A77 W81 L82 C83 T119 Y166 Y199	L75-H79 WeakPolarHBondContact O-CB 3.38Å; L75-H79 PolarHBondContact O-N 3.18Å; L75-H79 VanDerWaalsContact O-N 3.08Å; T76-H79 WeakPolarHBondContact O-CB 3.37Å; T76-H79 PolarHBondContact O-N 3.22Å; T76-H79 VanDerWaalsContact O-N 3.12Å; A77-H79 VanDerWaalsContact C-N 3.33Å; A77-H79 PolarHBondContact O-N 3.38Å; H79-W81 VanDerWaalsContact C-N 3.29Å; H79-W81 PolarHBondContact O-N 3.26Å; H79-L82 PolarHBondContact O-N 3.48Å; H79-C83 PolarHBondContact NE2-SG 3.49Å; H79-C83 VanDerWaalsContact NE2-SG 3.4Å; H79-C83 PolarHBondContact O-N 3.23Å; H79-T119 WeakPolarHBondContact NE2-CG2 3.33Å; H79-Y166 AromaticContact CE1-CD1 3.58Å; H79-Y166 AromaticContact CE1-CE1 3.58Å; H79-Y166 AromaticContact CE1-CG 3.99Å; H79-Y199 HydrophobicContact CB-CE2 4Å; H79-Y199 PolarHBondContact CE1-OH 3.06Å; H79-Y199 AromaticContact ND1-CE2 3.71Å; H79-Y199 AromaticContact ND1-CZ 3.67Å; H79-Y199 PolarHBondContact ND1-OH 3.23Å
80	S	98.5	Very high	97.8	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-43.1	173	-64.9	0	0	0	0	111.2	Q45 T76 A77 L82 C83 A84	Q45-S80 WeakPolarHBondContact CG-O 3.3Å; T76-S80 PolarHBondContact O-N 3.15Å; T76-S80 PolarHBondContact O-OG 2.87Å; A77-S80 PolarHBondContact O-N 2.95Å; S80-L82 PolarHBondContact O-N 3.44Å; S80-C83 PolarHBondContact O-N 2.92Å; S80-A84 WeakPolarHBondContact O-CB 3.41Å; S80-A84 PolarHBondContact O-N 2.91Å
81	W	98.4	Very high	98	Very high	102 Å²	102	43.6 Å²	43.6	39%	0.386	21%	0.212	S	C	.	.	H	α-helix	trans	-56.4	-51.3	175	-179.9	74.5	0	0	0	111.8	T48 W56 A77 Y78 H79 C83 A84 Y85	T48-W81 VanDerWaalsContact O-CD1 3.25Å; T48-W81 VanDerWaalsContact OG1-CA 3.31Å; T48-W81 WeakPolarHBondContact OG1-CA 3.34Å; T48-W81 PolarHBondContact OG1-N 3.38Å; W56-W81 HydrophobicContact CH2-CB 4.35Å; W56-W81 HydrophobicContact CH2-CG 4.35Å; A77-W81 VanDerWaalsContact O-CB 3.3Å; A77-W81 WeakPolarHBondContact O-CB 3.42Å; A77-W81 PolarHBondContact O-N 3.34Å; Y78-W81 WeakPolarHBondContact O-CB 3.48Å; H79-W81 VanDerWaalsContact C-N 3.29Å; H79-W81 PolarHBondContact O-N 3.26Å; W81-C83 PolarHBondContact O-N 3.02Å; W81-A84 WeakPolarHBondContact O-CB 3.46Å; W81-A84 PolarHBondContact O-N 2.97Å; W81-A84 VanDerWaalsContact O-N 3.1Å; W81-Y85 AromaticContact CD1-CE2 3.79Å; W81-Y85 HydrophobicContact CD2-CD2 4.25Å; W81-Y85 HydrophobicContact CD2-CE2 4.01Å; W81-Y85 AromaticContact CE2-CD2 3.99Å; W81-Y85 AromaticContact CE2-CE2 3.32Å; W81-Y85 HydrophobicContact CG-CD2 4.45Å; W81-Y85 HydrophobicContact CG-CE2 4.28Å; W81-Y85 HydrophobicContact CH2-CE2 4.47Å; W81-Y85 HydrophobicContact CZ2-CD2 4.32Å; W81-Y85 AromaticContact CZ2-CE2 3.58Å; W81-Y85 HydrophobicContact CZ2-CE2 3.58Å; W81-Y85 AromaticContact CZ2-CZ 3.98Å; W81-Y85 AromaticContact NE1-CE2 3.28Å; W81-Y85 VanDerWaalsContact NE1-CE2 3.28Å; W81-Y85 WeakPolarHBondContact O-CD2 3.17Å; W81-Y85 PolarHBondContact O-N 3.2Å; W81-Y85 VanDerWaalsContact O-N 3.08Å
82	L	98.4	Very high	98.2	Very high	109 Å²	109	45.2 Å²	45.2	57%	0.571	22%	0.224	S	C	*	.	H	α-helix	trans	-59.2	-45.4	177.6	179.1	63.8	0	0	0	112.1	Y78 H79 S80 A84 Y85 V86	Y78-L82 PolarHBondContact O-N 3.46Å; H79-L82 PolarHBondContact O-N 3.48Å; S80-L82 PolarHBondContact O-N 3.44Å; L82-A84 VanDerWaalsContact C-N 3.29Å; L82-A84 PolarHBondContact O-N 3.42Å; L82-Y85 PolarHBondContact O-N 3.25Å; L82-V86 PolarHBondContact O-N 2.91Å
83	C	98.6	Very high	98.3	Very high	11 Å²	11	47 Å²	47	7%	0.074	24%	0.237	C	C	.	.	H	α-helix	trans	-60.1	-40.8	175.2	-74.8	0	0	0	0	111.4	Q45 H79 S80 W81 Y85 V86 A87 F111 T115	Q45-C83 HydrophobicContact CG-CB 4.2Å; H79-C83 PolarHBondContact NE2-SG 3.49Å; H79-C83 VanDerWaalsContact NE2-SG 3.4Å; H79-C83 PolarHBondContact O-N 3.23Å; S80-C83 PolarHBondContact O-N 2.92Å; W81-C83 PolarHBondContact O-N 3.02Å; C83-Y85 PolarHBondContact O-N 3.03Å; C83-V86 PolarHBondContact O-N 3.48Å; C83-A87 PolarHBondContact O-N 3.22Å; C83-F111 WeakPolarHBondContact O-CZ 3.37Å; C83-T115 HydrophobicContact CB-CG2 4.45Å
84	A	98.3	Very high	98.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-36.1	-179.1	0	0	0	0	0	113.2	Q45 Y49 S80 W81 L82 V86 A87 N88 V95	Q45-A84 HydrophobicContact CB-CB 3.66Å; Q45-A84 HydrophobicContact CG-CB 4.3Å; Q45-A84 WeakPolarHBondContact O-CB 3.46Å; Y49-A84 HydrophobicContact CD2-CB 4.26Å; Y49-A84 HydrophobicContact CG-CB 4.24Å; S80-A84 WeakPolarHBondContact O-CB 3.41Å; S80-A84 PolarHBondContact O-N 2.91Å; W81-A84 WeakPolarHBondContact O-CB 3.46Å; W81-A84 PolarHBondContact O-N 2.97Å; W81-A84 VanDerWaalsContact O-N 3.1Å; L82-A84 VanDerWaalsContact C-N 3.29Å; L82-A84 PolarHBondContact O-N 3.42Å; A84-V86 VanDerWaalsContact C-N 3.34Å; A84-V86 PolarHBondContact O-N 2.9Å; A84-A87 WeakPolarHBondContact O-CB 3.33Å; A84-A87 PolarHBondContact O-N 3.41Å; A84-N88 WeakPolarHBondContact O-CB 3.46Å; A84-N88 PolarHBondContact O-N 3.4Å; A84-V95 HydrophobicContact CB-CG1 4.26Å
85	Y	98.4	Very high	98.3	Very high	101 Å²	101	47.6 Å²	47.6	40%	0.396	24%	0.239	S	C	.	.	H	α-helix	trans	-60.8	-44.1	172.2	-89.8	-92.4	0	0	0	111.8	Y49 W81 L82 C83 A87 N88 I89	Y49-Y85 HydrophobicContact CD2-CD1 4.45Å; Y49-Y85 AromaticContact CD2-CD2 3.81Å; Y49-Y85 HydrophobicContact CD2-CD2 3.81Å; Y49-Y85 HydrophobicContact CD2-CE1 4.49Å; Y49-Y85 AromaticContact CD2-CE2 3.75Å; Y49-Y85 HydrophobicContact CD2-CE2 3.75Å; Y49-Y85 HydrophobicContact CD2-CG 4.14Å; Y49-Y85 AromaticContact CE2-CD1 3.82Å; Y49-Y85 HydrophobicContact CE2-CD1 3.82Å; Y49-Y85 HydrophobicContact CE2-CD2 4.01Å; Y49-Y85 AromaticContact CE2-CE1 3.84Å; Y49-Y85 HydrophobicContact CE2-CE1 3.84Å; Y49-Y85 AromaticContact CE2-CE2 3.93Å; Y49-Y85 HydrophobicContact CE2-CE2 3.93Å; Y49-Y85 AromaticContact CE2-CG 3.93Å; Y49-Y85 HydrophobicContact CE2-CG 3.93Å; Y49-Y85 AromaticContact CE2-CZ 3.91Å; W81-Y85 AromaticContact CD1-CE2 3.79Å; W81-Y85 HydrophobicContact CD2-CD2 4.25Å; W81-Y85 HydrophobicContact CD2-CE2 4.01Å; W81-Y85 AromaticContact CE2-CD2 3.99Å; W81-Y85 AromaticContact CE2-CE2 3.32Å; W81-Y85 HydrophobicContact CG-CD2 4.45Å; W81-Y85 HydrophobicContact CG-CE2 4.28Å; W81-Y85 HydrophobicContact CH2-CE2 4.47Å; W81-Y85 HydrophobicContact CZ2-CD2 4.32Å; W81-Y85 AromaticContact CZ2-CE2 3.58Å; W81-Y85 HydrophobicContact CZ2-CE2 3.58Å; W81-Y85 AromaticContact CZ2-CZ 3.98Å; W81-Y85 AromaticContact NE1-CE2 3.28Å; W81-Y85 VanDerWaalsContact NE1-CE2 3.28Å; W81-Y85 WeakPolarHBondContact O-CD2 3.17Å; W81-Y85 PolarHBondContact O-N 3.2Å; W81-Y85 VanDerWaalsContact O-N 3.08Å; L82-Y85 PolarHBondContact O-N 3.25Å; C83-Y85 PolarHBondContact O-N 3.03Å; Y85-A87 VanDerWaalsContact C-N 3.34Å; Y85-N88 PolarHBondContact O-N 3.14Å; Y85-I89 WeakPolarHBondContact O-CD1 3.19Å; Y85-I89 VanDerWaalsContact O-CG1 3.29Å; Y85-I89 WeakPolarHBondContact O-CG1 3.32Å; Y85-I89 PolarHBondContact O-N 2.79Å; Y85-I89 VanDerWaalsContact O-N 3.16Å
86	V	98.6	Very high	98.3	Very high	67 Å²	67	49 Å²	49	41%	0.406	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-40.6	176.3	-176	0	0	0	0	110.4	L82 C83 A84 I89 L90 F111	L82-V86 PolarHBondContact O-N 2.91Å; C83-V86 PolarHBondContact O-N 3.48Å; A84-V86 VanDerWaalsContact C-N 3.34Å; A84-V86 PolarHBondContact O-N 2.9Å; V86-I89 PolarHBondContact O-N 3.28Å; V86-L90 HydrophobicContact CG1-CD1 4.09Å; V86-L90 WeakPolarHBondContact O-CG 3.18Å; V86-L90 PolarHBondContact O-N 3.24Å; V86-L90 VanDerWaalsContact O-N 3.14Å; V86-F111 HydrophobicContact CB-CE2 4.22Å; V86-F111 HydrophobicContact CG1-CE2 3.89Å
87	A	98.4	Very high	98.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.3	-50.5	175.6	0	0	0	0	0	111.1	C83 A84 Y85 I89 L90 N91 W94 V95 F111	C83-A87 PolarHBondContact O-N 3.22Å; A84-A87 WeakPolarHBondContact O-CB 3.33Å; A84-A87 PolarHBondContact O-N 3.41Å; Y85-A87 VanDerWaalsContact C-N 3.34Å; A87-I89 VanDerWaalsContact C-N 3.3Å; A87-I89 PolarHBondContact O-N 3.11Å; A87-L90 PolarHBondContact O-N 3.45Å; A87-L90 VanDerWaalsContact O-N 3.1Å; A87-N91 CarbonylContact O-C 3.44Å; A87-N91 PolarHBondContact O-N 3.37Å; A87-N91 VanDerWaalsContact O-O 3.06Å; A87-W94 HydrophobicContact CB-CE3 4.12Å; A87-V95 HydrophobicContact CB-CG1 3.82Å; A87-F111 HydrophobicContact CB-CD1 4.44Å; A87-F111 HydrophobicContact CB-CE1 3.61Å; A87-F111 HydrophobicContact CB-CZ 3.66Å
88	N	98.3	Very high	98	Very high	46 Å²	46	55.4 Å²	55.4	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-61.3	-36.2	179.7	-176.9	83	0	0	0	113	Y49 A84 Y85 L90 P92 V95	Y49-N88 HydrophobicContact CE1-CB 3.99Å; Y49-N88 HydrophobicContact CE2-CB 4.04Å; Y49-N88 VanDerWaalsContact CZ-CG 3.49Å; Y49-N88 PolarHBondContact OH-ND2 3.47Å; A84-N88 WeakPolarHBondContact O-CB 3.46Å; A84-N88 PolarHBondContact O-N 3.4Å; Y85-N88 PolarHBondContact O-N 3.14Å; N88-L90 VanDerWaalsContact C-N 3.34Å; N88-P92 WeakPolarHBondContact O-CD 3.41Å; N88-P92 WeakPolarHBondContact O-CG 3.32Å; N88-V95 HydrophobicContact CB-CG2 3.88Å
89	I	98.3	Very high	97.9	Very high	134 Å²	134	62 Å²	62	69%	0.687	30%	0.299	S	S	*	.	H	α-helix	trans	-65.9	-38.2	176.2	-68.2	164.3	0	0	0	111.2	Y85 V86 A87	Y85-I89 WeakPolarHBondContact O-CD1 3.19Å; Y85-I89 VanDerWaalsContact O-CG1 3.29Å; Y85-I89 WeakPolarHBondContact O-CG1 3.32Å; Y85-I89 PolarHBondContact O-N 2.79Å; Y85-I89 VanDerWaalsContact O-N 3.16Å; V86-I89 PolarHBondContact O-N 3.28Å; A87-I89 VanDerWaalsContact C-N 3.3Å; A87-I89 PolarHBondContact O-N 3.11Å
90	L	98.2	Very high	97.7	Very high	107 Å²	107	60.7 Å²	60.7	56%	0.56	29%	0.293	S	S	*	.	H	α-helix	trans	-80.7	-45.4	-177.7	-66.9	175	0	0	0	112.4	V86 A87 N88 W94 F111	V86-L90 HydrophobicContact CG1-CD1 4.09Å; V86-L90 WeakPolarHBondContact O-CG 3.18Å; V86-L90 PolarHBondContact O-N 3.24Å; V86-L90 VanDerWaalsContact O-N 3.14Å; A87-L90 PolarHBondContact O-N 3.45Å; A87-L90 VanDerWaalsContact O-N 3.1Å; N88-L90 VanDerWaalsContact C-N 3.34Å; L90-W94 HydrophobicContact CB-CH2 4.11Å; L90-W94 HydrophobicContact CB-CZ3 3.77Å; L90-W94 HydrophobicContact CD1-CZ3 4.13Å; L90-F111 HydrophobicContact CD1-CD2 3.68Å; L90-F111 HydrophobicContact CD1-CE2 4.03Å
91	N	98.3	Very high	97.6	Very high	40 Å²	40	64.4 Å²	64.4	21%	0.214	31%	0.307	C	S	.	.			trans	-159.1	108.6	175.4	-173.3	-21.4	0	0	0	110.2	A87 D93 W94	A87-N91 CarbonylContact O-C 3.44Å; A87-N91 PolarHBondContact O-N 3.37Å; A87-N91 VanDerWaalsContact O-O 3.06Å; N91-D93 PolarHBondContact O-N 2.68Å; N91-D93 VanDerWaalsContact OD1-CB 3.26Å; N91-D93 WeakPolarHBondContact OD1-CB 3.47Å; N91-D93 PolarHBondContact OD1-N 3.31Å; N91-W94 HydrophobicContact CB-CD2 3.72Å; N91-W94 VanDerWaalsContact CB-CE2 3.46Å; N91-W94 HydrophobicContact CB-CE3 4.19Å; N91-W94 HydrophobicContact CB-CG 4.12Å; N91-W94 HydrophobicContact CB-CH2 4.21Å; N91-W94 HydrophobicContact CB-CZ2 3.74Å; N91-W94 HydrophobicContact CB-CZ3 4.41Å; N91-W94 PolarHBondContact ND2-NE1 3.41Å; N91-W94 PolarHBondContact O-N 2.99Å
92	P	97.8	Very high	97.5	Very high	69 Å²	69	60.3 Å²	60.3	45%	0.448	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-55.6	-30.5	178.2	-26.6	35	0	0	0	114.7	N88 W94 V95 E96	N88-P92 WeakPolarHBondContact O-CD 3.41Å; N88-P92 WeakPolarHBondContact O-CG 3.32Å; P92-W94 PolarHBondContact O-N 3Å; P92-W94 VanDerWaalsContact O-N 3.1Å; P92-V95 PolarHBondContact O-N 3.01Å; P92-V95 VanDerWaalsContact O-N 3.16Å; P92-E96 PolarHBondContact O-N 3.34Å; P92-E96 VanDerWaalsContact O-N 3.1Å
93	D	98.1	Very high	97.3	Very high	79 Å²	79	57.9 Å²	57.9	42%	0.422	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-62.5	-22	-176.6	-57.8	-13.7	0	0	0	112.6	N91 V95 S100 Y103	N91-D93 PolarHBondContact O-N 2.68Å; N91-D93 VanDerWaalsContact OD1-CB 3.26Å; N91-D93 WeakPolarHBondContact OD1-CB 3.47Å; N91-D93 PolarHBondContact OD1-N 3.31Å; D93-V95 VanDerWaalsContact C-N 3.27Å; D93-V95 PolarHBondContact O-N 3.5Å; D93-S100 WeakPolarHBondContact O-CB 3.14Å; D93-Y103 HydrophobicContact CB-CE2 4.04Å
94	W	98.1	Very high	97.2	Very high	15 Å²	15	61.1 Å²	61.1	6%	0.057	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-70.5	-25.6	-179.3	-61.9	-10.2	0	0	0	113.2	R42 A87 L90 N91 P92 S100 Y103 A107 H108 F111	R42-W94 PolarHBondContact NH1-O 3.34Å; A87-W94 HydrophobicContact CB-CE3 4.12Å; L90-W94 HydrophobicContact CB-CH2 4.11Å; L90-W94 HydrophobicContact CB-CZ3 3.77Å; L90-W94 HydrophobicContact CD1-CZ3 4.13Å; N91-W94 HydrophobicContact CB-CD2 3.72Å; N91-W94 VanDerWaalsContact CB-CE2 3.46Å; N91-W94 HydrophobicContact CB-CE3 4.19Å; N91-W94 HydrophobicContact CB-CG 4.12Å; N91-W94 HydrophobicContact CB-CH2 4.21Å; N91-W94 HydrophobicContact CB-CZ2 3.74Å; N91-W94 HydrophobicContact CB-CZ3 4.41Å; N91-W94 PolarHBondContact ND2-NE1 3.41Å; N91-W94 PolarHBondContact O-N 2.99Å; P92-W94 PolarHBondContact O-N 3Å; P92-W94 VanDerWaalsContact O-N 3.1Å; W94-S100 WeakPolarHBondContact O-CB 2.9Å; W94-Y103 AromaticContact CD1-CD1 3.88Å; W94-Y103 AromaticContact CD1-CE1 3.3Å; W94-Y103 AromaticContact CD1-CZ 3.53Å; W94-Y103 HydrophobicContact CG-CE1 4.42Å; W94-Y103 AromaticContact NE1-CE1 3.53Å; W94-Y103 AromaticContact NE1-CZ 3.75Å; W94-Y103 PolarHBondContact NE1-OH 3.41Å; W94-A107 HydrophobicContact CZ2-CB 3.93Å; W94-H108 HydrophobicContact CD2-CB 4.21Å; W94-H108 AromaticContact CD2-CD2 3.65Å; W94-H108 HydrophobicContact CG-CB 4.3Å; W94-H108 AromaticContact CG-CD2 3.54Å; W94-H108 HydrophobicContact CZ2-CB 4.39Å; W94-F111 HydrophobicContact CE3-CB 4.24Å; W94-F111 AromaticContact CE3-CD1 3.85Å; W94-F111 HydrophobicContact CE3-CD1 3.85Å; W94-F111 HydrophobicContact CE3-CE1 4.43Å; W94-F111 AromaticContact CE3-CG 3.97Å; W94-F111 HydrophobicContact CE3-CG 3.97Å; W94-F111 HydrophobicContact CH2-CB 3.81Å; W94-F111 HydrophobicContact CH2-CG 4.28Å; W94-F111 HydrophobicContact CZ3-CB 3.51Å; W94-F111 AromaticContact CZ3-CD1 3.86Å; W94-F111 HydrophobicContact CZ3-CD1 3.86Å; W94-F111 AromaticContact CZ3-CD2 3.94Å; W94-F111 HydrophobicContact CZ3-CD2 3.94Å; W94-F111 AromaticContact CZ3-CG 3.47Å; W94-F111 HydrophobicContact CZ3-CG 3.47Å; W94-F111 VanDerWaalsContact CZ3-CG 3.47Å
95	V	97.9	Very high	97.1	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.006	30%	0.303	C	S	.	.	S	Bend	trans	-126.4	13.6	-176.9	-63.4	0	0	0	0	112	Q45 Y49 N50 A84 A87 N88 P92 D93 L97	Q45-V95 HydrophobicContact CB-CG1 4.1Å; Y49-V95 HydrophobicContact CD1-CG2 4.1Å; Y49-V95 HydrophobicContact CE1-CG2 4.47Å; N50-V95 PolarHBondContact ND2-O 3.37Å; A84-V95 HydrophobicContact CB-CG1 4.26Å; A87-V95 HydrophobicContact CB-CG1 3.82Å; N88-V95 HydrophobicContact CB-CG2 3.88Å; P92-V95 PolarHBondContact O-N 3.01Å; P92-V95 VanDerWaalsContact O-N 3.16Å; D93-V95 VanDerWaalsContact C-N 3.27Å; D93-V95 PolarHBondContact O-N 3.5Å; V95-L97 PolarHBondContact O-N 3.45Å
96	E	97.6	Very high	97.1	Very high	65 Å²	65	63.1 Å²	63.1	30%	0.304	32%	0.32	S	S	.	.			trans	-64.8	121.5	178.2	-169.9	-176.6	-176.1	0	0	110.4	P92 H98 R99 S100	P92-E96 PolarHBondContact O-N 3.34Å; P92-E96 VanDerWaalsContact O-N 3.1Å; E96-H98 PolarHBondContact O-N 3.06Å; E96-R99 HydrophobicContact CB-CB 4.36Å; E96-R99 HydrophobicContact CG-CB 4.16Å; E96-R99 PolarHBondContact O-N 3.2Å; E96-R99 WeakPolarHBondContact OE1-CD 3.42Å; E96-R99 IonicContact OE1-CZ 3.84Å; E96-R99 IonicContact OE1-NE 3.53Å; E96-R99 IonicContact OE1-NH1 3.82Å; E96-R99 PolarHBondContact OE1-NH1 2.85Å; E96-R99 WeakPolarHBondContact OE2-CD 3.48Å; E96-R99 IonicContact OE2-NH1 2.94Å; E96-S100 PolarHBondContact N-OG 2.88Å; E96-S100 VanDerWaalsContact O-CB 3.23Å; E96-S100 WeakPolarHBondContact O-CB 3.26Å; E96-S100 PolarHBondContact O-N 3.2Å; E96-S100 PolarHBondContact O-OG 2.98Å
97	L	96.8	Very high	97.1	Very high	40 Å²	40	62.4 Å²	62.4	21%	0.209	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	134	-178.2	-169.4	69	0	0	0	110.7	E46 N50 L51 D62 V95 R99	E46-L97 HydrophobicContact CG-CD1 4.22Å; E46-L97 WeakPolarHBondContact OE1-CA 3.34Å; N50-L97 HydrophobicContact CB-CB 4.11Å; N50-L97 HydrophobicContact CB-CD1 4.09Å; N50-L97 HydrophobicContact CB-CD2 4.29Å; N50-L97 HydrophobicContact CB-CG 4.39Å; L51-L97 HydrophobicContact CD2-CD1 4.12Å; L51-L97 HydrophobicContact CD2-CD2 3.94Å; L51-L97 HydrophobicContact CG-CD1 4.43Å; D62-L97 HydrophobicContact CB-CD2 4.38Å; V95-L97 PolarHBondContact O-N 3.45Å; L97-R99 PolarHBondContact O-N 3.46Å
98	H	94.1	Very high	97	Very high	96 Å²	96	62.4 Å²	62.4	44%	0.444	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	-17.2	179.7	-57.3	-63.8	0	0	0	116.6	E46 D62 E96	E46-H98 PolarHBondContact OE1-N 3.11Å; D62-H98 IonicContact OD1-CD2 2.8Å; D62-H98 IonicContact OD1-CE1 3.31Å; D62-H98 PolarHBondContact OD1-CE1 3.23Å; D62-H98 IonicContact OD1-NE2 3.73Å; D62-H98 PolarHBondContact OD1-NE2 3.16Å; E96-H98 PolarHBondContact O-N 3.06Å
99	R	95.6	Very high	97	Very high	190 Å²	190	62.3 Å²	62.3	72%	0.717	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-30.3	180	-66.5	-159.5	-177.2	150.5	-11.5	114.1	E96 L97 R101	E96-R99 HydrophobicContact CB-CB 4.36Å; E96-R99 HydrophobicContact CG-CB 4.16Å; E96-R99 PolarHBondContact O-N 3.2Å; E96-R99 WeakPolarHBondContact OE1-CD 3.42Å; E96-R99 IonicContact OE1-CZ 3.84Å; E96-R99 IonicContact OE1-NE 3.53Å; E96-R99 IonicContact OE1-NH1 3.82Å; E96-R99 PolarHBondContact OE1-NH1 2.85Å; E96-R99 WeakPolarHBondContact OE2-CD 3.48Å; E96-R99 IonicContact OE2-NH1 2.94Å; L97-R99 PolarHBondContact O-N 3.46Å; R99-R101 VanDerWaalsContact C-N 3.27Å; R99-R101 PolarHBondContact O-N 3.24Å
100	S	96.1	Very high	97	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.31	C	S	.	.			trans	-80.7	-0.5	-175.4	61.3	0	0	0	0	114.6	R42 E46 D93 W94 E96 G102 Y103	R42-S100 PolarHBondContact NE-O 3.39Å; R42-S100 PolarHBondContact NH1-O 3.29Å; R42-S100 PolarHBondContact NH1-OG 2.92Å; R42-S100 PolarHBondContact NH2-O 3.31Å; E46-S100 VanDerWaalsContact CD-OG 3.28Å; E46-S100 PolarHBondContact OE2-OG 3.18Å; D93-S100 WeakPolarHBondContact O-CB 3.14Å; W94-S100 WeakPolarHBondContact O-CB 2.9Å; E96-S100 PolarHBondContact N-OG 2.88Å; E96-S100 VanDerWaalsContact O-CB 3.23Å; E96-S100 WeakPolarHBondContact O-CB 3.26Å; E96-S100 PolarHBondContact O-N 3.2Å; E96-S100 PolarHBondContact O-OG 2.98Å; S100-G102 PolarHBondContact O-N 2.94Å; S100-Y103 WeakPolarHBondContact O-CB 3.43Å; S100-Y103 PolarHBondContact O-N 3.23Å
101	R	95.6	Very high	97.1	Very high	81 Å²	81	56.1 Å²	56.1	31%	0.306	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	123.4	176.9	-68.1	-171.6	-175.7	-171.4	2.8	111.1	Y67 R99 Y103	Y67-R101 HydrophobicContact CD1-CG 4.37Å; Y67-R101 HydrophobicContact CE1-CB 4.05Å; Y67-R101 HydrophobicContact CE1-CG 3.8Å; R99-R101 VanDerWaalsContact C-N 3.27Å; R99-R101 PolarHBondContact O-N 3.24Å; R101-Y103 VanDerWaalsContact C-N 3.29Å
102	G	95.1	Very high	97.1	Very high	15 Å²	15	54.2 Å²	54.2	16%	0.155	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	23.1	-176.8	0	0	0	0	0	114.2	E39 Y67 S100 E104	E39-G102 VanDerWaalsContact CD-N 3.25Å; E39-G102 PolarHBondContact OE1-N 3.31Å; E39-G102 PolarHBondContact OE2-N 3Å; Y67-G102 PolarHBondContact OH-N 3.21Å; S100-G102 PolarHBondContact O-N 2.94Å; G102-E104 PolarHBondContact O-N 2.97Å
103	Y	96.2	Very high	97.1	Very high	59 Å²	59	51.1 Å²	51.1	23%	0.231	26%	0.255	C	S	.	.			trans	-66.8	121.2	-179.6	-174.2	-78	0	0	0	111.5	D93 W94 S100 R101 S105 H108	D93-Y103 HydrophobicContact CB-CE2 4.04Å; W94-Y103 AromaticContact CD1-CD1 3.88Å; W94-Y103 AromaticContact CD1-CE1 3.3Å; W94-Y103 AromaticContact CD1-CZ 3.53Å; W94-Y103 HydrophobicContact CG-CE1 4.42Å; W94-Y103 AromaticContact NE1-CE1 3.53Å; W94-Y103 AromaticContact NE1-CZ 3.75Å; W94-Y103 PolarHBondContact NE1-OH 3.41Å; S100-Y103 WeakPolarHBondContact O-CB 3.43Å; S100-Y103 PolarHBondContact O-N 3.23Å; R101-Y103 VanDerWaalsContact C-N 3.29Å; Y103-S105 WeakPolarHBondContact CE1-OG 3.43Å; Y103-H108 HydrophobicContact CD1-CB 3.97Å; Y103-H108 AromaticContact CD1-CG 3.93Å; Y103-H108 AromaticContact CD1-ND1 3.91Å; Y103-H108 HydrophobicContact CE1-CB 3.75Å; Y103-H108 PolarHBondContact O-ND1 3.5Å
104	E	95.6	Very high	97.1	Very high	79 Å²	79	49.9 Å²	49.9	37%	0.369	25%	0.251	S	S	.	.			trans	-123.6	121.8	177.1	-62.5	-167.8	116.8	0	0	110.6	Y26 A29 G30 F35 G102	Y26-E104 PolarHBondContact OH-OE1 3.08Å; A29-E104 WeakPolarHBondContact CA-OE1 3.37Å; G30-E104 PolarHBondContact N-OE1 2.93Å; G30-E104 PolarHBondContact N-OE2 3.04Å; F35-E104 HydrophobicContact CE1-CG 4.29Å; G102-E104 PolarHBondContact O-N 2.97Å
105	S	97	Very high	97.1	Very high	26 Å²	26	49.8 Å²	49.8	18%	0.182	25%	0.252	C	S	.	.			trans	-151.1	154.8	167.5	84.4	0	0	0	0	111.1	Y103 A107 H108 K109	Y103-S105 WeakPolarHBondContact CE1-OG 3.43Å; S105-A107 PolarHBondContact O-N 3.05Å; S105-H108 PolarHBondContact O-N 3.26Å; S105-H108 WeakPolarHBondContact OG-CB 3.16Å; S105-H108 PolarHBondContact OG-N 3.3Å; S105-K109 WeakPolarHBondContact O-CB 3.35Å; S105-K109 PolarHBondContact O-N 3.49Å
106	P	97.3	Very high	97.1	Very high	116 Å²	116	49.9 Å²	49.9	75%	0.753	25%	0.252	S	S	*	.	H	α-helix	trans	-58.1	-36.1	175.4	-25.9	35.1	0	0	0	113.2	L110	P106-L110 WeakPolarHBondContact O-CB 3.46Å; P106-L110 PolarHBondContact O-N 3.28Å
107	A	98.1	Very high	97.2	Very high	52 Å²	52	48.2 Å²	48.2	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-69.5	-42.4	178.4	0	0	0	0	0	111.9	W94 S105 L110 F111	W94-A107 HydrophobicContact CZ2-CB 3.93Å; S105-A107 PolarHBondContact O-N 3.05Å; A107-L110 WeakPolarHBondContact O-CB 3.3Å; A107-L110 PolarHBondContact O-N 2.96Å; A107-F111 PolarHBondContact O-N 3.07Å
108	H	97.9	Very high	97.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-40.1	175.9	-178.4	-120.7	0	0	0	111.6	Y38 R42 W94 Y103 S105 L110 F111 M112	Y38-H108 AromaticContact CE1-CE1 3.64Å; Y38-H108 AromaticContact CE1-ND1 3.74Å; Y38-H108 AromaticContact CZ-CE1 3.79Å; Y38-H108 AromaticContact CZ-ND1 3.8Å; Y38-H108 VanDerWaalsContact OH-C 3.26Å; Y38-H108 PolarHBondContact OH-CE1 3.34Å; Y38-H108 VanDerWaalsContact OH-CE1 3.25Å; Y38-H108 PolarHBondContact OH-ND1 2.96Å; Y38-H108 PolarHBondContact OH-O 2.97Å; Y38-H108 VanDerWaalsContact OH-O 3.14Å; R42-H108 VanDerWaalsContact CG-CE1 3.48Å; R42-H108 WeakPolarHBondContact CG-CE1 3.23Å; W94-H108 HydrophobicContact CD2-CB 4.21Å; W94-H108 AromaticContact CD2-CD2 3.65Å; W94-H108 HydrophobicContact CG-CB 4.3Å; W94-H108 AromaticContact CG-CD2 3.54Å; W94-H108 HydrophobicContact CZ2-CB 4.39Å; Y103-H108 HydrophobicContact CD1-CB 3.97Å; Y103-H108 AromaticContact CD1-CG 3.93Å; Y103-H108 AromaticContact CD1-ND1 3.91Å; Y103-H108 HydrophobicContact CE1-CB 3.75Å; Y103-H108 PolarHBondContact O-ND1 3.5Å; S105-H108 PolarHBondContact O-N 3.26Å; S105-H108 WeakPolarHBondContact OG-CB 3.16Å; S105-H108 PolarHBondContact OG-N 3.3Å; H108-L110 PolarHBondContact O-N 3.43Å; H108-F111 PolarHBondContact O-N 2.86Å; H108-M112 WeakPolarHBondContact O-CB 3.4Å; H108-M112 WeakPolarHBondContact O-CG 3.19Å; H108-M112 PolarHBondContact O-N 3.46Å
109	K	98.2	Very high	97.4	Very high	45 Å²	45	46 Å²	46	20%	0.196	24%	0.24	C	C	.	.	H	α-helix	trans	-56.4	-49.1	170.7	-175	-173	178.1	-177.9	0	111.2	L23 N24 Y26 Y38 S105 F111 M112 R113	L23-K109 PolarHBondContact O-NZ 3.5Å; N24-K109 WeakPolarHBondContact O-CE 3.4Å; N24-K109 PolarHBondContact O-NZ 3.07Å; Y26-K109 HydrophobicContact CD1-CD 4.15Å; Y26-K109 HydrophobicContact CD1-CG 4.16Å; Y26-K109 HydrophobicContact CE1-CB 4.49Å; Y26-K109 HydrophobicContact CE1-CD 3.96Å; Y26-K109 HydrophobicContact CE1-CG 4.03Å; Y38-K109 VanDerWaalsContact OH-CA 3.27Å; Y38-K109 WeakPolarHBondContact OH-CA 3.41Å; Y38-K109 PolarHBondContact OH-N 3.36Å; S105-K109 WeakPolarHBondContact O-CB 3.35Å; S105-K109 PolarHBondContact O-N 3.49Å; K109-F111 PolarHBondContact O-N 2.93Å; K109-M112 PolarHBondContact O-N 3.29Å; K109-R113 HydrophobicContact CG-CG 4.39Å; K109-R113 VanDerWaalsContact O-CG 3.29Å; K109-R113 WeakPolarHBondContact O-CG 3.38Å; K109-R113 PolarHBondContact O-N 3.38Å
110	L	98.3	Very high	97.5	Very high	95 Å²	95	37.1 Å²	37.1	50%	0.497	21%	0.207	S	C	.	.	H	α-helix	trans	-59.3	-46.2	178.4	176.8	62.8	0	0	0	111.9	W19 P106 A107 H108 R113 T114	W19-L110 HydrophobicContact CH2-CD1 3.74Å; W19-L110 HydrophobicContact CZ2-CD1 3.63Å; P106-L110 WeakPolarHBondContact O-CB 3.46Å; P106-L110 PolarHBondContact O-N 3.28Å; A107-L110 WeakPolarHBondContact O-CB 3.3Å; A107-L110 PolarHBondContact O-N 2.96Å; H108-L110 PolarHBondContact O-N 3.43Å; L110-R113 PolarHBondContact O-N 3.42Å; L110-T114 WeakPolarHBondContact O-CB 3.4Å; L110-T114 PolarHBondContact O-N 3.42Å; L110-T114 PolarHBondContact O-OG1 3.18Å
111	F	98.6	Very high	97.6	Very high	16 Å²	16	40.3 Å²	40.3	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-56.3	-54.8	176.5	167.8	-106.4	0	0	0	111.2	C83 V86 A87 L90 W94 A107 H108 K109 R113 T114 T115	C83-F111 WeakPolarHBondContact O-CZ 3.37Å; V86-F111 HydrophobicContact CB-CE2 4.22Å; V86-F111 HydrophobicContact CG1-CE2 3.89Å; A87-F111 HydrophobicContact CB-CD1 4.44Å; A87-F111 HydrophobicContact CB-CE1 3.61Å; A87-F111 HydrophobicContact CB-CZ 3.66Å; L90-F111 HydrophobicContact CD1-CD2 3.68Å; L90-F111 HydrophobicContact CD1-CE2 4.03Å; W94-F111 HydrophobicContact CE3-CB 4.24Å; W94-F111 AromaticContact CE3-CD1 3.85Å; W94-F111 HydrophobicContact CE3-CD1 3.85Å; W94-F111 HydrophobicContact CE3-CE1 4.43Å; W94-F111 AromaticContact CE3-CG 3.97Å; W94-F111 HydrophobicContact CE3-CG 3.97Å; W94-F111 HydrophobicContact CH2-CB 3.81Å; W94-F111 HydrophobicContact CH2-CG 4.28Å; W94-F111 HydrophobicContact CZ3-CB 3.51Å; W94-F111 AromaticContact CZ3-CD1 3.86Å; W94-F111 HydrophobicContact CZ3-CD1 3.86Å; W94-F111 AromaticContact CZ3-CD2 3.94Å; W94-F111 HydrophobicContact CZ3-CD2 3.94Å; W94-F111 AromaticContact CZ3-CG 3.47Å; W94-F111 HydrophobicContact CZ3-CG 3.47Å; W94-F111 VanDerWaalsContact CZ3-CG 3.47Å; A107-F111 PolarHBondContact O-N 3.07Å; H108-F111 PolarHBondContact O-N 2.86Å; K109-F111 PolarHBondContact O-N 2.93Å; F111-R113 PolarHBondContact O-N 3.25Å; F111-T114 WeakPolarHBondContact O-CA 3.3Å; F111-T114 VanDerWaalsContact O-CB 3.32Å; F111-T114 WeakPolarHBondContact O-CB 3.26Å; F111-T114 PolarHBondContact O-N 3.12Å; F111-T115 HydrophobicContact CD2-CG2 4.39Å; F111-T115 HydrophobicContact CE1-CG2 4.18Å; F111-T115 HydrophobicContact CE2-CG2 3.86Å; F111-T115 HydrophobicContact CZ-CG2 3.73Å; F111-T115 PolarHBondContact O-N 2.91Å
112	M	98.5	Very high	97.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-42.7	-179.8	-72.8	-67.8	-92.5	0	0	112.1	Y38 Q41 R42 Q45 H108 K109 T114 T115 V116 F164	Y38-M112 HydrophobicContact CE2-CB 3.51Å; Y38-M112 HydrophobicContact CE2-CE 4.47Å; Y38-M112 HydrophobicContact CE2-CG 3.88Å; Y38-M112 VanDerWaalsContact OH-CG 3.29Å; Y38-M112 WeakPolarHBondContact OH-CG 3.39Å; Q41-M112 HydrophobicContact CB-CE 3.94Å; R42-M112 HydrophobicContact CB-CE 4.03Å; Q45-M112 PolarHBondContact NE2-SD 3.1Å; H108-M112 WeakPolarHBondContact O-CB 3.4Å; H108-M112 WeakPolarHBondContact O-CG 3.19Å; H108-M112 PolarHBondContact O-N 3.46Å; K109-M112 PolarHBondContact O-N 3.29Å; M112-T114 PolarHBondContact O-N 2.89Å; M112-T115 PolarHBondContact O-N 3.48Å; M112-T115 PolarHBondContact O-OG1 3.4Å; M112-V116 PolarHBondContact O-N 3.24Å; M112-F164 VanDerWaalsContact C-CE2 3.44Å; M112-F164 HydrophobicContact CB-CE2 3.61Å; M112-F164 HydrophobicContact CB-CZ 3.61Å; M112-F164 HydrophobicContact CE-CE1 3.53Å; M112-F164 HydrophobicContact CE-CZ 3.6Å; M112-F164 HydrophobicContact CG-CZ 4.3Å; M112-F164 WeakPolarHBondContact O-CE2 3.44Å; M112-F164 HydrophobicContact SD-CZ 4.04Å
113	R	98.1	Very high	97.9	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.011	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-32.7	175	-67.8	-55.2	-160.7	-164.1	-3.1	112.4	W19 S22 N24 S25 K109 L110 F111 L117 Y161 G162	W19-R113 HydrophobicContact CZ3-CB 4.36Å; S22-R113 PolarHBondContact O-NE 2.96Å; S22-R113 VanDerWaalsContact O-NE 3.08Å; N24-R113 PolarHBondContact O-NH2 3.5Å; S25-R113 PolarHBondContact O-NH2 3.23Å; K109-R113 HydrophobicContact CG-CG 4.39Å; K109-R113 VanDerWaalsContact O-CG 3.29Å; K109-R113 WeakPolarHBondContact O-CG 3.38Å; K109-R113 PolarHBondContact O-N 3.38Å; L110-R113 PolarHBondContact O-N 3.42Å; F111-R113 PolarHBondContact O-N 3.25Å; R113-L117 PolarHBondContact O-N 3.41Å; R113-Y161 PolarHBondContact NE-O 3.16Å; R113-Y161 VanDerWaalsContact NH1-C 3.27Å; R113-Y161 PolarHBondContact NH1-O 3.46Å; R113-Y161 PolarHBondContact NH2-O 2.69Å; R113-G162 VanDerWaalsContact CZ-O 3.3Å; R113-G162 PolarHBondContact NH1-O 2.94Å; R113-G162 PolarHBondContact NH2-O 2.83Å
114	T	98.4	Very high	98	Very high	53 Å²	53	40.3 Å²	40.3	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-70.8	-39.7	178.8	-55.3	0	0	0	0	111.5	L110 F111 M112 V116 L117 V118	L110-T114 WeakPolarHBondContact O-CB 3.4Å; L110-T114 PolarHBondContact O-N 3.42Å; L110-T114 PolarHBondContact O-OG1 3.18Å; F111-T114 WeakPolarHBondContact O-CA 3.3Å; F111-T114 VanDerWaalsContact O-CB 3.32Å; F111-T114 WeakPolarHBondContact O-CB 3.26Å; F111-T114 PolarHBondContact O-N 3.12Å; M112-T114 PolarHBondContact O-N 2.89Å; T114-V116 VanDerWaalsContact C-N 3.32Å; T114-V116 PolarHBondContact O-N 3.37Å; T114-L117 PolarHBondContact O-N 2.93Å; T114-L117 VanDerWaalsContact O-N 3.16Å; T114-V118 HydrophobicContact CG2-CG2 4.23Å; T114-V118 WeakPolarHBondContact O-CG2 3.47Å; T114-V118 PolarHBondContact O-N 3.26Å
115	T	98.5	Very high	98.2	Very high	14 Å²	14	36.9 Å²	36.9	9%	0.086	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-40.9	177.5	57.6	0	0	0	0	111.4	C83 F111 M112 V118 T119 Y166	C83-T115 HydrophobicContact CB-CG2 4.45Å; F111-T115 HydrophobicContact CD2-CG2 4.39Å; F111-T115 HydrophobicContact CE1-CG2 4.18Å; F111-T115 HydrophobicContact CE2-CG2 3.86Å; F111-T115 HydrophobicContact CZ-CG2 3.73Å; F111-T115 PolarHBondContact O-N 2.91Å; M112-T115 PolarHBondContact O-N 3.48Å; M112-T115 PolarHBondContact O-OG1 3.4Å; T115-V118 PolarHBondContact O-N 2.71Å; T115-T119 WeakPolarHBondContact O-CG2 3.44Å; T115-T119 PolarHBondContact O-N 3.26Å; T115-T119 VanDerWaalsContact O-N 3.1Å; T115-T119 PolarHBondContact O-OG1 2.86Å; T115-Y166 PolarHBondContact OG1-OH 3.16Å
116	V	98.3	Very high	98.3	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-50.1	172.9	178.7	0	0	0	0	110.5	M112 T114 V118 T119 D120 D160 Y161 F164 Y166	M112-V116 PolarHBondContact O-N 3.24Å; T114-V116 VanDerWaalsContact C-N 3.32Å; T114-V116 PolarHBondContact O-N 3.37Å; V116-V118 PolarHBondContact O-N 3.04Å; V116-T119 PolarHBondContact O-N 3.3Å; V116-T119 PolarHBondContact O-OG1 3.24Å; V116-D120 WeakPolarHBondContact O-CB 3.36Å; V116-D120 PolarHBondContact O-N 3.3Å; V116-D160 HydrophobicContact CG1-CB 4.1Å; V116-Y161 HydrophobicContact CG1-CD1 4.36Å; V116-Y161 HydrophobicContact CG1-CD2 4.49Å; V116-Y161 HydrophobicContact CG1-CE1 4.06Å; V116-Y161 HydrophobicContact CG1-CE2 4.2Å; V116-F164 HydrophobicContact CG2-CD2 4.2Å; V116-F164 HydrophobicContact CG2-CE2 3.58Å; V116-F164 HydrophobicContact CG2-CZ 3.87Å; V116-Y166 HydrophobicContact CB-CD1 4.47Å; V116-Y166 HydrophobicContact CB-CE1 4.22Å; V116-Y166 HydrophobicContact CG2-CD1 3.89Å; V116-Y166 HydrophobicContact CG2-CE1 3.53Å
117	L	98.5	Very high	98.3	Very high	30 Å²	30	32 Å²	32	16%	0.157	18%	0.183	C	C	.	.	H	α-helix	trans	-58.8	-44.9	178.8	179.8	61.9	0	0	0	112.8	V15 W19 R113 T114 T119 D120 V121 Y161	V15-L117 HydrophobicContact CG1-CD1 4.05Å; V15-L117 HydrophobicContact CG2-CD1 4.45Å; W19-L117 HydrophobicContact CE3-CD2 3.81Å; W19-L117 HydrophobicContact CZ3-CB 4.44Å; W19-L117 HydrophobicContact CZ3-CD2 3.91Å; R113-L117 PolarHBondContact O-N 3.41Å; T114-L117 PolarHBondContact O-N 2.93Å; T114-L117 VanDerWaalsContact O-N 3.16Å; L117-T119 VanDerWaalsContact C-N 3.34Å; L117-T119 PolarHBondContact O-N 2.96Å; L117-D120 PolarHBondContact O-N 3.18Å; L117-V121 HydrophobicContact CD1-CG2 3.96Å; L117-V121 HydrophobicContact CG-CG2 4.32Å; L117-V121 WeakPolarHBondContact O-CB 3.22Å; L117-V121 WeakPolarHBondContact O-CG2 3.23Å; L117-V121 PolarHBondContact O-N 2.79Å; L117-Y161 WeakPolarHBondContact CA-OH 3.36Å; L117-Y161 HydrophobicContact CB-CE1 4.08Å; L117-Y161 HydrophobicContact CD1-CE1 4.22Å
118	V	98.5	Very high	98.3	Very high	73 Å²	73	29.5 Å²	29.5	44%	0.442	16%	0.163	S	C	.	.	H	α-helix	trans	-58.6	-48.5	179.5	167.5	0	0	0	0	110.2	T114 T115 V116 D120 V121 L122	T114-V118 HydrophobicContact CG2-CG2 4.23Å; T114-V118 WeakPolarHBondContact O-CG2 3.47Å; T114-V118 PolarHBondContact O-N 3.26Å; T115-V118 PolarHBondContact O-N 2.71Å; V116-V118 PolarHBondContact O-N 3.04Å; V118-D120 VanDerWaalsContact C-N 3.33Å; V118-D120 PolarHBondContact O-N 3.15Å; V118-V121 PolarHBondContact O-N 2.87Å; V118-L122 HydrophobicContact CG1-CD1 3.74Å; V118-L122 HydrophobicContact CG1-CG 4.42Å; V118-L122 WeakPolarHBondContact O-CB 3.4Å; V118-L122 VanDerWaalsContact O-CG 3.23Å; V118-L122 WeakPolarHBondContact O-CG 3.43Å; V118-L122 PolarHBondContact O-N 2.88Å
119	T	97.9	Very high	98.4	Very high	16 Å²	16	30.3 Å²	30.3	10%	0.098	17%	0.168	C	C	.	.	H	α-helix	trans	-64.9	-36.6	179.3	61.9	0	0	0	0	113.2	H79 T115 V116 L117 L122 I123 V169	H79-T119 WeakPolarHBondContact NE2-CG2 3.33Å; T115-T119 WeakPolarHBondContact O-CG2 3.44Å; T115-T119 PolarHBondContact O-N 3.26Å; T115-T119 VanDerWaalsContact O-N 3.1Å; T115-T119 PolarHBondContact O-OG1 2.86Å; V116-T119 PolarHBondContact O-N 3.3Å; V116-T119 PolarHBondContact O-OG1 3.24Å; L117-T119 VanDerWaalsContact C-N 3.34Å; L117-T119 PolarHBondContact O-N 2.96Å; T119-L122 PolarHBondContact O-N 2.95Å; T119-I123 WeakPolarHBondContact O-CB 3.5Å; T119-I123 PolarHBondContact O-N 3.02Å; T119-V169 HydrophobicContact CG2-CG2 4.11Å
120	D	97.1	Very high	98.4	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	17%	0.17	C	C	.	.	I	π-helix	trans	-66.3	-43.2	177.9	-159.1	25	0	0	0	111.5	R18 V116 L117 V118 L122 Y124 I125 Y161	R18-D120 VanDerWaalsContact CD-OD2 3.3Å; R18-D120 WeakPolarHBondContact CD-OD2 3.48Å; R18-D120 IonicContact CZ-OD2 2.74Å; R18-D120 IonicContact NE-OD2 3.94Å; R18-D120 PolarHBondContact NE-OD2 3.28Å; R18-D120 IonicContact NH2-OD2 2.93Å; V116-D120 WeakPolarHBondContact O-CB 3.36Å; V116-D120 PolarHBondContact O-N 3.3Å; L117-D120 PolarHBondContact O-N 3.18Å; V118-D120 VanDerWaalsContact C-N 3.33Å; V118-D120 PolarHBondContact O-N 3.15Å; D120-L122 VanDerWaalsContact C-N 3.34Å; D120-L122 PolarHBondContact O-N 3.25Å; D120-Y124 PolarHBondContact O-N 3Å; D120-Y124 VanDerWaalsContact O-N 3.15Å; D120-Y124 WeakPolarHBondContact OD1-CB 3.32Å; D120-Y124 WeakPolarHBondContact OD1-CD1 3.46Å; D120-I125 WeakPolarHBondContact O-CB 3.12Å; D120-I125 WeakPolarHBondContact O-CG1 3.17Å; D120-I125 PolarHBondContact O-N 2.7Å; D120-Y161 WeakPolarHBondContact CB-OH 3.33Å; D120-Y161 VanDerWaalsContact CG-OH 3.25Å; D120-Y161 WeakPolarHBondContact OD2-CE2 3.41Å; D120-Y161 PolarHBondContact OD2-OH 2.95Å
121	V	98.2	Very high	98.4	Very high	68 Å²	68	26 Å²	26	41%	0.412	15%	0.147	S	C	.	.	I	π-helix	trans	-66.3	-33.8	175.7	170.3	0	0	0	0	112.2	L117 V118 I125 P126	L117-V121 HydrophobicContact CD1-CG2 3.96Å; L117-V121 HydrophobicContact CG-CG2 4.32Å; L117-V121 WeakPolarHBondContact O-CB 3.22Å; L117-V121 WeakPolarHBondContact O-CG2 3.23Å; L117-V121 PolarHBondContact O-N 2.79Å; V118-V121 PolarHBondContact O-N 2.87Å; V121-I125 HydrophobicContact CG2-CD1 4.08Å; V121-P126 WeakPolarHBondContact O-CD 3.25Å; V121-P126 WeakPolarHBondContact O-CG 3.43Å
122	L	98.4	Very high	98.3	Very high	123 Å²	123	25.2 Å²	25.2	64%	0.644	14%	0.144	S	C	*	.	I	π-helix	trans	-81.7	-33.1	-179.6	-69.6	176	0	0	0	113.3	V118 T119 D120	V118-L122 HydrophobicContact CG1-CD1 3.74Å; V118-L122 HydrophobicContact CG1-CG 4.42Å; V118-L122 WeakPolarHBondContact O-CB 3.4Å; V118-L122 VanDerWaalsContact O-CG 3.23Å; V118-L122 WeakPolarHBondContact O-CG 3.43Å; V118-L122 PolarHBondContact O-N 2.88Å; T119-L122 PolarHBondContact O-N 2.95Å; D120-L122 VanDerWaalsContact C-N 3.34Å; D120-L122 PolarHBondContact O-N 3.25Å
123	I	98.6	Very high	98.2	Very high	27 Å²	27	26.4 Å²	26.4	14%	0.138	15%	0.149	C	C	.	.	I	π-helix	trans	-117	-63.2	-166.6	-55.3	177.4	0	0	0	111.6	T119 A127 V169 F173 W176	T119-I123 WeakPolarHBondContact O-CB 3.5Å; T119-I123 PolarHBondContact O-N 3.02Å; I123-A127 WeakPolarHBondContact O-CB 3.26Å; I123-A127 PolarHBondContact O-N 2.61Å; I123-V169 HydrophobicContact CD1-CB 4.41Å; I123-V169 HydrophobicContact CD1-CG1 3.72Å; I123-V169 HydrophobicContact CD1-CG2 4.27Å; I123-F173 HydrophobicContact CD1-CE2 4.07Å; I123-F173 HydrophobicContact CD1-CZ 3.87Å; I123-F173 HydrophobicContact CG2-CD1 4.17Å; I123-F173 HydrophobicContact CG2-CE1 4.22Å; I123-F173 HydrophobicContact CG2-CG 4.32Å; I123-F173 HydrophobicContact CG2-CZ 4.43Å; I123-W176 PolarHBondContact O-NE1 2.69Å
124	Y	98.8	Very high	98.1	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.016	18%	0.176	C	C	.	.	I	π-helix	trans	-78.3	-49.2	-168.5	179.5	-99.3	0	0	0	113.3	D120 A127 V128 L151 L156 G168 L171 L353	D120-Y124 PolarHBondContact O-N 3Å; D120-Y124 VanDerWaalsContact O-N 3.15Å; D120-Y124 WeakPolarHBondContact OD1-CB 3.32Å; D120-Y124 WeakPolarHBondContact OD1-CD1 3.46Å; Y124-A127 WeakPolarHBondContact O-CB 3.17Å; Y124-A127 PolarHBondContact O-N 3.19Å; Y124-A127 VanDerWaalsContact O-N 3.1Å; Y124-V128 HydrophobicContact CD1-CG2 4.2Å; Y124-V128 HydrophobicContact CE1-CG2 3.77Å; Y124-V128 HydrophobicContact CE2-CG2 4.16Å; Y124-V128 WeakPolarHBondContact O-CG2 3.44Å; Y124-V128 PolarHBondContact O-N 3.16Å; Y124-L151 HydrophobicContact CE1-CD2 4.44Å; Y124-L156 HydrophobicContact CD1-CD2 4.32Å; Y124-L156 HydrophobicContact CD2-CD2 4.47Å; Y124-L156 HydrophobicContact CE1-CD2 3.66Å; Y124-L156 HydrophobicContact CE2-CD2 3.84Å; Y124-L156 WeakPolarHBondContact OH-CD2 3.48Å; Y124-G168 WeakPolarHBondContact CB-O 3.41Å; Y124-L171 HydrophobicContact CD2-CB 4.44Å; Y124-L171 HydrophobicContact CE2-CB 4.36Å; Y124-L353 HydrophobicContact CE2-CD1 4.4Å
125	I	98.6	Very high	97.9	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.041	17%	0.169	C	C	.	.	H	α-helix	trans	-58.3	-47.6	-178.9	-65.8	174.2	0	0	0	110.9	V11 V15 D120 V121 A127 V128 V129 L151	V11-I125 HydrophobicContact CG1-CG2 3.96Å; V11-I125 HydrophobicContact CG2-CG2 4.11Å; V15-I125 HydrophobicContact CG2-CD1 4.06Å; D120-I125 WeakPolarHBondContact O-CB 3.12Å; D120-I125 WeakPolarHBondContact O-CG1 3.17Å; D120-I125 PolarHBondContact O-N 2.7Å; V121-I125 HydrophobicContact CG2-CD1 4.08Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 2.92Å; I125-V128 PolarHBondContact O-N 3.44Å; I125-V129 HydrophobicContact CG2-CG2 4.29Å; I125-V129 VanDerWaalsContact O-CG2 3.26Å; I125-V129 WeakPolarHBondContact O-CG2 3.27Å; I125-V129 PolarHBondContact O-N 3.44Å; I125-L151 HydrophobicContact CB-CD2 4.46Å; I125-L151 HydrophobicContact CG1-CD2 4.1Å; I125-L151 HydrophobicContact CG2-CD2 4.38Å
126	P	98.7	Very high	97.6	Very high	39 Å²	39	32 Å²	32	25%	0.253	17%	0.167	S	C	.	.	H	α-helix	trans	-60.4	-39.3	174.9	-25.8	36.7	0	0	0	113.1	V121 V128 V129 L130 W176	V121-P126 WeakPolarHBondContact O-CD 3.25Å; V121-P126 WeakPolarHBondContact O-CG 3.43Å; P126-V128 VanDerWaalsContact C-N 3.35Å; P126-V128 PolarHBondContact O-N 3.23Å; P126-V129 PolarHBondContact O-N 3.17Å; P126-L130 WeakPolarHBondContact O-CB 3.41Å; P126-L130 VanDerWaalsContact O-CG 3.25Å; P126-L130 WeakPolarHBondContact O-CG 3.36Å; P126-L130 PolarHBondContact O-N 3.12Å; P126-W176 HydrophobicContact CB-CZ2 4.03Å
127	A	98.6	Very high	97.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-45	177.2	0	0	0	0	0	111.5	I123 Y124 I125 Y131 L175 W176	I123-A127 WeakPolarHBondContact O-CB 3.26Å; I123-A127 PolarHBondContact O-N 2.61Å; Y124-A127 WeakPolarHBondContact O-CB 3.17Å; Y124-A127 PolarHBondContact O-N 3.19Å; Y124-A127 VanDerWaalsContact O-N 3.1Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 2.92Å; A127-Y131 WeakPolarHBondContact O-CB 3.48Å; A127-Y131 PolarHBondContact O-N 3.3Å; A127-L175 HydrophobicContact CB-CB 4.06Å; A127-L175 HydrophobicContact CB-CD2 3.81Å; A127-L175 HydrophobicContact CB-CG 3.87Å; A127-W176 HydrophobicContact CB-CD2 4.2Å; A127-W176 HydrophobicContact CB-CG 4.03Å
128	V	98.7	Very high	96.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.8	-48.4	176.6	175.3	0	0	0	0	111.1	Y124 I125 P126 L130 Y131 C132 L147 I150 L151 L175	Y124-V128 HydrophobicContact CD1-CG2 4.2Å; Y124-V128 HydrophobicContact CE1-CG2 3.77Å; Y124-V128 HydrophobicContact CE2-CG2 4.16Å; Y124-V128 WeakPolarHBondContact O-CG2 3.44Å; Y124-V128 PolarHBondContact O-N 3.16Å; I125-V128 PolarHBondContact O-N 3.44Å; P126-V128 VanDerWaalsContact C-N 3.35Å; P126-V128 PolarHBondContact O-N 3.23Å; V128-L130 PolarHBondContact O-N 3.39Å; V128-Y131 PolarHBondContact O-N 3.24Å; V128-C132 WeakPolarHBondContact O-CB 3.49Å; V128-C132 PolarHBondContact O-N 3.39Å; V128-C132 PolarHBondContact O-SG 3.29Å; V128-C132 VanDerWaalsContact O-SG 3.41Å; V128-L147 HydrophobicContact CG1-CG 4.49Å; V128-I150 HydrophobicContact CB-CG2 4.39Å; V128-I150 HydrophobicContact CG1-CB 3.85Å; V128-I150 HydrophobicContact CG1-CD1 4.49Å; V128-I150 HydrophobicContact CG1-CG2 3.64Å; V128-I150 HydrophobicContact CG2-CG2 3.75Å; V128-L151 HydrophobicContact CB-CD2 3.88Å; V128-L151 HydrophobicContact CG1-CD2 3.8Å; V128-L151 HydrophobicContact CG1-CG 3.95Å; V128-L151 HydrophobicContact CG2-CD2 4.13Å; V128-L175 HydrophobicContact CB-CD2 4.35Å; V128-L175 HydrophobicContact CG2-CD2 3.61Å
129	V	98.5	Very high	96.3	Very high	17 Å²	17	36.8 Å²	36.8	10%	0.103	21%	0.208	C	C	.	.	H	α-helix	trans	-56.7	-51.2	180	171	0	0	0	0	110.5	V7 V11 I125 P126 C132 L133 L147	V7-V129 HydrophobicContact CG1-CG1 3.93Å; V7-V129 HydrophobicContact CG1-CG2 4.4Å; V11-V129 HydrophobicContact CG2-CG2 3.85Å; I125-V129 HydrophobicContact CG2-CG2 4.29Å; I125-V129 VanDerWaalsContact O-CG2 3.26Å; I125-V129 WeakPolarHBondContact O-CG2 3.27Å; I125-V129 PolarHBondContact O-N 3.44Å; P126-V129 PolarHBondContact O-N 3.17Å; V129-C132 PolarHBondContact O-N 3.3Å; V129-L133 HydrophobicContact CG1-CD1 3.8Å; V129-L133 HydrophobicContact CG1-CG 4.47Å; V129-L133 WeakPolarHBondContact O-CB 3.45Å; V129-L133 VanDerWaalsContact O-CG 3.24Å; V129-L133 WeakPolarHBondContact O-CG 3.43Å; V129-L133 PolarHBondContact O-N 3.47Å; V129-L147 HydrophobicContact CB-CD1 4.26Å; V129-L147 HydrophobicContact CG1-CD1 4.32Å; V129-L147 HydrophobicContact CG2-CD1 4.05Å
130	L	98.2	Very high	95.9	Very high	46 Å²	46	38 Å²	38	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-70.5	-38.9	-176.6	-63.1	169.8	0	0	0	111.7	P126 V128 C132 L133 Y134 W176 L179	P126-L130 WeakPolarHBondContact O-CB 3.41Å; P126-L130 VanDerWaalsContact O-CG 3.25Å; P126-L130 WeakPolarHBondContact O-CG 3.36Å; P126-L130 PolarHBondContact O-N 3.12Å; V128-L130 PolarHBondContact O-N 3.39Å; L130-C132 PolarHBondContact O-N 3.28Å; L130-L133 PolarHBondContact O-N 3.03Å; L130-Y134 HydrophobicContact CB-CD2 4.22Å; L130-Y134 HydrophobicContact CD2-CD2 4.24Å; L130-Y134 HydrophobicContact CD2-CE2 3.68Å; L130-Y134 WeakPolarHBondContact O-CB 3.45Å; L130-Y134 VanDerWaalsContact O-CD2 3.27Å; L130-Y134 WeakPolarHBondContact O-CD2 3.3Å; L130-Y134 PolarHBondContact O-N 2.92Å; L130-W176 HydrophobicContact CD1-CH2 3.2Å; L130-W176 HydrophobicContact CD1-CZ2 3.96Å; L130-W176 HydrophobicContact CD1-CZ3 3.78Å; L130-L179 HydrophobicContact CB-CD2 3.59Å; L130-L179 HydrophobicContact CD1-CD2 4.47Å
131	Y	98.3	Very high	95.7	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.012	25%	0.25	C	S	.	.	H	α-helix	trans	-56.4	-49.6	172.7	177.4	-91.2	0	0	0	111.8	A127 V128 L133 L135 T136 L175 V178 F322 K326 L357	A127-Y131 WeakPolarHBondContact O-CB 3.48Å; A127-Y131 PolarHBondContact O-N 3.3Å; V128-Y131 PolarHBondContact O-N 3.24Å; Y131-L133 VanDerWaalsContact C-N 3.35Å; Y131-L133 PolarHBondContact O-N 3.45Å; Y131-L135 HydrophobicContact CD2-CB 4.13Å; Y131-L135 HydrophobicContact CD2-CD1 3.84Å; Y131-L135 HydrophobicContact CD2-CG 4.5Å; Y131-L135 HydrophobicContact CE2-CB 3.99Å; Y131-L135 HydrophobicContact CE2-CD1 3.94Å; Y131-L135 PolarHBondContact O-N 3.06Å; Y131-T136 PolarHBondContact O-N 3.38Å; Y131-L175 HydrophobicContact CD2-CD1 4.02Å; Y131-L175 HydrophobicContact CG-CD1 4.07Å; Y131-V178 HydrophobicContact CE2-CG1 4.28Å; Y131-F322 HydrophobicContact CE2-CE1 4.45Å; Y131-F322 HydrophobicContact CE2-CZ 4.14Å; Y131-K326 WeakPolarHBondContact OH-CD 3.43Å; Y131-L357 HydrophobicContact CD1-CD2 3.97Å; Y131-L357 HydrophobicContact CD2-CD2 4.23Å; Y131-L357 HydrophobicContact CE1-CB 4.41Å; Y131-L357 HydrophobicContact CE1-CD2 3.56Å; Y131-L357 HydrophobicContact CE2-CD2 3.85Å; Y131-L357 HydrophobicContact CG-CD2 4.31Å; Y131-L357 WeakPolarHBondContact OH-CB 3.43Å; Y131-L357 PolarHBondContact OH-O 2.88Å
132	C	97.5	Very high	95.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.2	-34.1	-179.6	-69.6	0	0	0	0	113.1	V128 V129 L130 T136 L147	V128-C132 WeakPolarHBondContact O-CB 3.49Å; V128-C132 PolarHBondContact O-N 3.39Å; V128-C132 PolarHBondContact O-SG 3.29Å; V128-C132 VanDerWaalsContact O-SG 3.41Å; V129-C132 PolarHBondContact O-N 3.3Å; L130-C132 PolarHBondContact O-N 3.28Å; C132-T136 WeakPolarHBondContact CA-OG1 3.34Å; C132-T136 VanDerWaalsContact O-CB 3.3Å; C132-T136 WeakPolarHBondContact O-CB 3.48Å; C132-L147 HydrophobicContact CB-CB 3.8Å; C132-L147 HydrophobicContact CB-CD1 4.26Å; C132-L147 HydrophobicContact CB-CG 4.37Å; C132-L147 VanDerWaalsContact SG-CA 3.59Å
133	L	95.6	Very high	95.1	Very high	24 Å²	24	41.7 Å²	41.7	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-75.4	-38.9	179.8	-70.6	177.5	0	0	0	113.2	W4 V7 V129 L130 Y131 R143	W4-L133 HydrophobicContact CH2-CD1 3.6Å; W4-L133 HydrophobicContact CZ2-CD1 4.29Å; W4-L133 HydrophobicContact CZ3-CD1 3.76Å; V7-L133 HydrophobicContact CG2-CD2 4.19Å; V129-L133 HydrophobicContact CG1-CD1 3.8Å; V129-L133 HydrophobicContact CG1-CG 4.47Å; V129-L133 WeakPolarHBondContact O-CB 3.45Å; V129-L133 VanDerWaalsContact O-CG 3.24Å; V129-L133 WeakPolarHBondContact O-CG 3.43Å; V129-L133 PolarHBondContact O-N 3.47Å; L130-L133 PolarHBondContact O-N 3.03Å; Y131-L133 VanDerWaalsContact C-N 3.35Å; Y131-L133 PolarHBondContact O-N 3.45Å; L133-R143 PolarHBondContact O-NH1 3.44Å
134	Y	95.5	Very high	95	Very high	146 Å²	146	41 Å²	41	57%	0.573	22%	0.218	S	C	*	.	H	α-helix	trans	-99.6	-35.3	-171.8	-70.5	-70.7	0	0	0	114.8	L130	L130-Y134 HydrophobicContact CB-CD2 4.22Å; L130-Y134 HydrophobicContact CD2-CD2 4.24Å; L130-Y134 HydrophobicContact CD2-CE2 3.68Å; L130-Y134 WeakPolarHBondContact O-CB 3.45Å; L130-Y134 VanDerWaalsContact O-CD2 3.27Å; L130-Y134 WeakPolarHBondContact O-CD2 3.3Å; L130-Y134 PolarHBondContact O-N 2.92Å
135	L	95	Very high	94.8	Very high	34 Å²	34	41.7 Å²	41.7	18%	0.178	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-5.4	-171.1	-62.9	-176	0	0	0	114.2	Y131 L179 L183 F322	Y131-L135 HydrophobicContact CD2-CB 4.13Å; Y131-L135 HydrophobicContact CD2-CD1 3.84Å; Y131-L135 HydrophobicContact CD2-CG 4.5Å; Y131-L135 HydrophobicContact CE2-CB 3.99Å; Y131-L135 HydrophobicContact CE2-CD1 3.94Å; Y131-L135 PolarHBondContact O-N 3.06Å; L135-L179 HydrophobicContact CD1-CD1 3.66Å; L135-L179 HydrophobicContact CG-CD1 3.93Å; L135-L183 HydrophobicContact CD2-CD2 3.91Å; L135-L183 HydrophobicContact CD2-CG 4.3Å; L135-F322 HydrophobicContact CB-CE1 4.46Å; L135-F322 HydrophobicContact CD1-CE1 4.17Å; L135-F322 HydrophobicContact CD1-CE2 4.49Å; L135-F322 HydrophobicContact CD1-CZ 3.74Å
136	T	92.5	Very high	94.7	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.043	22%	0.222	C	C	.	.			trans	-95.5	125	176.3	-56.9	0	0	0	0	111	Y131 C132 R143 I146 N360	Y131-T136 PolarHBondContact O-N 3.38Å; C132-T136 WeakPolarHBondContact CA-OG1 3.34Å; C132-T136 VanDerWaalsContact O-CB 3.3Å; C132-T136 WeakPolarHBondContact O-CB 3.48Å; T136-R143 HydrophobicContact CG2-CG 4.31Å; T136-R143 VanDerWaalsContact O-CZ 3.29Å; T136-R143 PolarHBondContact O-NE 2.96Å; T136-R143 PolarHBondContact O-NH2 2.96Å; T136-R143 VanDerWaalsContact O-NH2 3.16Å; T136-I146 HydrophobicContact CG2-CD1 3.55Å; T136-N360 HydrophobicContact CG2-CB 4.09Å
137	D	87.5	Confident	94.7	Very high	85 Å²	85	39.6 Å²	39.6	46%	0.455	21%	0.21	S	C	.	.			trans	-76.7	145.9	173.8	-70.8	-29.9	0	0	0	111.4	N360 K498	D137-N360 PolarHBondContact O-ND2 3.01Å; D137-N360 PolarHBondContact O-OD1 3.31Å; D137-K498 IonicContact OD2-NZ 3.24Å; D137-K498 PolarHBondContact OD2-NZ 2.96Å
138	G	87.9	Confident	94.6	Very high	48 Å²	48	40.4 Å²	40.4	50%	0.495	22%	0.215	S	C	.	.	S	Bend	trans	132.2	-176.4	172.8	0	0	0	0	0	113.8
139	S	91.2	Very high	94.6	Very high	73 Å²	73	40.5 Å²	40.5	51%	0.51	22%	0.215	S	C	.	.			trans	-65.8	157.6	175.2	71.3	0	0	0	0	111.1	K141 R142 R143	S139-K141 PolarHBondContact O-N 3.42Å; S139-R142 PolarHBondContact O-N 3.49Å; S139-R142 PolarHBondContact OG-N 3.45Å; S139-R143 PolarHBondContact O-N 3.38Å
140	A	91.3	Very high	94.5	Very high	42 Å²	42	39.8 Å²	39.8	35%	0.347	21%	0.211	S	C	.	.	H	α-helix	trans	-53.8	-38.8	174.8	0	0	0	0	0	112.2	T3 R143 V144	T3-A140 HydrophobicContact CG2-CB 3.92Å; A140-R143 PolarHBondContact O-N 3.38Å; A140-V144 WeakPolarHBondContact O-CG2 3.27Å; A140-V144 PolarHBondContact O-N 3.48Å
141	K	91.1	Very high	94.6	Very high	154 Å²	154	37.6 Å²	37.6	67%	0.67	20%	0.199	S	C	*	.	H	α-helix	trans	-60.9	-49.2	175.1	-66.9	-176.6	179.3	-178.2	0	111.6	S139 R143 V144 S145	S139-K141 PolarHBondContact O-N 3.42Å; K141-R143 VanDerWaalsContact C-N 3.35Å; K141-R143 PolarHBondContact O-N 2.87Å; K141-V144 PolarHBondContact O-N 2.94Å; K141-S145 PolarHBondContact O-N 3.26Å; K141-S145 PolarHBondContact O-OG 3.39Å
142	R	91.1	Very high	94.5	Very high	41 Å²	41	38.3 Å²	38.3	16%	0.155	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-43.4	178.3	-178	61	167.2	-152.6	-3.2	111.9	S139 V144 S145 I146 N360 L405 D410	S139-R142 PolarHBondContact O-N 3.49Å; S139-R142 PolarHBondContact OG-N 3.45Å; R142-V144 PolarHBondContact O-N 2.77Å; R142-S145 WeakPolarHBondContact O-CB 3.25Å; R142-S145 PolarHBondContact O-N 3.4Å; R142-I146 HydrophobicContact CG-CD1 4.02Å; R142-I146 WeakPolarHBondContact O-CG1 3.45Å; R142-I146 PolarHBondContact O-N 3.44Å; R142-N360 PolarHBondContact NE-OD1 3.47Å; R142-L405 VanDerWaalsContact NH1-C 3.25Å; R142-L405 VanDerWaalsContact NH1-CA 3.28Å; R142-L405 PolarHBondContact NH1-O 3.13Å; R142-D410 IonicContact CZ-OD2 3.28Å; R142-D410 IonicContact NH1-OD2 2.65Å; R142-D410 PolarHBondContact NH1-OD2 3.04Å; R142-D410 IonicContact NH2-OD2 3.49Å; R142-D410 PolarHBondContact NH2-OD2 3.49Å
143	R	94.5	Very high	94.6	Very high	78 Å²	78	38.7 Å²	38.7	29%	0.294	21%	0.205	S	C	.	.	H	α-helix	trans	-60.2	-44.6	176.6	-68.6	178.8	178.9	177.4	-1.6	112	L133 T136 S139 A140 K141 I146 L147	L133-R143 PolarHBondContact O-NH1 3.44Å; T136-R143 HydrophobicContact CG2-CG 4.31Å; T136-R143 VanDerWaalsContact O-CZ 3.29Å; T136-R143 PolarHBondContact O-NE 2.96Å; T136-R143 PolarHBondContact O-NH2 2.96Å; T136-R143 VanDerWaalsContact O-NH2 3.16Å; S139-R143 PolarHBondContact O-N 3.38Å; A140-R143 PolarHBondContact O-N 3.38Å; K141-R143 VanDerWaalsContact C-N 3.35Å; K141-R143 PolarHBondContact O-N 2.87Å; R143-I146 PolarHBondContact O-N 2.96Å; R143-L147 WeakPolarHBondContact O-CB 3.47Å; R143-L147 PolarHBondContact O-N 3.02Å
144	V	95.7	Very high	94.7	Very high	11 Å²	11	37.5 Å²	37.5	7%	0.067	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-39.4	177.2	176.2	0	0	0	0	111.6	T3 L6 V7 S10 A140 K141 R142 I146 L147 L148	T3-V144 HydrophobicContact CG2-CG2 4.27Å; L6-V144 HydrophobicContact CB-CG1 4.03Å; L6-V144 HydrophobicContact CB-CG2 4.16Å; V7-V144 HydrophobicContact CG2-CG2 3.88Å; S10-V144 WeakPolarHBondContact OG-CG1 3.48Å; A140-V144 WeakPolarHBondContact O-CG2 3.27Å; A140-V144 PolarHBondContact O-N 3.48Å; K141-V144 PolarHBondContact O-N 2.94Å; R142-V144 PolarHBondContact O-N 2.77Å; V144-I146 VanDerWaalsContact C-N 3.33Å; V144-I146 PolarHBondContact O-N 3.32Å; V144-L147 WeakPolarHBondContact O-CB 3.44Å; V144-L147 PolarHBondContact O-N 3.46Å; V144-L148 WeakPolarHBondContact O-CB 3.39Å; V144-L148 PolarHBondContact O-N 3.43Å
145	S	95.4	Very high	94.8	Very high	19 Å²	19	30.6 Å²	30.6	13%	0.133	17%	0.171	C	C	.	.	H	α-helix	trans	-57.5	-46.8	174.1	-65.4	0	0	0	0	111.4	K141 R142 L148 S149 L404	K141-S145 PolarHBondContact O-N 3.26Å; K141-S145 PolarHBondContact O-OG 3.39Å; R142-S145 WeakPolarHBondContact O-CB 3.25Å; R142-S145 PolarHBondContact O-N 3.4Å; S145-L148 PolarHBondContact O-N 2.87Å; S145-S149 PolarHBondContact O-N 2.76Å; S145-S149 PolarHBondContact O-OG 3.33Å; S145-S149 VanDerWaalsContact O-OG 3.07Å; S145-L404 PolarHBondContact OG-O 2.95Å
146	I	96.1	Very high	95	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-45.8	178.2	-67.3	163.2	0	0	0	110.8	T136 R142 R143 V144 L148 S149 I150 L359 N360 L405	T136-I146 HydrophobicContact CG2-CD1 3.55Å; R142-I146 HydrophobicContact CG-CD1 4.02Å; R142-I146 WeakPolarHBondContact O-CG1 3.45Å; R142-I146 PolarHBondContact O-N 3.44Å; R143-I146 PolarHBondContact O-N 2.96Å; V144-I146 VanDerWaalsContact C-N 3.33Å; V144-I146 PolarHBondContact O-N 3.32Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 3.07Å; I146-S149 PolarHBondContact O-N 3.39Å; I146-I150 HydrophobicContact CG2-CD1 3.95Å; I146-I150 HydrophobicContact CG2-CG1 4.35Å; I146-I150 WeakPolarHBondContact O-CG1 3.41Å; I146-I150 PolarHBondContact O-N 2.94Å; I146-L359 HydrophobicContact CG2-CB 4.18Å; I146-N360 HydrophobicContact CD1-CB 3.58Å; I146-N360 VanDerWaalsContact CD1-OD1 3.3Å; I146-N360 WeakPolarHBondContact CD1-OD1 3.33Å; I146-L405 HydrophobicContact CG1-CD2 3.66Å
147	L	97.7	Very high	95.3	Very high	1 Å²	1	29 Å²	29	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-53.6	-49.6	175.3	179.3	162.3	0	0	0	110.9	V7 V128 V129 C132 R143 V144 S149 I150 L151	V7-L147 HydrophobicContact CG1-CD1 4.09Å; V7-L147 HydrophobicContact CG2-CD1 4.18Å; V128-L147 HydrophobicContact CG1-CG 4.49Å; V129-L147 HydrophobicContact CB-CD1 4.26Å; V129-L147 HydrophobicContact CG1-CD1 4.32Å; V129-L147 HydrophobicContact CG2-CD1 4.05Å; C132-L147 HydrophobicContact CB-CB 3.8Å; C132-L147 HydrophobicContact CB-CD1 4.26Å; C132-L147 HydrophobicContact CB-CG 4.37Å; C132-L147 VanDerWaalsContact SG-CA 3.59Å; R143-L147 WeakPolarHBondContact O-CB 3.47Å; R143-L147 PolarHBondContact O-N 3.02Å; V144-L147 WeakPolarHBondContact O-CB 3.44Å; V144-L147 PolarHBondContact O-N 3.46Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.44Å; L147-I150 PolarHBondContact O-N 3.29Å; L147-L151 HydrophobicContact CD2-CD1 3.53Å; L147-L151 HydrophobicContact CD2-CG 4.18Å; L147-L151 HydrophobicContact CG-CD1 4.43Å; L147-L151 WeakPolarHBondContact O-CB 3.13Å; L147-L151 WeakPolarHBondContact O-CG 3.16Å; L147-L151 PolarHBondContact O-N 3.2Å
148	L	97.5	Very high	95.8	Very high	18 Å²	18	25 Å²	25	9%	0.094	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-41.5	179.9	-177.9	57.2	0	0	0	111.5	L13 V144 S145 I146 L151 L152 L400 L404	L13-L148 HydrophobicContact CD2-CD1 4.14Å; V144-L148 WeakPolarHBondContact O-CB 3.39Å; V144-L148 PolarHBondContact O-N 3.43Å; S145-L148 PolarHBondContact O-N 2.87Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 3.07Å; L148-L151 PolarHBondContact O-N 2.92Å; L148-L152 HydrophobicContact CD1-CD1 3.53Å; L148-L152 HydrophobicContact CD1-CG 3.8Å; L148-L152 HydrophobicContact CG-CD1 3.83Å; L148-L152 HydrophobicContact CG-CG 4.38Å; L148-L152 VanDerWaalsContact O-CB 3.3Å; L148-L152 WeakPolarHBondContact O-CB 3.22Å; L148-L152 WeakPolarHBondContact O-CG 3.22Å; L148-L152 PolarHBondContact O-N 3Å; L148-L400 HydrophobicContact CD2-CD2 4.48Å; L148-L404 HydrophobicContact CD2-CD1 3.79Å; L148-L404 HydrophobicContact CG-CD1 4.43Å
149	S	97.6	Very high	96.3	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-41.8	176.6	-64.1	0	0	0	0	113	S145 I146 L147 L152 Y153 F397 T401	S145-S149 PolarHBondContact O-N 2.76Å; S145-S149 PolarHBondContact O-OG 3.33Å; S145-S149 VanDerWaalsContact O-OG 3.07Å; I146-S149 PolarHBondContact O-N 3.39Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.44Å; S149-L152 PolarHBondContact O-N 3.33Å; S149-Y153 PolarHBondContact O-N 3.5Å; S149-F397 WeakPolarHBondContact O-CE2 3.33Å; S149-T401 WeakPolarHBondContact OG-CG2 3.41Å; S149-T401 PolarHBondContact OG-OG1 3.1Å
150	I	98.3	Very high	96.6	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.015	9%	0.094	C	C	.	.	H	α-helix	trans	-64.9	-46.3	175.7	-62.6	177.5	0	0	0	110	V128 I146 L147 L152 Y153 C356 L359	V128-I150 HydrophobicContact CB-CG2 4.39Å; V128-I150 HydrophobicContact CG1-CB 3.85Å; V128-I150 HydrophobicContact CG1-CD1 4.49Å; V128-I150 HydrophobicContact CG1-CG2 3.64Å; V128-I150 HydrophobicContact CG2-CG2 3.75Å; I146-I150 HydrophobicContact CG2-CD1 3.95Å; I146-I150 HydrophobicContact CG2-CG1 4.35Å; I146-I150 WeakPolarHBondContact O-CG1 3.41Å; I146-I150 PolarHBondContact O-N 2.94Å; L147-I150 PolarHBondContact O-N 3.29Å; I150-L152 VanDerWaalsContact C-N 3.29Å; I150-L152 PolarHBondContact O-N 2.87Å; I150-Y153 WeakPolarHBondContact O-CB 3.45Å; I150-Y153 PolarHBondContact O-N 3.43Å; I150-C356 HydrophobicContact CD1-CB 4.09Å; I150-C356 HydrophobicContact CG1-CB 3.85Å; I150-C356 HydrophobicContact CG2-CB 4.3Å; I150-L359 HydrophobicContact CD1-CD1 4.45Å; I150-L359 HydrophobicContact CG1-CD1 3.68Å
151	L	98.4	Very high	97	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.5	-31.2	179.8	-70.4	-174.2	0	0	0	112.7	V11 A14 R18 Y124 I125 V128 L147 L148	V11-L151 HydrophobicContact CG2-CD1 4.04Å; A14-L151 HydrophobicContact CB-CB 3.64Å; A14-L151 HydrophobicContact CB-CD1 3.89Å; A14-L151 HydrophobicContact CB-CG 4.34Å; R18-L151 VanDerWaalsContact CZ-O 3.23Å; R18-L151 PolarHBondContact NH1-O 2.96Å; R18-L151 PolarHBondContact NH2-O 2.93Å; Y124-L151 HydrophobicContact CE1-CD2 4.44Å; I125-L151 HydrophobicContact CB-CD2 4.46Å; I125-L151 HydrophobicContact CG1-CD2 4.1Å; I125-L151 HydrophobicContact CG2-CD2 4.38Å; V128-L151 HydrophobicContact CB-CD2 3.88Å; V128-L151 HydrophobicContact CG1-CD2 3.8Å; V128-L151 HydrophobicContact CG1-CG 3.95Å; V128-L151 HydrophobicContact CG2-CD2 4.13Å; L147-L151 HydrophobicContact CD2-CD1 3.53Å; L147-L151 HydrophobicContact CD2-CG 4.18Å; L147-L151 HydrophobicContact CG-CD1 4.43Å; L147-L151 WeakPolarHBondContact O-CB 3.13Å; L147-L151 WeakPolarHBondContact O-CG 3.16Å; L147-L151 PolarHBondContact O-N 3.2Å; L148-L151 PolarHBondContact O-N 2.92Å
152	L	98.1	Very high	97.3	Very high	18 Å²	18	10.1 Å²	10.1	9%	0.094	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	9.8	179.4	-69.7	-179.3	0	0	0	114.4	L13 A14 V17 L148 S149 I150 P154 F397 L400	L13-L152 HydrophobicContact CD2-CD1 4.42Å; A14-L152 HydrophobicContact CB-CD2 4.46Å; V17-L152 HydrophobicContact CB-CD2 4.03Å; V17-L152 HydrophobicContact CG1-CD2 4.29Å; V17-L152 HydrophobicContact CG2-CD2 3.85Å; L148-L152 HydrophobicContact CD1-CD1 3.53Å; L148-L152 HydrophobicContact CD1-CG 3.8Å; L148-L152 HydrophobicContact CG-CD1 3.83Å; L148-L152 HydrophobicContact CG-CG 4.38Å; L148-L152 VanDerWaalsContact O-CB 3.3Å; L148-L152 WeakPolarHBondContact O-CB 3.22Å; L148-L152 WeakPolarHBondContact O-CG 3.22Å; L148-L152 PolarHBondContact O-N 3Å; S149-L152 PolarHBondContact O-N 3.33Å; I150-L152 VanDerWaalsContact C-N 3.29Å; I150-L152 PolarHBondContact O-N 2.87Å; L152-P154 WeakPolarHBondContact O-CD 3.41Å; L152-P154 VanDerWaalsContact O-N 3.11Å; L152-F397 HydrophobicContact CB-CD2 4.49Å; L152-F397 WeakPolarHBondContact O-CD2 3.4Å; L152-L400 HydrophobicContact CD1-CD2 3.36Å
153	Y	98.3	Very high	97.6	Very high	7 Å²	7	8.3 Å²	8.3	3%	0.027	4%	0.039	C	C	.	.			trans	-57.4	114.6	178.1	169.2	-130.2	0	0	0	111.5	S149 I150 G155 L156 I157 L349 A352 L370 S373	S149-Y153 PolarHBondContact O-N 3.5Å; I150-Y153 WeakPolarHBondContact O-CB 3.45Å; I150-Y153 PolarHBondContact O-N 3.43Å; Y153-G155 PolarHBondContact O-N 2.91Å; Y153-L156 HydrophobicContact CD1-CB 3.62Å; Y153-L156 HydrophobicContact CE1-CB 3.92Å; Y153-L156 VanDerWaalsContact CE1-N 3.34Å; Y153-I157 WeakPolarHBondContact O-CG1 3.02Å; Y153-I157 PolarHBondContact O-N 3.46Å; Y153-L349 HydrophobicContact CE1-CD2 3.69Å; Y153-A352 HydrophobicContact CE1-CB 3.65Å; Y153-A352 WeakPolarHBondContact OH-CB 3.48Å; Y153-L370 HydrophobicContact CD2-CB 3.88Å; Y153-L370 HydrophobicContact CD2-CD1 4.41Å; Y153-L370 HydrophobicContact CD2-CD2 3.74Å; Y153-L370 HydrophobicContact CD2-CG 4.19Å; Y153-L370 HydrophobicContact CE1-CD2 4.45Å; Y153-L370 HydrophobicContact CE2-CB 3.83Å; Y153-L370 HydrophobicContact CE2-CD2 3.61Å; Y153-L370 HydrophobicContact CE2-CG 4.26Å; Y153-L370 HydrophobicContact CG-CD2 4.23Å; Y153-S373 WeakPolarHBondContact CE2-OG 3.43Å; Y153-S373 PolarHBondContact OH-OG 2.89Å
154	P	98.3	Very high	97.8	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-64	-38.7	-171.9	-28.4	38.1	0	0	0	114	L152 L156 I157 L158 T374 F397	L152-P154 WeakPolarHBondContact O-CD 3.41Å; L152-P154 VanDerWaalsContact O-N 3.11Å; P154-L156 VanDerWaalsContact C-N 3.34Å; P154-L156 PolarHBondContact O-N 3.1Å; P154-I157 PolarHBondContact O-N 2.84Å; P154-L158 HydrophobicContact CB-CD1 4.34Å; P154-L158 WeakPolarHBondContact O-CB 3.27Å; P154-L158 VanDerWaalsContact O-CG 3.3Å; P154-L158 WeakPolarHBondContact O-CG 3.41Å; P154-L158 PolarHBondContact O-N 3.42Å; P154-T374 HydrophobicContact CB-CG2 3.75Å; P154-F397 VanDerWaalsContact CD-CG 3.43Å; P154-F397 HydrophobicContact CG-CB 3.43Å; P154-F397 VanDerWaalsContact CG-CB 3.43Å; P154-F397 HydrophobicContact CG-CD1 4.12Å; P154-F397 HydrophobicContact CG-CD2 4.16Å; P154-F397 HydrophobicContact CG-CG 3.64Å
155	G	97.8	Very high	97.8	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-57.1	-45.2	-176.3	0	0	0	0	0	112.7	Y153 I159 T374	Y153-G155 PolarHBondContact O-N 2.91Å; G155-I159 WeakPolarHBondContact O-CB 3.26Å; G155-I159 VanDerWaalsContact O-CG1 3.22Å; G155-I159 WeakPolarHBondContact O-CG1 3.49Å; G155-I159 PolarHBondContact O-N 3.38Å; G155-T374 PolarHBondContact N-OG1 2.65Å
156	L	98.4	Very high	98	Very high	6 Å²	6	3.9 Å²	3.9	3%	0.031	2%	0.019	C	C	.	.	H	α-helix	trans	-70.5	-43.1	177.1	-176.9	61.4	0	0	0	111.8	Y124 Y153 P154 I159 D160 N167 L171 L349	Y124-L156 HydrophobicContact CD1-CD2 4.32Å; Y124-L156 HydrophobicContact CD2-CD2 4.47Å; Y124-L156 HydrophobicContact CE1-CD2 3.66Å; Y124-L156 HydrophobicContact CE2-CD2 3.84Å; Y124-L156 WeakPolarHBondContact OH-CD2 3.48Å; Y153-L156 HydrophobicContact CD1-CB 3.62Å; Y153-L156 HydrophobicContact CE1-CB 3.92Å; Y153-L156 VanDerWaalsContact CE1-N 3.34Å; P154-L156 VanDerWaalsContact C-N 3.34Å; P154-L156 PolarHBondContact O-N 3.1Å; L156-I159 PolarHBondContact O-N 3.49Å; L156-D160 WeakPolarHBondContact O-CB 3.18Å; L156-D160 PolarHBondContact O-N 3.25Å; L156-N167 HydrophobicContact CD1-CB 3.97Å; L156-L171 HydrophobicContact CD1-CD1 3.87Å; L156-L349 HydrophobicContact CB-CD2 4.44Å; L156-L349 HydrophobicContact CD1-CD1 4.22Å
157	I	98.6	Very high	98.1	Very high	2 Å²	2	4.2 Å²	4.2	1%	0.01	2%	0.021	C	C	.	.	H	α-helix	trans	-61.9	-48.8	-179.4	-64.3	173.7	0	0	0	110.9	V17 R18 V21 Y153 P154 I159 Y161	V17-I157 HydrophobicContact CG1-CD1 4.11Å; R18-I157 HydrophobicContact CG-CD1 4.35Å; R18-I157 HydrophobicContact CG-CG1 4.04Å; R18-I157 HydrophobicContact CG-CG2 4.12Å; V21-I157 HydrophobicContact CB-CG2 4.12Å; V21-I157 HydrophobicContact CG1-CG2 4.45Å; V21-I157 HydrophobicContact CG2-CG2 3.78Å; Y153-I157 WeakPolarHBondContact O-CG1 3.02Å; Y153-I157 PolarHBondContact O-N 3.46Å; P154-I157 PolarHBondContact O-N 2.84Å; I157-I159 VanDerWaalsContact C-N 3.3Å; I157-I159 PolarHBondContact O-N 3.43Å; I157-Y161 HydrophobicContact CG2-CD2 4.46Å; I157-Y161 WeakPolarHBondContact O-CA 3.43Å; I157-Y161 VanDerWaalsContact O-CB 3.29Å; I157-Y161 WeakPolarHBondContact O-CB 2.95Å; I157-Y161 PolarHBondContact O-N 3.3Å
158	L	98.6	Very high	98	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.022	C	C	.	.	I	π-helix	trans	-65.8	-34.3	-178	-68.7	170.9	0	0	0	111.9	V21 P154 G162 H163 T374 F381 P389 Y390	V21-L158 HydrophobicContact CG1-CD2 4.12Å; V21-L158 HydrophobicContact CG2-CD2 4.44Å; P154-L158 HydrophobicContact CB-CD1 4.34Å; P154-L158 WeakPolarHBondContact O-CB 3.27Å; P154-L158 VanDerWaalsContact O-CG 3.3Å; P154-L158 WeakPolarHBondContact O-CG 3.41Å; P154-L158 PolarHBondContact O-N 3.42Å; L158-G162 CarbonylContact O-C 3.24Å; L158-G162 WeakPolarHBondContact O-CA 3.37Å; L158-G162 PolarHBondContact O-N 3.02Å; L158-H163 PolarHBondContact O-N 2.85Å; L158-T374 HydrophobicContact CD1-CG2 3.92Å; L158-F381 HydrophobicContact CB-CD1 4.25Å; L158-F381 HydrophobicContact CB-CE1 3.55Å; L158-F381 HydrophobicContact CB-CE2 4.35Å; L158-F381 HydrophobicContact CB-CZ 3.61Å; L158-F381 HydrophobicContact CD1-CD2 4.15Å; L158-F381 HydrophobicContact CD1-CE1 4.34Å; L158-F381 HydrophobicContact CD1-CE2 3.67Å; L158-F381 HydrophobicContact CD1-CZ 3.79Å; L158-F381 HydrophobicContact CG-CZ 4.37Å; L158-P389 HydrophobicContact CD2-CB 3.86Å; L158-P389 HydrophobicContact CD2-CG 4.33Å; L158-Y390 HydrophobicContact CD1-CD2 4.03Å
159	I	98.4	Very high	98.1	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.018	C	C	.	.	I	π-helix	trans	-74.2	-50.7	177.4	-67.9	-66.5	0	0	0	111.3	G155 L156 I157 H163 F164 Q165 N167 K346 L349 M377 L380 F381	G155-I159 WeakPolarHBondContact O-CB 3.26Å; G155-I159 VanDerWaalsContact O-CG1 3.22Å; G155-I159 WeakPolarHBondContact O-CG1 3.49Å; G155-I159 PolarHBondContact O-N 3.38Å; L156-I159 PolarHBondContact O-N 3.49Å; I157-I159 VanDerWaalsContact C-N 3.3Å; I157-I159 PolarHBondContact O-N 3.43Å; I159-H163 HydrophobicContact CD1-CB 4.19Å; I159-H163 CarbonylContact O-C 3.44Å; I159-H163 WeakPolarHBondContact O-CB 3.32Å; I159-H163 PolarHBondContact O-N 3.49Å; I159-F164 PolarHBondContact O-N 2.85Å; I159-Q165 HydrophobicContact CG2-CB 3.87Å; I159-Q165 HydrophobicContact CG2-CG 4.28Å; I159-Q165 PolarHBondContact O-N 3.18Å; I159-N167 WeakPolarHBondContact CG2-ND2 3.26Å; I159-K346 HydrophobicContact CD1-CD 4.09Å; I159-K346 HydrophobicContact CD1-CG 3.87Å; I159-K346 HydrophobicContact CG2-CD 4.45Å; I159-L349 HydrophobicContact CB-CD1 4.07Å; I159-L349 HydrophobicContact CG1-CD1 4.18Å; I159-L349 HydrophobicContact CG2-CD1 4Å; I159-M377 HydrophobicContact CD1-SD 3.75Å; I159-M377 HydrophobicContact CG1-CE 4.12Å; I159-M377 HydrophobicContact CG1-SD 3.69Å; I159-L380 HydrophobicContact CD1-CD2 3.69Å; I159-F381 HydrophobicContact CD1-CE1 3.71Å; I159-F381 HydrophobicContact CD1-CZ 4.25Å; I159-F381 HydrophobicContact CG1-CE1 4.17Å; I159-F381 HydrophobicContact CG1-CZ 4.4Å
160	D	98.4	Very high	98.1	Very high	4 Å²	4	3.7 Å²	3.7	2%	0.021	2%	0.019	C	C	.	.	I	π-helix	trans	-75.5	-43.7	-174.4	-76.1	10.3	0	0	0	111.6	V116 L156 F164 Q165 N167 G168	V116-D160 HydrophobicContact CG1-CB 4.1Å; L156-D160 WeakPolarHBondContact O-CB 3.18Å; L156-D160 PolarHBondContact O-N 3.25Å; D160-F164 WeakPolarHBondContact O-CA 3.49Å; D160-Q165 WeakPolarHBondContact CA-O 3.48Å; D160-Q165 VanDerWaalsContact CB-O 3.31Å; D160-Q165 WeakPolarHBondContact CB-O 3.16Å; D160-Q165 PolarHBondContact O-N 3.4Å; D160-N167 VanDerWaalsContact OD1-CB 3.29Å; D160-N167 WeakPolarHBondContact OD1-CB 3.36Å; D160-N167 PolarHBondContact OD1-N 3.43Å; D160-N167 PolarHBondContact OD1-ND2 2.97Å; D160-N167 PolarHBondContact OD2-N 3.33Å; D160-G168 PolarHBondContact OD2-N 3.23Å
161	Y	98.3	Very high	98.1	Very high	2 Å²	2	3.9 Å²	3.9	1%	0.008	2%	0.02	C	C	.	.	I	π-helix	trans	-97.7	-15.3	-175.6	-64.8	-94.5	0	0	0	114.3	R18 S22 R113 V116 L117 D120 I157	R18-Y161 HydrophobicContact CB-CD1 3.8Å; R18-Y161 HydrophobicContact CB-CD2 3.92Å; R18-Y161 HydrophobicContact CB-CE1 3.71Å; R18-Y161 HydrophobicContact CB-CE2 3.84Å; R18-Y161 HydrophobicContact CB-CG 3.89Å; R18-Y161 WeakPolarHBondContact CD-OH 3.43Å; R18-Y161 HydrophobicContact CG-CD1 4.47Å; R18-Y161 HydrophobicContact CG-CD2 3.71Å; R18-Y161 HydrophobicContact CG-CE1 4.25Å; R18-Y161 HydrophobicContact CG-CE2 3.45Å; R18-Y161 VanDerWaalsContact CG-CE2 3.45Å; R18-Y161 HydrophobicContact CG-CG 4.21Å; S22-Y161 VanDerWaalsContact CA-O 3.24Å; S22-Y161 WeakPolarHBondContact CA-O 3.46Å; R113-Y161 PolarHBondContact NE-O 3.16Å; R113-Y161 VanDerWaalsContact NH1-C 3.27Å; R113-Y161 PolarHBondContact NH1-O 3.46Å; R113-Y161 PolarHBondContact NH2-O 2.69Å; V116-Y161 HydrophobicContact CG1-CD1 4.36Å; V116-Y161 HydrophobicContact CG1-CD2 4.49Å; V116-Y161 HydrophobicContact CG1-CE1 4.06Å; V116-Y161 HydrophobicContact CG1-CE2 4.2Å; L117-Y161 WeakPolarHBondContact CA-OH 3.36Å; L117-Y161 HydrophobicContact CB-CE1 4.08Å; L117-Y161 HydrophobicContact CD1-CE1 4.22Å; D120-Y161 WeakPolarHBondContact CB-OH 3.33Å; D120-Y161 VanDerWaalsContact CG-OH 3.25Å; D120-Y161 WeakPolarHBondContact OD2-CE2 3.41Å; D120-Y161 PolarHBondContact OD2-OH 2.95Å; I157-Y161 HydrophobicContact CG2-CD2 4.46Å; I157-Y161 WeakPolarHBondContact O-CA 3.43Å; I157-Y161 VanDerWaalsContact O-CB 3.29Å; I157-Y161 WeakPolarHBondContact O-CB 2.95Å; I157-Y161 PolarHBondContact O-N 3.3Å
162	G	97.5	Very high	98.1	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.02	C	C	.	.	I	π-helix	trans	-100.2	-73.8	173.4	0	0	0	0	0	110.7	Y26 R113 L158 F164	Y26-G162 WeakPolarHBondContact CA-O 3.04Å; R113-G162 VanDerWaalsContact CZ-O 3.3Å; R113-G162 PolarHBondContact NH1-O 2.94Å; R113-G162 PolarHBondContact NH2-O 2.83Å; L158-G162 CarbonylContact O-C 3.24Å; L158-G162 WeakPolarHBondContact O-CA 3.37Å; L158-G162 PolarHBondContact O-N 3.02Å; G162-F164 PolarHBondContact O-N 3.49Å; G162-F164 VanDerWaalsContact O-N 3.14Å
163	H	97.7	Very high	98.2	Very high	2 Å²	2	5 Å²	5	1%	0.009	2%	0.024	C	C	.	.	I	π-helix	trans	-59.2	-26.5	-178.7	-177.8	68.4	0	0	0	112.9	S27 D37 L158 I159 Q165 K346 D384 L386	S27-H163 VanDerWaalsContact CB-CE1 3.45Å; S27-H163 WeakPolarHBondContact CB-CE1 3.3Å; S27-H163 WeakPolarHBondContact CB-ND1 3.47Å; S27-H163 WeakPolarHBondContact CB-O 3.11Å; S27-H163 PolarHBondContact N-O 3.14Å; S27-H163 VanDerWaalsContact N-O 3.09Å; S27-H163 PolarHBondContact OG-CE1 3.33Å; S27-H163 PolarHBondContact OG-ND1 3.39Å; D37-H163 IonicContact OD2-CD2 3.5Å; D37-H163 IonicContact OD2-CE1 3.93Å; D37-H163 IonicContact OD2-NE2 3.7Å; D37-H163 PolarHBondContact OD2-NE2 3.1Å; L158-H163 PolarHBondContact O-N 2.85Å; I159-H163 HydrophobicContact CD1-CB 4.19Å; I159-H163 CarbonylContact O-C 3.44Å; I159-H163 WeakPolarHBondContact O-CB 3.32Å; I159-H163 PolarHBondContact O-N 3.49Å; H163-Q165 PolarHBondContact CD2-NE2 3.28Å; H163-Q165 PolarHBondContact NE2-NE2 2.99Å; H163-K346 WeakPolarHBondContact NE2-CD 3.29Å; H163-K346 PolarHBondContact NE2-NZ 3.26Å; H163-D384 IonicContact CE1-OD2 3.99Å; H163-D384 IonicContact CG-OD2 2.72Å; H163-D384 IonicContact ND1-OD2 3.9Å; H163-D384 PolarHBondContact ND1-OD2 3.4Å; H163-L386 HydrophobicContact CB-CD1 4.47Å
164	F	98.1	Very high	98.2	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.024	C	C	.	.	I	π-helix	trans	80.5	92.6	-179.6	-166.3	-92	0	0	0	113.2	Y38 Q41 M112 V116 I159 D160 G162 Y166	Y38-F164 HydrophobicContact CD2-CB 4Å; Y38-F164 AromaticContact CD2-CD1 3.8Å; Y38-F164 HydrophobicContact CD2-CD1 3.8Å; Y38-F164 AromaticContact CD2-CD2 3.74Å; Y38-F164 HydrophobicContact CD2-CD2 3.74Å; Y38-F164 HydrophobicContact CD2-CE1 4.24Å; Y38-F164 HydrophobicContact CD2-CE2 4.2Å; Y38-F164 AromaticContact CD2-CG 3.53Å; Y38-F164 HydrophobicContact CD2-CG 3.53Å; Y38-F164 HydrophobicContact CD2-CZ 4.44Å; Y38-F164 HydrophobicContact CE2-CD2 4.1Å; Y38-F164 HydrophobicContact CE2-CE2 4.2Å; Y38-F164 HydrophobicContact CE2-CG 4.33Å; Y38-F164 HydrophobicContact CE2-CZ 4.49Å; Y38-F164 HydrophobicContact CG-CD1 4.34Å; Y38-F164 HydrophobicContact CG-CG 4.36Å; Q41-F164 HydrophobicContact CB-CD1 4.28Å; Q41-F164 HydrophobicContact CB-CE1 3.71Å; Q41-F164 HydrophobicContact CG-CD1 4Å; Q41-F164 HydrophobicContact CG-CE1 3.77Å; M112-F164 VanDerWaalsContact C-CE2 3.44Å; M112-F164 HydrophobicContact CB-CE2 3.61Å; M112-F164 HydrophobicContact CB-CZ 3.61Å; M112-F164 HydrophobicContact CE-CE1 3.53Å; M112-F164 HydrophobicContact CE-CZ 3.6Å; M112-F164 HydrophobicContact CG-CZ 4.3Å; M112-F164 WeakPolarHBondContact O-CE2 3.44Å; M112-F164 HydrophobicContact SD-CZ 4.04Å; V116-F164 HydrophobicContact CG2-CD2 4.2Å; V116-F164 HydrophobicContact CG2-CE2 3.58Å; V116-F164 HydrophobicContact CG2-CZ 3.87Å; I159-F164 PolarHBondContact O-N 2.85Å; D160-F164 WeakPolarHBondContact O-CA 3.49Å; G162-F164 PolarHBondContact O-N 3.49Å; G162-F164 VanDerWaalsContact O-N 3.14Å; F164-Y166 HydrophobicContact CE1-CE2 4.11Å; F164-Y166 HydrophobicContact CZ-CE2 4.29Å
165	Q	97.3	Very high	98.2	Very high	4 Å²	4	5 Å²	5	2%	0.019	2%	0.024	C	C	.	.			trans	-151.4	158.2	-178	-117.7	51.3	-94.5	0	0	110.9	D37 I159 D160 H163 N167	D37-Q165 PolarHBondContact OD2-NE2 3.4Å; I159-Q165 HydrophobicContact CG2-CB 3.87Å; I159-Q165 HydrophobicContact CG2-CG 4.28Å; I159-Q165 PolarHBondContact O-N 3.18Å; D160-Q165 WeakPolarHBondContact CA-O 3.48Å; D160-Q165 VanDerWaalsContact CB-O 3.31Å; D160-Q165 WeakPolarHBondContact CB-O 3.16Å; D160-Q165 PolarHBondContact O-N 3.4Å; H163-Q165 PolarHBondContact CD2-NE2 3.28Å; H163-Q165 PolarHBondContact NE2-NE2 2.99Å; Q165-N167 WeakPolarHBondContact CB-ND2 3.41Å
166	Y	97.9	Very high	98.3	Very high	11 Å²	11	8.9 Å²	8.9	4%	0.043	4%	0.039	C	C	.	.			trans	-107.2	48.1	174.9	-61.7	-81.2	0	0	0	112.4	Q41 H79 T115 V116 F164 G168 Y199	Q41-Y166 HydrophobicContact CB-CE2 4.25Å; Q41-Y166 HydrophobicContact CG-CD2 4.27Å; Q41-Y166 HydrophobicContact CG-CE2 4.04Å; H79-Y166 AromaticContact CE1-CD1 3.58Å; H79-Y166 AromaticContact CE1-CE1 3.58Å; H79-Y166 AromaticContact CE1-CG 3.99Å; T115-Y166 PolarHBondContact OG1-OH 3.16Å; V116-Y166 HydrophobicContact CB-CD1 4.47Å; V116-Y166 HydrophobicContact CB-CE1 4.22Å; V116-Y166 HydrophobicContact CG2-CD1 3.89Å; V116-Y166 HydrophobicContact CG2-CE1 3.53Å; F164-Y166 HydrophobicContact CE1-CE2 4.11Å; F164-Y166 HydrophobicContact CZ-CE2 4.29Å; Y166-G168 VanDerWaalsContact C-N 3.34Å; Y166-Y199 WeakPolarHBondContact CB-OH 3.49Å; Y166-Y199 WeakPolarHBondContact O-CE1 3.43Å
167	N	98.1	Very high	98.3	Very high	10 Å²	10	8.6 Å²	8.6	5%	0.053	4%	0.038	C	C	.	.	H	α-helix	trans	-71.2	-32.1	179.5	-60.7	-67.2	0	0	0	112.2	L156 I159 D160 Q165 V169 S170 L171 K200 L349	L156-N167 HydrophobicContact CD1-CB 3.97Å; I159-N167 WeakPolarHBondContact CG2-ND2 3.26Å; D160-N167 VanDerWaalsContact OD1-CB 3.29Å; D160-N167 WeakPolarHBondContact OD1-CB 3.36Å; D160-N167 PolarHBondContact OD1-N 3.43Å; D160-N167 PolarHBondContact OD1-ND2 2.97Å; D160-N167 PolarHBondContact OD2-N 3.33Å; Q165-N167 WeakPolarHBondContact CB-ND2 3.41Å; N167-V169 PolarHBondContact O-N 3.23Å; N167-V169 VanDerWaalsContact O-N 3.17Å; N167-S170 PolarHBondContact O-N 3.46Å; N167-L171 HydrophobicContact CB-CD1 4.16Å; N167-L171 WeakPolarHBondContact O-CB 3.39Å; N167-L171 WeakPolarHBondContact O-CG 3.23Å; N167-L171 PolarHBondContact O-N 3.26Å; N167-K200 PolarHBondContact OD1-NZ 2.91Å; N167-L349 HydrophobicContact CB-CD1 4.36Å
168	G	97.4	Very high	98.3	Very high	2 Å²	2	8.7 Å²	8.7	2%	0.021	4%	0.038	C	C	.	.	H	α-helix	trans	-54.4	-32.7	179.1	0	0	0	0	0	113.5	Y124 D160 Y166 G172	Y124-G168 WeakPolarHBondContact CB-O 3.41Å; D160-G168 PolarHBondContact OD2-N 3.23Å; Y166-G168 VanDerWaalsContact C-N 3.34Å; G168-G172 VanDerWaalsContact O-CA 3.27Å; G168-G172 WeakPolarHBondContact O-CA 3.32Å; G168-G172 PolarHBondContact O-N 3.47Å
169	V	98.5	Very high	98.3	Very high	4 Å²	4	8.9 Å²	8.9	2%	0.024	4%	0.04	C	C	.	.	H	α-helix	trans	-64.8	-54.5	176.9	-179.4	0	0	0	0	111.4	T119 I123 N167 G172 F173 Y199	T119-V169 HydrophobicContact CG2-CG2 4.11Å; I123-V169 HydrophobicContact CD1-CB 4.41Å; I123-V169 HydrophobicContact CD1-CG1 3.72Å; I123-V169 HydrophobicContact CD1-CG2 4.27Å; N167-V169 PolarHBondContact O-N 3.23Å; N167-V169 VanDerWaalsContact O-N 3.17Å; V169-G172 PolarHBondContact O-N 2.96Å; V169-F173 HydrophobicContact CG1-CD2 3.84Å; V169-F173 HydrophobicContact CG1-CE2 3.56Å; V169-F173 VanDerWaalsContact O-CD2 3.28Å; V169-F173 WeakPolarHBondContact O-CD2 3.46Å; V169-F173 PolarHBondContact O-N 3.34Å; V169-Y199 HydrophobicContact CB-CD1 4.02Å; V169-Y199 HydrophobicContact CB-CD2 4.27Å; V169-Y199 HydrophobicContact CB-CE1 3.62Å; V169-Y199 HydrophobicContact CB-CE2 3.9Å; V169-Y199 HydrophobicContact CB-CG 4.31Å; V169-Y199 HydrophobicContact CG1-CD1 3.98Å; V169-Y199 HydrophobicContact CG1-CD2 3.45Å; V169-Y199 VanDerWaalsContact CG1-CD2 3.45Å; V169-Y199 HydrophobicContact CG1-CE1 3.91Å; V169-Y199 HydrophobicContact CG1-CE2 3.36Å; V169-Y199 HydrophobicContact CG1-CG 3.76Å; V169-Y199 HydrophobicContact CG2-CE1 4.3Å; V169-Y199 HydrophobicContact CG2-CE2 4.29Å
170	S	98.2	Very high	98.3	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.014	4%	0.042	C	C	.	.	H	α-helix	trans	-60.4	-53	179.4	-174.8	0	0	0	0	111.7	N167 G172 F173 A174 A196 K200 E203	N167-S170 PolarHBondContact O-N 3.46Å; S170-G172 VanDerWaalsContact C-N 3.26Å; S170-G172 PolarHBondContact O-N 3.15Å; S170-F173 PolarHBondContact O-N 2.69Å; S170-A174 PolarHBondContact O-N 2.97Å; S170-A196 WeakPolarHBondContact O-CB 3.45Å; S170-K200 WeakPolarHBondContact OG-CB 3.49Å; S170-E203 VanDerWaalsContact OG-CD 3.32Å; S170-E203 WeakPolarHBondContact OG-CG 3.33Å; S170-E203 PolarHBondContact OG-OE1 3.06Å
171	L	98.7	Very high	98.3	Very high	8 Å²	8	9.2 Å²	9.2	4%	0.042	4%	0.042	C	C	.	.	H	α-helix	trans	-64.1	-34.3	-179.9	-66.6	174.7	0	0	0	111.5	Y124 L156 N167 A174 L175 E203 L349 L350 L353	Y124-L171 HydrophobicContact CD2-CB 4.44Å; Y124-L171 HydrophobicContact CE2-CB 4.36Å; L156-L171 HydrophobicContact CD1-CD1 3.87Å; N167-L171 HydrophobicContact CB-CD1 4.16Å; N167-L171 WeakPolarHBondContact O-CB 3.39Å; N167-L171 WeakPolarHBondContact O-CG 3.23Å; N167-L171 PolarHBondContact O-N 3.26Å; L171-A174 PolarHBondContact O-N 3.38Å; L171-L175 WeakPolarHBondContact O-CB 3.38Å; L171-L175 PolarHBondContact O-N 2.89Å; L171-E203 PolarHBondContact N-OE1 3.41Å; L171-L349 HydrophobicContact CD1-CB 4.27Å; L171-L350 HydrophobicContact CD2-CD2 4.02Å; L171-L353 HydrophobicContact CB-CD2 4.14Å; L171-L353 HydrophobicContact CD2-CB 4.16Å; L171-L353 HydrophobicContact CD2-CD2 3.96Å; L171-L353 WeakPolarHBondContact O-CD2 3.25Å
172	G	98.7	Very high	98.3	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-66.3	-46	175.8	0	0	0	0	0	111.9	G168 V169 S170 A174 L175 W176	G168-G172 VanDerWaalsContact O-CA 3.27Å; G168-G172 WeakPolarHBondContact O-CA 3.32Å; G168-G172 PolarHBondContact O-N 3.47Å; V169-G172 PolarHBondContact O-N 2.96Å; S170-G172 VanDerWaalsContact C-N 3.26Å; S170-G172 PolarHBondContact O-N 3.15Å; G172-A174 VanDerWaalsContact C-N 3.35Å; G172-A174 PolarHBondContact O-N 3.41Å; G172-L175 PolarHBondContact O-N 2.86Å; G172-W176 PolarHBondContact O-N 3.37Å
173	F	98.9	Very high	98.3	Very high	42 Å²	42	13.6 Å²	13.6	18%	0.184	7%	0.072	C	C	.	.	H	α-helix	trans	-62.8	-39.6	172.7	-77.2	-48.9	0	0	0	112.5	L75 I123 V169 S170 L175 W176 G177 L195 A196	L75-F173 HydrophobicContact CD2-CE2 4.26Å; I123-F173 HydrophobicContact CD1-CE2 4.07Å; I123-F173 HydrophobicContact CD1-CZ 3.87Å; I123-F173 HydrophobicContact CG2-CD1 4.17Å; I123-F173 HydrophobicContact CG2-CE1 4.22Å; I123-F173 HydrophobicContact CG2-CG 4.32Å; I123-F173 HydrophobicContact CG2-CZ 4.43Å; V169-F173 HydrophobicContact CG1-CD2 3.84Å; V169-F173 HydrophobicContact CG1-CE2 3.56Å; V169-F173 VanDerWaalsContact O-CD2 3.28Å; V169-F173 WeakPolarHBondContact O-CD2 3.46Å; V169-F173 PolarHBondContact O-N 3.34Å; S170-F173 PolarHBondContact O-N 2.69Å; F173-L175 VanDerWaalsContact C-N 3.34Å; F173-L175 PolarHBondContact O-N 2.74Å; F173-W176 PolarHBondContact O-N 3.02Å; F173-G177 PolarHBondContact O-N 3.35Å; F173-L195 HydrophobicContact CD1-CB 4.2Å; F173-L195 HydrophobicContact CD1-CD1 4.31Å; F173-L195 HydrophobicContact CD2-CB 4.16Å; F173-L195 HydrophobicContact CE1-CB 4.44Å; F173-L195 HydrophobicContact CE1-CD1 4.03Å; F173-L195 HydrophobicContact CE2-CB 4.38Å; F173-L195 HydrophobicContact CG-CB 4.08Å; F173-L195 HydrophobicContact CZ-CD1 4.43Å; F173-A196 HydrophobicContact CB-CB 3.67Å
174	A	98.8	Very high	98.2	Very high	2 Å²	2	15.2 Å²	15.2	2%	0.017	9%	0.089	C	C	.	.	H	α-helix	trans	-61.1	-43.4	173.2	0	0	0	0	0	111.4	S170 L171 G172 G177 V178 A196 E203 L353	S170-A174 PolarHBondContact O-N 2.97Å; L171-A174 PolarHBondContact O-N 3.38Å; G172-A174 VanDerWaalsContact C-N 3.35Å; G172-A174 PolarHBondContact O-N 3.41Å; A174-G177 CarbonylContact O-C 3.58Å; A174-G177 WeakPolarHBondContact O-CA 3.29Å; A174-G177 PolarHBondContact O-N 2.93Å; A174-G177 VanDerWaalsContact O-N 3.12Å; A174-V178 WeakPolarHBondContact O-CG2 3.47Å; A174-V178 PolarHBondContact O-N 3.41Å; A174-A196 HydrophobicContact CB-CB 4.19Å; A174-E203 WeakPolarHBondContact CB-OE2 3.43Å; A174-L353 HydrophobicContact CB-CD2 4.16Å
175	L	98.8	Very high	98.2	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-66.6	-39.6	176.8	-176.2	55.7	0	0	0	112.7	A127 V128 Y131 L171 G172 F173 G177 V178 L179 L353 L357	A127-L175 HydrophobicContact CB-CB 4.06Å; A127-L175 HydrophobicContact CB-CD2 3.81Å; A127-L175 HydrophobicContact CB-CG 3.87Å; V128-L175 HydrophobicContact CB-CD2 4.35Å; V128-L175 HydrophobicContact CG2-CD2 3.61Å; Y131-L175 HydrophobicContact CD2-CD1 4.02Å; Y131-L175 HydrophobicContact CG-CD1 4.07Å; L171-L175 WeakPolarHBondContact O-CB 3.38Å; L171-L175 PolarHBondContact O-N 2.89Å; G172-L175 PolarHBondContact O-N 2.86Å; F173-L175 VanDerWaalsContact C-N 3.34Å; F173-L175 PolarHBondContact O-N 2.74Å; L175-G177 PolarHBondContact O-N 3.19Å; L175-V178 PolarHBondContact O-N 3.36Å; L175-L179 WeakPolarHBondContact O-CB 3.46Å; L175-L179 PolarHBondContact O-N 3.36Å; L175-L353 HydrophobicContact CB-CD1 4.31Å; L175-L353 HydrophobicContact CB-CD2 4.47Å; L175-L353 HydrophobicContact CD2-CD1 4.27Å; L175-L357 HydrophobicContact CD1-CD2 3.61Å
176	W	98.8	Very high	98.3	Very high	82 Å²	82	23.2 Å²	23.2	31%	0.311	12%	0.121	S	C	.	.	H	α-helix	trans	-57.9	-40.6	169.1	-85.8	114	0	0	0	111.4	I123 P126 A127 L130 G172 F173 L179 A180 A192	I123-W176 PolarHBondContact O-NE1 2.69Å; P126-W176 HydrophobicContact CB-CZ2 4.03Å; A127-W176 HydrophobicContact CB-CD2 4.2Å; A127-W176 HydrophobicContact CB-CG 4.03Å; L130-W176 HydrophobicContact CD1-CH2 3.2Å; L130-W176 HydrophobicContact CD1-CZ2 3.96Å; L130-W176 HydrophobicContact CD1-CZ3 3.78Å; G172-W176 PolarHBondContact O-N 3.37Å; F173-W176 PolarHBondContact O-N 3.02Å; W176-L179 HydrophobicContact CE3-CD2 3.8Å; W176-L179 HydrophobicContact CZ3-CD2 3.78Å; W176-L179 PolarHBondContact O-N 2.85Å; W176-A180 WeakPolarHBondContact O-CB 3.29Å; W176-A180 PolarHBondContact O-N 3.38Å; W176-A192 HydrophobicContact CB-CB 3.92Å
177	G	98.8	Very high	98.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-54.5	-55.1	170.4	0	0	0	0	0	111.7	F173 A174 L175 L179 A180 L181	F173-G177 PolarHBondContact O-N 3.35Å; A174-G177 CarbonylContact O-C 3.58Å; A174-G177 WeakPolarHBondContact O-CA 3.29Å; A174-G177 PolarHBondContact O-N 2.93Å; A174-G177 VanDerWaalsContact O-N 3.12Å; L175-G177 PolarHBondContact O-N 3.19Å; G177-L179 PolarHBondContact O-N 3.44Å; G177-A180 PolarHBondContact O-N 3.07Å; G177-L181 WeakPolarHBondContact O-CB 3.44Å; G177-L181 VanDerWaalsContact O-CG 3.22Å; G177-L181 WeakPolarHBondContact O-CG 3.38Å; G177-L181 PolarHBondContact O-N 3.49Å
178	V	98.8	Very high	98.3	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.024	15%	0.153	C	C	.	.	H	α-helix	trans	-59.6	-44.2	178.7	176.3	0	0	0	0	112	Y131 A174 L175 L181 G182 F210 F322 F325 L329 L357	Y131-V178 HydrophobicContact CE2-CG1 4.28Å; A174-V178 WeakPolarHBondContact O-CG2 3.47Å; A174-V178 PolarHBondContact O-N 3.41Å; L175-V178 PolarHBondContact O-N 3.36Å; V178-L181 PolarHBondContact O-N 3.39Å; V178-G182 PolarHBondContact O-N 3.47Å; V178-F210 HydrophobicContact CG2-CE2 4.12Å; V178-F210 HydrophobicContact CG2-CZ 3.76Å; V178-F322 HydrophobicContact CG1-CE2 3.91Å; V178-F322 HydrophobicContact CG1-CZ 3.83Å; V178-F325 HydrophobicContact CB-CE1 4.38Å; V178-F325 HydrophobicContact CG1-CE1 4.16Å; V178-F325 HydrophobicContact CG2-CE1 4.04Å; V178-F325 HydrophobicContact CG2-CZ 4.28Å; V178-L329 HydrophobicContact CG2-CD1 3.78Å; V178-L357 HydrophobicContact CG1-CD1 3.91Å; V178-L357 HydrophobicContact CG2-CD1 4.47Å
179	L	98.7	Very high	98.3	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-53	178.5	172	57.9	0	0	0	111.4	L130 L135 L175 W176 G177 L181 G182 L183	L130-L179 HydrophobicContact CB-CD2 3.59Å; L130-L179 HydrophobicContact CD1-CD2 4.47Å; L135-L179 HydrophobicContact CD1-CD1 3.66Å; L135-L179 HydrophobicContact CG-CD1 3.93Å; L175-L179 WeakPolarHBondContact O-CB 3.46Å; L175-L179 PolarHBondContact O-N 3.36Å; W176-L179 HydrophobicContact CE3-CD2 3.8Å; W176-L179 HydrophobicContact CZ3-CD2 3.78Å; W176-L179 PolarHBondContact O-N 2.85Å; G177-L179 PolarHBondContact O-N 3.44Å; L179-L181 VanDerWaalsContact C-N 3.32Å; L179-L181 PolarHBondContact O-N 2.87Å; L179-G182 PolarHBondContact O-N 3.34Å; L179-L183 HydrophobicContact CD1-CD1 3.85Å; L179-L183 HydrophobicContact CD1-CG 4.17Å; L179-L183 HydrophobicContact CG-CD1 4.25Å; L179-L183 WeakPolarHBondContact O-CG 3.45Å; L179-L183 PolarHBondContact O-N 2.91Å
180	A	98.6	Very high	98.3	Very high	7 Å²	7	28.4 Å²	28.4	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-41.5	179.4	0	0	0	0	0	111.6	W176 G177 G182 L183 G184 W185 L188	W176-A180 WeakPolarHBondContact O-CB 3.29Å; W176-A180 PolarHBondContact O-N 3.38Å; G177-A180 PolarHBondContact O-N 3.07Å; A180-G182 PolarHBondContact O-N 3.12Å; A180-L183 CarbonylContact O-C 3.47Å; A180-L183 PolarHBondContact O-N 3.49Å; A180-G184 PolarHBondContact O-N 2.87Å; A180-G184 VanDerWaalsContact O-N 3.07Å; A180-W185 HydrophobicContact CB-CB 4.23Å; A180-W185 WeakPolarHBondContact O-CA 3.44Å; A180-W185 PolarHBondContact O-N 3.27Å; A180-L188 HydrophobicContact CB-CB 4.02Å
181	L	98.4	Very high	98.4	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-64.3	-38.9	175.3	-69.1	-173.5	0	0	0	113	G177 V178 L179 L183 G184 F210 F213 L214 F325	G177-L181 WeakPolarHBondContact O-CB 3.44Å; G177-L181 VanDerWaalsContact O-CG 3.22Å; G177-L181 WeakPolarHBondContact O-CG 3.38Å; G177-L181 PolarHBondContact O-N 3.49Å; V178-L181 PolarHBondContact O-N 3.39Å; L179-L181 VanDerWaalsContact C-N 3.32Å; L179-L181 PolarHBondContact O-N 2.87Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L181-G184 PolarHBondContact O-N 3.03Å; L181-G184 VanDerWaalsContact O-N 3.13Å; L181-F210 HydrophobicContact CD1-CD1 3.53Å; L181-F210 HydrophobicContact CD1-CE1 3.5Å; L181-F210 VanDerWaalsContact CD1-CE1 3.5Å; L181-F210 HydrophobicContact CD1-CZ 4.48Å; L181-F210 HydrophobicContact CG-CE1 4.43Å; L181-F213 HydrophobicContact CB-CD1 4.48Å; L181-F213 HydrophobicContact CB-CE1 3.95Å; L181-F213 HydrophobicContact CD1-CD1 3.96Å; L181-F213 HydrophobicContact CD1-CE1 4.27Å; L181-F213 HydrophobicContact CG-CE1 4.47Å; L181-L214 HydrophobicContact CD2-CD2 3.55Å; L181-L214 HydrophobicContact CD2-CG 4.35Å; L181-F325 HydrophobicContact CB-CE1 4.38Å; L181-F325 HydrophobicContact CD1-CE1 3.93Å; L181-F325 HydrophobicContact CD1-CZ 3.8Å
182	G	97.4	Very high	98.4	Very high	28 Å²	28	31.6 Å²	31.6	29%	0.289	17%	0.17	S	C	.	.	H	α-helix	trans	-64.2	-35.5	174.6	0	0	0	0	0	113.1	V178 L179 A180 G184 F322	V178-G182 PolarHBondContact O-N 3.47Å; L179-G182 PolarHBondContact O-N 3.34Å; A180-G182 PolarHBondContact O-N 3.12Å; G182-G184 VanDerWaalsContact C-N 3.28Å; G182-G184 PolarHBondContact O-N 3.39Å; G182-F322 VanDerWaalsContact CA-CE2 3.47Å
183	L	97.6	Very high	98.4	Very high	67 Å²	67	32.3 Å²	32.3	35%	0.351	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.1	173.6	-64.1	175.1	0	0	0	113.6	L135 L179 A180 L181 W185	L135-L183 HydrophobicContact CD2-CD2 3.91Å; L135-L183 HydrophobicContact CD2-CG 4.3Å; L179-L183 HydrophobicContact CD1-CD1 3.85Å; L179-L183 HydrophobicContact CD1-CG 4.17Å; L179-L183 HydrophobicContact CG-CD1 4.25Å; L179-L183 WeakPolarHBondContact O-CG 3.45Å; L179-L183 PolarHBondContact O-N 2.91Å; A180-L183 CarbonylContact O-C 3.47Å; A180-L183 PolarHBondContact O-N 3.49Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L183-W185 HydrophobicContact CB-CD2 4.4Å; L183-W185 HydrophobicContact CD1-CE3 4.42Å; L183-W185 HydrophobicContact CD1-CH2 4.4Å; L183-W185 HydrophobicContact CD1-CZ3 4.23Å
184	G	96.8	Very high	98.4	Very high	35 Å²	35	30.5 Å²	30.5	36%	0.361	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	3.9	179.5	0	0	0	0	0	115.3	A180 L181 G182 N186	A180-G184 PolarHBondContact O-N 2.87Å; A180-G184 VanDerWaalsContact O-N 3.07Å; L181-G184 PolarHBondContact O-N 3.03Å; L181-G184 VanDerWaalsContact O-N 3.13Å; G182-G184 VanDerWaalsContact C-N 3.28Å; G182-G184 PolarHBondContact O-N 3.39Å; G184-N186 VanDerWaalsContact C-N 3.33Å; G184-N186 PolarHBondContact O-N 3.46Å
185	W	97.6	Very high	98.4	Very high	151 Å²	151	32.2 Å²	32.2	57%	0.572	18%	0.175	S	C	*	.			trans	-81.9	73.5	177.7	-59.5	-15.8	0	0	0	111.4	A180 L183 S187 L188 G189	A180-W185 HydrophobicContact CB-CB 4.23Å; A180-W185 WeakPolarHBondContact O-CA 3.44Å; A180-W185 PolarHBondContact O-N 3.27Å; L183-W185 HydrophobicContact CB-CD2 4.4Å; L183-W185 HydrophobicContact CD1-CE3 4.42Å; L183-W185 HydrophobicContact CD1-CH2 4.4Å; L183-W185 HydrophobicContact CD1-CZ3 4.23Å; W185-S187 PolarHBondContact O-N 2.94Å; W185-L188 HydrophobicContact CB-CB 4.16Å; W185-L188 HydrophobicContact CB-CD1 4.19Å; W185-L188 HydrophobicContact CB-CG 4.49Å; W185-L188 HydrophobicContact CD2-CD1 4.14Å; W185-L188 HydrophobicContact CE3-CD1 3.67Å; W185-L188 HydrophobicContact CG-CD1 4.39Å; W185-L188 HydrophobicContact CZ3-CD1 4.37Å; W185-L188 PolarHBondContact O-N 3.33Å; W185-G189 PolarHBondContact O-N 2.99Å
186	N	97.9	Very high	98.4	Very high	22 Å²	22	32.1 Å²	32.1	12%	0.118	17%	0.174	C	C	.	.	H	α-helix	trans	-56.9	-45.2	-171.3	-55.1	-52.5	0	0	0	113.3	G184 G189 S190 L214 K217 L230 I234	G184-N186 VanDerWaalsContact C-N 3.33Å; G184-N186 PolarHBondContact O-N 3.46Å; N186-G189 PolarHBondContact O-N 3.39Å; N186-S190 PolarHBondContact O-N 2.9Å; N186-S190 PolarHBondContact O-OG 3.4Å; N186-S190 VanDerWaalsContact O-OG 3.08Å; N186-L214 HydrophobicContact CB-CD2 4.08Å; N186-K217 PolarHBondContact OD1-NZ 3.23Å; N186-L230 HydrophobicContact CB-CD1 3.96Å; N186-L230 WeakPolarHBondContact ND2-CD1 3.17Å; N186-I234 HydrophobicContact CB-CD1 4.27Å; N186-I234 HydrophobicContact CB-CG1 4.3Å
187	S	98.1	Very high	98.3	Very high	43 Å²	43	29.5 Å²	29.5	30%	0.301	17%	0.166	S	C	.	.	H	α-helix	trans	-63.9	-45.8	179.3	-63.8	0	0	0	0	112.5	W185 G189 S190 L191 T237	W185-S187 PolarHBondContact O-N 2.94Å; S187-G189 VanDerWaalsContact C-N 3.27Å; S187-G189 PolarHBondContact O-N 3Å; S187-S190 PolarHBondContact O-N 2.99Å; S187-L191 WeakPolarHBondContact O-CB 3.28Å; S187-L191 PolarHBondContact O-N 2.94Å; S187-T237 WeakPolarHBondContact O-CG2 3.26Å
188	L	98.3	Very high	98.3	Very high	89 Å²	89	29.5 Å²	29.5	47%	0.466	17%	0.166	S	C	.	.	H	α-helix	trans	-63.6	-36.5	176.7	-67.8	177.6	0	0	0	111.5	A180 W185 L191 A192	A180-L188 HydrophobicContact CB-CB 4.02Å; W185-L188 HydrophobicContact CB-CB 4.16Å; W185-L188 HydrophobicContact CB-CD1 4.19Å; W185-L188 HydrophobicContact CB-CG 4.49Å; W185-L188 HydrophobicContact CD2-CD1 4.14Å; W185-L188 HydrophobicContact CE3-CD1 3.67Å; W185-L188 HydrophobicContact CG-CD1 4.39Å; W185-L188 HydrophobicContact CZ3-CD1 4.37Å; W185-L188 PolarHBondContact O-N 3.33Å; L188-L191 HydrophobicContact CD2-CD2 4.23Å; L188-L191 PolarHBondContact O-N 3.48Å; L188-A192 WeakPolarHBondContact O-CB 3.39Å; L188-A192 PolarHBondContact O-N 3.31Å
189	G	98.4	Very high	98.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-44.4	173.4	0	0	0	0	0	112.9	W185 N186 S187 F193	W185-G189 PolarHBondContact O-N 2.99Å; N186-G189 PolarHBondContact O-N 3.39Å; S187-G189 VanDerWaalsContact C-N 3.27Å; S187-G189 PolarHBondContact O-N 3Å; G189-F193 WeakPolarHBondContact O-CB 3.46Å; G189-F193 PolarHBondContact O-N 3.41Å
190	S	98.6	Very high	98.2	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-39.4	176.6	-60.2	0	0	0	0	112.9	N186 S187 S194 L214	N186-S190 PolarHBondContact O-N 2.9Å; N186-S190 PolarHBondContact O-OG 3.4Å; N186-S190 VanDerWaalsContact O-OG 3.08Å; S187-S190 PolarHBondContact O-N 2.99Å; S190-S194 VanDerWaalsContact O-CB 3.29Å; S190-S194 WeakPolarHBondContact O-CB 3.37Å; S190-S194 PolarHBondContact O-N 2.78Å; S190-S194 PolarHBondContact O-OG 3.22Å; S190-L214 VanDerWaalsContact OG-CD1 3.26Å; S190-L214 WeakPolarHBondContact OG-CD1 3.48Å
191	L	98.8	Very high	98	Very high	65 Å²	65	31 Å²	31	34%	0.34	17%	0.17	S	C	.	.	H	α-helix	trans	-58.1	-56.5	173.3	173.7	74.4	0	0	0	110.1	S187 L188 F193 S194 L195 T237 T241	S187-L191 WeakPolarHBondContact O-CB 3.28Å; S187-L191 PolarHBondContact O-N 2.94Å; L188-L191 HydrophobicContact CD2-CD2 4.23Å; L188-L191 PolarHBondContact O-N 3.48Å; L191-F193 PolarHBondContact O-N 3.41Å; L191-S194 WeakPolarHBondContact O-CB 3.46Å; L191-S194 PolarHBondContact O-N 2.79Å; L191-S194 VanDerWaalsContact O-N 3.15Å; L191-L195 HydrophobicContact CG-CD1 4.45Å; L191-L195 WeakPolarHBondContact O-CG 3.39Å; L191-L195 PolarHBondContact O-N 3.5Å; L191-T237 HydrophobicContact CB-CG2 3.94Å; L191-T241 HydrophobicContact CD1-CG2 3.84Å; L191-T241 WeakPolarHBondContact CD1-OG1 3.38Å
192	A	98.8	Very high	97.7	Very high	12 Å²	12	33.6 Å²	33.6	10%	0.099	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-43.1	-177.1	0	0	0	0	0	112.2	W176 L188 S194 L195 A196	W176-A192 HydrophobicContact CB-CB 3.92Å; L188-A192 WeakPolarHBondContact O-CB 3.39Å; L188-A192 PolarHBondContact O-N 3.31Å; A192-S194 VanDerWaalsContact C-N 3.34Å; A192-S194 PolarHBondContact O-N 2.97Å; A192-L195 WeakPolarHBondContact O-CB 3.35Å; A192-L195 PolarHBondContact O-N 2.9Å; A192-A196 PolarHBondContact O-N 2.95Å
193	F	98.8	Very high	97.7	Very high	15 Å²	15	32.3 Å²	32.3	7%	0.066	17%	0.17	C	C	.	.	H	α-helix	trans	-67.8	-33.8	176.8	-173.9	-114.2	0	0	0	113	G189 L191 L195 A196 L197 E203 H206 A207 F210	G189-F193 WeakPolarHBondContact O-CB 3.46Å; G189-F193 PolarHBondContact O-N 3.41Å; L191-F193 PolarHBondContact O-N 3.41Å; F193-L195 VanDerWaalsContact C-N 3.34Å; F193-A196 HydrophobicContact CD2-CB 4.41Å; F193-A196 WeakPolarHBondContact O-CB 3.24Å; F193-A196 PolarHBondContact O-N 3.25Å; F193-L197 HydrophobicContact CD1-CD1 4.09Å; F193-L197 HydrophobicContact CE1-CD1 3.64Å; F193-L197 HydrophobicContact CE1-CG 4.12Å; F193-L197 HydrophobicContact CZ-CD1 4.09Å; F193-L197 HydrophobicContact CZ-CD2 4.29Å; F193-L197 HydrophobicContact CZ-CG 4.08Å; F193-L197 PolarHBondContact O-N 3.17Å; F193-E203 HydrophobicContact CE2-CB 4.33Å; F193-H206 HydrophobicContact CE2-CB 3.75Å; F193-H206 HydrophobicContact CZ-CB 3.98Å; F193-A207 HydrophobicContact CE1-CB 4.14Å; F193-A207 HydrophobicContact CZ-CB 4.11Å; F193-F210 HydrophobicContact CB-CD1 3.74Å; F193-F210 HydrophobicContact CB-CE1 3.59Å; F193-F210 HydrophobicContact CB-CG 4.41Å; F193-F210 HydrophobicContact CB-CZ 4.13Å; F193-F210 HydrophobicContact CD1-CB 3.86Å; F193-F210 AromaticContact CD1-CD1 3.84Å; F193-F210 HydrophobicContact CD1-CD1 3.84Å; F193-F210 HydrophobicContact CD1-CD2 4.23Å; F193-F210 HydrophobicContact CD1-CE1 4.44Å; F193-F210 AromaticContact CD1-CG 3.72Å; F193-F210 HydrophobicContact CD1-CG 3.72Å; F193-F210 HydrophobicContact CD2-CD1 4.1Å; F193-F210 AromaticContact CD2-CD2 3.77Å; F193-F210 HydrophobicContact CD2-CD2 3.77Å; F193-F210 AromaticContact CD2-CE1 3.96Å; F193-F210 HydrophobicContact CD2-CE1 3.96Å; F193-F210 AromaticContact CD2-CE2 3.61Å; F193-F210 HydrophobicContact CD2-CE2 3.61Å; F193-F210 HydrophobicContact CD2-CG 4.01Å; F193-F210 AromaticContact CD2-CZ 3.7Å; F193-F210 HydrophobicContact CD2-CZ 3.7Å; F193-F210 HydrophobicContact CE1-CB 3.84Å; F193-F210 HydrophobicContact CE1-CD2 4.21Å; F193-F210 AromaticContact CE1-CG 3.97Å; F193-F210 HydrophobicContact CE1-CG 3.97Å; F193-F210 AromaticContact CE2-CD2 3.78Å; F193-F210 HydrophobicContact CE2-CD2 3.78Å; F193-F210 AromaticContact CE2-CE2 3.86Å; F193-F210 HydrophobicContact CE2-CE2 3.86Å; F193-F210 HydrophobicContact CE2-CG 4.26Å; F193-F210 HydrophobicContact CE2-CZ 4.41Å; F193-F210 HydrophobicContact CG-CB 4.4Å; F193-F210 AromaticContact CG-CD1 3.59Å; F193-F210 HydrophobicContact CG-CD1 3.59Å; F193-F210 HydrophobicContact CG-CD2 4.02Å; F193-F210 AromaticContact CG-CE1 3.72Å; F193-F210 HydrophobicContact CG-CE1 3.72Å; F193-F210 HydrophobicContact CG-CE2 4.13Å; F193-F210 AromaticContact CG-CG 3.75Å; F193-F210 HydrophobicContact CG-CG 3.75Å; F193-F210 AromaticContact CG-CZ 3.98Å; F193-F210 HydrophobicContact CG-CZ 3.98Å; F193-F210 HydrophobicContact CZ-CB 4.39Å; F193-F210 HydrophobicContact CZ-CD2 4Å; F193-F210 HydrophobicContact CZ-CG 4.24Å
194	S	98.8	Very high	97.6	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.028	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-39.2	173.2	-59	0	0	0	0	111.2	S190 L191 A192 L197 N198	S190-S194 VanDerWaalsContact O-CB 3.29Å; S190-S194 WeakPolarHBondContact O-CB 3.37Å; S190-S194 PolarHBondContact O-N 2.78Å; S190-S194 PolarHBondContact O-OG 3.22Å; L191-S194 WeakPolarHBondContact O-CB 3.46Å; L191-S194 PolarHBondContact O-N 2.79Å; L191-S194 VanDerWaalsContact O-N 3.15Å; A192-S194 VanDerWaalsContact C-N 3.34Å; A192-S194 PolarHBondContact O-N 2.97Å; S194-L197 PolarHBondContact O-N 3.43Å; S194-N198 WeakPolarHBondContact O-CB 3.43Å; S194-N198 PolarHBondContact O-N 2.89Å; S194-N198 PolarHBondContact O-ND2 3.04Å
195	L	98.8	Very high	97.6	Very high	39 Å²	39	31.6 Å²	31.6	20%	0.204	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-40.2	172.6	-65.8	173.5	0	0	0	111.8	L75 F173 L191 A192 F193 L197 N198 Y199 T241	L75-L195 HydrophobicContact CD2-CB 4.1Å; L75-L195 HydrophobicContact CD2-CD2 3.95Å; L75-L195 WeakPolarHBondContact CD2-O 3.49Å; F173-L195 HydrophobicContact CD1-CB 4.2Å; F173-L195 HydrophobicContact CD1-CD1 4.31Å; F173-L195 HydrophobicContact CD2-CB 4.16Å; F173-L195 HydrophobicContact CE1-CB 4.44Å; F173-L195 HydrophobicContact CE1-CD1 4.03Å; F173-L195 HydrophobicContact CE2-CB 4.38Å; F173-L195 HydrophobicContact CG-CB 4.08Å; F173-L195 HydrophobicContact CZ-CD1 4.43Å; L191-L195 HydrophobicContact CG-CD1 4.45Å; L191-L195 WeakPolarHBondContact O-CG 3.39Å; L191-L195 PolarHBondContact O-N 3.5Å; A192-L195 WeakPolarHBondContact O-CB 3.35Å; A192-L195 PolarHBondContact O-N 2.9Å; F193-L195 VanDerWaalsContact C-N 3.34Å; L195-L197 PolarHBondContact O-N 3.5Å; L195-N198 CarbonylContact O-C 3.04Å; L195-N198 PolarHBondContact O-N 3.25Å; L195-Y199 WeakPolarHBondContact O-CB 3.47Å; L195-Y199 PolarHBondContact O-N 2.72Å; L195-T241 HydrophobicContact CD2-CG2 3.88Å; L195-T241 HydrophobicContact CG-CG2 4.12Å
196	A	98.7	Very high	97.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-56.9	-49.4	174.8	0	0	0	0	0	111.5	S170 F173 A174 A192 F193 N198 Y199 K200 E203	S170-A196 WeakPolarHBondContact O-CB 3.45Å; F173-A196 HydrophobicContact CB-CB 3.67Å; A174-A196 HydrophobicContact CB-CB 4.19Å; A192-A196 PolarHBondContact O-N 2.95Å; F193-A196 HydrophobicContact CD2-CB 4.41Å; F193-A196 WeakPolarHBondContact O-CB 3.24Å; F193-A196 PolarHBondContact O-N 3.25Å; A196-N198 VanDerWaalsContact C-N 3.35Å; A196-N198 PolarHBondContact O-N 3.17Å; A196-Y199 WeakPolarHBondContact O-CB 3.35Å; A196-Y199 PolarHBondContact O-N 3.35Å; A196-Y199 VanDerWaalsContact O-N 3.14Å; A196-K200 PolarHBondContact O-N 3.04Å; A196-E203 HydrophobicContact CB-CB 4.47Å; A196-E203 HydrophobicContact CB-CG 3.93Å
197	L	97.9	Very high	97.6	Very high	27 Å²	27	24.7 Å²	24.7	14%	0.141	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-38.9	176.4	-74.3	169.3	0	0	0	113.2	P73 F193 S194 L195 Y199 K200 E203 L204 F242	P73-L197 VanDerWaalsContact CG-O 3.27Å; P73-L197 WeakPolarHBondContact CG-O 3.21Å; F193-L197 HydrophobicContact CD1-CD1 4.09Å; F193-L197 HydrophobicContact CE1-CD1 3.64Å; F193-L197 HydrophobicContact CE1-CG 4.12Å; F193-L197 HydrophobicContact CZ-CD1 4.09Å; F193-L197 HydrophobicContact CZ-CD2 4.29Å; F193-L197 HydrophobicContact CZ-CG 4.08Å; F193-L197 PolarHBondContact O-N 3.17Å; S194-L197 PolarHBondContact O-N 3.43Å; L195-L197 PolarHBondContact O-N 3.5Å; L197-Y199 VanDerWaalsContact C-N 3.26Å; L197-Y199 PolarHBondContact O-N 3.15Å; L197-K200 CarbonylContact O-C 3.52Å; L197-E203 HydrophobicContact CD2-CB 3.78Å; L197-E203 HydrophobicContact CG-CB 4.24Å; L197-L204 HydrophobicContact CD2-CB 4.45Å; L197-L204 HydrophobicContact CD2-CD2 3.81Å; L197-L204 HydrophobicContact CD2-CG 3.82Å; L197-F242 HydrophobicContact CB-CZ 4.31Å; L197-F242 HydrophobicContact CD1-CZ 4.32Å
198	N	98.3	Very high	97.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-76.3	-14.2	178.2	-79.4	-77.9	0	0	0	113.3	P73 L75 S194 L195 A196 F242 C245 W246	P73-N198 CarbonylContact C-O 3.58Å; P73-N198 WeakPolarHBondContact CB-O 3.41Å; P73-N198 WeakPolarHBondContact CG-O 3.35Å; L75-N198 HydrophobicContact CB-CB 4.12Å; L75-N198 WeakPolarHBondContact CB-O 3.5Å; L75-N198 PolarHBondContact N-O 3.37Å; L75-N198 VanDerWaalsContact N-O 3.14Å; S194-N198 WeakPolarHBondContact O-CB 3.43Å; S194-N198 PolarHBondContact O-N 2.89Å; S194-N198 PolarHBondContact O-ND2 3.04Å; L195-N198 CarbonylContact O-C 3.04Å; L195-N198 PolarHBondContact O-N 3.25Å; A196-N198 VanDerWaalsContact C-N 3.35Å; A196-N198 PolarHBondContact O-N 3.17Å; N198-F242 WeakPolarHBondContact ND2-CD1 3.22Å; N198-F242 VanDerWaalsContact ND2-CE1 3.29Å; N198-F242 WeakPolarHBondContact ND2-CE1 3.48Å; N198-F242 WeakPolarHBondContact ND2-CZ 3.4Å; N198-C245 HydrophobicContact CB-CB 4.22Å; N198-W246 VanDerWaalsContact OD1-CD1 3.32Å; N198-W246 PolarHBondContact OD1-NE1 3.29Å
199	Y	98.4	Very high	97.6	Very high	7 Å²	7	20.6 Å²	20.6	3%	0.027	11%	0.109	C	C	.	.	H	α-helix	trans	-85.7	-54.1	170.2	-163.6	-88.7	0	0	0	110.6	P73 L75 T76 H79 Y166 V169 L195 A196 L197	P73-Y199 WeakPolarHBondContact CD-O 3.48Å; L75-Y199 HydrophobicContact CB-CD2 4.46Å; L75-Y199 HydrophobicContact CD2-CD2 4.31Å; L75-Y199 HydrophobicContact CG-CD2 4.1Å; T76-Y199 PolarHBondContact OG1-O 3.41Å; H79-Y199 HydrophobicContact CB-CE2 4Å; H79-Y199 PolarHBondContact CE1-OH 3.06Å; H79-Y199 AromaticContact ND1-CE2 3.71Å; H79-Y199 AromaticContact ND1-CZ 3.67Å; H79-Y199 PolarHBondContact ND1-OH 3.23Å; Y166-Y199 WeakPolarHBondContact CB-OH 3.49Å; Y166-Y199 WeakPolarHBondContact O-CE1 3.43Å; V169-Y199 HydrophobicContact CB-CD1 4.02Å; V169-Y199 HydrophobicContact CB-CD2 4.27Å; V169-Y199 HydrophobicContact CB-CE1 3.62Å; V169-Y199 HydrophobicContact CB-CE2 3.9Å; V169-Y199 HydrophobicContact CB-CG 4.31Å; V169-Y199 HydrophobicContact CG1-CD1 3.98Å; V169-Y199 HydrophobicContact CG1-CD2 3.45Å; V169-Y199 VanDerWaalsContact CG1-CD2 3.45Å; V169-Y199 HydrophobicContact CG1-CE1 3.91Å; V169-Y199 HydrophobicContact CG1-CE2 3.36Å; V169-Y199 HydrophobicContact CG1-CG 3.76Å; V169-Y199 HydrophobicContact CG2-CE1 4.3Å; V169-Y199 HydrophobicContact CG2-CE2 4.29Å; L195-Y199 WeakPolarHBondContact O-CB 3.47Å; L195-Y199 PolarHBondContact O-N 2.72Å; A196-Y199 WeakPolarHBondContact O-CB 3.35Å; A196-Y199 PolarHBondContact O-N 3.35Å; A196-Y199 VanDerWaalsContact O-N 3.14Å; L197-Y199 VanDerWaalsContact C-N 3.26Å; L197-Y199 PolarHBondContact O-N 3.15Å
200	K	96.6	Very high	97.6	Very high	24 Å²	24	20.8 Å²	20.8	10%	0.104	11%	0.11	C	C	.	.			trans	-138.2	118.9	178.9	-151	178.4	-160.2	-170.2	0	110.7	Y72 N167 S170 A196 L197 M202 E203	Y72-K200 HydrophobicContact CD2-CG 4.36Å; Y72-K200 HydrophobicContact CE2-CD 4.26Å; Y72-K200 HydrophobicContact CE2-CG 4.11Å; Y72-K200 WeakPolarHBondContact OH-CE 3.48Å; Y72-K200 PolarHBondContact OH-NZ 3.08Å; N167-K200 PolarHBondContact OD1-NZ 2.91Å; S170-K200 WeakPolarHBondContact OG-CB 3.49Å; A196-K200 PolarHBondContact O-N 3.04Å; L197-K200 CarbonylContact O-C 3.52Å; K200-M202 HydrophobicContact CD-CG 4.47Å; K200-M202 HydrophobicContact CG-CB 4.44Å; K200-M202 HydrophobicContact CG-CG 4.27Å; K200-M202 PolarHBondContact O-N 2.85Å; K200-E203 PolarHBondContact O-N 3.36Å; K200-E203 VanDerWaalsContact O-N 3.13Å
201	Q	94.4	Very high	97.6	Very high	15 Å²	15	26.5 Å²	26.5	7%	0.07	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-60.1	-20.5	-178.9	69.9	-83.7	34.4	0	0	113.9	D71 P73 E203 L204 I263 F264	D71-Q201 PolarHBondContact O-NE2 3.38Å; P73-Q201 HydrophobicContact CG-CB 4.47Å; Q201-E203 PolarHBondContact O-N 3.31Å; Q201-E203 VanDerWaalsContact O-N 3.15Å; Q201-L204 WeakPolarHBondContact O-CB 3.29Å; Q201-L204 VanDerWaalsContact O-CG 3.22Å; Q201-L204 WeakPolarHBondContact O-CG 3.42Å; Q201-L204 PolarHBondContact O-N 3.4Å; Q201-I263 HydrophobicContact CB-CG2 3.42Å; Q201-I263 VanDerWaalsContact CB-CG2 3.42Å; Q201-I263 HydrophobicContact CG-CG2 3.49Å; Q201-I263 VanDerWaalsContact CG-CG2 3.49Å; Q201-I263 PolarHBondContact NE2-O 2.96Å; Q201-F264 HydrophobicContact CB-CE1 4.22Å; Q201-F264 HydrophobicContact CB-CZ 4.1Å; Q201-F264 HydrophobicContact CG-CE1 4.25Å
202	M	92.8	Very high	97.6	Very high	59 Å²	59	24 Å²	24	29%	0.291	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-63.8	-18.3	178.9	-54	-62.9	174.2	0	0	112.8	K200 L204 Y205 L350	K200-M202 HydrophobicContact CD-CG 4.47Å; K200-M202 HydrophobicContact CG-CB 4.44Å; K200-M202 HydrophobicContact CG-CG 4.27Å; K200-M202 PolarHBondContact O-N 2.85Å; M202-L204 PolarHBondContact O-N 3.49Å; M202-Y205 WeakPolarHBondContact O-CD1 3.47Å; M202-Y205 PolarHBondContact O-N 3.38Å; M202-Y205 VanDerWaalsContact O-N 3.16Å; M202-L350 HydrophobicContact CB-CD1 3.75Å; M202-L350 WeakPolarHBondContact O-CD1 3.41Å
203	E	96.7	Very high	97.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-61.2	-9.4	170.7	-69.8	-67.1	165.1	0	0	113.9	S170 L171 A174 F193 A196 L197 K200 Q201 Y205 H206 A207	S170-E203 VanDerWaalsContact OG-CD 3.32Å; S170-E203 WeakPolarHBondContact OG-CG 3.33Å; S170-E203 PolarHBondContact OG-OE1 3.06Å; L171-E203 PolarHBondContact N-OE1 3.41Å; A174-E203 WeakPolarHBondContact CB-OE2 3.43Å; F193-E203 HydrophobicContact CE2-CB 4.33Å; A196-E203 HydrophobicContact CB-CB 4.47Å; A196-E203 HydrophobicContact CB-CG 3.93Å; L197-E203 HydrophobicContact CD2-CB 3.78Å; L197-E203 HydrophobicContact CG-CB 4.24Å; K200-E203 PolarHBondContact O-N 3.36Å; K200-E203 VanDerWaalsContact O-N 3.13Å; Q201-E203 PolarHBondContact O-N 3.31Å; Q201-E203 VanDerWaalsContact O-N 3.15Å; E203-Y205 PolarHBondContact O-N 2.86Å; E203-H206 WeakPolarHBondContact O-CB 3.21Å; E203-H206 PolarHBondContact O-N 2.85Å; E203-H206 IonicContact OE2-CE1 2.7Å; E203-H206 PolarHBondContact OE2-CE1 2.66Å; E203-H206 IonicContact OE2-CG 3.86Å; E203-H206 IonicContact OE2-ND1 2.69Å; E203-H206 PolarHBondContact OE2-ND1 3.24Å; E203-A207 PolarHBondContact O-N 2.93Å
204	L	96.2	Very high	97.6	Very high	72 Å²	72	23.8 Å²	23.8	38%	0.377	12%	0.12	S	C	.	.	H	α-helix	trans	-54.4	-22.5	168.8	-77.2	172.8	0	0	0	113.1	L197 Q201 M202 H206 A207 F264	L197-L204 HydrophobicContact CD2-CB 4.45Å; L197-L204 HydrophobicContact CD2-CD2 3.81Å; L197-L204 HydrophobicContact CD2-CG 3.82Å; Q201-L204 WeakPolarHBondContact O-CB 3.29Å; Q201-L204 VanDerWaalsContact O-CG 3.22Å; Q201-L204 WeakPolarHBondContact O-CG 3.42Å; Q201-L204 PolarHBondContact O-N 3.4Å; M202-L204 PolarHBondContact O-N 3.49Å; L204-H206 PolarHBondContact O-N 3.26Å; L204-A207 HydrophobicContact CD2-CB 4.03Å; L204-A207 WeakPolarHBondContact O-CB 3.5Å; L204-A207 PolarHBondContact O-N 2.84Å; L204-F264 HydrophobicContact CD1-CE1 3.58Å; L204-F264 HydrophobicContact CD1-CZ 3.62Å
205	Y	96.8	Very high	97.6	Very high	16 Å²	16	25.6 Å²	25.6	6%	0.063	13%	0.129	C	C	.	.	H	α-helix	trans	-59.7	-27.3	174.1	-76.5	31.6	0	0	0	112	M202 E203 S332 F336 F337 L350	M202-Y205 WeakPolarHBondContact O-CD1 3.47Å; M202-Y205 PolarHBondContact O-N 3.38Å; M202-Y205 VanDerWaalsContact O-N 3.16Å; E203-Y205 PolarHBondContact O-N 2.86Å; Y205-S332 PolarHBondContact O-OG 3.15Å; Y205-F336 HydrophobicContact CD1-CB 3.68Å; Y205-F336 HydrophobicContact CD1-CD1 4.12Å; Y205-F336 AromaticContact CD1-CG 3.88Å; Y205-F336 HydrophobicContact CD1-CG 3.88Å; Y205-F336 HydrophobicContact CD2-CB 3.5Å; Y205-F336 VanDerWaalsContact CD2-CB 3.5Å; Y205-F336 HydrophobicContact CD2-CG 4.45Å; Y205-F336 HydrophobicContact CE1-CB 3.8Å; Y205-F336 HydrophobicContact CE1-CD1 4.23Å; Y205-F336 HydrophobicContact CE1-CG 4.24Å; Y205-F336 HydrophobicContact CE2-CB 3.62Å; Y205-F336 HydrophobicContact CG-CB 3.54Å; Y205-F336 HydrophobicContact CG-CD2 4.41Å; Y205-F336 HydrophobicContact CG-CG 4.01Å; Y205-F337 HydrophobicContact CE2-CB 4.35Å; Y205-L350 HydrophobicContact CD1-CD1 4.41Å; Y205-L350 HydrophobicContact CD2-CB 4.18Å; Y205-L350 HydrophobicContact CD2-CD1 3.59Å; Y205-L350 HydrophobicContact CE2-CD1 3.91Å; Y205-L350 HydrophobicContact CG-CD1 3.86Å
206	H	98.4	Very high	97.5	Very high	3 Å²	3	23.7 Å²	23.7	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-97.1	-9.3	176.3	-59	133	0	0	0	113.7	F193 E203 L204 L208 P209 F210 L329 L350	F193-H206 HydrophobicContact CE2-CB 3.75Å; F193-H206 HydrophobicContact CZ-CB 3.98Å; E203-H206 WeakPolarHBondContact O-CB 3.21Å; E203-H206 PolarHBondContact O-N 2.85Å; E203-H206 IonicContact OE2-CE1 2.7Å; E203-H206 PolarHBondContact OE2-CE1 2.66Å; E203-H206 IonicContact OE2-CG 3.86Å; E203-H206 IonicContact OE2-ND1 2.69Å; E203-H206 PolarHBondContact OE2-ND1 3.24Å; L204-H206 PolarHBondContact O-N 3.26Å; H206-L208 PolarHBondContact O-N 3.28Å; H206-P209 VanDerWaalsContact O-CD 3.23Å; H206-P209 WeakPolarHBondContact O-CD 3.36Å; H206-F210 HydrophobicContact CB-CD2 4.11Å; H206-F210 HydrophobicContact CB-CE2 4.25Å; H206-F210 WeakPolarHBondContact O-CD2 3.39Å; H206-F210 PolarHBondContact O-N 3.37Å; H206-F210 VanDerWaalsContact O-N 3.12Å; H206-L329 HydrophobicContact CB-CD2 3.84Å; H206-L350 PolarHBondContact CE1-O 3.06Å; H206-L350 VanDerWaalsContact CE1-O 3.25Å; H206-L350 PolarHBondContact NE2-O 3.35Å
207	A	97.8	Very high	97.4	Very high	25 Å²	25	26.2 Å²	26.2	21%	0.207	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-42.3	-171.3	0	0	0	0	0	113.1	F193 E203 L204 F210 F211	F193-A207 HydrophobicContact CE1-CB 4.14Å; F193-A207 HydrophobicContact CZ-CB 4.11Å; E203-A207 PolarHBondContact O-N 2.93Å; L204-A207 HydrophobicContact CD2-CB 4.03Å; L204-A207 WeakPolarHBondContact O-CB 3.5Å; L204-A207 PolarHBondContact O-N 2.84Å; A207-F210 PolarHBondContact O-N 2.55Å; A207-F211 VanDerWaalsContact O-CB 3.24Å; A207-F211 WeakPolarHBondContact O-CB 3.24Å; A207-F211 PolarHBondContact O-N 3.16Å
208	L	97.8	Very high	97.4	Very high	45 Å²	45	24.9 Å²	24.9	24%	0.236	12%	0.123	C	C	.	.	H	α-helix	trans	-59.2	-50.8	177.2	-74.7	178	0	0	0	112.2	H206 F210 F211 C212 A309 F336	H206-L208 PolarHBondContact O-N 3.28Å; L208-F210 PolarHBondContact O-N 2.91Å; L208-F211 PolarHBondContact O-N 3.05Å; L208-C212 WeakPolarHBondContact O-CB 3.29Å; L208-C212 PolarHBondContact O-N 2.82Å; L208-C212 PolarHBondContact O-SG 3.47Å; L208-A309 HydrophobicContact CD1-CB 4.18Å; L208-F336 HydrophobicContact CD1-CE2 4.07Å; L208-F336 HydrophobicContact CD1-CZ 4.19Å
209	P	98.4	Very high	97.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-55.5	-47.8	172.5	-29.7	32.5	0	0	0	114.5	H206 F211 C212 F213 L316 F325 A328 L329 S332	H206-P209 VanDerWaalsContact O-CD 3.23Å; H206-P209 WeakPolarHBondContact O-CD 3.36Å; P209-F211 PolarHBondContact O-N 2.93Å; P209-C212 PolarHBondContact O-N 2.9Å; P209-F213 VanDerWaalsContact O-CB 3.25Å; P209-F213 WeakPolarHBondContact O-CB 3.49Å; P209-F213 PolarHBondContact O-N 2.9Å; P209-L316 HydrophobicContact CB-CD2 4.21Å; P209-L316 WeakPolarHBondContact O-CD2 3.2Å; P209-F325 HydrophobicContact CB-CD2 4.23Å; P209-F325 HydrophobicContact CB-CE2 4.01Å; P209-A328 HydrophobicContact CB-CB 4.17Å; P209-A328 HydrophobicContact CG-CB 4.25Å; P209-A328 VanDerWaalsContact CG-O 3.31Å; P209-A328 WeakPolarHBondContact CG-O 3.41Å; P209-L329 HydrophobicContact CB-CD2 3.67Å; P209-L329 HydrophobicContact CB-CG 3.98Å; P209-L329 HydrophobicContact CG-CD2 4.11Å; P209-L329 HydrophobicContact CG-CG 4.5Å; P209-S332 WeakPolarHBondContact CD-OG 3.48Å; P209-S332 VanDerWaalsContact CG-CB 3.42Å
210	F	98.7	Very high	97.2	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.018	17%	0.168	C	C	.	.	H	α-helix	trans	-61.1	-46.6	179.5	-91.6	-98.1	0	0	0	111.3	V178 L181 F193 H206 A207 L208 L214 F325 L329	V178-F210 HydrophobicContact CG2-CE2 4.12Å; V178-F210 HydrophobicContact CG2-CZ 3.76Å; L181-F210 HydrophobicContact CD1-CD1 3.53Å; L181-F210 HydrophobicContact CD1-CE1 3.5Å; L181-F210 VanDerWaalsContact CD1-CE1 3.5Å; L181-F210 HydrophobicContact CD1-CZ 4.48Å; L181-F210 HydrophobicContact CG-CE1 4.43Å; F193-F210 HydrophobicContact CB-CD1 3.74Å; F193-F210 HydrophobicContact CB-CE1 3.59Å; F193-F210 HydrophobicContact CB-CG 4.41Å; F193-F210 HydrophobicContact CB-CZ 4.13Å; F193-F210 HydrophobicContact CD1-CB 3.86Å; F193-F210 AromaticContact CD1-CD1 3.84Å; F193-F210 HydrophobicContact CD1-CD1 3.84Å; F193-F210 HydrophobicContact CD1-CD2 4.23Å; F193-F210 HydrophobicContact CD1-CE1 4.44Å; F193-F210 AromaticContact CD1-CG 3.72Å; F193-F210 HydrophobicContact CD1-CG 3.72Å; F193-F210 HydrophobicContact CD2-CD1 4.1Å; F193-F210 AromaticContact CD2-CD2 3.77Å; F193-F210 HydrophobicContact CD2-CD2 3.77Å; F193-F210 AromaticContact CD2-CE1 3.96Å; F193-F210 HydrophobicContact CD2-CE1 3.96Å; F193-F210 AromaticContact CD2-CE2 3.61Å; F193-F210 HydrophobicContact CD2-CE2 3.61Å; F193-F210 HydrophobicContact CD2-CG 4.01Å; F193-F210 AromaticContact CD2-CZ 3.7Å; F193-F210 HydrophobicContact CD2-CZ 3.7Å; F193-F210 HydrophobicContact CE1-CB 3.84Å; F193-F210 HydrophobicContact CE1-CD2 4.21Å; F193-F210 AromaticContact CE1-CG 3.97Å; F193-F210 HydrophobicContact CE1-CG 3.97Å; F193-F210 AromaticContact CE2-CD2 3.78Å; F193-F210 HydrophobicContact CE2-CD2 3.78Å; F193-F210 AromaticContact CE2-CE2 3.86Å; F193-F210 HydrophobicContact CE2-CE2 3.86Å; F193-F210 HydrophobicContact CE2-CG 4.26Å; F193-F210 HydrophobicContact CE2-CZ 4.41Å; F193-F210 HydrophobicContact CG-CB 4.4Å; F193-F210 AromaticContact CG-CD1 3.59Å; F193-F210 HydrophobicContact CG-CD1 3.59Å; F193-F210 HydrophobicContact CG-CD2 4.02Å; F193-F210 AromaticContact CG-CE1 3.72Å; F193-F210 HydrophobicContact CG-CE1 3.72Å; F193-F210 HydrophobicContact CG-CE2 4.13Å; F193-F210 AromaticContact CG-CG 3.75Å; F193-F210 HydrophobicContact CG-CG 3.75Å; F193-F210 AromaticContact CG-CZ 3.98Å; F193-F210 HydrophobicContact CG-CZ 3.98Å; F193-F210 HydrophobicContact CZ-CB 4.39Å; F193-F210 HydrophobicContact CZ-CD2 4Å; F193-F210 HydrophobicContact CZ-CG 4.24Å; H206-F210 HydrophobicContact CB-CD2 4.11Å; H206-F210 HydrophobicContact CB-CE2 4.25Å; H206-F210 WeakPolarHBondContact O-CD2 3.39Å; H206-F210 PolarHBondContact O-N 3.37Å; H206-F210 VanDerWaalsContact O-N 3.12Å; A207-F210 PolarHBondContact O-N 2.55Å; L208-F210 PolarHBondContact O-N 2.91Å; F210-L214 WeakPolarHBondContact O-CB 2.9Å; F210-L214 WeakPolarHBondContact O-CG 3.24Å; F210-L214 PolarHBondContact O-N 3.42Å; F210-F325 HydrophobicContact CD1-CZ 4.15Å; F210-F325 HydrophobicContact CD2-CE2 4.08Å; F210-F325 AromaticContact CD2-CZ 3.87Å; F210-F325 HydrophobicContact CD2-CZ 3.87Å; F210-F325 HydrophobicContact CE1-CZ 4.08Å; F210-F325 HydrophobicContact CE2-CE2 4.41Å; F210-F325 AromaticContact CE2-CZ 3.81Å; F210-F325 HydrophobicContact CE2-CZ 3.81Å; F210-F325 HydrophobicContact CG-CE2 4.27Å; F210-F325 HydrophobicContact CG-CZ 4.06Å; F210-F325 AromaticContact CZ-CZ 3.93Å; F210-F325 HydrophobicContact CZ-CZ 3.93Å; F210-L329 HydrophobicContact CD2-CD2 3.92Å; F210-L329 HydrophobicContact CE2-CD2 3.83Å
211	F	98.5	Very high	97	Very high	124 Å²	124	35.8 Å²	35.8	54%	0.544	18%	0.183	S	C	.	.	H	α-helix	trans	-59.8	-54.6	177	175	-99.5	0	0	0	111.6	A207 L208 P209 F213 L214 L215	A207-F211 VanDerWaalsContact O-CB 3.24Å; A207-F211 WeakPolarHBondContact O-CB 3.24Å; A207-F211 PolarHBondContact O-N 3.16Å; L208-F211 PolarHBondContact O-N 3.05Å; P209-F211 PolarHBondContact O-N 2.93Å; F211-F213 VanDerWaalsContact C-N 3.33Å; F211-F213 PolarHBondContact O-N 3.12Å; F211-L214 PolarHBondContact O-N 2.96Å; F211-L215 HydrophobicContact CE1-CD2 3.76Å; F211-L215 HydrophobicContact CE2-CD2 4.42Å; F211-L215 HydrophobicContact CZ-CD2 3.62Å; F211-L215 VanDerWaalsContact O-CB 3.24Å; F211-L215 WeakPolarHBondContact O-CB 3.34Å; F211-L215 PolarHBondContact O-N 3.34Å
212	C	98.6	Very high	96.9	Very high	12 Å²	12	36.6 Å²	36.6	8%	0.081	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-34.9	-177.8	-72.8	0	0	0	0	112.7	L208 P209 G216 S313 L316 L317	L208-C212 WeakPolarHBondContact O-CB 3.29Å; L208-C212 PolarHBondContact O-N 2.82Å; L208-C212 PolarHBondContact O-SG 3.47Å; P209-C212 PolarHBondContact O-N 2.9Å; C212-G216 WeakPolarHBondContact O-CA 3.35Å; C212-G216 PolarHBondContact O-N 3.25Å; C212-S313 WeakPolarHBondContact CB-O 3.43Å; C212-L316 HydrophobicContact CB-CB 4.48Å; C212-L316 HydrophobicContact CB-CD2 4.15Å; C212-L316 HydrophobicContact CB-CG 4.35Å; C212-L317 HydrophobicContact CB-CB 4.11Å
213	F	98.6	Very high	96.8	Very high	7 Å²	7	37.9 Å²	37.9	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-51.8	174.9	-177.5	-108.2	0	0	0	111.8	L181 P209 F211 G216 K217 L316 P320 F325	L181-F213 HydrophobicContact CB-CD1 4.48Å; L181-F213 HydrophobicContact CB-CE1 3.95Å; L181-F213 HydrophobicContact CD1-CD1 3.96Å; L181-F213 HydrophobicContact CD1-CE1 4.27Å; L181-F213 HydrophobicContact CG-CE1 4.47Å; P209-F213 VanDerWaalsContact O-CB 3.25Å; P209-F213 WeakPolarHBondContact O-CB 3.49Å; P209-F213 PolarHBondContact O-N 2.9Å; F211-F213 VanDerWaalsContact C-N 3.33Å; F211-F213 PolarHBondContact O-N 3.12Å; F213-G216 PolarHBondContact O-N 3.3Å; F213-K217 HydrophobicContact CD1-CD 4.11Å; F213-K217 HydrophobicContact CE1-CD 3.59Å; F213-K217 HydrophobicContact CE2-CD 4.36Å; F213-K217 HydrophobicContact CZ-CD 3.76Å; F213-K217 WeakPolarHBondContact O-CG 3.3Å; F213-K217 PolarHBondContact O-N 2.66Å; F213-L316 HydrophobicContact CB-CD1 4.39Å; F213-L316 HydrophobicContact CB-CD2 4.02Å; F213-L316 HydrophobicContact CB-CG 4.28Å; F213-L316 HydrophobicContact CD2-CD1 3.95Å; F213-P320 HydrophobicContact CD2-CB 3.95Å; F213-P320 HydrophobicContact CE2-CB 4.29Å; F213-F325 HydrophobicContact CB-CD2 3.77Å; F213-F325 HydrophobicContact CB-CE2 4.09Å; F213-F325 HydrophobicContact CB-CG 4.3Å; F213-F325 HydrophobicContact CD2-CB 3.76Å; F213-F325 HydrophobicContact CD2-CD2 4.3Å; F213-F325 AromaticContact CD2-CG 3.99Å; F213-F325 HydrophobicContact CD2-CG 3.99Å; F213-F325 HydrophobicContact CE2-CB 4.01Å; F213-F325 HydrophobicContact CE2-CG 4.39Å; F213-F325 HydrophobicContact CG-CB 4.3Å; F213-F325 HydrophobicContact CG-CD1 4.5Å; F213-F325 HydrophobicContact CG-CD2 4Å; F213-F325 HydrophobicContact CG-CE2 4.46Å; F213-F325 HydrophobicContact CG-CG 4.02Å
214	L	98.4	Very high	96.4	Very high	16 Å²	16	46.3 Å²	46.3	8%	0.084	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-47.4	-178.3	-74.9	173.2	0	0	0	111.7	L181 N186 S190 F210 F211 G216 K217 C218 I234	L181-L214 HydrophobicContact CD2-CD2 3.55Å; L181-L214 HydrophobicContact CD2-CG 4.35Å; N186-L214 HydrophobicContact CB-CD2 4.08Å; S190-L214 VanDerWaalsContact OG-CD1 3.26Å; S190-L214 WeakPolarHBondContact OG-CD1 3.48Å; F210-L214 WeakPolarHBondContact O-CB 2.9Å; F210-L214 WeakPolarHBondContact O-CG 3.24Å; F210-L214 PolarHBondContact O-N 3.42Å; F211-L214 PolarHBondContact O-N 2.96Å; L214-G216 VanDerWaalsContact C-N 3.35Å; L214-G216 PolarHBondContact O-N 3.2Å; L214-K217 PolarHBondContact O-N 3.3Å; L214-C218 PolarHBondContact O-N 3.25Å; L214-C218 PolarHBondContact O-SG 3.42Å; L214-I234 HydrophobicContact CB-CD1 4.28Å; L214-I234 HydrophobicContact CD1-CG2 4.19Å; L214-I234 HydrophobicContact CD2-CD1 3.89Å
215	L	98.3	Very high	96.2	Very high	41 Å²	41	44.8 Å²	44.8	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-42.7	176.4	-178.4	60.8	0	0	0	111	F211 K217 C218 I219 L231 L317	F211-L215 HydrophobicContact CE1-CD2 3.76Å; F211-L215 HydrophobicContact CE2-CD2 4.42Å; F211-L215 HydrophobicContact CZ-CD2 3.62Å; F211-L215 VanDerWaalsContact O-CB 3.24Å; F211-L215 WeakPolarHBondContact O-CB 3.34Å; F211-L215 PolarHBondContact O-N 3.34Å; L215-K217 VanDerWaalsContact C-N 3.3Å; L215-K217 PolarHBondContact O-N 2.95Å; L215-C218 WeakPolarHBondContact O-CA 3.27Å; L215-C218 WeakPolarHBondContact O-CB 3.47Å; L215-C218 PolarHBondContact O-N 3.19Å; L215-I219 HydrophobicContact CD1-CD1 4.35Å; L215-I219 HydrophobicContact CD1-CG1 4.37Å; L215-I219 HydrophobicContact CG-CD1 3.95Å; L215-I219 HydrophobicContact CG-CG1 4.41Å; L215-I219 WeakPolarHBondContact O-CG1 3.46Å; L215-I219 PolarHBondContact O-N 3.3Å; L215-L231 HydrophobicContact CD1-CD1 4.47Å; L215-L317 HydrophobicContact CB-CD1 3.96Å; L215-L317 HydrophobicContact CD2-CD1 3.91Å; L215-L317 HydrophobicContact CG-CD1 3.85Å
216	G	97.8	Very high	96	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-40.2	176.3	0	0	0	0	0	112.3	C212 F213 L214 I219 K220 L317	C212-G216 WeakPolarHBondContact O-CA 3.35Å; C212-G216 PolarHBondContact O-N 3.25Å; F213-G216 PolarHBondContact O-N 3.3Å; L214-G216 VanDerWaalsContact C-N 3.35Å; L214-G216 PolarHBondContact O-N 3.2Å; G216-I219 PolarHBondContact O-N 3.46Å; G216-K220 WeakPolarHBondContact O-CB 3.42Å; G216-K220 PolarHBondContact O-N 3.41Å; G216-L317 WeakPolarHBondContact CA-O 3.44Å
217	K	96.8	Very high	95.8	Very high	52 Å²	52	54.2 Å²	54.2	23%	0.226	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-41.2	173.2	-73.7	-179.1	77.9	174.5	0	111.8	N186 F213 L214 L215 A221 P320	N186-K217 PolarHBondContact OD1-NZ 3.23Å; F213-K217 HydrophobicContact CD1-CD 4.11Å; F213-K217 HydrophobicContact CE1-CD 3.59Å; F213-K217 HydrophobicContact CE2-CD 4.36Å; F213-K217 HydrophobicContact CZ-CD 3.76Å; F213-K217 WeakPolarHBondContact O-CG 3.3Å; F213-K217 PolarHBondContact O-N 2.66Å; L214-K217 PolarHBondContact O-N 3.3Å; L215-K217 VanDerWaalsContact C-N 3.3Å; L215-K217 PolarHBondContact O-N 2.95Å; K217-A221 WeakPolarHBondContact O-CB 3.22Å; K217-A221 PolarHBondContact O-N 2.98Å; K217-P320 HydrophobicContact CG-CB 4.06Å; K217-P320 HydrophobicContact CG-CG 4.32Å
218	C	97.3	Very high	95.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-46.2	176.3	-60.6	0	0	0	0	111.4	L214 L215 K220 A221 G222 L223 G227 L231	L214-C218 PolarHBondContact O-N 3.25Å; L214-C218 PolarHBondContact O-SG 3.42Å; L215-C218 WeakPolarHBondContact O-CA 3.27Å; L215-C218 WeakPolarHBondContact O-CB 3.47Å; L215-C218 PolarHBondContact O-N 3.19Å; C218-K220 PolarHBondContact O-N 3.09Å; C218-A221 PolarHBondContact O-N 3.24Å; C218-G222 PolarHBondContact O-N 3.19Å; C218-L223 HydrophobicContact CB-CD2 4.41Å; C218-G227 VanDerWaalsContact O-CA 3.3Å; C218-G227 WeakPolarHBondContact O-CA 3.3Å; C218-L231 HydrophobicContact CB-CB 4.33Å
219	I	96.8	Very high	95.7	Very high	79 Å²	79	60 Å²	60	41%	0.405	31%	0.308	S	S	.	.	H	α-helix	trans	-60.3	-48.4	178	-67.2	169.5	0	0	0	110.5	L215 G216 A221 G222 L223 L317	L215-I219 HydrophobicContact CD1-CD1 4.35Å; L215-I219 HydrophobicContact CD1-CG1 4.37Å; L215-I219 HydrophobicContact CG-CD1 3.95Å; L215-I219 HydrophobicContact CG-CG1 4.41Å; L215-I219 WeakPolarHBondContact O-CG1 3.46Å; L215-I219 PolarHBondContact O-N 3.3Å; G216-I219 PolarHBondContact O-N 3.46Å; I219-A221 PolarHBondContact O-N 3.22Å; I219-G222 PolarHBondContact O-N 2.71Å; I219-L223 HydrophobicContact CG1-CD1 4.24Å; I219-L223 HydrophobicContact CG1-CD2 4.26Å; I219-L223 HydrophobicContact CG1-CG 4.33Å; I219-L317 HydrophobicContact CD1-CD1 4Å
220	K	94.9	Very high	95.6	Very high	130 Å²	130	61.6 Å²	61.6	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-62.8	-28.7	178.1	-80.7	-164.2	171	179.4	0	114.1	G216 C218 G222 M318 P320	G216-K220 WeakPolarHBondContact O-CB 3.42Å; G216-K220 PolarHBondContact O-N 3.41Å; C218-K220 PolarHBondContact O-N 3.09Å; K220-G222 VanDerWaalsContact C-N 3.29Å; K220-M318 VanDerWaalsContact CE-O 3.26Å; K220-M318 WeakPolarHBondContact CE-O 3.25Å; K220-P320 HydrophobicContact CD-CG 3.7Å; K220-P320 VanDerWaalsContact CE-CD 3.5Å; K220-P320 HydrophobicContact CG-CG 4.27Å
221	A	93.3	Very high	95.5	Very high	51 Å²	51	64 Å²	64	42%	0.421	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-2.4	175.6	0	0	0	0	0	113.6	K217 C218 I219 G227	K217-A221 WeakPolarHBondContact O-CB 3.22Å; K217-A221 PolarHBondContact O-N 2.98Å; C218-A221 PolarHBondContact O-N 3.24Å; I219-A221 PolarHBondContact O-N 3.22Å; A221-G227 PolarHBondContact O-N 2.93Å
222	G	93.1	Very high	95.5	Very high	32 Å²	32	61.5 Å²	61.5	33%	0.33	32%	0.324	S	S	.	.			trans	85.5	114.9	178.8	0	0	0	0	0	113.7	C218 I219 K220 I224 G225 G227	C218-G222 PolarHBondContact O-N 3.19Å; I219-G222 PolarHBondContact O-N 2.71Å; K220-G222 VanDerWaalsContact C-N 3.29Å; G222-I224 PolarHBondContact O-N 3.19Å; G222-G225 PolarHBondContact O-N 3.03Å; G222-G225 VanDerWaalsContact O-N 3.16Å; G222-G227 WeakPolarHBondContact O-CA 3.39Å; G222-G227 PolarHBondContact O-N 3.33Å
223	L	89.8	Confident	95.4	Very high	87 Å²	87	66.8 Å²	66.8	46%	0.455	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-7.7	-175.9	-69.7	179.4	0	0	0	115.6	C218 I219 F228	C218-L223 HydrophobicContact CB-CD2 4.41Å; I219-L223 HydrophobicContact CG1-CD1 4.24Å; I219-L223 HydrophobicContact CG1-CD2 4.26Å; I219-L223 HydrophobicContact CG1-CG 4.33Å; L223-F228 WeakPolarHBondContact O-CB 3.24Å
224	I	88.9	Confident	95.4	Very high	176 Å²	176	67.1 Å²	67.1	90%	0.903	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-11.8	176	-60.9	171.1	0	0	0	110.9	G222	G222-I224 PolarHBondContact O-N 3.19Å
225	G	91.9	Very high	95.4	Very high	40 Å²	40	69.5 Å²	69.5	41%	0.412	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129	-120.8	-174.6	0	0	0	0	0	113.3	G222 G227 F228 V229	G222-G225 PolarHBondContact O-N 3.03Å; G222-G225 VanDerWaalsContact O-N 3.16Å; G225-G227 PolarHBondContact O-N 3.32Å; G225-F228 WeakPolarHBondContact O-CB 3.44Å; G225-F228 PolarHBondContact O-N 3.08Å; G225-V229 PolarHBondContact O-N 3.43Å
226	R	92.3	Very high	95.4	Very high	218 Å²	218	69.8 Å²	69.8	82%	0.823	37%	0.372	S	S	*	.	H	α-helix	trans	-59.6	-33.2	-176.3	-66.4	-177.7	-178.5	177.4	0.8	112.8	V229 L230	R226-V229 PolarHBondContact O-N 3.33Å; R226-L230 WeakPolarHBondContact O-CB 3.37Å; R226-L230 PolarHBondContact O-N 3.3Å
227	G	94.6	Very high	95.4	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-63.5	-38.2	175.3	0	0	0	0	0	113.2	C218 A221 G222 G225 L230 L231	C218-G227 VanDerWaalsContact O-CA 3.3Å; C218-G227 WeakPolarHBondContact O-CA 3.3Å; A221-G227 PolarHBondContact O-N 2.93Å; G222-G227 WeakPolarHBondContact O-CA 3.39Å; G222-G227 PolarHBondContact O-N 3.33Å; G225-G227 PolarHBondContact O-N 3.32Å; G227-L230 PolarHBondContact O-N 3.15Å; G227-L231 WeakPolarHBondContact O-CB 3.49Å; G227-L231 PolarHBondContact O-N 2.81Å
228	F	96.1	Very high	95.5	Very high	116 Å²	116	70.9 Å²	70.9	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-48.5	175	-173.3	-108.8	0	0	0	111.7	L223 G225 L230 L231 V232	L223-F228 WeakPolarHBondContact O-CB 3.24Å; G225-F228 WeakPolarHBondContact O-CB 3.44Å; G225-F228 PolarHBondContact O-N 3.08Å; F228-L230 VanDerWaalsContact C-N 3.26Å; F228-L230 PolarHBondContact O-N 3.41Å; F228-L231 WeakPolarHBondContact O-CB 3.28Å; F228-L231 PolarHBondContact O-N 2.98Å; F228-L231 VanDerWaalsContact O-N 3.11Å; F228-V232 HydrophobicContact CD1-CG2 4.15Å; F228-V232 HydrophobicContact CE1-CG2 3.76Å; F228-V232 HydrophobicContact CE2-CG2 4.28Å; F228-V232 HydrophobicContact CZ-CG2 3.82Å; F228-V232 WeakPolarHBondContact O-CG2 3.49Å; F228-V232 PolarHBondContact O-N 2.68Å
229	V	96.6	Very high	95.6	Very high	75 Å²	75	76.4 Å²	76.4	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-60.1	-41	178.5	178.2	0	0	0	0	110.7	G225 R226 V232 K233	G225-V229 PolarHBondContact O-N 3.43Å; R226-V229 PolarHBondContact O-N 3.33Å; V229-V232 PolarHBondContact O-N 2.92Å; V229-K233 HydrophobicContact CG1-CD 4.38Å; V229-K233 WeakPolarHBondContact O-CB 3.3Å; V229-K233 WeakPolarHBondContact O-CG 3.4Å; V229-K233 PolarHBondContact O-N 3.5Å
230	L	96.1	Very high	95.6	Very high	33 Å²	33	77 Å²	77	17%	0.173	42%	0.418	C	S	.	.	H	α-helix	trans	-63	-44.6	175.4	179.4	59.9	0	0	0	111.6	N186 R226 G227 F228 K233 I234	N186-L230 HydrophobicContact CB-CD1 3.96Å; N186-L230 WeakPolarHBondContact ND2-CD1 3.17Å; R226-L230 WeakPolarHBondContact O-CB 3.37Å; R226-L230 PolarHBondContact O-N 3.3Å; G227-L230 PolarHBondContact O-N 3.15Å; F228-L230 VanDerWaalsContact C-N 3.26Å; F228-L230 PolarHBondContact O-N 3.41Å; L230-K233 PolarHBondContact O-N 2.97Å; L230-I234 HydrophobicContact CD1-CD1 3.84Å; L230-I234 HydrophobicContact CD1-CG1 4.2Å; L230-I234 HydrophobicContact CD2-CD1 4.47Å; L230-I234 HydrophobicContact CG-CD1 3.74Å; L230-I234 WeakPolarHBondContact O-CD1 3.44Å; L230-I234 VanDerWaalsContact O-CG1 3.3Å; L230-I234 WeakPolarHBondContact O-CG1 3.43Å; L230-I234 PolarHBondContact O-N 2.95Å
231	L	97.6	Very high	95.8	Very high	54 Å²	54	71.1 Å²	71.1	28%	0.283	39%	0.394	S	S	.	.	H	α-helix	trans	-59.6	-48.6	177	-179	63.1	0	0	0	111.2	L215 C218 G227 F228 K233 I234 T235	L215-L231 HydrophobicContact CD1-CD1 4.47Å; C218-L231 HydrophobicContact CB-CB 4.33Å; G227-L231 WeakPolarHBondContact O-CB 3.49Å; G227-L231 PolarHBondContact O-N 2.81Å; F228-L231 WeakPolarHBondContact O-CB 3.28Å; F228-L231 PolarHBondContact O-N 2.98Å; F228-L231 VanDerWaalsContact O-N 3.11Å; L231-K233 VanDerWaalsContact C-N 3.33Å; L231-K233 PolarHBondContact O-N 2.91Å; L231-I234 PolarHBondContact O-N 3.08Å; L231-T235 WeakPolarHBondContact O-CB 3.47Å; L231-T235 PolarHBondContact O-N 3.25Å; L231-T235 PolarHBondContact O-OG1 3.35Å
232	V	97.5	Very high	96	Very high	73 Å²	73	72 Å²	72	44%	0.442	39%	0.388	S	S	.	.	H	α-helix	trans	-59	-44.5	177.3	172.6	0	0	0	0	111.1	F228 V229 I234 T235 A236	F228-V232 HydrophobicContact CD1-CG2 4.15Å; F228-V232 HydrophobicContact CE1-CG2 3.76Å; F228-V232 HydrophobicContact CE2-CG2 4.28Å; F228-V232 HydrophobicContact CZ-CG2 3.82Å; F228-V232 WeakPolarHBondContact O-CG2 3.49Å; F228-V232 PolarHBondContact O-N 2.68Å; V229-V232 PolarHBondContact O-N 2.92Å; V232-I234 PolarHBondContact O-N 3.15Å; V232-T235 PolarHBondContact O-N 2.97Å; V232-A236 VanDerWaalsContact O-CB 3.25Å; V232-A236 WeakPolarHBondContact O-CB 3.32Å; V232-A236 PolarHBondContact O-N 3.08Å
233	K	97.7	Very high	96.2	Very high	123 Å²	123	71.6 Å²	71.6	54%	0.535	38%	0.384	S	S	.	.	H	α-helix	trans	-61.2	-44.3	176.9	-76.7	-179.3	177.6	-172.6	0	112.3	V229 L230 L231 T237	V229-K233 HydrophobicContact CG1-CD 4.38Å; V229-K233 WeakPolarHBondContact O-CB 3.3Å; V229-K233 WeakPolarHBondContact O-CG 3.4Å; V229-K233 PolarHBondContact O-N 3.5Å; L230-K233 PolarHBondContact O-N 2.97Å; L231-K233 VanDerWaalsContact C-N 3.33Å; L231-K233 PolarHBondContact O-N 2.91Å; K233-T237 WeakPolarHBondContact O-CB 3.3Å; K233-T237 PolarHBondContact O-N 3.19Å; K233-T237 PolarHBondContact O-OG1 2.83Å
234	I	98	Very high	96.6	Very high	13 Å²	13	73 Å²	73	7%	0.067	39%	0.392	C	S	.	.	H	α-helix	trans	-63.2	-51.5	177.5	-71.3	161.4	0	0	0	109.9	N186 L214 L230 L231 V232 A236 T237 V238	N186-I234 HydrophobicContact CB-CD1 4.27Å; N186-I234 HydrophobicContact CB-CG1 4.3Å; L214-I234 HydrophobicContact CB-CD1 4.28Å; L214-I234 HydrophobicContact CD1-CG2 4.19Å; L214-I234 HydrophobicContact CD2-CD1 3.89Å; L230-I234 HydrophobicContact CD1-CD1 3.84Å; L230-I234 HydrophobicContact CD1-CG1 4.2Å; L230-I234 HydrophobicContact CD2-CD1 4.47Å; L230-I234 HydrophobicContact CG-CD1 3.74Å; L230-I234 WeakPolarHBondContact O-CD1 3.44Å; L230-I234 VanDerWaalsContact O-CG1 3.3Å; L230-I234 WeakPolarHBondContact O-CG1 3.43Å; L230-I234 PolarHBondContact O-N 2.95Å; L231-I234 PolarHBondContact O-N 3.08Å; V232-I234 PolarHBondContact O-N 3.15Å; I234-A236 PolarHBondContact O-N 2.85Å; I234-T237 WeakPolarHBondContact O-CB 3.47Å; I234-T237 PolarHBondContact O-N 2.87Å; I234-T237 VanDerWaalsContact O-N 3.1Å; I234-V238 WeakPolarHBondContact O-CG2 3.43Å; I234-V238 PolarHBondContact O-N 3.49Å
235	T	97.9	Very high	97	Very high	67 Å²	67	65.1 Å²	65.1	41%	0.411	35%	0.352	S	S	.	.	H	α-helix	trans	-58.2	-47.6	179.6	-60.3	0	0	0	0	111.4	L231 V232 T237 V238 L239	L231-T235 WeakPolarHBondContact O-CB 3.47Å; L231-T235 PolarHBondContact O-N 3.25Å; L231-T235 PolarHBondContact O-OG1 3.35Å; V232-T235 PolarHBondContact O-N 2.97Å; T235-T237 VanDerWaalsContact C-N 3.3Å; T235-T237 PolarHBondContact O-N 2.88Å; T235-V238 PolarHBondContact O-N 3.31Å; T235-L239 HydrophobicContact CG2-CD1 3.87Å; T235-L239 HydrophobicContact CG2-CG 4.23Å; T235-L239 WeakPolarHBondContact O-CB 3.34Å; T235-L239 WeakPolarHBondContact O-CG 3.27Å; T235-L239 PolarHBondContact O-N 3.29Å
236	A	98.4	Very high	97.2	Very high	47 Å²	47	64.6 Å²	64.6	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-59.4	-41.9	176	0	0	0	0	0	111.7	V232 I234 V238 L239 V240	V232-A236 VanDerWaalsContact O-CB 3.25Å; V232-A236 WeakPolarHBondContact O-CB 3.32Å; V232-A236 PolarHBondContact O-N 3.08Å; I234-A236 PolarHBondContact O-N 2.85Å; A236-V238 PolarHBondContact O-N 2.79Å; A236-L239 PolarHBondContact O-N 3.36Å; A236-V240 WeakPolarHBondContact O-CB 3.46Å; A236-V240 VanDerWaalsContact O-CG2 3.23Å; A236-V240 WeakPolarHBondContact O-CG2 3.28Å; A236-V240 PolarHBondContact O-N 3.01Å
237	T	98.5	Very high	97.4	Very high	31 Å²	31	59.1 Å²	59.1	19%	0.19	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-46.8	177.4	-54	0	0	0	0	111.3	S187 L191 K233 I234 T235 T241	S187-T237 WeakPolarHBondContact O-CG2 3.26Å; L191-T237 HydrophobicContact CB-CG2 3.94Å; K233-T237 WeakPolarHBondContact O-CB 3.3Å; K233-T237 PolarHBondContact O-N 3.19Å; K233-T237 PolarHBondContact O-OG1 2.83Å; I234-T237 WeakPolarHBondContact O-CB 3.47Å; I234-T237 PolarHBondContact O-N 2.87Å; I234-T237 VanDerWaalsContact O-N 3.1Å; T235-T237 VanDerWaalsContact C-N 3.3Å; T235-T237 PolarHBondContact O-N 2.88Å; T237-T241 WeakPolarHBondContact O-CB 3.01Å; T237-T241 PolarHBondContact O-N 3.45Å; T237-T241 PolarHBondContact O-OG1 3.48Å
238	V	98.4	Very high	97.3	Very high	44 Å²	44	61.9 Å²	61.9	27%	0.267	34%	0.342	S	S	.	.	H	α-helix	trans	-63.2	-50.5	178.5	175.3	0	0	0	0	110.6	I234 T235 A236 V240 T241 F242	I234-V238 WeakPolarHBondContact O-CG2 3.43Å; I234-V238 PolarHBondContact O-N 3.49Å; T235-V238 PolarHBondContact O-N 3.31Å; A236-V238 PolarHBondContact O-N 2.79Å; V238-V240 PolarHBondContact O-N 2.87Å; V238-T241 PolarHBondContact O-N 2.91Å; V238-F242 HydrophobicContact CG1-CD2 3.79Å; V238-F242 HydrophobicContact CG1-CE2 3.97Å; V238-F242 WeakPolarHBondContact O-CD2 3.42Å; V238-F242 PolarHBondContact O-N 3.27Å
239	L	98.3	Very high	97.1	Very high	116 Å²	116	56.4 Å²	56.4	61%	0.607	32%	0.318	S	S	*	.	H	α-helix	trans	-61.4	-42.7	-178.6	-69.5	178.3	0	0	0	112.4	T235 A236 G243	T235-L239 HydrophobicContact CG2-CD1 3.87Å; T235-L239 HydrophobicContact CG2-CG 4.23Å; T235-L239 WeakPolarHBondContact O-CB 3.34Å; T235-L239 WeakPolarHBondContact O-CG 3.27Å; T235-L239 PolarHBondContact O-N 3.29Å; A236-L239 PolarHBondContact O-N 3.36Å; L239-G243 WeakPolarHBondContact O-CA 3.39Å; L239-G243 PolarHBondContact O-N 2.95Å
240	V	98.3	Very high	96.9	Very high	90 Å²	90	56.9 Å²	56.9	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-65	-43.2	176.2	170.4	0	0	0	0	110.6	A236 V238 G243 L244	A236-V240 WeakPolarHBondContact O-CB 3.46Å; A236-V240 VanDerWaalsContact O-CG2 3.23Å; A236-V240 WeakPolarHBondContact O-CG2 3.28Å; A236-V240 PolarHBondContact O-N 3.01Å; V238-V240 PolarHBondContact O-N 2.87Å; V240-G243 PolarHBondContact O-N 3.33Å; V240-L244 HydrophobicContact CG1-CD1 3.93Å; V240-L244 HydrophobicContact CG1-CG 4.33Å; V240-L244 WeakPolarHBondContact O-CB 3.23Å; V240-L244 VanDerWaalsContact O-CG 3.26Å; V240-L244 WeakPolarHBondContact O-CG 3.28Å; V240-L244 PolarHBondContact O-N 3.24Å
241	T	98.4	Very high	96.7	Very high	8 Å²	8	60.9 Å²	60.9	5%	0.049	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-48.9	179.8	-51.7	0	0	0	0	111.6	L191 L195 T237 V238 L244 C245	L191-T241 HydrophobicContact CD1-CG2 3.84Å; L191-T241 WeakPolarHBondContact CD1-OG1 3.38Å; L195-T241 HydrophobicContact CD2-CG2 3.88Å; L195-T241 HydrophobicContact CG-CG2 4.12Å; T237-T241 WeakPolarHBondContact O-CB 3.01Å; T237-T241 PolarHBondContact O-N 3.45Å; T237-T241 PolarHBondContact O-OG1 3.48Å; V238-T241 PolarHBondContact O-N 2.91Å; T241-L244 PolarHBondContact O-N 3.32Å; T241-C245 PolarHBondContact O-N 3.36Å; T241-C245 PolarHBondContact O-SG 3.42Å
242	F	97.8	Very high	96.4	Very high	68 Å²	68	61.6 Å²	61.6	30%	0.298	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175.1	-89	-95.4	0	0	0	111.4	L197 N198 V238 L244 C245 W246	L197-F242 HydrophobicContact CB-CZ 4.31Å; L197-F242 HydrophobicContact CD1-CZ 4.32Å; N198-F242 WeakPolarHBondContact ND2-CD1 3.22Å; N198-F242 VanDerWaalsContact ND2-CE1 3.29Å; N198-F242 WeakPolarHBondContact ND2-CE1 3.48Å; N198-F242 WeakPolarHBondContact ND2-CZ 3.4Å; V238-F242 HydrophobicContact CG1-CD2 3.79Å; V238-F242 HydrophobicContact CG1-CE2 3.97Å; V238-F242 WeakPolarHBondContact O-CD2 3.42Å; V238-F242 PolarHBondContact O-N 3.27Å; F242-L244 VanDerWaalsContact C-N 3.28Å; F242-L244 PolarHBondContact O-N 2.78Å; F242-C245 PolarHBondContact O-N 3.41Å; F242-W246 AromaticContact CD1-NE1 3.88Å; F242-W246 WeakPolarHBondContact O-CB 3.39Å; F242-W246 PolarHBondContact O-N 2.9Å
243	G	97.4	Very high	96.2	Very high	25 Å²	25	64.7 Å²	64.7	26%	0.258	36%	0.364	S	S	.	.	H	α-helix	trans	-56.4	-41.4	176.8	0	0	0	0	0	112.4	L239 V240 L247	L239-G243 WeakPolarHBondContact O-CA 3.39Å; L239-G243 PolarHBondContact O-N 2.95Å; V240-G243 PolarHBondContact O-N 3.33Å; G243-L247 VanDerWaalsContact O-CA 3.26Å; G243-L247 WeakPolarHBondContact O-CA 3.44Å; G243-L247 VanDerWaalsContact O-CB 3.28Å; G243-L247 WeakPolarHBondContact O-CB 3.19Å; G243-L247 PolarHBondContact O-N 3.47Å
244	L	97.4	Very high	95.9	Very high	116 Å²	116	61.7 Å²	61.7	61%	0.607	36%	0.358	S	S	*	.	H	α-helix	trans	-70.3	-44.3	176.4	-70.5	173.4	0	0	0	112.7	V240 T241 F242 W246 L247	V240-L244 HydrophobicContact CG1-CD1 3.93Å; V240-L244 HydrophobicContact CG1-CG 4.33Å; V240-L244 WeakPolarHBondContact O-CB 3.23Å; V240-L244 VanDerWaalsContact O-CG 3.26Å; V240-L244 WeakPolarHBondContact O-CG 3.28Å; V240-L244 PolarHBondContact O-N 3.24Å; T241-L244 PolarHBondContact O-N 3.32Å; F242-L244 VanDerWaalsContact C-N 3.28Å; F242-L244 PolarHBondContact O-N 2.78Å; L244-W246 VanDerWaalsContact C-N 3.29Å; L244-W246 PolarHBondContact O-N 2.87Å; L244-L247 PolarHBondContact O-N 3.27Å
245	C	97.3	Very high	95.7	Very high	11 Å²	11	61.8 Å²	61.8	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-62.8	-37.8	177.4	-71.1	0	0	0	0	112.2	P74 Y78 N198 T241 F242	P74-C245 WeakPolarHBondContact CB-O 3.4Å; Y78-C245 VanDerWaalsContact CE2-O 3.26Å; Y78-C245 WeakPolarHBondContact CE2-O 3.28Å; Y78-C245 PolarHBondContact OH-O 3.46Å; N198-C245 HydrophobicContact CB-CB 4.22Å; T241-C245 PolarHBondContact O-N 3.36Å; T241-C245 PolarHBondContact O-SG 3.42Å; F242-C245 PolarHBondContact O-N 3.41Å
246	W	97.1	Very high	95.5	Very high	29 Å²	29	60.4 Å²	60.4	11%	0.11	35%	0.35	C	S	.	.	H	α-helix	trans	-94.6	-4.3	-176	-71	71.5	0	0	0	113.6	P74 N198 F242 L244 P248 F249 L250 V256 V259 V260 I263	P74-W246 HydrophobicContact CG-CD2 3.98Å; P74-W246 HydrophobicContact CG-CE3 4.31Å; P74-W246 HydrophobicContact CG-CG 4.36Å; P74-W246 HydrophobicContact CG-CZ2 4.27Å; N198-W246 VanDerWaalsContact OD1-CD1 3.32Å; N198-W246 PolarHBondContact OD1-NE1 3.29Å; F242-W246 AromaticContact CD1-NE1 3.88Å; F242-W246 WeakPolarHBondContact O-CB 3.39Å; F242-W246 PolarHBondContact O-N 2.9Å; L244-W246 VanDerWaalsContact C-N 3.29Å; L244-W246 PolarHBondContact O-N 2.87Å; W246-P248 VanDerWaalsContact C-N 3.31Å; W246-F249 WeakPolarHBondContact O-CA 3.32Å; W246-F249 WeakPolarHBondContact O-CB 3.26Å; W246-F249 PolarHBondContact O-N 3.11Å; W246-L250 HydrophobicContact CB-CD2 4.08Å; W246-L250 HydrophobicContact CB-CG 4.21Å; W246-L250 WeakPolarHBondContact O-CG 3.26Å; W246-L250 PolarHBondContact O-N 2.79Å; W246-V256 HydrophobicContact CE3-CG1 4.38Å; W246-V256 HydrophobicContact CZ3-CG1 4.17Å; W246-V259 HydrophobicContact CH2-CB 4.15Å; W246-V259 HydrophobicContact CH2-CG1 3.48Å; W246-V259 VanDerWaalsContact CH2-CG1 3.48Å; W246-V259 HydrophobicContact CZ2-CG1 4.4Å; W246-V259 HydrophobicContact CZ3-CB 3.84Å; W246-V259 HydrophobicContact CZ3-CG1 3.55Å; W246-V260 HydrophobicContact CH2-CG2 3.97Å; W246-V260 HydrophobicContact CZ3-CG2 4.25Å; W246-I263 HydrophobicContact CH2-CD1 3.78Å; W246-I263 HydrophobicContact CZ2-CD1 3.98Å
247	L	95	Very high	95.3	Very high	103 Å²	103	62.1 Å²	62.1	54%	0.539	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-45.3	-169.6	-171.7	65.2	0	0	0	114.3	G243 L244 F249 L250 P251	G243-L247 VanDerWaalsContact O-CA 3.26Å; G243-L247 WeakPolarHBondContact O-CA 3.44Å; G243-L247 VanDerWaalsContact O-CB 3.28Å; G243-L247 WeakPolarHBondContact O-CB 3.19Å; G243-L247 PolarHBondContact O-N 3.47Å; L244-L247 PolarHBondContact O-N 3.27Å; L247-F249 VanDerWaalsContact C-N 3.26Å; L247-F249 PolarHBondContact O-N 2.9Å; L247-L250 PolarHBondContact O-N 3.46Å; L247-P251 WeakPolarHBondContact O-CD 3.47Å
248	P	92.4	Very high	95.1	Very high	58 Å²	58	62.4 Å²	62.4	38%	0.377	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-21	-179.1	-20.1	35.6	0	0	0	114.5	L53 Y78 W246	L53-P248 HydrophobicContact CD1-CB 3.4Å; L53-P248 VanDerWaalsContact CD1-CB 3.4Å; L53-P248 HydrophobicContact CD1-CG 3.99Å; L53-P248 HydrophobicContact CD2-CB 3.82Å; L53-P248 HydrophobicContact CG-CB 4.28Å; Y78-P248 WeakPolarHBondContact OH-CD 3.49Å; Y78-P248 WeakPolarHBondContact OH-CG 3.47Å; W246-P248 VanDerWaalsContact C-N 3.31Å
249	F	93.3	Very high	94.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-23.7	-178.8	-57.1	-85.9	0	0	0	112.5	L53 W56 Y57 P74 Y78 W246 L247 D252 Q255 V256 V259	L53-F249 HydrophobicContact CD1-CE2 4.32Å; L53-F249 HydrophobicContact CD1-CZ 4.09Å; L53-F249 HydrophobicContact CD2-CD1 3.71Å; L53-F249 HydrophobicContact CD2-CD2 4.47Å; L53-F249 HydrophobicContact CD2-CE1 3.42Å; L53-F249 VanDerWaalsContact CD2-CE1 3.42Å; L53-F249 HydrophobicContact CD2-CE2 4.22Å; L53-F249 HydrophobicContact CD2-CG 4.23Å; L53-F249 HydrophobicContact CD2-CZ 3.7Å; L53-F249 HydrophobicContact CG-CE1 3.95Å; L53-F249 HydrophobicContact CG-CE2 4.48Å; L53-F249 HydrophobicContact CG-CZ 3.83Å; W56-F249 HydrophobicContact CE3-CZ 4.28Å; Y57-F249 AromaticContact CD2-CE1 3.89Å; Y57-F249 HydrophobicContact CD2-CE1 3.89Å; Y57-F249 HydrophobicContact CD2-CZ 4.3Å; Y57-F249 AromaticContact CE2-CE1 3.82Å; Y57-F249 HydrophobicContact CE2-CE1 3.82Å; Y57-F249 AromaticContact CE2-CZ 3.77Å; Y57-F249 HydrophobicContact CE2-CZ 3.77Å; P74-F249 HydrophobicContact CB-CD2 4.38Å; P74-F249 HydrophobicContact CB-CE2 3.84Å; P74-F249 HydrophobicContact CG-CD2 4.07Å; P74-F249 HydrophobicContact CG-CE2 3.88Å; Y78-F249 WeakPolarHBondContact OH-CE2 3.43Å; W246-F249 WeakPolarHBondContact O-CA 3.32Å; W246-F249 WeakPolarHBondContact O-CB 3.26Å; W246-F249 PolarHBondContact O-N 3.11Å; L247-F249 VanDerWaalsContact C-N 3.26Å; L247-F249 PolarHBondContact O-N 2.9Å; F249-D252 PolarHBondContact O-N 2.92Å; F249-Q255 HydrophobicContact CD1-CB 4.48Å; F249-V256 HydrophobicContact CB-CG2 4.38Å; F249-V256 VanDerWaalsContact O-CG2 3.28Å; F249-V256 WeakPolarHBondContact O-CG2 3.43Å; F249-V259 HydrophobicContact CD1-CG2 3.77Å; F249-V259 HydrophobicContact CE1-CG2 3.98Å; F249-V259 HydrophobicContact CG-CG2 4.39Å
250	L	92.4	Very high	94.7	Very high	85 Å²	85	57.6 Å²	57.6	45%	0.445	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.2	-175.6	-66.4	-179.9	0	0	0	116.3	W246 L247 D252 V256	W246-L250 HydrophobicContact CB-CD2 4.08Å; W246-L250 HydrophobicContact CB-CG 4.21Å; W246-L250 WeakPolarHBondContact O-CG 3.26Å; W246-L250 PolarHBondContact O-N 2.79Å; L247-L250 PolarHBondContact O-N 3.46Å; L250-D252 PolarHBondContact O-N 3.41Å; L250-V256 HydrophobicContact CD2-CG2 4.44Å
251	P	92	Very high	94.4	Very high	117 Å²	117	60.6 Å²	60.6	76%	0.76	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.2	-178.5	-26.1	36	0	0	0	114.5	L247	L247-P251 WeakPolarHBondContact O-CD 3.47Å
252	D	91.4	Very high	94.1	Very high	70 Å²	70	62.5 Å²	62.5	37%	0.374	33%	0.334	S	S	.	.			trans	-121.7	112.3	-178.3	-178.9	-1	0	0	0	110.8	F249 L250 S254 Q255 V256	F249-D252 PolarHBondContact O-N 2.92Å; L250-D252 PolarHBondContact O-N 3.41Å; D252-S254 PolarHBondContact O-N 2.9Å; D252-S254 VanDerWaalsContact OD1-CB 3.31Å; D252-S254 WeakPolarHBondContact OD1-CB 3.46Å; D252-S254 PolarHBondContact OD1-N 3.35Å; D252-S254 PolarHBondContact OD1-OG 3.32Å; D252-S254 PolarHBondContact OD2-OG 3.43Å; D252-Q255 HydrophobicContact CB-CB 4.12Å; D252-Q255 HydrophobicContact CB-CG 3.77Å; D252-Q255 WeakPolarHBondContact O-CB 3.37Å; D252-Q255 PolarHBondContact O-N 3Å; D252-Q255 VanDerWaalsContact O-N 3.07Å; D252-Q255 WeakPolarHBondContact OD2-CG 3.43Å; D252-V256 PolarHBondContact O-N 3.24Å
253	N	92.1	Very high	93.9	Very high	137 Å²	137	59.6 Å²	59.6	73%	0.733	32%	0.322	S	S	*	.	H	α-helix	trans	-58.5	-30.4	178.4	-71.6	-24.7	0	0	0	112.8	L257	N253-L257 WeakPolarHBondContact O-CB 3.44Å; N253-L257 PolarHBondContact O-N 3.28Å
254	S	92.6	Very high	93.5	Very high	60 Å²	60	63.2 Å²	63.2	42%	0.42	33%	0.33	S	S	.	.	H	α-helix	trans	-68.8	-36.8	178.4	78.2	0	0	0	0	111.6	D252 Q258	D252-S254 PolarHBondContact O-N 2.9Å; D252-S254 VanDerWaalsContact OD1-CB 3.31Å; D252-S254 WeakPolarHBondContact OD1-CB 3.46Å; D252-S254 PolarHBondContact OD1-N 3.35Å; D252-S254 PolarHBondContact OD1-OG 3.32Å; D252-S254 PolarHBondContact OD2-OG 3.43Å; S254-Q258 WeakPolarHBondContact O-CB 3.48Å; S254-Q258 PolarHBondContact O-N 2.8Å
255	Q	92.9	Very high	92.5	Very high	16 Å²	16	59.7 Å²	59.7	8%	0.075	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-50.9	174	-69.5	-75.2	-32.5	0	0	110.8	Q54 F58 F249 D252 L257 Q258 V259	Q54-Q255 PolarHBondContact O-NE2 3.4Å; F58-Q255 HydrophobicContact CE2-CG 4.37Å; F58-Q255 VanDerWaalsContact CE2-OE1 3.3Å; F249-Q255 HydrophobicContact CD1-CB 4.48Å; D252-Q255 HydrophobicContact CB-CB 4.12Å; D252-Q255 HydrophobicContact CB-CG 3.77Å; D252-Q255 WeakPolarHBondContact O-CB 3.37Å; D252-Q255 PolarHBondContact O-N 3Å; D252-Q255 VanDerWaalsContact O-N 3.07Å; D252-Q255 WeakPolarHBondContact OD2-CG 3.43Å; Q255-L257 VanDerWaalsContact C-N 3.33Å; Q255-L257 PolarHBondContact O-N 2.97Å; Q255-Q258 PolarHBondContact O-N 3.44Å; Q255-V259 VanDerWaalsContact O-CG2 3.29Å; Q255-V259 WeakPolarHBondContact O-CG2 3.36Å; Q255-V259 PolarHBondContact O-N 3.39Å
256	V	94.3	Very high	91	Very high	37 Å²	37	65.4 Å²	65.4	22%	0.224	35%	0.349	C	S	.	.	H	α-helix	trans	-56.8	-48.4	178	179	0	0	0	0	111	W246 F249 L250 D252 Q258 V259 V260	W246-V256 HydrophobicContact CE3-CG1 4.38Å; W246-V256 HydrophobicContact CZ3-CG1 4.17Å; F249-V256 HydrophobicContact CB-CG2 4.38Å; F249-V256 VanDerWaalsContact O-CG2 3.28Å; F249-V256 WeakPolarHBondContact O-CG2 3.43Å; L250-V256 HydrophobicContact CD2-CG2 4.44Å; D252-V256 PolarHBondContact O-N 3.24Å; V256-Q258 VanDerWaalsContact C-N 3.32Å; V256-Q258 PolarHBondContact O-N 3.08Å; V256-V259 PolarHBondContact O-N 3.49Å; V256-V260 HydrophobicContact CG1-CG2 4.5Å; V256-V260 WeakPolarHBondContact O-CG2 3.39Å; V256-V260 PolarHBondContact O-N 3.46Å
257	L	94.2	Very high	89.1	Confident	84 Å²	84	68.9 Å²	68.9	44%	0.44	38%	0.384	S	S	.	.	H	α-helix	trans	-63.3	-38.9	-178.9	-176.4	60.7	0	0	0	112	N253 Q255 V260 R261	N253-L257 WeakPolarHBondContact O-CB 3.44Å; N253-L257 PolarHBondContact O-N 3.28Å; Q255-L257 VanDerWaalsContact C-N 3.33Å; Q255-L257 PolarHBondContact O-N 2.97Å; L257-V260 PolarHBondContact O-N 2.85Å; L257-R261 VanDerWaalsContact O-CG 3.29Å; L257-R261 WeakPolarHBondContact O-CG 3.3Å; L257-R261 PolarHBondContact O-N 2.98Å
258	Q	94.3	Very high	87.4	Confident	37 Å²	37	68.5 Å²	68.5	17%	0.173	38%	0.375	C	S	.	.	H	α-helix	trans	-65.9	-45.6	177.5	-179.7	62.9	7.3	0	0	111.9	Y57 F58 S254 Q255 V256 V260 R261 R262	Y57-Q258 VanDerWaalsContact O-CG 3.28Å; Y57-Q258 WeakPolarHBondContact O-CG 3.31Å; Y57-Q258 PolarHBondContact O-NE2 3.4Å; F58-Q258 HydrophobicContact CD1-CG 4.06Å; F58-Q258 HydrophobicContact CD2-CB 4.47Å; F58-Q258 HydrophobicContact CD2-CG 3.91Å; F58-Q258 HydrophobicContact CE1-CB 3.89Å; F58-Q258 HydrophobicContact CE1-CG 3.76Å; F58-Q258 HydrophobicContact CE2-CB 3.63Å; F58-Q258 HydrophobicContact CE2-CG 3.55Å; F58-Q258 HydrophobicContact CG-CG 4.15Å; F58-Q258 HydrophobicContact CZ-CB 3.31Å; F58-Q258 HydrophobicContact CZ-CG 3.51Å; S254-Q258 WeakPolarHBondContact O-CB 3.48Å; S254-Q258 PolarHBondContact O-N 2.8Å; Q255-Q258 PolarHBondContact O-N 3.44Å; V256-Q258 VanDerWaalsContact C-N 3.32Å; V256-Q258 PolarHBondContact O-N 3.08Å; Q258-V260 VanDerWaalsContact C-N 3.31Å; Q258-V260 PolarHBondContact O-N 3.01Å; Q258-R261 PolarHBondContact O-N 3.1Å; Q258-R262 PolarHBondContact O-N 3.41Å
259	V	94.9	Very high	85.7	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-58.2	-46.2	176	176.9	0	0	0	0	110.1	Y57 P74 W246 F249 Q255 V256 R261 R262 I263	Y57-V259 HydrophobicContact CD1-CG1 4.41Å; Y57-V259 HydrophobicContact CD1-CG2 4.2Å; Y57-V259 HydrophobicContact CD2-CG2 3.6Å; Y57-V259 HydrophobicContact CE1-CG1 4.02Å; Y57-V259 HydrophobicContact CE1-CG2 4.42Å; Y57-V259 HydrophobicContact CE2-CG1 4.38Å; Y57-V259 HydrophobicContact CE2-CG2 3.87Å; Y57-V259 HydrophobicContact CG-CG2 3.76Å; P74-V259 HydrophobicContact CG-CG1 4.41Å; W246-V259 HydrophobicContact CH2-CB 4.15Å; W246-V259 HydrophobicContact CH2-CG1 3.48Å; W246-V259 VanDerWaalsContact CH2-CG1 3.48Å; W246-V259 HydrophobicContact CZ2-CG1 4.4Å; W246-V259 HydrophobicContact CZ3-CB 3.84Å; W246-V259 HydrophobicContact CZ3-CG1 3.55Å; F249-V259 HydrophobicContact CD1-CG2 3.77Å; F249-V259 HydrophobicContact CE1-CG2 3.98Å; F249-V259 HydrophobicContact CG-CG2 4.39Å; Q255-V259 VanDerWaalsContact O-CG2 3.29Å; Q255-V259 WeakPolarHBondContact O-CG2 3.36Å; Q255-V259 PolarHBondContact O-N 3.39Å; V256-V259 PolarHBondContact O-N 3.49Å; V259-R261 VanDerWaalsContact C-N 3.35Å; V259-R261 PolarHBondContact O-N 2.97Å; V259-R262 PolarHBondContact O-N 3.35Å; V259-I263 HydrophobicContact CG1-CD1 3.66Å; V259-I263 HydrophobicContact CG1-CG1 4.35Å; V259-I263 VanDerWaalsContact O-CG1 3.24Å; V259-I263 WeakPolarHBondContact O-CG1 3.43Å; V259-I263 PolarHBondContact O-N 2.91Å
260	V	94.1	Very high	83.8	Confident	58 Å²	58	67.7 Å²	67.7	35%	0.352	37%	0.374	S	S	.	.	H	α-helix	trans	-60	-42.6	177.1	171.4	0	0	0	0	111.9	W246 V256 L257 Q258 R262 I263 F264	W246-V260 HydrophobicContact CH2-CG2 3.97Å; W246-V260 HydrophobicContact CZ3-CG2 4.25Å; V256-V260 HydrophobicContact CG1-CG2 4.5Å; V256-V260 WeakPolarHBondContact O-CG2 3.39Å; V256-V260 PolarHBondContact O-N 3.46Å; L257-V260 PolarHBondContact O-N 2.85Å; Q258-V260 VanDerWaalsContact C-N 3.31Å; Q258-V260 PolarHBondContact O-N 3.01Å; V260-R262 VanDerWaalsContact C-N 3.33Å; V260-R262 PolarHBondContact O-N 3.34Å; V260-I263 PolarHBondContact O-N 2.78Å; V260-F264 HydrophobicContact CG1-CD2 4.3Å; V260-F264 PolarHBondContact O-N 3.14Å
261	R	91.7	Very high	82.1	Confident	153 Å²	153	64.8 Å²	64.8	58%	0.577	36%	0.358	S	S	*	.	H	α-helix	trans	-64.1	-34.9	177.4	-75.8	172.7	177.9	177	-0.6	113	L257 Q258 V259 F264	L257-R261 VanDerWaalsContact O-CG 3.29Å; L257-R261 WeakPolarHBondContact O-CG 3.3Å; L257-R261 PolarHBondContact O-N 2.98Å; Q258-R261 PolarHBondContact O-N 3.1Å; V259-R261 VanDerWaalsContact C-N 3.35Å; V259-R261 PolarHBondContact O-N 2.97Å; R261-F264 CarbonylContact O-C 3.38Å
262	R	92	Very high	80.3	Confident	48 Å²	48	64.2 Å²	64.2	18%	0.181	35%	0.345	C	S	.	.	H	α-helix	trans	-71.6	-40.8	174.7	-68.9	-57.7	-60.9	-162.8	-7.7	112.1	Y57 L65 D71 Q258 V259 V260 F264	Y57-R262 HydrophobicContact CD1-CB 4.1Å; Y57-R262 HydrophobicContact CD1-CG 4.19Å; L65-R262 PolarHBondContact O-NH2 3.5Å; D71-R262 IonicContact OD1-CZ 2.73Å; D71-R262 IonicContact OD1-NE 2.97Å; D71-R262 PolarHBondContact OD1-NE 3.07Å; D71-R262 IonicContact OD1-NH2 3.75Å; D71-R262 PolarHBondContact OD1-NH2 2.71Å; D71-R262 IonicContact OD2-NH2 2.64Å; Q258-R262 PolarHBondContact O-N 3.41Å; V259-R262 PolarHBondContact O-N 3.35Å; V260-R262 VanDerWaalsContact C-N 3.33Å; V260-R262 PolarHBondContact O-N 3.34Å; R262-F264 VanDerWaalsContact C-N 3.35Å; R262-F264 PolarHBondContact O-N 3.25Å
263	I	92.2	Very high	78.9	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-64.9	-39.3	178.2	-66.4	165.4	0	0	0	111.7	P73 Q201 W246 V259 V260 P265	P73-I263 HydrophobicContact CB-CD1 3.72Å; P73-I263 HydrophobicContact CB-CG1 4.35Å; P73-I263 HydrophobicContact CG-CD1 4.38Å; Q201-I263 HydrophobicContact CB-CG2 3.42Å; Q201-I263 VanDerWaalsContact CB-CG2 3.42Å; Q201-I263 HydrophobicContact CG-CG2 3.49Å; Q201-I263 VanDerWaalsContact CG-CG2 3.49Å; Q201-I263 PolarHBondContact NE2-O 2.96Å; W246-I263 HydrophobicContact CH2-CD1 3.78Å; W246-I263 HydrophobicContact CZ2-CD1 3.98Å; V259-I263 HydrophobicContact CG1-CD1 3.66Å; V259-I263 HydrophobicContact CG1-CG1 4.35Å; V259-I263 VanDerWaalsContact O-CG1 3.24Å; V259-I263 WeakPolarHBondContact O-CG1 3.43Å; V259-I263 PolarHBondContact O-N 2.91Å; V260-I263 PolarHBondContact O-N 2.78Å; I263-P265 VanDerWaalsContact C-CD 3.5Å; I263-P265 VanDerWaalsContact O-CD 3.31Å; I263-P265 WeakPolarHBondContact O-CD 3.23Å
264	F	89.6	Confident	78.2	Confident	100 Å²	100	62.3 Å²	62.3	44%	0.439	33%	0.331	S	S	.	.	S	Bend	trans	-118.6	77.8	-178.6	-60.8	-72.3	0	0	0	111.4	Q201 L204 V260 R261 R262 V266	Q201-F264 HydrophobicContact CB-CE1 4.22Å; Q201-F264 HydrophobicContact CB-CZ 4.1Å; Q201-F264 HydrophobicContact CG-CE1 4.25Å; L204-F264 HydrophobicContact CD1-CE1 3.58Å; L204-F264 HydrophobicContact CD1-CZ 3.62Å; V260-F264 HydrophobicContact CG1-CD2 4.3Å; V260-F264 PolarHBondContact O-N 3.14Å; R261-F264 CarbonylContact O-C 3.38Å; R262-F264 VanDerWaalsContact C-N 3.35Å; R262-F264 PolarHBondContact O-N 3.25Å; F264-V266 PolarHBondContact O-N 2.81Å
265	P	77.4	Confident	77.9	Confident	43 Å²	43	59.6 Å²	59.6	28%	0.279	31%	0.312	S	S	.	.			trans	-73.9	101.3	179.7	30.4	-33.9	0	0	0	110.3	I263 A267	I263-P265 VanDerWaalsContact C-CD 3.5Å; I263-P265 VanDerWaalsContact O-CD 3.31Å; I263-P265 WeakPolarHBondContact O-CD 3.23Å; P265-A267 PolarHBondContact O-N 3.18Å
266	V	65.4	Low	77.7	Confident	131 Å²	131	59 Å²	59	79%	0.794	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.8	-178.7	-172.8	0	0	0	0	112.7	F264	F264-V266 PolarHBondContact O-N 2.81Å
267	A	57.3	Low	77.6	Confident	102 Å²	102	57.5 Å²	57.5	84%	0.843	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	13.1	-168.8	0	0	0	0	0	116.1	P265	P265-A267 PolarHBondContact O-N 3.18Å
268	R	58.7	Low	77.4	Confident	94 Å²	94	54.1 Å²	54.1	36%	0.355	28%	0.283	S	S	.	.			trans	-99.1	144.9	178.1	-68.9	-172.4	-172.2	169.2	8.2	111.4	D71 E272 Y341 Q342	D71-R268 IonicContact OD2-NH2 3.64Å; R268-E272 WeakPolarHBondContact CA-OE1 3.37Å; R268-E272 WeakPolarHBondContact CB-OE1 3.29Å; R268-Y341 WeakPolarHBondContact O-CE1 3.42Å; R268-Q342 VanDerWaalsContact CD-NE2 3.35Å
269	G	56.6	Low	77.2	Confident	28 Å²	28	52.9 Å²	52.9	29%	0.289	28%	0.277	S	S	.	.			trans	-85.8	157.5	-172.1	0	0	0	0	0	115.1	F271 E272	G269-F271 VanDerWaalsContact C-N 3.27Å; G269-F271 PolarHBondContact O-N 2.86Å; G269-E272 PolarHBondContact N-OE1 2.83Å
270	L	53.9	Low	76.8	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.068	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.2	-173.8	-173.6	63.4	0	0	0	116.4	W279 Q297 Y341	L270-W279 HydrophobicContact CD1-CB 4.42Å; L270-W279 HydrophobicContact CD1-CG 4.2Å; L270-W279 HydrophobicContact CD2-CB 4.18Å; L270-W279 HydrophobicContact CD2-CG 4.32Å; L270-W279 HydrophobicContact CG-CB 4.41Å; L270-Q297 HydrophobicContact CD2-CB 3.88Å; L270-Q297 HydrophobicContact CD2-CG 3.94Å; L270-Y341 HydrophobicContact CB-CD2 4.04Å; L270-Y341 HydrophobicContact CB-CE1 4.22Å; L270-Y341 HydrophobicContact CB-CE2 3.51Å; L270-Y341 VanDerWaalsContact CD1-CA 3.45Å; L270-Y341 HydrophobicContact CD1-CD1 4.32Å; L270-Y341 HydrophobicContact CD1-CD2 3.21Å; L270-Y341 HydrophobicContact CD1-CE2 3.65Å; L270-Y341 HydrophobicContact CD1-CG 3.61Å; L270-Y341 WeakPolarHBondContact CD1-O 3.47Å; L270-Y341 HydrophobicContact CD2-CD2 4.44Å; L270-Y341 HydrophobicContact CD2-CE2 4.31Å; L270-Y341 HydrophobicContact CG-CD2 4.06Å; L270-Y341 HydrophobicContact CG-CE2 3.98Å; L270-Y341 PolarHBondContact N-OH 3.43Å
271	F	56.6	Low	76.4	Confident	24 Å²	24	50.9 Å²	50.9	11%	0.105	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.2	52.3	-174.2	-28.8	-114.9	0	0	0	113.3	G269 D273 W279 N283 I288 R289	G269-F271 VanDerWaalsContact C-N 3.27Å; G269-F271 PolarHBondContact O-N 2.86Å; F271-D273 VanDerWaalsContact C-N 3.29Å; F271-W279 HydrophobicContact CE1-CB 3.94Å; F271-W279 WeakPolarHBondContact CE1-O 3.49Å; F271-N283 HydrophobicContact CD1-CB 4.19Å; F271-N283 HydrophobicContact CE1-CB 3.58Å; F271-N283 HydrophobicContact CZ-CB 4.2Å; F271-I288 HydrophobicContact CZ-CB 4.2Å; F271-I288 HydrophobicContact CZ-CG2 4.3Å; F271-R289 VanDerWaalsContact CA-NH2 3.28Å; F271-R289 HydrophobicContact CD2-CG 3.69Å; F271-R289 HydrophobicContact CE2-CG 3.26Å; F271-R289 HydrophobicContact CZ-CG 4.04Å; F271-R289 PolarHBondContact O-NH2 2.91Å
272	E	55	Low	76.2	Confident	105 Å²	105	46.7 Å²	46.7	49%	0.491	25%	0.254	S	S	.	.	S	Bend	trans	-64.9	-36.1	174.2	-73.8	173.3	-173.2	0	0	111.3	R268 G269	R268-E272 WeakPolarHBondContact CA-OE1 3.37Å; R268-E272 WeakPolarHBondContact CB-OE1 3.29Å; G269-E272 PolarHBondContact N-OE1 2.83Å
273	D	62.1	Low	76	Confident	78 Å²	78	45.7 Å²	45.7	42%	0.417	25%	0.253	S	S	.	.	S	Bend	trans	-128.4	159.3	-178.7	-64.8	-47.5	0	0	0	114	F271 V275 H344 E345	F271-D273 VanDerWaalsContact C-N 3.29Å; D273-V275 HydrophobicContact CB-CG2 4.12Å; D273-V275 PolarHBondContact O-N 3.43Å; D273-V275 VanDerWaalsContact O-N 3.08Å; D273-H344 IonicContact OD2-ND1 3.9Å; D273-E345 WeakPolarHBondContact CB-OE1 3.27Å
274	K	77.6	Confident	75.5	Confident	89 Å²	89	48 Å²	48	39%	0.387	27%	0.267	S	S	.	.			trans	-82.5	78.8	179.4	-58.3	-59.9	-174.2	-173.1	0	111.1	D466 V470	K274-D466 VanDerWaalsContact CE-OD2 3.28Å; K274-D466 WeakPolarHBondContact CE-OD2 3.26Å; K274-D466 IonicContact NZ-OD2 2.98Å; K274-V470 HydrophobicContact CD-CG2 4.13Å
275	V	84.8	Confident	75.3	Confident	4 Å²	4	50 Å²	50	2%	0.024	28%	0.282	C	S	.	.			trans	-94.3	149.9	-176.6	-174.4	0	0	0	0	111.8	D273 N277 C280 F337 V343 E345	D273-V275 HydrophobicContact CB-CG2 4.12Å; D273-V275 PolarHBondContact O-N 3.43Å; D273-V275 VanDerWaalsContact O-N 3.08Å; V275-N277 HydrophobicContact CG1-CB 4.44Å; V275-N277 PolarHBondContact O-N 3.33Å; V275-C280 WeakPolarHBondContact O-CB 3.41Å; V275-F337 HydrophobicContact CG1-CE2 4.29Å; V275-F337 HydrophobicContact CG1-CZ 3.94Å; V275-V343 HydrophobicContact CG1-CB 4.3Å; V275-V343 HydrophobicContact CG1-CG1 3.94Å; V275-V343 WeakPolarHBondContact CG2-O 3.48Å; V275-E345 HydrophobicContact CG2-CG 4.08Å
276	A	89.4	Confident	75.6	Confident	4 Å²	4	52.6 Å²	52.6	3%	0.033	29%	0.292	C	S	.	.	S	Bend	trans	-74.3	44	175.4	0	0	0	0	0	113.4	F337 S473 A476 F477 F480	A276-F337 HydrophobicContact CB-CE1 4.4Å; A276-F337 WeakPolarHBondContact O-CE1 3.45Å; A276-S473 WeakPolarHBondContact CA-O 3.16Å; A276-S473 VanDerWaalsContact CB-O 3.27Å; A276-S473 WeakPolarHBondContact CB-O 3.33Å; A276-A476 HydrophobicContact CB-CB 3.86Å; A276-F477 HydrophobicContact CB-CB 4.31Å; A276-F480 HydrophobicContact CB-CD2 3.95Å; A276-F480 HydrophobicContact CB-CE2 3.64Å
277	N	91.5	Very high	76.5	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.021	28%	0.28	C	S	.	.	S	Bend	trans	-102.7	170.9	176.4	77.3	-3.3	0	0	0	111.5	V275 W279 C280 S281 F337	V275-N277 HydrophobicContact CG1-CB 4.44Å; V275-N277 PolarHBondContact O-N 3.33Å; N277-W279 VanDerWaalsContact C-N 3.34Å; N277-W279 PolarHBondContact O-N 2.99Å; N277-W279 PolarHBondContact OD1-N 3.12Å; N277-C280 WeakPolarHBondContact OD1-CB 3.49Å; N277-C280 PolarHBondContact OD1-N 3.08Å; N277-S281 WeakPolarHBondContact O-CB 3.42Å; N277-S281 PolarHBondContact O-N 2.86Å; N277-S281 VanDerWaalsContact O-N 3.11Å; N277-S281 PolarHBondContact O-OG 3Å; N277-F337 WeakPolarHBondContact CB-O 3.28Å
278	T	91.1	Very high	77.7	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.08	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-44.2	-177.7	-56	0	0	0	0	111.2	L282 L338 F339 F477	T278-L282 HydrophobicContact CG2-CD1 3.62Å; T278-L282 HydrophobicContact CG2-CG 4.21Å; T278-L282 VanDerWaalsContact O-CB 3.28Å; T278-L282 WeakPolarHBondContact O-CB 3.14Å; T278-L282 VanDerWaalsContact O-CG 3.25Å; T278-L282 WeakPolarHBondContact O-CG 3.35Å; T278-L282 PolarHBondContact O-N 3.42Å; T278-L338 WeakPolarHBondContact CB-O 3.43Å; T278-L338 PolarHBondContact N-O 3.21Å; T278-L338 PolarHBondContact OG1-O 3Å; T278-F339 HydrophobicContact CG2-CD1 4.22Å; T278-F339 HydrophobicContact CG2-CE1 4.09Å; T278-F339 VanDerWaalsContact OG1-CD1 3.31Å; T278-F339 WeakPolarHBondContact OG1-CD1 3.29Å; T278-F339 WeakPolarHBondContact OG1-CE1 3.46Å; T278-F477 VanDerWaalsContact CA-CE2 3.46Å; T278-F477 HydrophobicContact CG2-CZ 4.42Å; T278-F477 WeakPolarHBondContact OG1-CE2 3.32Å
279	W	89.6	Confident	78.6	Confident	12 Å²	12	50.4 Å²	50.4	5%	0.045	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-49.6	-175	-49.6	117.1	0	0	0	111.8	L270 F271 N277 L282 N283 I288 L300 S301 F304 F339 S340	L270-W279 HydrophobicContact CD1-CB 4.42Å; L270-W279 HydrophobicContact CD1-CG 4.2Å; L270-W279 HydrophobicContact CD2-CB 4.18Å; L270-W279 HydrophobicContact CD2-CG 4.32Å; L270-W279 HydrophobicContact CG-CB 4.41Å; F271-W279 HydrophobicContact CE1-CB 3.94Å; F271-W279 WeakPolarHBondContact CE1-O 3.49Å; N277-W279 VanDerWaalsContact C-N 3.34Å; N277-W279 PolarHBondContact O-N 2.99Å; N277-W279 PolarHBondContact OD1-N 3.12Å; W279-L282 PolarHBondContact O-N 3.37Å; W279-N283 WeakPolarHBondContact O-CB 3.44Å; W279-N283 PolarHBondContact O-N 3.48Å; W279-I288 HydrophobicContact CE3-CD1 4.28Å; W279-L300 HydrophobicContact CH2-CD2 3.99Å; W279-L300 HydrophobicContact CH2-CG 3.99Å; W279-L300 HydrophobicContact CZ3-CD2 3.9Å; W279-L300 HydrophobicContact CZ3-CG 4.42Å; W279-S301 PolarHBondContact NE1-OG 3.28Å; W279-F304 HydrophobicContact CH2-CB 4.41Å; W279-F304 HydrophobicContact CH2-CD2 4.21Å; W279-F304 HydrophobicContact CH2-CG 4.15Å; W279-F304 HydrophobicContact CZ2-CB 4.17Å; W279-F304 HydrophobicContact CZ2-CG 4.39Å; W279-F339 VanDerWaalsContact NE1-C 3.33Å; W279-F339 PolarHBondContact NE1-O 2.73Å; W279-S340 VanDerWaalsContact CD1-O 3.27Å; W279-S340 PolarHBondContact NE1-O 3.16Å
280	C	85.9	Confident	79.8	Confident	10 Å²	10	53.7 Å²	53.7	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-42.5	179.4	-176.4	0	0	0	0	111.4	V275 N277 N283	V275-C280 WeakPolarHBondContact O-CB 3.41Å; N277-C280 WeakPolarHBondContact OD1-CB 3.49Å; N277-C280 PolarHBondContact OD1-N 3.08Å; C280-N283 PolarHBondContact O-N 3.14Å
281	S	86.7	Confident	81.4	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-45.9	178.5	-55.6	0	0	0	0	111.6	N277 N283 T284 F477	N277-S281 WeakPolarHBondContact O-CB 3.42Å; N277-S281 PolarHBondContact O-N 2.86Å; N277-S281 VanDerWaalsContact O-N 3.11Å; N277-S281 PolarHBondContact O-OG 3Å; S281-N283 VanDerWaalsContact C-N 3.33Å; S281-N283 PolarHBondContact O-N 3.49Å; S281-T284 WeakPolarHBondContact O-CB 3.47Å; S281-T284 PolarHBondContact O-N 3.43Å; S281-T284 PolarHBondContact O-OG1 2.65Å; S281-F477 VanDerWaalsContact OG-CB 3.29Å; S281-F477 WeakPolarHBondContact OG-CB 3.34Å; S281-F477 WeakPolarHBondContact OG-CD1 3.48Å; S281-F477 WeakPolarHBondContact OG-CG 3.48Å
282	L	87.2	Confident	82.9	Confident	65 Å²	65	60.5 Å²	60.5	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-68.2	-31.5	176.7	-70.9	177.8	0	0	0	112.6	T278 W279 T284 L285 I286 I288	T278-L282 HydrophobicContact CG2-CD1 3.62Å; T278-L282 HydrophobicContact CG2-CG 4.21Å; T278-L282 VanDerWaalsContact O-CB 3.28Å; T278-L282 WeakPolarHBondContact O-CB 3.14Å; T278-L282 VanDerWaalsContact O-CG 3.25Å; T278-L282 WeakPolarHBondContact O-CG 3.35Å; T278-L282 PolarHBondContact O-N 3.42Å; W279-L282 PolarHBondContact O-N 3.37Å; L282-T284 PolarHBondContact O-N 2.77Å; L282-T284 VanDerWaalsContact O-N 3.13Å; L282-L285 PolarHBondContact O-N 3.02Å; L282-I286 PolarHBondContact O-N 3.13Å; L282-I288 HydrophobicContact CB-CD1 3.91Å
283	N	86.7	Confident	84.5	Confident	27 Å²	27	59.6 Å²	59.6	14%	0.144	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-17.1	178.5	-170.8	69.1	0	0	0	113.7	F271 W279 C280 S281 L285 I286 I288	F271-N283 HydrophobicContact CD1-CB 4.19Å; F271-N283 HydrophobicContact CE1-CB 3.58Å; F271-N283 HydrophobicContact CZ-CB 4.2Å; W279-N283 WeakPolarHBondContact O-CB 3.44Å; W279-N283 PolarHBondContact O-N 3.48Å; C280-N283 PolarHBondContact O-N 3.14Å; S281-N283 VanDerWaalsContact C-N 3.33Å; S281-N283 PolarHBondContact O-N 3.49Å; N283-L285 VanDerWaalsContact C-N 3.35Å; N283-I286 WeakPolarHBondContact CA-O 3.18Å; N283-I288 PolarHBondContact OD1-N 3.31Å; N283-I288 VanDerWaalsContact OD1-N 3.12Å
284	T	82.8	Confident	85.6	Confident	55 Å²	55	59.4 Å²	59.4	34%	0.337	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-32.7	171.2	69.2	0	0	0	0	112.3	S281 L282 V470	S281-T284 WeakPolarHBondContact O-CB 3.47Å; S281-T284 PolarHBondContact O-N 3.43Å; S281-T284 PolarHBondContact O-OG1 2.65Å; L282-T284 PolarHBondContact O-N 2.77Å; L282-T284 VanDerWaalsContact O-N 3.13Å; T284-V470 HydrophobicContact CG2-CG1 3.61Å
285	L	84.2	Confident	86.1	Confident	144 Å²	144	60.2 Å²	60.2	75%	0.754	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-47.1	-177.1	-58	177.4	0	0	0	112	L282 N283	L282-L285 PolarHBondContact O-N 3.02Å; N283-L285 VanDerWaalsContact C-N 3.35Å
286	I	84.1	Confident	86.3	Confident	96 Å²	96	62.6 Å²	62.6	49%	0.492	34%	0.339	S	S	.	.	S	Bend	trans	-119.3	116.8	-177.3	-60.1	167.6	0	0	0	106.3	L282 N283 I288 I291	L282-I286 PolarHBondContact O-N 3.13Å; N283-I286 WeakPolarHBondContact CA-O 3.18Å; I286-I288 HydrophobicContact CG2-CG1 4.39Å; I286-I288 WeakPolarHBondContact O-CG1 3.14Å; I286-I288 PolarHBondContact O-N 2.94Å; I286-I291 HydrophobicContact CG2-CD1 3.67Å
287	K	85	Confident	86.3	Confident	123 Å²	123	63 Å²	63	54%	0.535	34%	0.34	S	S	.	.			trans	-70.4	76.9	179.7	-62.2	-61.1	-179.9	-168.3	0	111.1	R289 S290	K287-R289 PolarHBondContact O-N 3.04Å; K287-R289 VanDerWaalsContact O-N 3.13Å; K287-S290 WeakPolarHBondContact CB-OG 3.27Å; K287-S290 PolarHBondContact O-N 3.5Å; K287-S290 PolarHBondContact O-OG 2.79Å
288	I	81.7	Confident	86.1	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.092	36%	0.355	C	S	.	.	H	α-helix	trans	-54.5	-38.1	-175.4	-65.6	171	0	0	0	110.8	F271 W279 L282 N283 I286 S290 I291 L292 Q297	F271-I288 HydrophobicContact CZ-CB 4.2Å; F271-I288 HydrophobicContact CZ-CG2 4.3Å; W279-I288 HydrophobicContact CE3-CD1 4.28Å; L282-I288 HydrophobicContact CB-CD1 3.91Å; N283-I288 PolarHBondContact OD1-N 3.31Å; N283-I288 VanDerWaalsContact OD1-N 3.12Å; I286-I288 HydrophobicContact CG2-CG1 4.39Å; I286-I288 WeakPolarHBondContact O-CG1 3.14Å; I286-I288 PolarHBondContact O-N 2.94Å; I288-S290 VanDerWaalsContact C-N 3.25Å; I288-S290 PolarHBondContact O-N 3.06Å; I288-I291 PolarHBondContact O-N 3.02Å; I288-I291 VanDerWaalsContact O-N 3.09Å; I288-L292 HydrophobicContact CG2-CD1 4.16Å; I288-L292 PolarHBondContact O-N 3.15Å; I288-Q297 HydrophobicContact CG2-CG 4.29Å
289	R	78.2	Confident	86.2	Confident	141 Å²	141	72.9 Å²	72.9	53%	0.532	38%	0.381	S	S	.	.	H	α-helix	trans	-57.6	-32.3	176	-74.1	-170.6	172	-170.2	-8	114.4	F271 K287	F271-R289 VanDerWaalsContact CA-NH2 3.28Å; F271-R289 HydrophobicContact CD2-CG 3.69Å; F271-R289 HydrophobicContact CE2-CG 3.26Å; F271-R289 HydrophobicContact CZ-CG 4.04Å; F271-R289 PolarHBondContact O-NH2 2.91Å; K287-R289 PolarHBondContact O-N 3.04Å; K287-R289 VanDerWaalsContact O-N 3.13Å
290	S	82	Confident	86.3	Confident	97 Å²	97	75.3 Å²	75.3	68%	0.678	40%	0.395	S	S	*	.	H	α-helix	trans	-86.8	-10.7	-179.5	66	0	0	0	0	112.9	K287 I288	K287-S290 WeakPolarHBondContact CB-OG 3.27Å; K287-S290 PolarHBondContact O-N 3.5Å; K287-S290 PolarHBondContact O-OG 2.79Å; I288-S290 VanDerWaalsContact C-N 3.25Å; I288-S290 PolarHBondContact O-N 3.06Å
291	I	87.9	Confident	86.6	Confident	115 Å²	115	74.9 Å²	74.9	59%	0.59	39%	0.392	S	S	*	.	H	α-helix	trans	-106.3	-38.9	-174.5	-56.2	171.3	0	0	0	111.2	I286 I288	I286-I291 HydrophobicContact CG2-CD1 3.67Å; I288-I291 PolarHBondContact O-N 3.02Å; I288-I291 VanDerWaalsContact O-N 3.09Å
292	L	87.3	Confident	86.9	Confident	64 Å²	64	79.2 Å²	79.2	34%	0.335	41%	0.414	S	S	.	.	S	Bend	trans	-117.6	142.4	-173.1	-63.1	-179.2	0	0	0	112.1	I288 Q297 L300	I288-L292 HydrophobicContact CG2-CD1 4.16Å; I288-L292 PolarHBondContact O-N 3.15Å; L292-Q297 HydrophobicContact CB-CG 3.91Å; L292-Q297 PolarHBondContact O-NE2 3.14Å; L292-L300 HydrophobicContact CD1-CD2 4.13Å
293	T	88.9	Confident	87.4	Confident	86 Å²	86	78.2 Å²	78.2	53%	0.528	42%	0.415	S	S	.	.			trans	-69.7	157.8	171.7	62.7	0	0	0	0	111.7	D295 S296 Q297	T293-D295 VanDerWaalsContact C-N 3.27Å; T293-D295 PolarHBondContact O-N 3.05Å; T293-S296 PolarHBondContact O-N 3.02Å; T293-S296 WeakPolarHBondContact OG1-CB 3.37Å; T293-S296 PolarHBondContact OG1-N 3.39Å; T293-S296 PolarHBondContact OG1-OG 3.46Å; T293-Q297 WeakPolarHBondContact O-CB 3.49Å; T293-Q297 VanDerWaalsContact O-CG 3.31Å; T293-Q297 WeakPolarHBondContact O-CG 2.94Å; T293-Q297 PolarHBondContact O-N 3.26Å
294	S	85.4	Confident	87.8	Confident	75 Å²	75	81.5 Å²	81.5	52%	0.524	43%	0.428	S	S	.	.	H	α-helix	trans	-57.1	-38.7	178.5	-57.6	0	0	0	0	112.9	Q297 L298	S294-Q297 WeakPolarHBondContact O-CB 3.49Å; S294-Q297 PolarHBondContact O-N 3.3Å; S294-L298 PolarHBondContact O-N 3.25Å
295	D	87.3	Confident	88.5	Confident	106 Å²	106	79 Å²	79	57%	0.567	41%	0.413	S	S	*	.	H	α-helix	trans	-66.8	-44	177.2	-60	-34.7	0	0	0	111.5	T293 Q297 L298 Y299	T293-D295 VanDerWaalsContact C-N 3.27Å; T293-D295 PolarHBondContact O-N 3.05Å; D295-Q297 VanDerWaalsContact C-N 3.3Å; D295-Q297 PolarHBondContact O-N 2.92Å; D295-L298 WeakPolarHBondContact O-CB 3.49Å; D295-L298 PolarHBondContact O-N 3.27Å; D295-L298 VanDerWaalsContact O-N 3.15Å; D295-Y299 HydrophobicContact CB-CE2 4.14Å; D295-Y299 WeakPolarHBondContact O-CD2 3.23Å; D295-Y299 PolarHBondContact O-N 2.69Å
296	S	89.6	Confident	89	Confident	54 Å²	54	75.3 Å²	75.3	38%	0.378	39%	0.394	S	S	.	.	H	α-helix	trans	-62.5	-40.8	177.4	-56.7	0	0	0	0	111.3	T293 L298 Y299 L300	T293-S296 PolarHBondContact O-N 3.02Å; T293-S296 WeakPolarHBondContact OG1-CB 3.37Å; T293-S296 PolarHBondContact OG1-N 3.39Å; T293-S296 PolarHBondContact OG1-OG 3.46Å; S296-L298 VanDerWaalsContact C-N 3.35Å; S296-Y299 PolarHBondContact O-N 3.17Å; S296-L300 WeakPolarHBondContact O-CB 3.24Å; S296-L300 PolarHBondContact O-N 2.96Å
297	Q	88.8	Confident	89.6	Confident	11 Å²	11	76.8 Å²	76.8	5%	0.051	40%	0.402	C	S	.	.	H	α-helix	trans	-59.9	-42.8	174	-76	172.8	35	0	0	111.9	L270 I288 L292 T293 S294 D295 S301 Y341	L270-Q297 HydrophobicContact CD2-CB 3.88Å; L270-Q297 HydrophobicContact CD2-CG 3.94Å; I288-Q297 HydrophobicContact CG2-CG 4.29Å; L292-Q297 HydrophobicContact CB-CG 3.91Å; L292-Q297 PolarHBondContact O-NE2 3.14Å; T293-Q297 WeakPolarHBondContact O-CB 3.49Å; T293-Q297 VanDerWaalsContact O-CG 3.31Å; T293-Q297 WeakPolarHBondContact O-CG 2.94Å; T293-Q297 PolarHBondContact O-N 3.26Å; S294-Q297 WeakPolarHBondContact O-CB 3.49Å; S294-Q297 PolarHBondContact O-N 3.3Å; D295-Q297 VanDerWaalsContact C-N 3.3Å; D295-Q297 PolarHBondContact O-N 2.92Å; Q297-S301 VanDerWaalsContact O-CB 3.29Å; Q297-S301 WeakPolarHBondContact O-CB 3.49Å; Q297-S301 PolarHBondContact O-N 3.07Å; Q297-S301 PolarHBondContact O-OG 3.27Å; Q297-Y341 HydrophobicContact CB-CD2 4.41Å; Q297-Y341 HydrophobicContact CB-CE2 3.81Å
298	L	88.6	Confident	90.2	Very high	66 Å²	66	71.9 Å²	71.9	35%	0.346	38%	0.384	S	S	.	.	H	α-helix	trans	-63.2	-51.1	176.9	178.9	64.2	0	0	0	111.8	S294 D295 S296 L300 S301 L302 Y341	S294-L298 PolarHBondContact O-N 3.25Å; D295-L298 WeakPolarHBondContact O-CB 3.49Å; D295-L298 PolarHBondContact O-N 3.27Å; D295-L298 VanDerWaalsContact O-N 3.15Å; S296-L298 VanDerWaalsContact C-N 3.35Å; L298-L300 VanDerWaalsContact C-N 3.35Å; L298-L300 PolarHBondContact O-N 2.98Å; L298-S301 PolarHBondContact O-N 3.5Å; L298-L302 WeakPolarHBondContact O-CB 3.35Å; L298-L302 PolarHBondContact O-N 3.29Å; L298-Y341 HydrophobicContact CB-CD2 3.93Å; L298-Y341 HydrophobicContact CB-CE2 3.96Å; L298-Y341 HydrophobicContact CB-CG 4.46Å; L298-Y341 HydrophobicContact CD1-CD1 3.98Å; L298-Y341 HydrophobicContact CD1-CD2 4Å; L298-Y341 HydrophobicContact CD1-CG 3.66Å
299	Y	91.4	Very high	90.9	Very high	160 Å²	160	71 Å²	71	63%	0.627	38%	0.38	S	S	*	.	H	α-helix	trans	-63.8	-39.9	179.7	-65.9	-57.2	0	0	0	112.3	D295 S296 L302 A303	D295-Y299 HydrophobicContact CB-CE2 4.14Å; D295-Y299 WeakPolarHBondContact O-CD2 3.23Å; D295-Y299 PolarHBondContact O-N 2.69Å; S296-Y299 PolarHBondContact O-N 3.17Å; Y299-L302 PolarHBondContact O-N 2.78Å; Y299-A303 WeakPolarHBondContact O-CB 3.35Å; Y299-A303 PolarHBondContact O-N 2.81Å
300	L	92.9	Very high	91.8	Very high	62 Å²	62	67.6 Å²	67.6	33%	0.325	37%	0.372	S	S	.	.	H	α-helix	trans	-63.6	-45.2	175.9	-169.3	68.6	0	0	0	111	W279 L292 S296 L298 L302 A303 F304	W279-L300 HydrophobicContact CH2-CD2 3.99Å; W279-L300 HydrophobicContact CH2-CG 3.99Å; W279-L300 HydrophobicContact CZ3-CD2 3.9Å; W279-L300 HydrophobicContact CZ3-CG 4.42Å; L292-L300 HydrophobicContact CD1-CD2 4.13Å; S296-L300 WeakPolarHBondContact O-CB 3.24Å; S296-L300 PolarHBondContact O-N 2.96Å; L298-L300 VanDerWaalsContact C-N 3.35Å; L298-L300 PolarHBondContact O-N 2.98Å; L300-L302 PolarHBondContact O-N 2.84Å; L300-A303 PolarHBondContact O-N 2.86Å; L300-F304 HydrophobicContact CD1-CD2 3.83Å; L300-F304 HydrophobicContact CD1-CE2 3.51Å; L300-F304 HydrophobicContact CG-CD2 3.91Å; L300-F304 HydrophobicContact CG-CE2 3.93Å; L300-F304 VanDerWaalsContact O-CD2 3.31Å; L300-F304 WeakPolarHBondContact O-CD2 3.39Å; L300-F304 PolarHBondContact O-N 2.93Å
301	S	92.8	Very high	92.4	Very high	1 Å²	1	65.7 Å²	65.7	1%	0.007	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-43.9	178	-58.1	0	0	0	0	112	W279 Q297 L298 F304 T305 F339	W279-S301 PolarHBondContact NE1-OG 3.28Å; Q297-S301 VanDerWaalsContact O-CB 3.29Å; Q297-S301 WeakPolarHBondContact O-CB 3.49Å; Q297-S301 PolarHBondContact O-N 3.07Å; Q297-S301 PolarHBondContact O-OG 3.27Å; L298-S301 PolarHBondContact O-N 3.5Å; S301-F304 PolarHBondContact O-N 3.14Å; S301-T305 VanDerWaalsContact O-CB 3.3Å; S301-T305 WeakPolarHBondContact O-CB 3.29Å; S301-T305 PolarHBondContact O-N 2.79Å; S301-T305 PolarHBondContact O-OG1 2.99Å; S301-F339 WeakPolarHBondContact CA-O 3.38Å; S301-F339 WeakPolarHBondContact CB-O 3.41Å
302	L	93.1	Very high	92.9	Very high	98 Å²	98	60.3 Å²	60.3	51%	0.513	33%	0.33	S	S	.	.	H	α-helix	trans	-59.7	-48.6	174.6	179	63.6	0	0	0	111.3	L298 Y299 L300 T305 L306	L298-L302 WeakPolarHBondContact O-CB 3.35Å; L298-L302 PolarHBondContact O-N 3.29Å; Y299-L302 PolarHBondContact O-N 2.78Å; L300-L302 PolarHBondContact O-N 2.84Å; L302-T305 PolarHBondContact O-N 2.94Å; L302-L306 HydrophobicContact CD1-CD1 3.98Å; L302-L306 HydrophobicContact CD1-CG 4.22Å; L302-L306 HydrophobicContact CG-CD1 4.1Å; L302-L306 WeakPolarHBondContact O-CG 3.41Å; L302-L306 PolarHBondContact O-N 3.32Å
303	A	96.1	Very high	93.3	Very high	43 Å²	43	57.3 Å²	57.3	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-49.1	179.7	0	0	0	0	0	111.7	Y299 L300 T305 L306 L307	Y299-A303 WeakPolarHBondContact O-CB 3.35Å; Y299-A303 PolarHBondContact O-N 2.81Å; L300-A303 PolarHBondContact O-N 2.86Å; A303-T305 PolarHBondContact O-N 3.26Å; A303-L306 PolarHBondContact O-N 3.02Å; A303-L307 WeakPolarHBondContact O-CB 3.27Å; A303-L307 WeakPolarHBondContact O-CG 3.32Å; A303-L307 PolarHBondContact O-N 2.99Å
304	F	96.1	Very high	93.7	Very high	96 Å²	96	57.5 Å²	57.5	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-42.3	178.4	-89.8	-105.7	0	0	0	112.3	W279 L300 S301 L306 L307 A308 F339	W279-F304 HydrophobicContact CH2-CB 4.41Å; W279-F304 HydrophobicContact CH2-CD2 4.21Å; W279-F304 HydrophobicContact CH2-CG 4.15Å; W279-F304 HydrophobicContact CZ2-CB 4.17Å; W279-F304 HydrophobicContact CZ2-CG 4.39Å; L300-F304 HydrophobicContact CD1-CD2 3.83Å; L300-F304 HydrophobicContact CD1-CE2 3.51Å; L300-F304 HydrophobicContact CG-CD2 3.91Å; L300-F304 HydrophobicContact CG-CE2 3.93Å; L300-F304 VanDerWaalsContact O-CD2 3.31Å; L300-F304 WeakPolarHBondContact O-CD2 3.39Å; L300-F304 PolarHBondContact O-N 2.93Å; S301-F304 PolarHBondContact O-N 3.14Å; F304-L306 PolarHBondContact O-N 3.22Å; F304-L307 PolarHBondContact O-N 3.39Å; F304-A308 VanDerWaalsContact O-CB 3.24Å; F304-A308 WeakPolarHBondContact O-CB 3.37Å; F304-A308 PolarHBondContact O-N 3.36Å; F304-F339 HydrophobicContact CB-CB 4.06Å; F304-F339 HydrophobicContact CB-CD1 4.35Å; F304-F339 HydrophobicContact CB-CG 4.32Å; F304-F339 HydrophobicContact CD1-CD1 4.33Å
305	T	96.6	Very high	94.2	Very high	4 Å²	4	56.4 Å²	56.4	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-60	-47.6	177.1	-58.6	0	0	0	0	111.3	S301 L302 A303 A308 A309 F336 F339 S340	S301-T305 VanDerWaalsContact O-CB 3.3Å; S301-T305 WeakPolarHBondContact O-CB 3.29Å; S301-T305 PolarHBondContact O-N 2.79Å; S301-T305 PolarHBondContact O-OG1 2.99Å; L302-T305 PolarHBondContact O-N 2.94Å; A303-T305 PolarHBondContact O-N 3.26Å; T305-A308 PolarHBondContact O-N 3.12Å; T305-A309 WeakPolarHBondContact O-CB 3.29Å; T305-A309 PolarHBondContact O-N 3.2Å; T305-F336 HydrophobicContact CG2-CB 4.45Å; T305-F336 HydrophobicContact CG2-CD1 3.46Å; T305-F336 VanDerWaalsContact CG2-CD1 3.46Å; T305-F336 HydrophobicContact CG2-CD2 4.45Å; T305-F336 HydrophobicContact CG2-CE1 3.68Å; T305-F336 HydrophobicContact CG2-CG 3.87Å; T305-F336 HydrophobicContact CG2-CZ 4.26Å; T305-F339 PolarHBondContact OG1-O 3.1Å; T305-S340 WeakPolarHBondContact OG1-CA 3.33Å; T305-S340 PolarHBondContact OG1-N 3.45Å
306	L	95.9	Very high	94.7	Very high	66 Å²	66	51.3 Å²	51.3	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-67.3	-44	179.2	-68.5	176.7	0	0	0	111.8	L302 A303 F304 A308 A309 L310	L302-L306 HydrophobicContact CD1-CD1 3.98Å; L302-L306 HydrophobicContact CD1-CG 4.22Å; L302-L306 HydrophobicContact CG-CD1 4.1Å; L302-L306 WeakPolarHBondContact O-CG 3.41Å; L302-L306 PolarHBondContact O-N 3.32Å; A303-L306 PolarHBondContact O-N 3.02Å; F304-L306 PolarHBondContact O-N 3.22Å; L306-A308 PolarHBondContact O-N 3.08Å; L306-A309 PolarHBondContact O-N 3.5Å; L306-L310 HydrophobicContact CB-CD1 4.16Å; L306-L310 WeakPolarHBondContact O-CB 3.45Å; L306-L310 WeakPolarHBondContact O-CG 3.31Å; L306-L310 PolarHBondContact O-N 3.47Å
307	L	96.6	Very high	95.1	Very high	126 Å²	126	51.1 Å²	51.1	66%	0.66	26%	0.262	S	S	*	.	H	α-helix	trans	-61.2	-34.6	177	-73	171.5	0	0	0	112.2	A303 F304 P311	A303-L307 WeakPolarHBondContact O-CB 3.27Å; A303-L307 WeakPolarHBondContact O-CG 3.32Å; A303-L307 PolarHBondContact O-N 2.99Å; F304-L307 PolarHBondContact O-N 3.39Å; L307-P311 WeakPolarHBondContact O-CD 3.28Å; L307-P311 WeakPolarHBondContact O-CG 3.31Å
308	A	96.8	Very high	95.5	Very high	20 Å²	20	56.8 Å²	56.8	17%	0.165	29%	0.29	C	S	.	.	H	α-helix	trans	-76.1	-39.4	176.4	0	0	0	0	0	113	F304 T305 L306 A335 F339 F484	F304-A308 VanDerWaalsContact O-CB 3.24Å; F304-A308 WeakPolarHBondContact O-CB 3.37Å; F304-A308 PolarHBondContact O-N 3.36Å; T305-A308 PolarHBondContact O-N 3.12Å; L306-A308 PolarHBondContact O-N 3.08Å; A308-A335 HydrophobicContact CB-CB 3.67Å; A308-F339 HydrophobicContact CB-CD2 3.62Å; A308-F339 HydrophobicContact CB-CE2 3.69Å; A308-F484 HydrophobicContact CB-CZ 3.87Å
309	A	97.1	Very high	95.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-85.4	-32.9	-174.8	0	0	0	0	0	114.5	L208 T305 L306 S313 A335 F336	L208-A309 HydrophobicContact CD1-CB 4.18Å; T305-A309 WeakPolarHBondContact O-CB 3.29Å; T305-A309 PolarHBondContact O-N 3.2Å; L306-A309 PolarHBondContact O-N 3.5Å; A309-S313 PolarHBondContact O-N 2.84Å; A309-S313 PolarHBondContact O-OG 3.44Å; A309-A335 HydrophobicContact CB-CB 3.92Å; A309-F336 HydrophobicContact CB-CE2 4.47Å
310	L	96.1	Very high	96	Very high	70 Å²	70	50.6 Å²	50.6	37%	0.366	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-43.6	-173.3	-77.2	172.2	0	0	0	114.3	L306 S312 S313 I314	L306-L310 HydrophobicContact CB-CD1 4.16Å; L306-L310 WeakPolarHBondContact O-CB 3.45Å; L306-L310 WeakPolarHBondContact O-CG 3.31Å; L306-L310 PolarHBondContact O-N 3.47Å; L310-S312 VanDerWaalsContact C-N 3.28Å; L310-S312 PolarHBondContact O-N 2.94Å; L310-S313 PolarHBondContact O-N 2.78Å; L310-S313 VanDerWaalsContact O-N 3.07Å; L310-I314 HydrophobicContact CB-CD1 4.35Å; L310-I314 WeakPolarHBondContact O-CB 3.36Å; L310-I314 VanDerWaalsContact O-CG1 3.28Å; L310-I314 WeakPolarHBondContact O-CG1 3.11Å; L310-I314 PolarHBondContact O-N 2.85Å
311	P	96.3	Very high	96.2	Very high	57 Å²	57	50.5 Å²	50.5	37%	0.37	27%	0.268	S	S	.	.	H	α-helix	trans	-56.3	-44.5	-178.1	-26.9	35.6	0	0	0	112.3	L307 R315 F492	L307-P311 WeakPolarHBondContact O-CD 3.28Å; L307-P311 WeakPolarHBondContact O-CG 3.31Å; P311-R315 WeakPolarHBondContact O-CB 3.16Å; P311-R315 PolarHBondContact O-N 3.26Å; P311-F492 HydrophobicContact CB-CE2 4.23Å; P311-F492 HydrophobicContact CB-CZ 3.66Å; P311-F492 WeakPolarHBondContact O-CZ 3.35Å
312	S	96.6	Very high	96.3	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.014	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-43.7	176.7	-179.8	0	0	0	0	112.1	L310 R315 L316 A328 Q491	L310-S312 VanDerWaalsContact C-N 3.28Å; L310-S312 PolarHBondContact O-N 2.94Å; S312-R315 PolarHBondContact O-N 2.72Å; S312-L316 PolarHBondContact O-N 3.44Å; S312-A328 VanDerWaalsContact OG-CA 3.27Å; S312-A328 WeakPolarHBondContact OG-CA 3.38Å; S312-A328 WeakPolarHBondContact OG-CB 3.43Å; S312-Q491 PolarHBondContact O-NE2 3.01Å; S312-Q491 VanDerWaalsContact O-NE2 3.15Å; S312-Q491 VanDerWaalsContact OG-CD 3.26Å; S312-Q491 PolarHBondContact OG-NE2 2.95Å; S312-Q491 VanDerWaalsContact OG-NE2 3.16Å; S312-Q491 PolarHBondContact OG-OE1 3.02Å
313	S	97.4	Very high	96.4	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-69.2	-39.4	-178.8	-57.8	0	0	0	0	112.2	C212 A309 L310 L316 L317	C212-S313 WeakPolarHBondContact CB-O 3.43Å; A309-S313 PolarHBondContact O-N 2.84Å; A309-S313 PolarHBondContact O-OG 3.44Å; L310-S313 PolarHBondContact O-N 2.78Å; L310-S313 VanDerWaalsContact O-N 3.07Å; S313-L316 WeakPolarHBondContact O-CB 3.34Å; S313-L316 PolarHBondContact O-N 3.45Å; S313-L317 PolarHBondContact O-N 2.99Å
314	I	97.3	Very high	96.4	Very high	89 Å²	89	49.1 Å²	49.1	46%	0.456	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-44.1	174.5	-67.5	165.8	0	0	0	110.3	L310 L316 L317 M318	L310-I314 HydrophobicContact CB-CD1 4.35Å; L310-I314 WeakPolarHBondContact O-CB 3.36Å; L310-I314 VanDerWaalsContact O-CG1 3.28Å; L310-I314 WeakPolarHBondContact O-CG1 3.11Å; L310-I314 PolarHBondContact O-N 2.85Å; I314-L316 VanDerWaalsContact C-N 3.27Å; I314-L316 PolarHBondContact O-N 2.87Å; I314-L317 WeakPolarHBondContact O-CB 3.17Å; I314-L317 PolarHBondContact O-N 2.91Å; I314-M318 HydrophobicContact CG2-SD 4.23Å; I314-M318 WeakPolarHBondContact O-CG 3.49Å; I314-M318 PolarHBondContact O-N 3.19Å
315	R	95.7	Very high	96.5	Very high	52 Å²	52	44.6 Å²	44.6	20%	0.196	23%	0.229	C	C	.	.	H	α-helix	trans	-58.4	-41.8	175.4	-179.9	59.9	169.6	-163	-6.9	111.4	P311 S312 K319 Q491 F492	P311-R315 WeakPolarHBondContact O-CB 3.16Å; P311-R315 PolarHBondContact O-N 3.26Å; S312-R315 PolarHBondContact O-N 2.72Å; R315-K319 PolarHBondContact O-N 3.36Å; R315-Q491 HydrophobicContact CG-CG 4.35Å; R315-F492 HydrophobicContact CB-CE1 4.1Å; R315-F492 HydrophobicContact CB-CZ 4.46Å; R315-F492 HydrophobicContact CG-CE1 4.39Å
316	L	97.6	Very high	96.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-44	175.3	178.5	64.1	0	0	0	112.3	P209 C212 F213 S312 S313 I314 M318 K319 P320 N324 F325 A328	P209-L316 HydrophobicContact CB-CD2 4.21Å; P209-L316 WeakPolarHBondContact O-CD2 3.2Å; C212-L316 HydrophobicContact CB-CB 4.48Å; C212-L316 HydrophobicContact CB-CD2 4.15Å; C212-L316 HydrophobicContact CB-CG 4.35Å; F213-L316 HydrophobicContact CB-CD1 4.39Å; F213-L316 HydrophobicContact CB-CD2 4.02Å; F213-L316 HydrophobicContact CB-CG 4.28Å; F213-L316 HydrophobicContact CD2-CD1 3.95Å; S312-L316 PolarHBondContact O-N 3.44Å; S313-L316 WeakPolarHBondContact O-CB 3.34Å; S313-L316 PolarHBondContact O-N 3.45Å; I314-L316 VanDerWaalsContact C-N 3.27Å; I314-L316 PolarHBondContact O-N 2.87Å; L316-M318 VanDerWaalsContact C-N 3.3Å; L316-M318 PolarHBondContact O-N 2.9Å; L316-K319 CarbonylContact O-C 3.56Å; L316-K319 PolarHBondContact O-N 2.92Å; L316-P320 VanDerWaalsContact O-CA 3.23Å; L316-P320 WeakPolarHBondContact O-CA 3.35Å; L316-P320 WeakPolarHBondContact O-CD 3.33Å; L316-N324 HydrophobicContact CD1-CB 3.81Å; L316-F325 HydrophobicContact CD1-CB 3.98Å; L316-F325 HydrophobicContact CD2-CD2 4.02Å; L316-A328 HydrophobicContact CB-CB 4.23Å; L316-A328 HydrophobicContact CD2-CB 3.67Å; L316-A328 HydrophobicContact CG-CB 4.46Å
317	L	97.7	Very high	96.6	Very high	49 Å²	49	41.6 Å²	41.6	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-57.5	-43.7	177.3	-177.5	66.5	0	0	0	111.6	C212 L215 G216 I219 S313 I314	C212-L317 HydrophobicContact CB-CB 4.11Å; L215-L317 HydrophobicContact CB-CD1 3.96Å; L215-L317 HydrophobicContact CD2-CD1 3.91Å; L215-L317 HydrophobicContact CG-CD1 3.85Å; G216-L317 WeakPolarHBondContact CA-O 3.44Å; I219-L317 HydrophobicContact CD1-CD1 4Å; S313-L317 PolarHBondContact O-N 2.99Å; I314-L317 WeakPolarHBondContact O-CB 3.17Å; I314-L317 PolarHBondContact O-N 2.91Å
318	M	96.1	Very high	96.7	Very high	130 Å²	130	35.6 Å²	35.6	64%	0.64	18%	0.181	S	C	*	.	H	α-helix	trans	-72.2	-38.1	178	-63.1	175.5	77.9	0	0	112.6	K220 I314 L316	K220-M318 VanDerWaalsContact CE-O 3.26Å; K220-M318 WeakPolarHBondContact CE-O 3.25Å; I314-M318 HydrophobicContact CG2-SD 4.23Å; I314-M318 WeakPolarHBondContact O-CG 3.49Å; I314-M318 PolarHBondContact O-N 3.19Å; L316-M318 VanDerWaalsContact C-N 3.3Å; L316-M318 PolarHBondContact O-N 2.9Å
319	K	95.6	Very high	96.8	Very high	80 Å²	80	34.8 Å²	34.8	35%	0.348	17%	0.174	S	C	.	.	S	Bend	trans	-127.7	75.6	-178.4	-65.5	-173.4	-178.5	-175.5	0	110.4	R315 L316 T321 N324 E494	R315-K319 PolarHBondContact O-N 3.36Å; L316-K319 CarbonylContact O-C 3.56Å; L316-K319 PolarHBondContact O-N 2.92Å; K319-T321 PolarHBondContact O-N 2.9Å; K319-N324 WeakPolarHBondContact CB-ND2 3.48Å; K319-N324 PolarHBondContact O-ND2 3.42Å; K319-E494 IonicContact NZ-OE1 2.9Å
320	P	96.3	Very high	96.8	Very high	16 Å²	16	34.8 Å²	34.8	10%	0.104	17%	0.174	C	C	.	.			trans	-75	66.6	-178.5	33.7	-42.4	0	0	0	111.7	F213 K217 K220 L316	F213-P320 HydrophobicContact CD2-CB 3.95Å; F213-P320 HydrophobicContact CE2-CB 4.29Å; K217-P320 HydrophobicContact CG-CB 4.06Å; K217-P320 HydrophobicContact CG-CG 4.32Å; K220-P320 HydrophobicContact CD-CG 3.7Å; K220-P320 VanDerWaalsContact CE-CD 3.5Å; K220-P320 HydrophobicContact CG-CG 4.27Å; L316-P320 VanDerWaalsContact O-CA 3.23Å; L316-P320 WeakPolarHBondContact O-CA 3.35Å; L316-P320 WeakPolarHBondContact O-CD 3.33Å
321	T	96.1	Very high	96.9	Very high	61 Å²	61	31.5 Å²	31.5	37%	0.374	16%	0.157	S	C	.	.			trans	-94.6	152.7	170.5	65.3	0	0	0	0	109.4	K319 W323 N324 F325	K319-T321 PolarHBondContact O-N 2.9Å; T321-W323 PolarHBondContact O-N 3.18Å; T321-N324 PolarHBondContact O-N 2.95Å; T321-N324 WeakPolarHBondContact OG1-CB 3.39Å; T321-N324 PolarHBondContact OG1-N 3.46Å; T321-N324 PolarHBondContact OG1-ND2 3.24Å; T321-F325 PolarHBondContact O-N 2.95Å
322	F	95.9	Very high	97	Very high	48 Å²	48	28.8 Å²	28.8	21%	0.211	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-33.6	178.4	-166.8	-116.2	0	0	0	112.2	Y131 L135 V178 G182 F325 K326	Y131-F322 HydrophobicContact CE2-CE1 4.45Å; Y131-F322 HydrophobicContact CE2-CZ 4.14Å; L135-F322 HydrophobicContact CB-CE1 4.46Å; L135-F322 HydrophobicContact CD1-CE1 4.17Å; L135-F322 HydrophobicContact CD1-CE2 4.49Å; L135-F322 HydrophobicContact CD1-CZ 3.74Å; V178-F322 HydrophobicContact CG1-CE2 3.91Å; V178-F322 HydrophobicContact CG1-CZ 3.83Å; G182-F322 VanDerWaalsContact CA-CE2 3.47Å; F322-F325 HydrophobicContact CD2-CD1 4.01Å; F322-F325 AromaticContact CE2-CD1 3.99Å; F322-F325 HydrophobicContact CE2-CD1 3.99Å; F322-F325 HydrophobicContact CE2-CE1 4.5Å; F322-F325 WeakPolarHBondContact O-CB 3.21Å; F322-F325 PolarHBondContact O-N 3.49Å; F322-K326 HydrophobicContact CE1-CD 4.08Å; F322-K326 HydrophobicContact CE1-CG 4.28Å; F322-K326 HydrophobicContact CZ-CG 4.48Å; F322-K326 WeakPolarHBondContact O-CG 3.35Å; F322-K326 PolarHBondContact O-N 3.29Å
323	W	94.8	Very high	97.1	Very high	54 Å²	54	28.7 Å²	28.7	21%	0.205	14%	0.138	C	C	.	.	H	α-helix	trans	-58.7	-52.5	172.2	179.2	-107.9	0	0	0	112.8	T321 F325 K326 L327 L358 E361 F362 V490	T321-W323 PolarHBondContact O-N 3.18Å; W323-F325 PolarHBondContact O-N 2.97Å; W323-K326 PolarHBondContact O-N 3.02Å; W323-L327 HydrophobicContact CD2-CD1 4.43Å; W323-L327 HydrophobicContact CZ2-CD1 4.08Å; W323-L327 HydrophobicContact CZ2-CD2 4.48Å; W323-L327 HydrophobicContact CZ2-CG 4.49Å; W323-L327 PolarHBondContact O-N 3.21Å; W323-L327 VanDerWaalsContact O-N 3.17Å; W323-L358 HydrophobicContact CH2-CD2 4.35Å; W323-L358 HydrophobicContact CZ3-CD2 3.99Å; W323-E361 HydrophobicContact CH2-CB 3.89Å; W323-E361 HydrophobicContact CH2-CG 3.96Å; W323-E361 HydrophobicContact CZ3-CB 3.98Å; W323-E361 HydrophobicContact CZ3-CG 3.58Å; W323-F362 HydrophobicContact CH2-CD2 4.35Å; W323-F362 AromaticContact CH2-CE2 3.53Å; W323-F362 HydrophobicContact CH2-CE2 3.53Å; W323-F362 HydrophobicContact CH2-CZ 4.19Å; W323-F362 AromaticContact CZ2-CE2 3.88Å; W323-F362 HydrophobicContact CZ2-CE2 3.88Å; W323-F362 HydrophobicContact CZ2-CZ 4.27Å; W323-V490 HydrophobicContact CZ2-CG1 4.19Å
324	N	96.3	Very high	97.1	Very high	11 Å²	11	28.6 Å²	28.6	6%	0.059	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-29.5	178	-73	-20.7	0	0	0	111.6	L316 K319 T321 A328	L316-N324 HydrophobicContact CD1-CB 3.81Å; K319-N324 WeakPolarHBondContact CB-ND2 3.48Å; K319-N324 PolarHBondContact O-ND2 3.42Å; T321-N324 PolarHBondContact O-N 2.95Å; T321-N324 WeakPolarHBondContact OG1-CB 3.39Å; T321-N324 PolarHBondContact OG1-N 3.46Å; T321-N324 PolarHBondContact OG1-ND2 3.24Å; N324-A328 WeakPolarHBondContact O-CB 3.08Å; N324-A328 PolarHBondContact O-N 3.46Å
325	F	98.3	Very high	97.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66.1	-47.9	176.6	-178.6	-133.4	0	0	0	111.4	V178 L181 P209 F210 F213 L316 T321 F322 W323 L327 A328 L329	V178-F325 HydrophobicContact CB-CE1 4.38Å; V178-F325 HydrophobicContact CG1-CE1 4.16Å; V178-F325 HydrophobicContact CG2-CE1 4.04Å; V178-F325 HydrophobicContact CG2-CZ 4.28Å; L181-F325 HydrophobicContact CB-CE1 4.38Å; L181-F325 HydrophobicContact CD1-CE1 3.93Å; L181-F325 HydrophobicContact CD1-CZ 3.8Å; P209-F325 HydrophobicContact CB-CD2 4.23Å; P209-F325 HydrophobicContact CB-CE2 4.01Å; F210-F325 HydrophobicContact CD1-CZ 4.15Å; F210-F325 HydrophobicContact CD2-CE2 4.08Å; F210-F325 AromaticContact CD2-CZ 3.87Å; F210-F325 HydrophobicContact CD2-CZ 3.87Å; F210-F325 HydrophobicContact CE1-CZ 4.08Å; F210-F325 HydrophobicContact CE2-CE2 4.41Å; F210-F325 AromaticContact CE2-CZ 3.81Å; F210-F325 HydrophobicContact CE2-CZ 3.81Å; F210-F325 HydrophobicContact CG-CE2 4.27Å; F210-F325 HydrophobicContact CG-CZ 4.06Å; F210-F325 AromaticContact CZ-CZ 3.93Å; F210-F325 HydrophobicContact CZ-CZ 3.93Å; F213-F325 HydrophobicContact CB-CD2 3.77Å; F213-F325 HydrophobicContact CB-CE2 4.09Å; F213-F325 HydrophobicContact CB-CG 4.3Å; F213-F325 HydrophobicContact CD2-CB 3.76Å; F213-F325 HydrophobicContact CD2-CD2 4.3Å; F213-F325 AromaticContact CD2-CG 3.99Å; F213-F325 HydrophobicContact CD2-CG 3.99Å; F213-F325 HydrophobicContact CE2-CB 4.01Å; F213-F325 HydrophobicContact CE2-CG 4.39Å; F213-F325 HydrophobicContact CG-CB 4.3Å; F213-F325 HydrophobicContact CG-CD1 4.5Å; F213-F325 HydrophobicContact CG-CD2 4Å; F213-F325 HydrophobicContact CG-CE2 4.46Å; F213-F325 HydrophobicContact CG-CG 4.02Å; L316-F325 HydrophobicContact CD1-CB 3.98Å; L316-F325 HydrophobicContact CD2-CD2 4.02Å; T321-F325 PolarHBondContact O-N 2.95Å; F322-F325 HydrophobicContact CD2-CD1 4.01Å; F322-F325 AromaticContact CE2-CD1 3.99Å; F322-F325 HydrophobicContact CE2-CD1 3.99Å; F322-F325 HydrophobicContact CE2-CE1 4.5Å; F322-F325 WeakPolarHBondContact O-CB 3.21Å; F322-F325 PolarHBondContact O-N 3.49Å; W323-F325 PolarHBondContact O-N 2.97Å; F325-L327 PolarHBondContact O-N 3.33Å; F325-A328 PolarHBondContact O-N 3.05Å; F325-L329 HydrophobicContact CD1-CD1 4.33Å; F325-L329 HydrophobicContact CD2-CD1 4.3Å; F325-L329 HydrophobicContact CD2-CG 4.24Å; F325-L329 HydrophobicContact CE1-CD1 4.03Å; F325-L329 HydrophobicContact CE2-CD1 3.99Å; F325-L329 HydrophobicContact CE2-CD2 4.05Å; F325-L329 HydrophobicContact CE2-CG 3.96Å; F325-L329 HydrophobicContact CG-CD1 4.46Å; F325-L329 HydrophobicContact CZ-CD1 3.86Å; F325-L329 HydrophobicContact CZ-CD2 4.32Å; F325-L329 HydrophobicContact CZ-CG 4.3Å; F325-L329 WeakPolarHBondContact O-CG 3.3Å; F325-L329 PolarHBondContact O-N 3.05Å
326	K	97.4	Very high	97.2	Very high	8 Å²	8	23.7 Å²	23.7	4%	0.035	12%	0.115	C	C	.	.	H	α-helix	trans	-57.3	-47	174.7	-65.7	-164.4	-63.7	173.7	0	112.1	Y131 F322 W323 L329 V330 L357 L358 E361	Y131-K326 WeakPolarHBondContact OH-CD 3.43Å; F322-K326 HydrophobicContact CE1-CD 4.08Å; F322-K326 HydrophobicContact CE1-CG 4.28Å; F322-K326 HydrophobicContact CZ-CG 4.48Å; F322-K326 WeakPolarHBondContact O-CG 3.35Å; F322-K326 PolarHBondContact O-N 3.29Å; W323-K326 PolarHBondContact O-N 3.02Å; K326-L329 PolarHBondContact O-N 2.88Å; K326-V330 PolarHBondContact O-N 3.44Å; K326-L357 HydrophobicContact CD-CB 3.91Å; K326-L357 HydrophobicContact CG-CB 4.45Å; K326-L357 PolarHBondContact NZ-O 2.95Å; K326-L358 HydrophobicContact CB-CD2 3.82Å; K326-L358 HydrophobicContact CD-CD2 4.19Å; K326-E361 VanDerWaalsContact NZ-CD 3.31Å; K326-E361 IonicContact NZ-OE1 3.21Å; K326-E361 PolarHBondContact NZ-OE1 3.41Å; K326-E361 IonicContact NZ-OE2 3.19Å; K326-E361 PolarHBondContact NZ-OE2 2.65Å
327	L	97.2	Very high	97.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-40.1	178.3	-67.2	176.4	0	0	0	112.5	W323 F325 L329 V330 N331 L358 F487 V490 Q491	W323-L327 HydrophobicContact CD2-CD1 4.43Å; W323-L327 HydrophobicContact CZ2-CD1 4.08Å; W323-L327 HydrophobicContact CZ2-CD2 4.48Å; W323-L327 HydrophobicContact CZ2-CG 4.49Å; W323-L327 PolarHBondContact O-N 3.21Å; W323-L327 VanDerWaalsContact O-N 3.17Å; F325-L327 PolarHBondContact O-N 3.33Å; L327-L329 VanDerWaalsContact C-N 3.34Å; L327-V330 PolarHBondContact O-N 2.79Å; L327-N331 WeakPolarHBondContact O-CB 3.5Å; L327-N331 VanDerWaalsContact O-CG 3.3Å; L327-N331 PolarHBondContact O-N 3Å; L327-N331 PolarHBondContact O-ND2 3.28Å; L327-L358 HydrophobicContact CD2-CD1 3.82Å; L327-L358 HydrophobicContact CD2-CD2 4.39Å; L327-F487 HydrophobicContact CD2-CD1 3.72Å; L327-F487 HydrophobicContact CD2-CE1 4.43Å; L327-F487 HydrophobicContact CD2-CG 4.49Å; L327-V490 HydrophobicContact CD1-CG1 4.01Å; L327-V490 HydrophobicContact CD2-CG1 4.12Å; L327-Q491 HydrophobicContact CB-CB 4.17Å; L327-Q491 HydrophobicContact CB-CG 4.03Å; L327-Q491 HydrophobicContact CD1-CB 3.83Å; L327-Q491 HydrophobicContact CD1-CG 4.02Å
328	A	98.2	Very high	97.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.2	-34.8	177.5	0	0	0	0	0	112.9	P209 S312 L316 N324 F325 V330 N331 S332	P209-A328 HydrophobicContact CB-CB 4.17Å; P209-A328 HydrophobicContact CG-CB 4.25Å; P209-A328 VanDerWaalsContact CG-O 3.31Å; P209-A328 WeakPolarHBondContact CG-O 3.41Å; S312-A328 VanDerWaalsContact OG-CA 3.27Å; S312-A328 WeakPolarHBondContact OG-CA 3.38Å; S312-A328 WeakPolarHBondContact OG-CB 3.43Å; L316-A328 HydrophobicContact CB-CB 4.23Å; L316-A328 HydrophobicContact CD2-CB 3.67Å; L316-A328 HydrophobicContact CG-CB 4.46Å; N324-A328 WeakPolarHBondContact O-CB 3.08Å; N324-A328 PolarHBondContact O-N 3.46Å; F325-A328 PolarHBondContact O-N 3.05Å; A328-V330 VanDerWaalsContact C-N 3.34Å; A328-N331 PolarHBondContact O-N 2.94Å; A328-S332 WeakPolarHBondContact O-CB 3.34Å; A328-S332 PolarHBondContact O-N 2.88Å
329	L	98.6	Very high	97.1	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-60.6	-44.9	172.4	-70.5	165	0	0	0	111.2	V178 H206 P209 F210 F325 K326 L327 S333 P354	V178-L329 HydrophobicContact CG2-CD1 3.78Å; H206-L329 HydrophobicContact CB-CD2 3.84Å; P209-L329 HydrophobicContact CB-CD2 3.67Å; P209-L329 HydrophobicContact CB-CG 3.98Å; P209-L329 HydrophobicContact CG-CD2 4.11Å; P209-L329 HydrophobicContact CG-CG 4.5Å; F210-L329 HydrophobicContact CD2-CD2 3.92Å; F210-L329 HydrophobicContact CE2-CD2 3.83Å; F325-L329 HydrophobicContact CD1-CD1 4.33Å; F325-L329 HydrophobicContact CD2-CD1 4.3Å; F325-L329 HydrophobicContact CD2-CG 4.24Å; F325-L329 HydrophobicContact CE1-CD1 4.03Å; F325-L329 HydrophobicContact CE2-CD1 3.99Å; F325-L329 HydrophobicContact CE2-CD2 4.05Å; F325-L329 HydrophobicContact CE2-CG 3.96Å; F325-L329 HydrophobicContact CG-CD1 4.46Å; F325-L329 HydrophobicContact CZ-CD1 3.86Å; F325-L329 HydrophobicContact CZ-CD2 4.32Å; F325-L329 HydrophobicContact CZ-CG 4.3Å; F325-L329 WeakPolarHBondContact O-CG 3.3Å; F325-L329 PolarHBondContact O-N 3.05Å; K326-L329 PolarHBondContact O-N 2.88Å; L327-L329 VanDerWaalsContact C-N 3.34Å; L329-S333 VanDerWaalsContact O-CB 3.3Å; L329-S333 WeakPolarHBondContact O-CB 3.21Å; L329-S333 PolarHBondContact O-N 3.37Å; L329-S333 PolarHBondContact O-OG 3.23Å; L329-P354 HydrophobicContact CB-CB 3.49Å; L329-P354 VanDerWaalsContact CB-CB 3.49Å; L329-P354 HydrophobicContact CB-CG 4.16Å
330	V	98.3	Very high	96.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.8	-51.7	175.3	176.3	0	0	0	0	111.3	K326 L327 A328 S332 S333 L334 P354 V355 L358 F487	K326-V330 PolarHBondContact O-N 3.44Å; L327-V330 PolarHBondContact O-N 2.79Å; A328-V330 VanDerWaalsContact C-N 3.34Å; V330-S332 PolarHBondContact O-N 3.01Å; V330-S333 PolarHBondContact O-N 3.47Å; V330-S333 PolarHBondContact O-OG 3.18Å; V330-S333 VanDerWaalsContact O-OG 3.08Å; V330-L334 HydrophobicContact CG1-CD1 3.71Å; V330-L334 HydrophobicContact CG1-CG 4.44Å; V330-L334 WeakPolarHBondContact O-CB 3.22Å; V330-L334 WeakPolarHBondContact O-CG 3.38Å; V330-L334 PolarHBondContact O-N 3.32Å; V330-P354 HydrophobicContact CG2-CB 3.73Å; V330-P354 HydrophobicContact CG2-CG 4.13Å; V330-V355 HydrophobicContact CG1-CG2 3.87Å; V330-V355 HydrophobicContact CG2-CG2 3.92Å; V330-L358 HydrophobicContact CG2-CD1 3.76Å; V330-F487 HydrophobicContact CG1-CB 4.17Å; V330-F487 HydrophobicContact CG1-CD2 3.6Å; V330-F487 HydrophobicContact CG1-CE2 4.24Å; V330-F487 HydrophobicContact CG1-CG 4.07Å
331	N	98.1	Very high	96.5	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.8	-41.2	-175.3	-68.7	-22.4	0	0	0	112.2	L327 A328 A335 F484 F487 S488 Q491	L327-N331 WeakPolarHBondContact O-CB 3.5Å; L327-N331 VanDerWaalsContact O-CG 3.3Å; L327-N331 PolarHBondContact O-N 3Å; L327-N331 PolarHBondContact O-ND2 3.28Å; A328-N331 PolarHBondContact O-N 2.94Å; N331-A335 WeakPolarHBondContact O-CB 3.23Å; N331-A335 PolarHBondContact O-N 2.84Å; N331-F484 HydrophobicContact CB-CE2 4.46Å; N331-F484 WeakPolarHBondContact O-CE2 3.48Å; N331-F487 PolarHBondContact ND2-O 2.85Å; N331-F487 VanDerWaalsContact OD1-CB 3.28Å; N331-F487 WeakPolarHBondContact OD1-CB 3.48Å; N331-S488 WeakPolarHBondContact ND2-CA 3.44Å; N331-S488 PolarHBondContact OD1-N 3.2Å; N331-Q491 PolarHBondContact ND2-OE1 2.85Å
332	S	98.3	Very high	95.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.8	-52.9	176.5	-176.4	0	0	0	0	111.2	Y205 P209 A328 V330 L334 A335 F336	Y205-S332 PolarHBondContact O-OG 3.15Å; P209-S332 WeakPolarHBondContact CD-OG 3.48Å; P209-S332 VanDerWaalsContact CG-CB 3.42Å; A328-S332 WeakPolarHBondContact O-CB 3.34Å; A328-S332 PolarHBondContact O-N 2.88Å; V330-S332 PolarHBondContact O-N 3.01Å; S332-L334 VanDerWaalsContact C-N 3.34Å; S332-L334 PolarHBondContact O-N 2.82Å; S332-A335 WeakPolarHBondContact O-CB 3.49Å; S332-A335 PolarHBondContact O-N 2.79Å; S332-A335 VanDerWaalsContact O-N 3.12Å; S332-F336 VanDerWaalsContact O-CD2 3.25Å; S332-F336 WeakPolarHBondContact O-CD2 3.29Å; S332-F336 PolarHBondContact O-N 3.45Å
333	S	98.2	Very high	95.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62	-39.3	-178	56.1	0	0	0	0	112.9	L329 V330 F337 A351	L329-S333 VanDerWaalsContact O-CB 3.3Å; L329-S333 WeakPolarHBondContact O-CB 3.21Å; L329-S333 PolarHBondContact O-N 3.37Å; L329-S333 PolarHBondContact O-OG 3.23Å; V330-S333 PolarHBondContact O-N 3.47Å; V330-S333 PolarHBondContact O-OG 3.18Å; V330-S333 VanDerWaalsContact O-OG 3.08Å; S333-F337 WeakPolarHBondContact O-CB 3.48Å; S333-F337 PolarHBondContact O-N 3.06Å; S333-A351 WeakPolarHBondContact OG-CA 3.38Å
334	L	98.2	Very high	95.1	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-68.5	-38.2	173	-73	175	0	0	0	112.8	V330 S332 F337 L338 I348 A351 F369 V483 F484	V330-L334 HydrophobicContact CG1-CD1 3.71Å; V330-L334 HydrophobicContact CG1-CG 4.44Å; V330-L334 WeakPolarHBondContact O-CB 3.22Å; V330-L334 WeakPolarHBondContact O-CG 3.38Å; V330-L334 PolarHBondContact O-N 3.32Å; S332-L334 VanDerWaalsContact C-N 3.34Å; S332-L334 PolarHBondContact O-N 2.82Å; L334-F337 PolarHBondContact O-N 3.29Å; L334-L338 VanDerWaalsContact O-CB 3.25Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 WeakPolarHBondContact O-CG 3.4Å; L334-L338 PolarHBondContact O-N 2.69Å; L334-I348 HydrophobicContact CD2-CD1 4.36Å; L334-A351 HydrophobicContact CD2-CB 3.58Å; L334-A351 HydrophobicContact CG-CB 3.9Å; L334-F369 HydrophobicContact CD2-CE2 3.64Å; L334-F369 HydrophobicContact CD2-CZ 3.82Å; L334-V483 HydrophobicContact CD1-CG1 3.97Å; L334-F484 HydrophobicContact CB-CB 4.18Å; L334-F484 HydrophobicContact CB-CD2 3.88Å; L334-F484 HydrophobicContact CB-CG 4.42Å; L334-F484 HydrophobicContact CD1-CB 4.05Å
335	A	97.9	Very high	94.7	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.7	-46.3	175	0	0	0	0	0	111.4	A308 A309 N331 S332 L338 F339 F484	A308-A335 HydrophobicContact CB-CB 3.67Å; A309-A335 HydrophobicContact CB-CB 3.92Å; N331-A335 WeakPolarHBondContact O-CB 3.23Å; N331-A335 PolarHBondContact O-N 2.84Å; S332-A335 WeakPolarHBondContact O-CB 3.49Å; S332-A335 PolarHBondContact O-N 2.79Å; S332-A335 VanDerWaalsContact O-N 3.12Å; A335-L338 PolarHBondContact O-N 2.72Å; A335-F339 WeakPolarHBondContact O-CB 3.13Å; A335-F339 WeakPolarHBondContact O-CD2 3.32Å; A335-F339 PolarHBondContact O-N 3.09Å; A335-F484 HydrophobicContact CB-CE2 4Å; A335-F484 HydrophobicContact CB-CZ 4.45Å
336	F	96.8	Very high	94.5	Very high	38 Å²	38	15 Å²	15	17%	0.167	7%	0.071	C	C	.	.	H	α-helix	trans	-62	-44.5	174	-81.5	-80.2	0	0	0	111.9	Y205 L208 T305 A309 S332 L338 S340	Y205-F336 HydrophobicContact CD1-CB 3.68Å; Y205-F336 HydrophobicContact CD1-CD1 4.12Å; Y205-F336 AromaticContact CD1-CG 3.88Å; Y205-F336 HydrophobicContact CD1-CG 3.88Å; Y205-F336 HydrophobicContact CD2-CB 3.5Å; Y205-F336 VanDerWaalsContact CD2-CB 3.5Å; Y205-F336 HydrophobicContact CD2-CG 4.45Å; Y205-F336 HydrophobicContact CE1-CB 3.8Å; Y205-F336 HydrophobicContact CE1-CD1 4.23Å; Y205-F336 HydrophobicContact CE1-CG 4.24Å; Y205-F336 HydrophobicContact CE2-CB 3.62Å; Y205-F336 HydrophobicContact CG-CB 3.54Å; Y205-F336 HydrophobicContact CG-CD2 4.41Å; Y205-F336 HydrophobicContact CG-CG 4.01Å; L208-F336 HydrophobicContact CD1-CE2 4.07Å; L208-F336 HydrophobicContact CD1-CZ 4.19Å; T305-F336 HydrophobicContact CG2-CB 4.45Å; T305-F336 HydrophobicContact CG2-CD1 3.46Å; T305-F336 VanDerWaalsContact CG2-CD1 3.46Å; T305-F336 HydrophobicContact CG2-CD2 4.45Å; T305-F336 HydrophobicContact CG2-CE1 3.68Å; T305-F336 HydrophobicContact CG2-CG 3.87Å; T305-F336 HydrophobicContact CG2-CZ 4.26Å; A309-F336 HydrophobicContact CB-CE2 4.47Å; S332-F336 VanDerWaalsContact O-CD2 3.25Å; S332-F336 WeakPolarHBondContact O-CD2 3.29Å; S332-F336 PolarHBondContact O-N 3.45Å; F336-L338 PolarHBondContact O-N 3.41Å; F336-S340 WeakPolarHBondContact O-CB 3.45Å; F336-S340 PolarHBondContact O-N 3.26Å
337	F	96.6	Very high	94.4	Very high	1 Å²	1	15.3 Å²	15.3	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-63.7	-41.3	178	-177.4	-90.2	0	0	0	113.2	Y205 V275 A276 N277 S333 L334 V343 S347 I348 F480	Y205-F337 HydrophobicContact CE2-CB 4.35Å; V275-F337 HydrophobicContact CG1-CE2 4.29Å; V275-F337 HydrophobicContact CG1-CZ 3.94Å; A276-F337 HydrophobicContact CB-CE1 4.4Å; A276-F337 WeakPolarHBondContact O-CE1 3.45Å; N277-F337 WeakPolarHBondContact CB-O 3.28Å; S333-F337 WeakPolarHBondContact O-CB 3.48Å; S333-F337 PolarHBondContact O-N 3.06Å; L334-F337 PolarHBondContact O-N 3.29Å; F337-V343 HydrophobicContact CD2-CG1 3.49Å; F337-V343 VanDerWaalsContact CD2-CG1 3.49Å; F337-V343 HydrophobicContact CE2-CG1 3.58Å; F337-V343 HydrophobicContact CG-CG1 4.15Å; F337-V343 HydrophobicContact CZ-CG1 4.31Å; F337-V343 WeakPolarHBondContact O-CG2 3.49Å; F337-S347 VanDerWaalsContact CD2-OG 3.32Å; F337-S347 WeakPolarHBondContact CD2-OG 3.37Å; F337-I348 HydrophobicContact CD1-CD1 3.84Å; F337-I348 HydrophobicContact CD2-CB 4.16Å; F337-I348 HydrophobicContact CD2-CD1 4.12Å; F337-I348 HydrophobicContact CE1-CD1 3.83Å; F337-I348 HydrophobicContact CE2-CB 3.68Å; F337-I348 HydrophobicContact CE2-CD1 4.12Å; F337-I348 HydrophobicContact CE2-CG1 4.45Å; F337-I348 HydrophobicContact CG-CD1 4Å; F337-I348 HydrophobicContact CZ-CB 3.99Å; F337-I348 HydrophobicContact CZ-CD1 3.97Å; F337-I348 HydrophobicContact CZ-CG1 4.4Å; F337-F480 HydrophobicContact CD1-CD2 4.27Å; F337-F480 AromaticContact CE1-CD2 3.61Å; F337-F480 HydrophobicContact CE1-CD2 3.61Å; F337-F480 AromaticContact CE1-CE2 3.82Å; F337-F480 HydrophobicContact CE1-CE2 3.82Å; F337-F480 HydrophobicContact CZ-CD2 4.41Å; F337-F480 HydrophobicContact CZ-CE2 4.17Å
338	L	96.4	Very high	94.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-79.7	-33.9	-173.5	-71.5	170.8	0	0	0	113.1	T278 L334 A335 F336 F477 F480 L481 F484	T278-L338 WeakPolarHBondContact CB-O 3.43Å; T278-L338 PolarHBondContact N-O 3.21Å; T278-L338 PolarHBondContact OG1-O 3Å; L334-L338 VanDerWaalsContact O-CB 3.25Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 WeakPolarHBondContact O-CG 3.4Å; L334-L338 PolarHBondContact O-N 2.69Å; A335-L338 PolarHBondContact O-N 2.72Å; F336-L338 PolarHBondContact O-N 3.41Å; L338-F477 HydrophobicContact CD2-CD2 3.76Å; L338-F477 HydrophobicContact CD2-CE2 3.85Å; L338-F480 HydrophobicContact CD2-CB 3.9Å; L338-L481 HydrophobicContact CD1-CD1 4.43Å; L338-F484 HydrophobicContact CD1-CB 3.79Å; L338-F484 HydrophobicContact CD1-CD1 4.31Å; L338-F484 HydrophobicContact CD1-CG 4.01Å
339	F	95.6	Very high	94.4	Very high	23 Å²	23	15.5 Å²	15.5	10%	0.101	8%	0.075	C	C	.	.	H	α-helix	trans	-121.2	-7.3	-167.1	-55.4	-65.9	0	0	0	114.5	T278 W279 S301 F304 T305 A308 A335 F484	T278-F339 HydrophobicContact CG2-CD1 4.22Å; T278-F339 HydrophobicContact CG2-CE1 4.09Å; T278-F339 VanDerWaalsContact OG1-CD1 3.31Å; T278-F339 WeakPolarHBondContact OG1-CD1 3.29Å; T278-F339 WeakPolarHBondContact OG1-CE1 3.46Å; W279-F339 VanDerWaalsContact NE1-C 3.33Å; W279-F339 PolarHBondContact NE1-O 2.73Å; S301-F339 WeakPolarHBondContact CA-O 3.38Å; S301-F339 WeakPolarHBondContact CB-O 3.41Å; F304-F339 HydrophobicContact CB-CB 4.06Å; F304-F339 HydrophobicContact CB-CD1 4.35Å; F304-F339 HydrophobicContact CB-CG 4.32Å; F304-F339 HydrophobicContact CD1-CD1 4.33Å; T305-F339 PolarHBondContact OG1-O 3.1Å; A308-F339 HydrophobicContact CB-CD2 3.62Å; A308-F339 HydrophobicContact CB-CE2 3.69Å; A335-F339 WeakPolarHBondContact O-CB 3.13Å; A335-F339 WeakPolarHBondContact O-CD2 3.32Å; A335-F339 PolarHBondContact O-N 3.09Å; F339-F484 HydrophobicContact CE2-CE1 4.12Å; F339-F484 HydrophobicContact CE2-CZ 4.45Å
340	S	92.3	Very high	94.4	Very high	26 Å²	26	15.9 Å²	15.9	18%	0.182	8%	0.077	C	C	.	.			trans	-66.1	152.8	176.5	-178.9	0	0	0	0	111.4	W279 T305 F336 Q342	W279-S340 VanDerWaalsContact CD1-O 3.27Å; W279-S340 PolarHBondContact NE1-O 3.16Å; T305-S340 WeakPolarHBondContact OG1-CA 3.33Å; T305-S340 PolarHBondContact OG1-N 3.45Å; F336-S340 WeakPolarHBondContact O-CB 3.45Å; F336-S340 PolarHBondContact O-N 3.26Å; S340-Q342 PolarHBondContact OG-O 3.1Å
341	Y	86.3	Confident	94.4	Very high	28 Å²	28	16 Å²	16	11%	0.11	8%	0.078	C	C	.	.	S	Bend	trans	-63.9	-51.2	178.4	-176	-97.2	0	0	0	110.6	R268 L270 Q297 L298	R268-Y341 WeakPolarHBondContact O-CE1 3.42Å; L270-Y341 HydrophobicContact CB-CD2 4.04Å; L270-Y341 HydrophobicContact CB-CE1 4.22Å; L270-Y341 HydrophobicContact CB-CE2 3.51Å; L270-Y341 VanDerWaalsContact CD1-CA 3.45Å; L270-Y341 HydrophobicContact CD1-CD1 4.32Å; L270-Y341 HydrophobicContact CD1-CD2 3.21Å; L270-Y341 HydrophobicContact CD1-CE2 3.65Å; L270-Y341 HydrophobicContact CD1-CG 3.61Å; L270-Y341 WeakPolarHBondContact CD1-O 3.47Å; L270-Y341 HydrophobicContact CD2-CD2 4.44Å; L270-Y341 HydrophobicContact CD2-CE2 4.31Å; L270-Y341 HydrophobicContact CG-CD2 4.06Å; L270-Y341 HydrophobicContact CG-CE2 3.98Å; L270-Y341 PolarHBondContact N-OH 3.43Å; Q297-Y341 HydrophobicContact CB-CD2 4.41Å; Q297-Y341 HydrophobicContact CB-CE2 3.81Å; L298-Y341 HydrophobicContact CB-CD2 3.93Å; L298-Y341 HydrophobicContact CB-CE2 3.96Å; L298-Y341 HydrophobicContact CB-CG 4.46Å; L298-Y341 HydrophobicContact CD1-CD1 3.98Å; L298-Y341 HydrophobicContact CD1-CD2 4Å; L298-Y341 HydrophobicContact CD1-CG 3.66Å
342	Q	83.6	Confident	94.4	Very high	50 Å²	50	16 Å²	16	23%	0.234	8%	0.078	C	C	.	.	S	Bend	trans	-112.7	122.2	179.4	-163.4	179.7	-1.3	0	0	109.9	R268 S340	R268-Q342 VanDerWaalsContact CD-NE2 3.35Å; S340-Q342 PolarHBondContact OG-O 3.1Å
343	V	86.3	Confident	94.4	Very high	12 Å²	12	16.6 Å²	16.6	7%	0.073	8%	0.081	C	C	.	.			trans	-141.8	143	179.9	-172.4	0	0	0	0	106.9	V275 F337 S347	V275-V343 HydrophobicContact CG1-CB 4.3Å; V275-V343 HydrophobicContact CG1-CG1 3.94Å; V275-V343 WeakPolarHBondContact CG2-O 3.48Å; F337-V343 HydrophobicContact CD2-CG1 3.49Å; F337-V343 VanDerWaalsContact CD2-CG1 3.49Å; F337-V343 HydrophobicContact CE2-CG1 3.58Å; F337-V343 HydrophobicContact CG-CG1 4.15Å; F337-V343 HydrophobicContact CZ-CG1 4.31Å; F337-V343 WeakPolarHBondContact O-CG2 3.49Å; V343-S347 WeakPolarHBondContact CG1-OG 3.32Å
344	H	87.4	Confident	94.4	Very high	50 Å²	50	16.7 Å²	16.7	23%	0.231	8%	0.082	C	C	.	.			trans	-111.8	154.9	173.4	-67.7	-75.7	0	0	0	109.1	D273 K346 S347	D273-H344 IonicContact OD2-ND1 3.9Å; H344-K346 PolarHBondContact O-N 3.03Å; H344-K346 VanDerWaalsContact O-N 3.1Å; H344-S347 PolarHBondContact O-N 3.21Å; H344-S347 PolarHBondContact O-OG 3.26Å
345	E	89.6	Confident	94.4	Very high	37 Å²	37	16.7 Å²	16.7	17%	0.173	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-55.2	-37.4	-178.8	-56.5	86.8	167.8	0	0	111.8	D273 V275 S347 I348 M377	D273-E345 WeakPolarHBondContact CB-OE1 3.27Å; V275-E345 HydrophobicContact CG2-CG 4.08Å; E345-S347 VanDerWaalsContact C-N 3.3Å; E345-S347 PolarHBondContact O-N 2.99Å; E345-I348 VanDerWaalsContact O-CG2 3.3Å; E345-I348 WeakPolarHBondContact O-CG2 3.19Å; E345-M377 HydrophobicContact CB-CG 4.36Å
346	K	93.6	Very high	94.4	Very high	40 Å²	40	16.7 Å²	16.7	17%	0.174	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-70.2	-20.2	-177.7	-53.9	-180	-75.2	-134.5	0	113.7	D37 I159 H163 H344 I348 L349 L380	D37-K346 IonicContact OD2-NZ 3.61Å; D37-K346 PolarHBondContact OD2-NZ 3.49Å; I159-K346 HydrophobicContact CD1-CD 4.09Å; I159-K346 HydrophobicContact CD1-CG 3.87Å; I159-K346 HydrophobicContact CG2-CD 4.45Å; H163-K346 WeakPolarHBondContact NE2-CD 3.29Å; H163-K346 PolarHBondContact NE2-NZ 3.26Å; H344-K346 PolarHBondContact O-N 3.03Å; H344-K346 VanDerWaalsContact O-N 3.1Å; K346-I348 PolarHBondContact O-N 3.38Å; K346-L349 WeakPolarHBondContact O-CB 3.13Å; K346-L349 VanDerWaalsContact O-CG 3.25Å; K346-L349 WeakPolarHBondContact O-CG 3.29Å; K346-L349 PolarHBondContact O-N 3.37Å; K346-L380 HydrophobicContact CD-CD2 3.84Å; K346-L380 HydrophobicContact CG-CD2 3.76Å
347	S	94.8	Very high	94.4	Very high	14 Å²	14	15.2 Å²	15.2	10%	0.098	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-71.8	-10.6	-177.1	67.6	0	0	0	0	112.9	F337 V343 H344 E345 L349 L350	F337-S347 VanDerWaalsContact CD2-OG 3.32Å; F337-S347 WeakPolarHBondContact CD2-OG 3.37Å; V343-S347 WeakPolarHBondContact CG1-OG 3.32Å; H344-S347 PolarHBondContact O-N 3.21Å; H344-S347 PolarHBondContact O-OG 3.26Å; E345-S347 VanDerWaalsContact C-N 3.3Å; E345-S347 PolarHBondContact O-N 2.99Å; S347-L349 PolarHBondContact O-N 3.31Å; S347-L349 VanDerWaalsContact O-N 3.12Å; S347-L350 WeakPolarHBondContact O-CB 3.45Å; S347-L350 PolarHBondContact O-N 3.38Å
348	I	97.6	Very high	94.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-58	-24.2	171.3	-165.1	61	0	0	0	112.5	L334 F337 E345 K346 L350 A351 A352 F369 M377 F480	L334-I348 HydrophobicContact CD2-CD1 4.36Å; F337-I348 HydrophobicContact CD1-CD1 3.84Å; F337-I348 HydrophobicContact CD2-CB 4.16Å; F337-I348 HydrophobicContact CD2-CD1 4.12Å; F337-I348 HydrophobicContact CE1-CD1 3.83Å; F337-I348 HydrophobicContact CE2-CB 3.68Å; F337-I348 HydrophobicContact CE2-CD1 4.12Å; F337-I348 HydrophobicContact CE2-CG1 4.45Å; F337-I348 HydrophobicContact CG-CD1 4Å; F337-I348 HydrophobicContact CZ-CB 3.99Å; F337-I348 HydrophobicContact CZ-CD1 3.97Å; F337-I348 HydrophobicContact CZ-CG1 4.4Å; E345-I348 VanDerWaalsContact O-CG2 3.3Å; E345-I348 WeakPolarHBondContact O-CG2 3.19Å; K346-I348 PolarHBondContact O-N 3.38Å; I348-L350 PolarHBondContact O-N 2.8Å; I348-A351 HydrophobicContact CD1-CB 4.31Å; I348-A351 PolarHBondContact O-N 3.3Å; I348-A352 PolarHBondContact O-N 3.44Å; I348-F369 HydrophobicContact CD1-CE2 4.21Å; I348-F369 HydrophobicContact CD1-CZ 3.71Å; I348-F369 HydrophobicContact CG1-CZ 4.13Å; I348-M377 HydrophobicContact CG2-CE 4.24Å; I348-M377 HydrophobicContact CG2-CG 4.48Å; I348-M377 HydrophobicContact CG2-SD 4.15Å; I348-F480 HydrophobicContact CD1-CD1 4.19Å; I348-F480 HydrophobicContact CD1-CD2 3.98Å; I348-F480 HydrophobicContact CD1-CE1 4.02Å; I348-F480 HydrophobicContact CD1-CE2 3.78Å; I348-F480 HydrophobicContact CD1-CG 4.18Å; I348-F480 HydrophobicContact CD1-CZ 3.82Å; I348-F480 HydrophobicContact CG1-CE1 4.14Å; I348-F480 HydrophobicContact CG1-CE2 4.05Å; I348-F480 HydrophobicContact CG1-CZ 3.75Å
349	L	98.2	Very high	94.1	Very high	4 Å²	4	15.2 Å²	15.2	2%	0.021	8%	0.076	C	C	.	.	H	α-helix	trans	-58.8	-29.6	175.1	-61.9	178.8	0	0	0	112.7	Y153 L156 I159 N167 L171 K346 S347 A351 A352 L353 M377	Y153-L349 HydrophobicContact CE1-CD2 3.69Å; L156-L349 HydrophobicContact CB-CD2 4.44Å; L156-L349 HydrophobicContact CD1-CD1 4.22Å; I159-L349 HydrophobicContact CB-CD1 4.07Å; I159-L349 HydrophobicContact CG1-CD1 4.18Å; I159-L349 HydrophobicContact CG2-CD1 4Å; N167-L349 HydrophobicContact CB-CD1 4.36Å; L171-L349 HydrophobicContact CD1-CB 4.27Å; K346-L349 WeakPolarHBondContact O-CB 3.13Å; K346-L349 VanDerWaalsContact O-CG 3.25Å; K346-L349 WeakPolarHBondContact O-CG 3.29Å; K346-L349 PolarHBondContact O-N 3.37Å; S347-L349 PolarHBondContact O-N 3.31Å; S347-L349 VanDerWaalsContact O-N 3.12Å; L349-A351 VanDerWaalsContact C-N 3.31Å; L349-A351 PolarHBondContact O-N 3.35Å; L349-A352 PolarHBondContact O-N 3.41Å; L349-L353 PolarHBondContact O-N 3Å; L349-L353 VanDerWaalsContact O-N 3.15Å; L349-M377 HydrophobicContact CD2-CE 4.09Å
350	L	98	Very high	93.9	Very high	11 Å²	11	15.6 Å²	15.6	6%	0.058	8%	0.079	C	C	.	.	H	α-helix	trans	-64.7	-37.6	175.1	-63.3	160	0	0	0	110.8	L171 M202 Y205 H206 S347 I348 P354	L171-L350 HydrophobicContact CD2-CD2 4.02Å; M202-L350 HydrophobicContact CB-CD1 3.75Å; M202-L350 WeakPolarHBondContact O-CD1 3.41Å; Y205-L350 HydrophobicContact CD1-CD1 4.41Å; Y205-L350 HydrophobicContact CD2-CB 4.18Å; Y205-L350 HydrophobicContact CD2-CD1 3.59Å; Y205-L350 HydrophobicContact CE2-CD1 3.91Å; Y205-L350 HydrophobicContact CG-CD1 3.86Å; H206-L350 PolarHBondContact CE1-O 3.06Å; H206-L350 VanDerWaalsContact CE1-O 3.25Å; H206-L350 PolarHBondContact NE2-O 3.35Å; S347-L350 WeakPolarHBondContact O-CB 3.45Å; S347-L350 PolarHBondContact O-N 3.38Å; I348-L350 PolarHBondContact O-N 2.8Å; L350-P354 WeakPolarHBondContact O-CD 3.21Å
351	A	98.2	Very high	93.7	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.008	8%	0.079	C	C	.	.	H	α-helix	trans	-79.4	-28.5	173.9	0	0	0	0	0	112.9	S333 L334 I348 L349 P354 V355 F369	S333-A351 WeakPolarHBondContact OG-CA 3.38Å; L334-A351 HydrophobicContact CD2-CB 3.58Å; L334-A351 HydrophobicContact CG-CB 3.9Å; I348-A351 HydrophobicContact CD1-CB 4.31Å; I348-A351 PolarHBondContact O-N 3.3Å; L349-A351 VanDerWaalsContact C-N 3.31Å; L349-A351 PolarHBondContact O-N 3.35Å; A351-P354 VanDerWaalsContact O-CD 3.24Å; A351-P354 WeakPolarHBondContact O-CD 3.43Å; A351-P354 WeakPolarHBondContact O-CG 3.42Å; A351-V355 VanDerWaalsContact O-CG2 3.24Å; A351-V355 WeakPolarHBondContact O-CG2 3.5Å; A351-V355 PolarHBondContact O-N 3.1Å; A351-F369 HydrophobicContact CB-CE1 4.46Å; A351-F369 HydrophobicContact CB-CZ 3.91Å
352	A	98.4	Very high	93.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.4	-40.6	176.8	0	0	0	0	0	112.9	Y153 I348 L349 V355 C356 F369 L370	Y153-A352 HydrophobicContact CE1-CB 3.65Å; Y153-A352 WeakPolarHBondContact OH-CB 3.48Å; I348-A352 PolarHBondContact O-N 3.44Å; L349-A352 PolarHBondContact O-N 3.41Å; A352-V355 PolarHBondContact O-N 3.4Å; A352-C356 PolarHBondContact O-N 3.31Å; A352-C356 PolarHBondContact O-SG 3.09Å; A352-F369 HydrophobicContact CB-CE1 4.25Å; A352-L370 HydrophobicContact CB-CD2 3.82Å
353	L	98.2	Very high	94.2	Very high	13 Å²	13	13.5 Å²	13.5	7%	0.068	7%	0.067	C	C	.	.	H	α-helix	trans	-55.9	-55.8	177.9	176.6	67.6	0	0	0	113.2	Y124 L171 A174 L175 L349 V355 C356 L357	Y124-L353 HydrophobicContact CE2-CD1 4.4Å; L171-L353 HydrophobicContact CB-CD2 4.14Å; L171-L353 HydrophobicContact CD2-CB 4.16Å; L171-L353 HydrophobicContact CD2-CD2 3.96Å; L171-L353 WeakPolarHBondContact O-CD2 3.25Å; A174-L353 HydrophobicContact CB-CD2 4.16Å; L175-L353 HydrophobicContact CB-CD1 4.31Å; L175-L353 HydrophobicContact CB-CD2 4.47Å; L175-L353 HydrophobicContact CD2-CD1 4.27Å; L349-L353 PolarHBondContact O-N 3Å; L349-L353 VanDerWaalsContact O-N 3.15Å; L353-V355 VanDerWaalsContact C-N 3.31Å; L353-V355 PolarHBondContact O-N 3.16Å; L353-C356 VanDerWaalsContact O-CB 3.27Å; L353-C356 WeakPolarHBondContact O-CB 3.43Å; L353-C356 PolarHBondContact O-N 3.47Å; L353-L357 WeakPolarHBondContact O-CG 3.15Å; L353-L357 PolarHBondContact O-N 3.32Å
354	P	97.9	Very high	94.4	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.013	7%	0.067	C	C	.	.	H	α-helix	trans	-69	-27.5	178.9	28.3	-35.7	0	0	0	113.3	L329 V330 L350 A351 C356 L357	L329-P354 HydrophobicContact CB-CB 3.49Å; L329-P354 VanDerWaalsContact CB-CB 3.49Å; L329-P354 HydrophobicContact CB-CG 4.16Å; V330-P354 HydrophobicContact CG2-CB 3.73Å; V330-P354 HydrophobicContact CG2-CG 4.13Å; L350-P354 WeakPolarHBondContact O-CD 3.21Å; A351-P354 VanDerWaalsContact O-CD 3.24Å; A351-P354 WeakPolarHBondContact O-CD 3.43Å; A351-P354 WeakPolarHBondContact O-CG 3.42Å; P354-C356 VanDerWaalsContact C-N 3.35Å; P354-L357 WeakPolarHBondContact O-CB 3.48Å; P354-L357 PolarHBondContact O-N 3.46Å; P354-L357 VanDerWaalsContact O-N 3.16Å
355	V	98.1	Very high	94.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-64.4	-40.2	171.3	170.1	0	0	0	0	110.9	V330 A351 A352 L353 L357 L358 C366 F369	V330-V355 HydrophobicContact CG1-CG2 3.87Å; V330-V355 HydrophobicContact CG2-CG2 3.92Å; A351-V355 VanDerWaalsContact O-CG2 3.24Å; A351-V355 WeakPolarHBondContact O-CG2 3.5Å; A351-V355 PolarHBondContact O-N 3.1Å; A352-V355 PolarHBondContact O-N 3.4Å; L353-V355 VanDerWaalsContact C-N 3.31Å; L353-V355 PolarHBondContact O-N 3.16Å; V355-L357 PolarHBondContact O-N 3.16Å; V355-L358 PolarHBondContact O-N 2.67Å; V355-C366 HydrophobicContact CG1-CB 3.78Å; V355-C366 PolarHBondContact O-SG 3.18Å; V355-F369 HydrophobicContact CB-CD1 3.87Å; V355-F369 HydrophobicContact CB-CE1 4.22Å; V355-F369 HydrophobicContact CG1-CB 4.13Å; V355-F369 HydrophobicContact CG1-CD1 3.67Å; V355-F369 HydrophobicContact CG1-CE1 4.5Å; V355-F369 HydrophobicContact CG1-CG 4.13Å; V355-F369 HydrophobicContact CG2-CD1 3.76Å; V355-F369 HydrophobicContact CG2-CE1 3.9Å; V355-F369 HydrophobicContact CG2-CG 4.22Å; V355-F369 HydrophobicContact CG2-CZ 4.45Å
356	C	97.7	Very high	94.8	Very high	1 Å²	1	11 Å²	11	1%	0.007	6%	0.055	C	C	.	.	H	α-helix	trans	-55.7	-33.4	172.1	-79.5	0	0	0	0	112.8	I150 A352 L353 P354 L358 L359	I150-C356 HydrophobicContact CD1-CB 4.09Å; I150-C356 HydrophobicContact CG1-CB 3.85Å; I150-C356 HydrophobicContact CG2-CB 4.3Å; A352-C356 PolarHBondContact O-N 3.31Å; A352-C356 PolarHBondContact O-SG 3.09Å; L353-C356 VanDerWaalsContact O-CB 3.27Å; L353-C356 WeakPolarHBondContact O-CB 3.43Å; L353-C356 PolarHBondContact O-N 3.47Å; P354-C356 VanDerWaalsContact C-N 3.35Å; C356-L358 PolarHBondContact O-N 3.48Å; C356-L359 HydrophobicContact CB-CD1 4.31Å; C356-L359 WeakPolarHBondContact O-CB 3.22Å; C356-L359 WeakPolarHBondContact O-CD1 3.45Å; C356-L359 WeakPolarHBondContact O-CG 3.35Å; C356-L359 PolarHBondContact O-N 2.95Å
357	L	96.8	Very high	94.8	Very high	7 Å²	7	9.1 Å²	9.1	4%	0.037	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.3	179.1	-51.1	-177.8	0	0	0	113.9	Y131 L175 V178 K326 L353 P354 V355	Y131-L357 HydrophobicContact CD1-CD2 3.97Å; Y131-L357 HydrophobicContact CD2-CD2 4.23Å; Y131-L357 HydrophobicContact CE1-CB 4.41Å; Y131-L357 HydrophobicContact CE1-CD2 3.56Å; Y131-L357 HydrophobicContact CE2-CD2 3.85Å; Y131-L357 HydrophobicContact CG-CD2 4.31Å; Y131-L357 WeakPolarHBondContact OH-CB 3.43Å; Y131-L357 PolarHBondContact OH-O 2.88Å; L175-L357 HydrophobicContact CD1-CD2 3.61Å; V178-L357 HydrophobicContact CG1-CD1 3.91Å; V178-L357 HydrophobicContact CG2-CD1 4.47Å; K326-L357 HydrophobicContact CD-CB 3.91Å; K326-L357 HydrophobicContact CG-CB 4.45Å; K326-L357 PolarHBondContact NZ-O 2.95Å; L353-L357 WeakPolarHBondContact O-CG 3.15Å; L353-L357 PolarHBondContact O-N 3.32Å; P354-L357 WeakPolarHBondContact O-CB 3.48Å; P354-L357 PolarHBondContact O-N 3.46Å; P354-L357 VanDerWaalsContact O-N 3.16Å; V355-L357 PolarHBondContact O-N 3.16Å
358	L	95.3	Very high	94.9	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	4.2	178.4	-61.9	177.1	0	0	0	113	W323 K326 L327 V330 V355 C356 N360 E361 F362 C366 F487	W323-L358 HydrophobicContact CH2-CD2 4.35Å; W323-L358 HydrophobicContact CZ3-CD2 3.99Å; K326-L358 HydrophobicContact CB-CD2 3.82Å; K326-L358 HydrophobicContact CD-CD2 4.19Å; L327-L358 HydrophobicContact CD2-CD1 3.82Å; L327-L358 HydrophobicContact CD2-CD2 4.39Å; V330-L358 HydrophobicContact CG2-CD1 3.76Å; V355-L358 PolarHBondContact O-N 2.67Å; C356-L358 PolarHBondContact O-N 3.48Å; L358-N360 PolarHBondContact O-N 3.48Å; L358-N360 VanDerWaalsContact O-N 3.15Å; L358-E361 WeakPolarHBondContact CA-OE2 3.41Å; L358-E361 PolarHBondContact O-N 3.14Å; L358-F362 PolarHBondContact O-N 3.09Å; L358-C366 VanDerWaalsContact C-SG 3.55Å; L358-F487 HydrophobicContact CD1-CD1 3.9Å; L358-F487 HydrophobicContact CD1-CE1 3.52Å; L358-F487 HydrophobicContact CD1-CZ 3.86Å
359	L	93.1	Very high	94.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-29	178.7	-85.5	165.8	0	0	0	113.4	I146 I150 C356 P363 C366 V367 L370 L405	I146-L359 HydrophobicContact CG2-CB 4.18Å; I150-L359 HydrophobicContact CD1-CD1 4.45Å; I150-L359 HydrophobicContact CG1-CD1 3.68Å; C356-L359 HydrophobicContact CB-CD1 4.31Å; C356-L359 WeakPolarHBondContact O-CB 3.22Å; C356-L359 WeakPolarHBondContact O-CD1 3.45Å; C356-L359 WeakPolarHBondContact O-CG 3.35Å; C356-L359 PolarHBondContact O-N 2.95Å; L359-P363 WeakPolarHBondContact O-CA 3.08Å; L359-P363 WeakPolarHBondContact O-CB 3.34Å; L359-C366 HydrophobicContact CD2-CB 3.53Å; L359-C366 HydrophobicContact CG-CB 3.93Å; L359-V367 HydrophobicContact CD2-CG2 4.19Å; L359-L370 HydrophobicContact CD1-CD1 4.48Å; L359-L405 HydrophobicContact CD2-CD1 3.96Å
360	N	90.4	Very high	94.8	Very high	32 Å²	32	9.7 Å²	9.7	17%	0.171	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-37	178.4	-164.6	39	0	0	0	112.2	T136 D137 R142 I146 L358	T136-N360 HydrophobicContact CG2-CB 4.09Å; D137-N360 PolarHBondContact O-ND2 3.01Å; D137-N360 PolarHBondContact O-OD1 3.31Å; R142-N360 PolarHBondContact NE-OD1 3.47Å; I146-N360 HydrophobicContact CD1-CB 3.58Å; I146-N360 VanDerWaalsContact CD1-OD1 3.3Å; I146-N360 WeakPolarHBondContact CD1-OD1 3.33Å; L358-N360 PolarHBondContact O-N 3.48Å; L358-N360 VanDerWaalsContact O-N 3.15Å
361	E	87.7	Confident	94.8	Very high	41 Å²	41	9.2 Å²	9.2	19%	0.192	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-28.2	-172.6	-61.5	96.7	156.4	0	0	114.1	W323 K326 L358	W323-E361 HydrophobicContact CH2-CB 3.89Å; W323-E361 HydrophobicContact CH2-CG 3.96Å; W323-E361 HydrophobicContact CZ3-CB 3.98Å; W323-E361 HydrophobicContact CZ3-CG 3.58Å; K326-E361 VanDerWaalsContact NZ-CD 3.31Å; K326-E361 IonicContact NZ-OE1 3.21Å; K326-E361 PolarHBondContact NZ-OE1 3.41Å; K326-E361 IonicContact NZ-OE2 3.19Å; K326-E361 PolarHBondContact NZ-OE2 2.65Å; L358-E361 WeakPolarHBondContact CA-OE2 3.41Å; L358-E361 PolarHBondContact O-N 3.14Å
362	F	89.6	Confident	94.8	Very high	19 Å²	19	9.1 Å²	9.1	8%	0.083	4%	0.044	C	C	.	.			trans	-138.7	63.6	-179.8	-59.4	-70.7	0	0	0	111.1	W323 L358 L364 M365 C366 L418 F487 V490	W323-F362 HydrophobicContact CH2-CD2 4.35Å; W323-F362 AromaticContact CH2-CE2 3.53Å; W323-F362 HydrophobicContact CH2-CE2 3.53Å; W323-F362 HydrophobicContact CH2-CZ 4.19Å; W323-F362 AromaticContact CZ2-CE2 3.88Å; W323-F362 HydrophobicContact CZ2-CE2 3.88Å; W323-F362 HydrophobicContact CZ2-CZ 4.27Å; L358-F362 PolarHBondContact O-N 3.09Å; F362-L364 PolarHBondContact O-N 3.28Å; F362-M365 HydrophobicContact CB-CB 4.32Å; F362-M365 PolarHBondContact O-N 2.91Å; F362-C366 WeakPolarHBondContact O-CB 3.18Å; F362-C366 PolarHBondContact O-N 2.73Å; F362-C366 PolarHBondContact O-SG 2.95Å; F362-L418 HydrophobicContact CE1-CD1 4Å; F362-L418 HydrophobicContact CZ-CD1 4.05Å; F362-F487 HydrophobicContact CB-CE1 4.49Å; F362-F487 AromaticContact CD2-CE1 3.65Å; F362-F487 HydrophobicContact CD2-CE1 3.65Å; F362-F487 HydrophobicContact CD2-CZ 4.43Å; F362-F487 HydrophobicContact CE2-CE1 4.09Å; F362-F487 HydrophobicContact CG-CE1 4.22Å; F362-V490 HydrophobicContact CE2-CG1 4.03Å; F362-V490 HydrophobicContact CZ-CG1 3.8Å; F362-V490 HydrophobicContact CZ-CG2 4.33Å
363	P	90.9	Very high	94.8	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-59.1	-47.1	-169.5	22.9	-33.8	0	0	0	112.8	L359 M365 C366 V367 L405 A407 D410	L359-P363 WeakPolarHBondContact O-CA 3.08Å; L359-P363 WeakPolarHBondContact O-CB 3.34Å; P363-M365 PolarHBondContact O-N 2.76Å; P363-C366 PolarHBondContact O-N 2.94Å; P363-V367 WeakPolarHBondContact O-CB 3.25Å; P363-V367 WeakPolarHBondContact O-CG2 3.37Å; P363-V367 PolarHBondContact O-N 3.31Å; P363-L405 HydrophobicContact CB-CB 4.13Å; P363-L405 HydrophobicContact CB-CD1 4.19Å; P363-A407 HydrophobicContact CB-CB 3.84Å; P363-A407 HydrophobicContact CG-CB 4.3Å; P363-D410 HydrophobicContact CG-CB 3.89Å
364	L	90.1	Very high	94.7	Very high	13 Å²	13	8.5 Å²	8.5	7%	0.068	4%	0.041	C	C	.	.	H	α-helix	trans	-63	-46.6	-178	-175.6	65.1	0	0	0	112.2	F362 C366 V367 W368 A407 L408 C411 F441	F362-L364 PolarHBondContact O-N 3.28Å; L364-C366 PolarHBondContact O-N 3.02Å; L364-V367 PolarHBondContact O-N 2.96Å; L364-W368 VanDerWaalsContact O-CB 3.32Å; L364-W368 WeakPolarHBondContact O-CB 3.15Å; L364-W368 PolarHBondContact O-N 3.03Å; L364-A407 HydrophobicContact CB-CB 4.43Å; L364-L408 HydrophobicContact CD1-CD2 3.99Å; L364-C411 HydrophobicContact CB-CB 4.47Å; L364-C411 HydrophobicContact CD2-CB 3.83Å; L364-C411 VanDerWaalsContact CD2-SG 3.51Å; L364-F441 HydrophobicContact CD1-CB 4.5Å; L364-F441 HydrophobicContact CD1-CD1 4.08Å; L364-F441 HydrophobicContact CD1-CD2 3.89Å; L364-F441 HydrophobicContact CD1-CE1 4.25Å; L364-F441 HydrophobicContact CD1-CE2 4.08Å; L364-F441 HydrophobicContact CD1-CG 3.89Å; L364-F441 HydrophobicContact CD1-CZ 4.26Å
365	M	91	Very high	94.7	Very high	34 Å²	34	8.4 Å²	8.4	17%	0.167	4%	0.04	C	C	.	.	H	α-helix	trans	-66	-39.6	-178	-167.2	60.8	173.3	0	0	111.7	F362 P363 W368 F369 V483 H486 F487	F362-M365 HydrophobicContact CB-CB 4.32Å; F362-M365 PolarHBondContact O-N 2.91Å; P363-M365 PolarHBondContact O-N 2.76Å; M365-W368 PolarHBondContact O-N 2.94Å; M365-W368 HydrophobicContact SD-CE3 4.24Å; M365-F369 WeakPolarHBondContact O-CB 3.45Å; M365-F369 PolarHBondContact O-N 2.95Å; M365-V483 HydrophobicContact CE-CB 3.87Å; M365-V483 HydrophobicContact CE-CG1 4.31Å; M365-V483 HydrophobicContact CE-CG2 3.29Å; M365-V483 HydrophobicContact SD-CG2 4.32Å; M365-H486 HydrophobicContact CE-CB 3.92Å; M365-F487 HydrophobicContact CG-CE2 4.38Å; M365-F487 HydrophobicContact CG-CZ 4.32Å
366	C	95.1	Very high	94.7	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-67.2	-46.2	176.8	-63.4	0	0	0	0	111.4	V355 L358 L359 F362 P363 L364 W368 F369 L370	V355-C366 HydrophobicContact CG1-CB 3.78Å; V355-C366 PolarHBondContact O-SG 3.18Å; L358-C366 VanDerWaalsContact C-SG 3.55Å; L359-C366 HydrophobicContact CD2-CB 3.53Å; L359-C366 HydrophobicContact CG-CB 3.93Å; F362-C366 WeakPolarHBondContact O-CB 3.18Å; F362-C366 PolarHBondContact O-N 2.73Å; F362-C366 PolarHBondContact O-SG 2.95Å; P363-C366 PolarHBondContact O-N 2.94Å; L364-C366 PolarHBondContact O-N 3.02Å; C366-W368 VanDerWaalsContact C-N 3.29Å; C366-W368 PolarHBondContact O-N 3.37Å; C366-F369 PolarHBondContact O-N 3.1Å; C366-L370 WeakPolarHBondContact O-CB 3.37Å; C366-L370 VanDerWaalsContact O-CG 3.22Å; C366-L370 WeakPolarHBondContact O-CG 3.14Å; C366-L370 PolarHBondContact O-N 2.87Å
367	V	94.6	Very high	94.7	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.4	-43.2	176.3	172.2	0	0	0	0	111.2	L359 P363 L364 L370 Q371 F397 P398 T401 V402	L359-V367 HydrophobicContact CD2-CG2 4.19Å; P363-V367 WeakPolarHBondContact O-CB 3.25Å; P363-V367 WeakPolarHBondContact O-CG2 3.37Å; P363-V367 PolarHBondContact O-N 3.31Å; L364-V367 PolarHBondContact O-N 2.96Å; V367-L370 PolarHBondContact O-N 3.33Å; V367-Q371 WeakPolarHBondContact O-CB 3.32Å; V367-Q371 PolarHBondContact O-N 2.96Å; V367-F397 HydrophobicContact CG1-CE1 4.49Å; V367-P398 HydrophobicContact CG1-CB 4.36Å; V367-T401 HydrophobicContact CG2-CG2 3.32Å; V367-V402 HydrophobicContact CG1-CG2 4.14Å
368	W	94.9	Very high	94.7	Very high	29 Å²	29	8.6 Å²	8.6	11%	0.11	4%	0.041	C	C	.	.	H	α-helix	trans	-61.7	-46.1	177.7	-168.4	2.4	0	0	0	111.8	L364 M365 C366 Q371 A372 K440 F441 S444 H479	L364-W368 VanDerWaalsContact O-CB 3.32Å; L364-W368 WeakPolarHBondContact O-CB 3.15Å; L364-W368 PolarHBondContact O-N 3.03Å; M365-W368 PolarHBondContact O-N 2.94Å; M365-W368 HydrophobicContact SD-CE3 4.24Å; C366-W368 VanDerWaalsContact C-N 3.29Å; C366-W368 PolarHBondContact O-N 3.37Å; W368-Q371 PolarHBondContact O-N 2.64Å; W368-A372 WeakPolarHBondContact O-CB 3.45Å; W368-A372 PolarHBondContact O-N 3.17Å; W368-K440 HydrophobicContact CH2-CB 3.82Å; W368-F441 HydrophobicContact CB-CD2 3.88Å; W368-F441 HydrophobicContact CB-CE2 3.99Å; W368-F441 AromaticContact CD2-CD2 3.93Å; W368-F441 HydrophobicContact CD2-CD2 3.93Å; W368-F441 HydrophobicContact CE3-CB 4.42Å; W368-F441 HydrophobicContact CE3-CD2 4.3Å; W368-F441 AromaticContact CG-CD2 3.75Å; W368-F441 HydrophobicContact CG-CD2 3.75Å; W368-F441 HydrophobicContact CG-CE2 4.19Å; W368-S444 PolarHBondContact NE1-OG 3.46Å; W368-H479 AromaticContact CE2-CE1 3.68Å; W368-H479 AromaticContact CE2-ND1 3.72Å; W368-H479 AromaticContact CZ2-CE1 3.48Å; W368-H479 VanDerWaalsContact CZ2-CE1 3.48Å; W368-H479 WeakPolarHBondContact CZ2-CE1 3.39Å; W368-H479 AromaticContact CZ2-ND1 3.72Å; W368-H479 AromaticContact NE1-CE1 3.48Å; W368-H479 PolarHBondContact NE1-CE1 3.12Å; W368-H479 AromaticContact NE1-ND1 3.58Å; W368-H479 AromaticContact NE1-NE2 3.97Å
369	F	97.6	Very high	94.7	Very high	1 Å²	1	10.6 Å²	10.6	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-62.5	-47.2	175.9	176.7	-90.8	0	0	0	112.4	L334 I348 A351 A352 V355 M365 C366 Q371 A372 S373 F480 V483	L334-F369 HydrophobicContact CD2-CE2 3.64Å; L334-F369 HydrophobicContact CD2-CZ 3.82Å; I348-F369 HydrophobicContact CD1-CE2 4.21Å; I348-F369 HydrophobicContact CD1-CZ 3.71Å; I348-F369 HydrophobicContact CG1-CZ 4.13Å; A351-F369 HydrophobicContact CB-CE1 4.46Å; A351-F369 HydrophobicContact CB-CZ 3.91Å; A352-F369 HydrophobicContact CB-CE1 4.25Å; V355-F369 HydrophobicContact CB-CD1 3.87Å; V355-F369 HydrophobicContact CB-CE1 4.22Å; V355-F369 HydrophobicContact CG1-CB 4.13Å; V355-F369 HydrophobicContact CG1-CD1 3.67Å; V355-F369 HydrophobicContact CG1-CE1 4.5Å; V355-F369 HydrophobicContact CG1-CG 4.13Å; V355-F369 HydrophobicContact CG2-CD1 3.76Å; V355-F369 HydrophobicContact CG2-CE1 3.9Å; V355-F369 HydrophobicContact CG2-CG 4.22Å; V355-F369 HydrophobicContact CG2-CZ 4.45Å; M365-F369 WeakPolarHBondContact O-CB 3.45Å; M365-F369 PolarHBondContact O-N 2.95Å; C366-F369 PolarHBondContact O-N 3.1Å; F369-Q371 PolarHBondContact O-N 2.82Å; F369-A372 PolarHBondContact O-N 3.4Å; F369-A372 VanDerWaalsContact O-N 3.15Å; F369-S373 WeakPolarHBondContact O-CB 3.2Å; F369-S373 PolarHBondContact O-N 3.29Å; F369-S373 PolarHBondContact O-OG 3.16Å; F369-F480 AromaticContact CD2-CD1 3.87Å; F369-F480 HydrophobicContact CD2-CD1 3.87Å; F369-F480 HydrophobicContact CD2-CE1 4.28Å; F369-F480 AromaticContact CE2-CD1 3.44Å; F369-F480 HydrophobicContact CE2-CD1 3.44Å; F369-F480 VanDerWaalsContact CE2-CD1 3.44Å; F369-F480 AromaticContact CE2-CE1 3.9Å; F369-F480 HydrophobicContact CE2-CE1 3.9Å; F369-F480 HydrophobicContact CE2-CG 4.29Å; F369-F480 HydrophobicContact CZ-CD1 4.3Å; F369-F480 HydrophobicContact CZ-CE1 4.42Å; F369-V483 HydrophobicContact CB-CG1 4.44Å; F369-V483 HydrophobicContact CB-CG2 4.15Å; F369-V483 HydrophobicContact CD2-CB 4Å; F369-V483 HydrophobicContact CD2-CG1 3.77Å; F369-V483 HydrophobicContact CD2-CG2 3.84Å; F369-V483 HydrophobicContact CE2-CG1 4.41Å; F369-V483 HydrophobicContact CG-CG1 4.29Å; F369-V483 HydrophobicContact CG-CG2 4.46Å
370	L	97.9	Very high	94.8	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.8	-36.1	179.2	-68	174.4	0	0	0	110.8	Y153 A352 L359 C366 V367 S373 T374 F397	Y153-L370 HydrophobicContact CD2-CB 3.88Å; Y153-L370 HydrophobicContact CD2-CD1 4.41Å; Y153-L370 HydrophobicContact CD2-CD2 3.74Å; Y153-L370 HydrophobicContact CD2-CG 4.19Å; Y153-L370 HydrophobicContact CE1-CD2 4.45Å; Y153-L370 HydrophobicContact CE2-CB 3.83Å; Y153-L370 HydrophobicContact CE2-CD2 3.61Å; Y153-L370 HydrophobicContact CE2-CG 4.26Å; Y153-L370 HydrophobicContact CG-CD2 4.23Å; A352-L370 HydrophobicContact CB-CD2 3.82Å; L359-L370 HydrophobicContact CD1-CD1 4.48Å; C366-L370 WeakPolarHBondContact O-CB 3.37Å; C366-L370 VanDerWaalsContact O-CG 3.22Å; C366-L370 WeakPolarHBondContact O-CG 3.14Å; C366-L370 PolarHBondContact O-N 2.87Å; V367-L370 PolarHBondContact O-N 3.33Å; L370-S373 WeakPolarHBondContact CA-OG 3.47Å; L370-S373 PolarHBondContact O-OG 3.37Å; L370-T374 PolarHBondContact O-N 2.93Å; L370-T374 VanDerWaalsContact O-N 3.15Å; L370-T374 PolarHBondContact O-OG1 3.15Å; L370-F397 HydrophobicContact CB-CE1 3.9Å; L370-F397 HydrophobicContact CB-CZ 4.15Å; L370-F397 HydrophobicContact CD1-CE1 4.39Å; L370-F397 HydrophobicContact CD1-CZ 3.84Å
371	Q	97	Very high	95.1	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-69.1	-48.5	173.1	-179.6	55.5	-57.2	0	0	112.6	V367 W368 F369 S373 T374 F375 F394 M445 M448	V367-Q371 WeakPolarHBondContact O-CB 3.32Å; V367-Q371 PolarHBondContact O-N 2.96Å; W368-Q371 PolarHBondContact O-N 2.64Å; F369-Q371 PolarHBondContact O-N 2.82Å; Q371-S373 PolarHBondContact O-N 3.23Å; Q371-T374 PolarHBondContact O-N 2.95Å; Q371-F375 PolarHBondContact O-N 3.19Å; Q371-F394 HydrophobicContact CG-CE2 4Å; Q371-F394 HydrophobicContact CG-CZ 4.22Å; Q371-F394 PolarHBondContact NE2-O 3.16Å; Q371-M445 HydrophobicContact CB-SD 4.3Å; Q371-M445 HydrophobicContact CG-CE 3.84Å; Q371-M445 HydrophobicContact CG-SD 3.72Å; Q371-M448 HydrophobicContact CG-CE 3.72Å; Q371-M448 HydrophobicContact CG-SD 4.31Å
372	A	97.8	Very high	95.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-57.4	-34.8	176.6	0	0	0	0	0	112.4	W368 F369 F375 S376 M448 H479 F480	W368-A372 WeakPolarHBondContact O-CB 3.45Å; W368-A372 PolarHBondContact O-N 3.17Å; F369-A372 PolarHBondContact O-N 3.4Å; F369-A372 VanDerWaalsContact O-N 3.15Å; A372-F375 PolarHBondContact O-N 3.07Å; A372-S376 WeakPolarHBondContact O-CB 3.36Å; A372-S376 PolarHBondContact O-N 3.23Å; A372-M448 HydrophobicContact CB-SD 4.34Å; A372-H479 HydrophobicContact CB-CB 3.86Å; A372-F480 HydrophobicContact CB-CE1 3.93Å
373	S	98.1	Very high	95.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-68.7	-33.5	174.9	73.3	0	0	0	0	113.5	Y153 F369 L370 Q371 S376 M377	Y153-S373 WeakPolarHBondContact CE2-OG 3.43Å; Y153-S373 PolarHBondContact OH-OG 2.89Å; F369-S373 WeakPolarHBondContact O-CB 3.2Å; F369-S373 PolarHBondContact O-N 3.29Å; F369-S373 PolarHBondContact O-OG 3.16Å; L370-S373 WeakPolarHBondContact CA-OG 3.47Å; L370-S373 PolarHBondContact O-OG 3.37Å; Q371-S373 PolarHBondContact O-N 3.23Å; S373-S376 PolarHBondContact O-OG 3.41Å; S373-M377 WeakPolarHBondContact O-CE 3.32Å
374	T	97.9	Very high	95.8	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-73.6	-43.2	174.1	-52.7	0	0	0	0	109.7	P154 G155 L158 L370 Q371 S376 M377 F381 Y390	P154-T374 HydrophobicContact CB-CG2 3.75Å; G155-T374 PolarHBondContact N-OG1 2.65Å; L158-T374 HydrophobicContact CD1-CG2 3.92Å; L370-T374 PolarHBondContact O-N 2.93Å; L370-T374 VanDerWaalsContact O-N 3.15Å; L370-T374 PolarHBondContact O-OG1 3.15Å; Q371-T374 PolarHBondContact O-N 2.95Å; T374-S376 VanDerWaalsContact C-N 3.35Å; T374-S376 PolarHBondContact O-N 3.06Å; T374-M377 PolarHBondContact O-N 3.15Å; T374-F381 HydrophobicContact CG2-CE2 4.24Å; T374-F381 WeakPolarHBondContact O-CE2 3.21Å; T374-Y390 HydrophobicContact CG2-CD2 4.21Å; T374-Y390 HydrophobicContact CG2-CE2 4.06Å
375	F	98.1	Very high	96.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-57.8	-42.7	174.8	176.6	-111.1	0	0	0	112.8	Q371 A372 M377 L378 F394 M448 L451 V472 T475 A476	Q371-F375 PolarHBondContact O-N 3.19Å; A372-F375 PolarHBondContact O-N 3.07Å; F375-M377 PolarHBondContact O-N 2.97Å; F375-M377 VanDerWaalsContact O-N 3.09Å; F375-L378 HydrophobicContact CE2-CD2 4.35Å; F375-L378 WeakPolarHBondContact O-CB 3.24Å; F375-L378 PolarHBondContact O-N 3.09Å; F375-F394 HydrophobicContact CB-CE2 4.02Å; F375-F394 HydrophobicContact CD2-CE2 4.45Å; F375-M448 HydrophobicContact CB-CG 4.3Å; F375-M448 HydrophobicContact CB-SD 3.75Å; F375-M448 HydrophobicContact CD1-CB 4.39Å; F375-M448 HydrophobicContact CD1-CG 3.73Å; F375-M448 HydrophobicContact CD1-SD 3.96Å; F375-M448 HydrophobicContact CD2-CB 3.78Å; F375-M448 HydrophobicContact CD2-CG 4.05Å; F375-M448 HydrophobicContact CE1-CG 4.01Å; F375-M448 HydrophobicContact CE2-CB 4.01Å; F375-M448 HydrophobicContact CE2-CG 4.31Å; F375-M448 WeakPolarHBondContact CE2-O 3.47Å; F375-M448 HydrophobicContact CG-CB 3.98Å; F375-M448 HydrophobicContact CG-CG 3.75Å; F375-M448 HydrophobicContact CG-SD 3.85Å; F375-M448 HydrophobicContact CZ-CB 4.4Å; F375-M448 HydrophobicContact CZ-CG 4.28Å; F375-L451 HydrophobicContact CE2-CB 4.01Å; F375-L451 HydrophobicContact CZ-CB 3.84Å; F375-L451 HydrophobicContact CZ-CD1 3.83Å; F375-V472 HydrophobicContact CD1-CG1 4.15Å; F375-V472 HydrophobicContact CE1-CB 4.21Å; F375-V472 HydrophobicContact CE1-CG1 3.78Å; F375-V472 HydrophobicContact CE1-CG2 4.4Å; F375-V472 HydrophobicContact CE2-CG1 4.29Å; F375-V472 HydrophobicContact CE2-CG2 4.08Å; F375-V472 HydrophobicContact CZ-CB 4.02Å; F375-V472 HydrophobicContact CZ-CG1 3.87Å; F375-V472 HydrophobicContact CZ-CG2 3.71Å; F375-V472 WeakPolarHBondContact O-CG1 3.4Å; F375-T475 HydrophobicContact CE1-CG2 4.13Å; F375-A476 HydrophobicContact CD1-CB 4.4Å
376	S	97.3	Very high	96.4	Very high	10 Å²	10	17.2 Å²	17.2	7%	0.07	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22	-178.3	68.9	0	0	0	0	113.8	A372 S373 T374 A476	A372-S376 WeakPolarHBondContact O-CB 3.36Å; A372-S376 PolarHBondContact O-N 3.23Å; S373-S376 PolarHBondContact O-OG 3.41Å; T374-S376 VanDerWaalsContact C-N 3.35Å; T374-S376 PolarHBondContact O-N 3.06Å; S376-A476 VanDerWaalsContact CB-CB 3.49Å
377	M	96.9	Very high	96.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	4.8	178.6	-61.8	-176	-74	0	0	113	I159 E345 I348 L349 S373 T374 F375 L380 F381	I159-M377 HydrophobicContact CD1-SD 3.75Å; I159-M377 HydrophobicContact CG1-CE 4.12Å; I159-M377 HydrophobicContact CG1-SD 3.69Å; E345-M377 HydrophobicContact CB-CG 4.36Å; I348-M377 HydrophobicContact CG2-CE 4.24Å; I348-M377 HydrophobicContact CG2-CG 4.48Å; I348-M377 HydrophobicContact CG2-SD 4.15Å; L349-M377 HydrophobicContact CD2-CE 4.09Å; S373-M377 WeakPolarHBondContact O-CE 3.32Å; T374-M377 PolarHBondContact O-N 3.15Å; F375-M377 PolarHBondContact O-N 2.97Å; F375-M377 VanDerWaalsContact O-N 3.09Å; M377-L380 VanDerWaalsContact O-CB 3.3Å; M377-L380 WeakPolarHBondContact O-CB 3.35Å; M377-L380 PolarHBondContact O-N 3.08Å; M377-L380 VanDerWaalsContact O-N 3.07Å; M377-F381 HydrophobicContact CB-CD2 4.35Å; M377-F381 HydrophobicContact CB-CE1 4.24Å; M377-F381 HydrophobicContact CB-CE2 3.63Å; M377-F381 HydrophobicContact CB-CZ 3.56Å; M377-F381 HydrophobicContact CE-CZ 4.11Å; M377-F381 WeakPolarHBondContact O-CD2 3.4Å; M377-F381 WeakPolarHBondContact O-CG 3.3Å; M377-F381 PolarHBondContact O-N 3.33Å; M377-F381 VanDerWaalsContact O-N 3.15Å; M377-F381 HydrophobicContact SD-CZ 4.43Å
378	L	96.9	Very high	96.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-50.7	-47.9	178.7	169.9	66.3	0	0	0	113.4	F375 L380 F381 L382 Y390 V472	F375-L378 HydrophobicContact CE2-CD2 4.35Å; F375-L378 WeakPolarHBondContact O-CB 3.24Å; F375-L378 PolarHBondContact O-N 3.09Å; L378-L380 PolarHBondContact O-N 3.35Å; L378-F381 PolarHBondContact O-N 3.44Å; L378-L382 HydrophobicContact CD1-CD1 4.05Å; L378-L382 HydrophobicContact CD1-CD2 4.05Å; L378-L382 HydrophobicContact CD1-CG 3.8Å; L378-L382 HydrophobicContact CG-CD1 4.09Å; L378-L382 HydrophobicContact CG-CG 4.26Å; L378-L382 WeakPolarHBondContact O-CG 3.07Å; L378-L382 PolarHBondContact O-N 2.95Å; L378-Y390 HydrophobicContact CB-CE2 4.45Å; L378-Y390 HydrophobicContact CD1-CD1 3.93Å; L378-Y390 HydrophobicContact CD1-CE1 3.58Å; L378-Y390 HydrophobicContact CD1-CE2 4.29Å; L378-Y390 HydrophobicContact CD1-CG 4.44Å; L378-V472 HydrophobicContact CD2-CG2 4.24Å
379	P	95.3	Very high	96.7	Very high	43 Å²	43	23.7 Å²	23.7	28%	0.279	14%	0.138	S	C	.	.	H	α-helix	trans	-57.9	-35.2	-179.7	-25.8	36.1	0	0	0	112.9	K383 P469 V472	P379-K383 PolarHBondContact O-N 3.41Å; P379-K383 VanDerWaalsContact O-N 3.09Å; P379-P469 HydrophobicContact CB-CB 4.45Å; P379-P469 HydrophobicContact CG-CB 4.23Å; P379-V472 HydrophobicContact CG-CB 4.47Å; P379-V472 HydrophobicContact CG-CG1 4.32Å
380	L	94.7	Very high	96.7	Very high	22 Å²	22	23.9 Å²	23.9	12%	0.115	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-47	175.8	-173.9	67.5	0	0	0	111	I159 K346 M377 L378 L382 K383 D384	I159-L380 HydrophobicContact CD1-CD2 3.69Å; K346-L380 HydrophobicContact CD-CD2 3.84Å; K346-L380 HydrophobicContact CG-CD2 3.76Å; M377-L380 VanDerWaalsContact O-CB 3.3Å; M377-L380 WeakPolarHBondContact O-CB 3.35Å; M377-L380 PolarHBondContact O-N 3.08Å; M377-L380 VanDerWaalsContact O-N 3.07Å; L378-L380 PolarHBondContact O-N 3.35Å; L380-L382 VanDerWaalsContact C-N 3.3Å; L380-L382 PolarHBondContact O-N 3.38Å; L380-K383 WeakPolarHBondContact O-CB 3.15Å; L380-K383 PolarHBondContact O-N 2.87Å; L380-K383 VanDerWaalsContact O-N 3.15Å; L380-D384 PolarHBondContact O-N 2.89Å; L380-D384 VanDerWaalsContact O-N 3.16Å
381	F	96.7	Very high	96.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-36.9	178.6	-56.4	-38.1	0	0	0	112.5	L158 I159 T374 M377 L378 D384 G385 L386 Y390	L158-F381 HydrophobicContact CB-CD1 4.25Å; L158-F381 HydrophobicContact CB-CE1 3.55Å; L158-F381 HydrophobicContact CB-CE2 4.35Å; L158-F381 HydrophobicContact CB-CZ 3.61Å; L158-F381 HydrophobicContact CD1-CD2 4.15Å; L158-F381 HydrophobicContact CD1-CE1 4.34Å; L158-F381 HydrophobicContact CD1-CE2 3.67Å; L158-F381 HydrophobicContact CD1-CZ 3.79Å; L158-F381 HydrophobicContact CG-CZ 4.37Å; I159-F381 HydrophobicContact CD1-CE1 3.71Å; I159-F381 HydrophobicContact CD1-CZ 4.25Å; I159-F381 HydrophobicContact CG1-CE1 4.17Å; I159-F381 HydrophobicContact CG1-CZ 4.4Å; T374-F381 HydrophobicContact CG2-CE2 4.24Å; T374-F381 WeakPolarHBondContact O-CE2 3.21Å; M377-F381 HydrophobicContact CB-CD2 4.35Å; M377-F381 HydrophobicContact CB-CE1 4.24Å; M377-F381 HydrophobicContact CB-CE2 3.63Å; M377-F381 HydrophobicContact CB-CZ 3.56Å; M377-F381 HydrophobicContact CE-CZ 4.11Å; M377-F381 WeakPolarHBondContact O-CD2 3.4Å; M377-F381 WeakPolarHBondContact O-CG 3.3Å; M377-F381 PolarHBondContact O-N 3.33Å; M377-F381 VanDerWaalsContact O-N 3.15Å; M377-F381 HydrophobicContact SD-CZ 4.43Å; L378-F381 PolarHBondContact O-N 3.44Å; F381-D384 PolarHBondContact O-N 3.49Å; F381-G385 PolarHBondContact O-N 2.98Å; F381-L386 HydrophobicContact CB-CB 4.08Å; F381-L386 HydrophobicContact CD1-CD1 4.27Å; F381-L386 WeakPolarHBondContact O-CB 3.25Å; F381-L386 PolarHBondContact O-N 3.45Å; F381-Y390 AromaticContact CD2-CD2 3.46Å; F381-Y390 HydrophobicContact CD2-CD2 3.46Å; F381-Y390 VanDerWaalsContact CD2-CD2 3.46Å; F381-Y390 HydrophobicContact CD2-CE2 4.07Å; F381-Y390 HydrophobicContact CD2-CG 4.17Å; F381-Y390 AromaticContact CE2-CD2 3.87Å; F381-Y390 HydrophobicContact CE2-CD2 3.87Å; F381-Y390 HydrophobicContact CE2-CE2 4.33Å; F381-Y390 HydrophobicContact CG-CD2 4.48Å
382	L	95.7	Very high	96.6	Very high	56 Å²	56	31.4 Å²	31.4	29%	0.293	18%	0.184	S	C	.	.	H	α-helix	trans	-64.5	-44	174	-65.1	179.9	0	0	0	111.3	L378 L380 D384 G385 L387 V456	L378-L382 HydrophobicContact CD1-CD1 4.05Å; L378-L382 HydrophobicContact CD1-CD2 4.05Å; L378-L382 HydrophobicContact CD1-CG 3.8Å; L378-L382 HydrophobicContact CG-CD1 4.09Å; L378-L382 HydrophobicContact CG-CG 4.26Å; L378-L382 WeakPolarHBondContact O-CG 3.07Å; L378-L382 PolarHBondContact O-N 2.95Å; L380-L382 VanDerWaalsContact C-N 3.3Å; L380-L382 PolarHBondContact O-N 3.38Å; L382-D384 PolarHBondContact O-N 3.45Å; L382-G385 PolarHBondContact O-N 3.21Å; L382-L387 HydrophobicContact CD2-CB 4.31Å; L382-L387 HydrophobicContact CD2-CD1 3.91Å; L382-V456 HydrophobicContact CD1-CG2 4.36Å; L382-V456 HydrophobicContact CD2-CG2 3.77Å
383	K	93.6	Very high	96.5	Very high	144 Å²	144	32.1 Å²	32.1	63%	0.626	19%	0.189	S	C	*	.	H	α-helix	trans	-58.9	-32.1	178	-176	176.8	177.7	-179	0	112.9	K31 P379 L380	K31-K383 PolarHBondContact NZ-O 3.41Å; P379-K383 PolarHBondContact O-N 3.41Å; P379-K383 VanDerWaalsContact O-N 3.09Å; L380-K383 WeakPolarHBondContact O-CB 3.15Å; L380-K383 PolarHBondContact O-N 2.87Å; L380-K383 VanDerWaalsContact O-N 3.15Å
384	D	95.4	Very high	96.4	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.027	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.4	-177.9	-59.4	-33.2	0	0	0	114.2	S25 S27 H163 L380 F381 L382 L386	S25-D384 WeakPolarHBondContact CB-O 3.46Å; S25-D384 PolarHBondContact OG-O 2.92Å; S27-D384 WeakPolarHBondContact CA-OD1 3.36Å; S27-D384 PolarHBondContact OG-OD1 3.46Å; H163-D384 IonicContact CE1-OD2 3.99Å; H163-D384 IonicContact CG-OD2 2.72Å; H163-D384 IonicContact ND1-OD2 3.9Å; H163-D384 PolarHBondContact ND1-OD2 3.4Å; L380-D384 PolarHBondContact O-N 2.89Å; L380-D384 VanDerWaalsContact O-N 3.16Å; F381-D384 PolarHBondContact O-N 3.49Å; L382-D384 PolarHBondContact O-N 3.45Å; D384-L386 HydrophobicContact CB-CD1 3.94Å; D384-L386 HydrophobicContact CB-CG 4.07Å
385	G	95.6	Very high	96.2	Very high	50 Å²	50	37.5 Å²	37.5	52%	0.515	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	30.7	-178.4	0	0	0	0	0	113.8	F381 L382	F381-G385 PolarHBondContact O-N 2.98Å; L382-G385 PolarHBondContact O-N 3.21Å
386	L	97.1	Very high	96.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.234	C	C	.	.			trans	-99.9	24.3	-176.9	-66	171.9	0	0	0	113.4	N24 S25 H163 F381 D384 V388 P389 Y390	N24-L386 HydrophobicContact CB-CD2 3.72Å; S25-L386 WeakPolarHBondContact O-CD2 3.42Å; H163-L386 HydrophobicContact CB-CD1 4.47Å; F381-L386 HydrophobicContact CB-CB 4.08Å; F381-L386 HydrophobicContact CD1-CD1 4.27Å; F381-L386 WeakPolarHBondContact O-CB 3.25Å; F381-L386 PolarHBondContact O-N 3.45Å; D384-L386 HydrophobicContact CB-CD1 3.94Å; D384-L386 HydrophobicContact CB-CG 4.07Å; L386-V388 PolarHBondContact O-N 2.95Å; L386-P389 HydrophobicContact CB-CG 4.09Å; L386-P389 HydrophobicContact CD2-CG 3.96Å; L386-P389 VanDerWaalsContact O-CD 3.3Å; L386-P389 WeakPolarHBondContact O-CD 3.27Å; L386-P389 VanDerWaalsContact O-CG 3.3Å; L386-P389 WeakPolarHBondContact O-CG 3.44Å; L386-Y390 VanDerWaalsContact O-CB 3.23Å; L386-Y390 WeakPolarHBondContact O-CB 3.43Å; L386-Y390 PolarHBondContact O-N 3.15Å
387	L	96.5	Very high	96	Very high	59 Å²	59	39 Å²	39	31%	0.309	23%	0.232	S	C	.	.	H	α-helix	trans	-58.8	-48	-177	177.2	59.8	0	0	0	112.6	L382 Y390 T391 V456	L382-L387 HydrophobicContact CD2-CB 4.31Å; L382-L387 HydrophobicContact CD2-CD1 3.91Å; L387-Y390 HydrophobicContact CD1-CD1 4.48Å; L387-Y390 WeakPolarHBondContact O-CB 3.45Å; L387-Y390 PolarHBondContact O-N 2.67Å; L387-T391 PolarHBondContact O-N 3.07Å; L387-T391 PolarHBondContact O-OG1 3.12Å; L387-T391 VanDerWaalsContact O-OG1 3.05Å; L387-V456 HydrophobicContact CD1-CG2 3.89Å; L387-V456 HydrophobicContact CD2-CG1 3.86Å; L387-V456 HydrophobicContact CD2-CG2 4.1Å
388	V	96.7	Very high	95.7	Very high	99 Å²	99	39.6 Å²	39.6	60%	0.6	24%	0.236	S	C	*	.	H	α-helix	trans	-60.3	-55.8	-178.7	177.8	0	0	0	0	112.5	L386 Y390 T391 V392	L386-V388 PolarHBondContact O-N 2.95Å; V388-Y390 PolarHBondContact O-N 3.29Å; V388-T391 PolarHBondContact O-N 3.08Å; V388-V392 WeakPolarHBondContact O-CG2 3.18Å; V388-V392 PolarHBondContact O-N 3.35Å; V388-V392 VanDerWaalsContact O-N 3.08Å
389	P	97.5	Very high	95.4	Very high	8 Å²	8	47.3 Å²	47.3	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-33.8	178.2	24.1	-33.8	0	0	0	112	V21 N24 L158 L386 T393	V21-P389 HydrophobicContact CB-CB 4.41Å; V21-P389 HydrophobicContact CG1-CB 4.14Å; V21-P389 HydrophobicContact CG2-CB 3.9Å; N24-P389 HydrophobicContact CB-CG 4.2Å; L158-P389 HydrophobicContact CD2-CB 3.86Å; L158-P389 HydrophobicContact CD2-CG 4.33Å; L386-P389 HydrophobicContact CB-CG 4.09Å; L386-P389 HydrophobicContact CD2-CG 3.96Å; L386-P389 VanDerWaalsContact O-CD 3.3Å; L386-P389 WeakPolarHBondContact O-CD 3.27Å; L386-P389 VanDerWaalsContact O-CG 3.3Å; L386-P389 WeakPolarHBondContact O-CG 3.44Å; P389-T393 WeakPolarHBondContact O-CB 3.32Å; P389-T393 WeakPolarHBondContact O-CG2 3.37Å; P389-T393 PolarHBondContact O-N 2.93Å; P389-T393 VanDerWaalsContact O-N 3.08Å; P389-T393 PolarHBondContact O-OG1 3.03Å
390	Y	97.9	Very high	95.2	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-59.2	-55.4	172.1	168	-97.2	0	0	0	111.4	L158 T374 L378 F381 L386 L387 V388 V392 T393 F394 S452	L158-Y390 HydrophobicContact CD1-CD2 4.03Å; T374-Y390 HydrophobicContact CG2-CD2 4.21Å; T374-Y390 HydrophobicContact CG2-CE2 4.06Å; L378-Y390 HydrophobicContact CB-CE2 4.45Å; L378-Y390 HydrophobicContact CD1-CD1 3.93Å; L378-Y390 HydrophobicContact CD1-CE1 3.58Å; L378-Y390 HydrophobicContact CD1-CE2 4.29Å; L378-Y390 HydrophobicContact CD1-CG 4.44Å; F381-Y390 AromaticContact CD2-CD2 3.46Å; F381-Y390 HydrophobicContact CD2-CD2 3.46Å; F381-Y390 VanDerWaalsContact CD2-CD2 3.46Å; F381-Y390 HydrophobicContact CD2-CE2 4.07Å; F381-Y390 HydrophobicContact CD2-CG 4.17Å; F381-Y390 AromaticContact CE2-CD2 3.87Å; F381-Y390 HydrophobicContact CE2-CD2 3.87Å; F381-Y390 HydrophobicContact CE2-CE2 4.33Å; F381-Y390 HydrophobicContact CG-CD2 4.48Å; L386-Y390 VanDerWaalsContact O-CB 3.23Å; L386-Y390 WeakPolarHBondContact O-CB 3.43Å; L386-Y390 PolarHBondContact O-N 3.15Å; L387-Y390 HydrophobicContact CD1-CD1 4.48Å; L387-Y390 WeakPolarHBondContact O-CB 3.45Å; L387-Y390 PolarHBondContact O-N 2.67Å; V388-Y390 PolarHBondContact O-N 3.29Å; Y390-V392 PolarHBondContact O-N 3.21Å; Y390-T393 PolarHBondContact O-N 3.4Å; Y390-T393 PolarHBondContact O-OG1 2.9Å; Y390-F394 HydrophobicContact CD2-CB 4.5Å; Y390-F394 HydrophobicContact CE1-CB 4.41Å; Y390-F394 HydrophobicContact CE1-CD2 4.37Å; Y390-F394 HydrophobicContact CE1-CG 4.33Å; Y390-F394 HydrophobicContact CE2-CB 4.27Å; Y390-F394 AromaticContact CE2-CD2 3.67Å; Y390-F394 HydrophobicContact CE2-CD2 3.67Å; Y390-F394 HydrophobicContact CE2-CE2 4.4Å; Y390-F394 HydrophobicContact CE2-CG 4.24Å; Y390-F394 AromaticContact CZ-CD2 3.52Å; Y390-F394 AromaticContact CZ-CG 3.91Å; Y390-F394 WeakPolarHBondContact O-CB 3.27Å; Y390-F394 PolarHBondContact O-N 3.48Å; Y390-F394 VanDerWaalsContact OH-CD2 3.26Å; Y390-F394 WeakPolarHBondContact OH-CD2 3.37Å; Y390-F394 VanDerWaalsContact OH-CE2 3.28Å; Y390-F394 WeakPolarHBondContact OH-CE2 3.46Å; Y390-S452 PolarHBondContact OH-OG 2.85Å
391	T	96.6	Very high	94.9	Very high	58 Å²	58	46.6 Å²	46.6	36%	0.356	26%	0.263	S	S	.	.	H	α-helix	trans	-59.3	-45	-176.9	-59.3	0	0	0	0	112	L387 V388 L395	L387-T391 PolarHBondContact O-N 3.07Å; L387-T391 PolarHBondContact O-OG1 3.12Å; L387-T391 VanDerWaalsContact O-OG1 3.05Å; V388-T391 PolarHBondContact O-N 3.08Å; T391-L395 HydrophobicContact CG2-CD1 3.91Å; T391-L395 WeakPolarHBondContact O-CB 3.41Å; T391-L395 WeakPolarHBondContact O-CG 3.3Å; T391-L395 PolarHBondContact O-N 3.18Å; T391-L395 VanDerWaalsContact O-N 3.08Å
392	V	96.8	Very high	94.5	Very high	100 Å²	100	47.7 Å²	47.7	61%	0.606	27%	0.27	S	S	*	.	H	α-helix	trans	-62.3	-48.8	179.9	173.7	0	0	0	0	111.1	V388 Y390 G396	V388-V392 WeakPolarHBondContact O-CG2 3.18Å; V388-V392 PolarHBondContact O-N 3.35Å; V388-V392 VanDerWaalsContact O-N 3.08Å; Y390-V392 PolarHBondContact O-N 3.21Å; V392-G396 PolarHBondContact O-N 3.26Å
393	T	96.3	Very high	94.1	Very high	16 Å²	16	53.5 Å²	53.5	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-73.4	-36.6	-177.7	57.5	0	0	0	0	112.4	V17 P389 Y390 L395 F397	V17-T393 HydrophobicContact CG1-CG2 4.44Å; P389-T393 WeakPolarHBondContact O-CB 3.32Å; P389-T393 WeakPolarHBondContact O-CG2 3.37Å; P389-T393 PolarHBondContact O-N 2.93Å; P389-T393 VanDerWaalsContact O-N 3.08Å; P389-T393 PolarHBondContact O-OG1 3.03Å; Y390-T393 PolarHBondContact O-N 3.4Å; Y390-T393 PolarHBondContact O-OG1 2.9Å; T393-L395 PolarHBondContact O-N 2.89Å; T393-F397 WeakPolarHBondContact O-CB 3.35Å; T393-F397 PolarHBondContact O-N 3.38Å
394	F	95	Very high	93.8	Very high	8 Å²	8	49 Å²	49	4%	0.035	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-39.5	177	-176.4	-87.7	0	0	0	112.4	Q371 F375 Y390 P398 M448	Q371-F394 HydrophobicContact CG-CE2 4Å; Q371-F394 HydrophobicContact CG-CZ 4.22Å; Q371-F394 PolarHBondContact NE2-O 3.16Å; F375-F394 HydrophobicContact CB-CE2 4.02Å; F375-F394 HydrophobicContact CD2-CE2 4.45Å; Y390-F394 HydrophobicContact CD2-CB 4.5Å; Y390-F394 HydrophobicContact CE1-CB 4.41Å; Y390-F394 HydrophobicContact CE1-CD2 4.37Å; Y390-F394 HydrophobicContact CE1-CG 4.33Å; Y390-F394 HydrophobicContact CE2-CB 4.27Å; Y390-F394 AromaticContact CE2-CD2 3.67Å; Y390-F394 HydrophobicContact CE2-CD2 3.67Å; Y390-F394 HydrophobicContact CE2-CE2 4.4Å; Y390-F394 HydrophobicContact CE2-CG 4.24Å; Y390-F394 AromaticContact CZ-CD2 3.52Å; Y390-F394 AromaticContact CZ-CG 3.91Å; Y390-F394 WeakPolarHBondContact O-CB 3.27Å; Y390-F394 PolarHBondContact O-N 3.48Å; Y390-F394 VanDerWaalsContact OH-CD2 3.26Å; Y390-F394 WeakPolarHBondContact OH-CD2 3.37Å; Y390-F394 VanDerWaalsContact OH-CE2 3.28Å; Y390-F394 WeakPolarHBondContact OH-CE2 3.46Å; F394-P398 WeakPolarHBondContact O-CD 3.36Å; F394-P398 VanDerWaalsContact O-CG 3.26Å; F394-P398 WeakPolarHBondContact O-CG 3.48Å; F394-M448 HydrophobicContact CZ-CB 3.9Å
395	L	94.1	Very high	93.3	Very high	104 Å²	104	48.7 Å²	48.7	55%	0.545	27%	0.27	S	S	.	.	H	α-helix	trans	-81.9	-42.1	177.2	-64.6	174.8	0	0	0	112	T391 T393 P398	T391-L395 HydrophobicContact CG2-CD1 3.91Å; T391-L395 WeakPolarHBondContact O-CB 3.41Å; T391-L395 WeakPolarHBondContact O-CG 3.3Å; T391-L395 PolarHBondContact O-N 3.18Å; T391-L395 VanDerWaalsContact O-N 3.08Å; T393-L395 PolarHBondContact O-N 2.89Å; L395-P398 WeakPolarHBondContact O-CD 3.28Å
396	G	94.7	Very high	92.7	Very high	35 Å²	35	48.9 Å²	48.9	36%	0.361	26%	0.264	S	S	.	.	H	α-helix	trans	-70.4	-40.4	-175.4	0	0	0	0	0	114	V392 F399 L400	V392-G396 PolarHBondContact O-N 3.26Å; G396-F399 PolarHBondContact O-N 3.31Å; G396-L400 VanDerWaalsContact O-CB 3.32Å; G396-L400 WeakPolarHBondContact O-CB 3.49Å; G396-L400 PolarHBondContact O-N 2.97Å
397	F	95.4	Very high	91.5	Very high	7 Å²	7	48.9 Å²	48.9	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-53.1	-176.2	173.9	-103.5	0	0	0	114.9	S149 L152 P154 V367 L370 T393 L400 T401	S149-F397 WeakPolarHBondContact O-CE2 3.33Å; L152-F397 HydrophobicContact CB-CD2 4.49Å; L152-F397 WeakPolarHBondContact O-CD2 3.4Å; P154-F397 VanDerWaalsContact CD-CG 3.43Å; P154-F397 HydrophobicContact CG-CB 3.43Å; P154-F397 VanDerWaalsContact CG-CB 3.43Å; P154-F397 HydrophobicContact CG-CD1 4.12Å; P154-F397 HydrophobicContact CG-CD2 4.16Å; P154-F397 HydrophobicContact CG-CG 3.64Å; V367-F397 HydrophobicContact CG1-CE1 4.49Å; L370-F397 HydrophobicContact CB-CE1 3.9Å; L370-F397 HydrophobicContact CB-CZ 4.15Å; L370-F397 HydrophobicContact CD1-CE1 4.39Å; L370-F397 HydrophobicContact CD1-CZ 3.84Å; T393-F397 WeakPolarHBondContact O-CB 3.35Å; T393-F397 PolarHBondContact O-N 3.38Å; F397-L400 PolarHBondContact O-N 3.21Å; F397-T401 WeakPolarHBondContact CE2-OG1 3.32Å; F397-T401 WeakPolarHBondContact O-CB 3.29Å; F397-T401 PolarHBondContact O-N 3.04Å; F397-T401 PolarHBondContact O-OG1 3Å
398	P	91.8	Very high	90.4	Very high	12 Å²	12	47.5 Å²	47.5	8%	0.078	26%	0.256	C	S	.	.	H	α-helix	trans	-66.2	-38.6	180	26.1	-34.6	0	0	0	111.4	V367 F394 L395 T401 V402 M445	V367-P398 HydrophobicContact CG1-CB 4.36Å; F394-P398 WeakPolarHBondContact O-CD 3.36Å; F394-P398 VanDerWaalsContact O-CG 3.26Å; F394-P398 WeakPolarHBondContact O-CG 3.48Å; L395-P398 WeakPolarHBondContact O-CD 3.28Å; P398-T401 PolarHBondContact O-N 3.15Å; P398-V402 WeakPolarHBondContact O-CB 3.32Å; P398-V402 WeakPolarHBondContact O-CG2 3.29Å; P398-V402 PolarHBondContact O-N 3.42Å; P398-M445 HydrophobicContact CB-CE 4.05Å; P398-M445 HydrophobicContact CG-CE 3.89Å
399	F	89.9	Confident	89.2	Confident	163 Å²	163	48.1 Å²	48.1	72%	0.715	26%	0.256	S	S	*	.	H	α-helix	trans	-58.3	-51.8	176.3	176.7	-99.2	0	0	0	111.3	G396 Y403	G396-F399 PolarHBondContact O-N 3.31Å; F399-Y403 VanDerWaalsContact O-CB 3.31Å; F399-Y403 WeakPolarHBondContact O-CB 3.42Å; F399-Y403 PolarHBondContact O-N 3.34Å
400	L	91.3	Very high	87.7	Confident	51 Å²	51	49.8 Å²	49.8	27%	0.267	27%	0.265	S	S	.	.	H	α-helix	trans	-63.9	-48	-179.9	-178.7	65.8	0	0	0	111.6	L148 L152 G396 F397 Y403 L404	L148-L400 HydrophobicContact CD2-CD2 4.48Å; L152-L400 HydrophobicContact CD1-CD2 3.36Å; G396-L400 VanDerWaalsContact O-CB 3.32Å; G396-L400 WeakPolarHBondContact O-CB 3.49Å; G396-L400 PolarHBondContact O-N 2.97Å; F397-L400 PolarHBondContact O-N 3.21Å; L400-Y403 PolarHBondContact O-N 3.41Å; L400-L404 HydrophobicContact CD1-CD1 3.7Å; L400-L404 HydrophobicContact CD1-CG 3.94Å; L400-L404 HydrophobicContact CD2-CD1 4.32Å; L400-L404 HydrophobicContact CG-CD1 3.68Å; L400-L404 HydrophobicContact CG-CG 4.23Å; L400-L404 WeakPolarHBondContact O-CB 3.37Å; L400-L404 VanDerWaalsContact O-CG 3.23Å; L400-L404 WeakPolarHBondContact O-CG 3.23Å; L400-L404 PolarHBondContact O-N 3.29Å
401	T	89.1	Confident	86	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-73.6	-39.2	-172.4	-58	0	0	0	0	112.3	S149 V367 F397 P398 Y403 L404 L405	S149-T401 WeakPolarHBondContact OG-CG2 3.41Å; S149-T401 PolarHBondContact OG-OG1 3.1Å; V367-T401 HydrophobicContact CG2-CG2 3.32Å; F397-T401 WeakPolarHBondContact CE2-OG1 3.32Å; F397-T401 WeakPolarHBondContact O-CB 3.29Å; F397-T401 PolarHBondContact O-N 3.04Å; F397-T401 PolarHBondContact O-OG1 3Å; P398-T401 PolarHBondContact O-N 3.15Å; T401-Y403 VanDerWaalsContact C-N 3.28Å; T401-Y403 PolarHBondContact O-N 2.8Å; T401-L404 PolarHBondContact O-N 2.98Å; T401-L405 HydrophobicContact CG2-CD1 3.56Å; T401-L405 HydrophobicContact CG2-CG 4.05Å; T401-L405 VanDerWaalsContact O-CB 3.29Å; T401-L405 WeakPolarHBondContact O-CB 3.47Å; T401-L405 WeakPolarHBondContact O-CG 3.49Å; T401-L405 PolarHBondContact O-N 3.02Å
402	V	87	Confident	84.1	Confident	23 Å²	23	50.5 Å²	50.5	14%	0.139	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-40.8	174.9	170.1	0	0	0	0	110.6	V367 P398 S406 A407 L408 F441	V367-V402 HydrophobicContact CG1-CG2 4.14Å; P398-V402 WeakPolarHBondContact O-CB 3.32Å; P398-V402 WeakPolarHBondContact O-CG2 3.29Å; P398-V402 PolarHBondContact O-N 3.42Å; V402-S406 WeakPolarHBondContact O-CA 3.39Å; V402-S406 PolarHBondContact O-N 3.42Å; V402-A407 HydrophobicContact CB-CB 4.47Å; V402-A407 HydrophobicContact CG1-CB 4.4Å; V402-A407 HydrophobicContact CG2-CB 4.33Å; V402-A407 PolarHBondContact O-N 3.45Å; V402-L408 HydrophobicContact CG1-CD1 3.57Å; V402-L408 HydrophobicContact CG1-CG 3.68Å; V402-F441 HydrophobicContact CG2-CZ 4.37Å
403	Y	87.6	Confident	82	Confident	177 Å²	177	51 Å²	51	69%	0.694	27%	0.268	S	S	*	.	H	α-helix	trans	-66.2	-52.8	176	178.3	-100	0	0	0	112.2	F399 L400 T401 L405 S406	F399-Y403 VanDerWaalsContact O-CB 3.31Å; F399-Y403 WeakPolarHBondContact O-CB 3.42Å; F399-Y403 PolarHBondContact O-N 3.34Å; L400-Y403 PolarHBondContact O-N 3.41Å; T401-Y403 VanDerWaalsContact C-N 3.28Å; T401-Y403 PolarHBondContact O-N 2.8Å; Y403-L405 VanDerWaalsContact C-N 3.28Å; Y403-L405 PolarHBondContact O-N 2.64Å; Y403-S406 PolarHBondContact O-N 2.84Å
404	L	86.9	Confident	80	Confident	49 Å²	49	51.5 Å²	51.5	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-65	-30.4	-176.4	-74	179.4	0	0	0	113.8	S145 L148 L400 T401	S145-L404 PolarHBondContact OG-O 2.95Å; L148-L404 HydrophobicContact CD2-CD1 3.79Å; L148-L404 HydrophobicContact CG-CD1 4.43Å; L400-L404 HydrophobicContact CD1-CD1 3.7Å; L400-L404 HydrophobicContact CD1-CG 3.94Å; L400-L404 HydrophobicContact CD2-CD1 4.32Å; L400-L404 HydrophobicContact CG-CD1 3.68Å; L400-L404 HydrophobicContact CG-CG 4.23Å; L400-L404 WeakPolarHBondContact O-CB 3.37Å; L400-L404 VanDerWaalsContact O-CG 3.23Å; L400-L404 WeakPolarHBondContact O-CG 3.23Å; L400-L404 PolarHBondContact O-N 3.29Å; T401-L404 PolarHBondContact O-N 2.98Å
405	L	85.1	Confident	78	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	3.1	-179.9	-57.9	-176.5	0	0	0	113.1	R142 I146 L359 P363 T401 Y403 A407	R142-L405 VanDerWaalsContact NH1-C 3.25Å; R142-L405 VanDerWaalsContact NH1-CA 3.28Å; R142-L405 PolarHBondContact NH1-O 3.13Å; I146-L405 HydrophobicContact CG1-CD2 3.66Å; L359-L405 HydrophobicContact CD2-CD1 3.96Å; P363-L405 HydrophobicContact CB-CB 4.13Å; P363-L405 HydrophobicContact CB-CD1 4.19Å; T401-L405 HydrophobicContact CG2-CD1 3.56Å; T401-L405 HydrophobicContact CG2-CG 4.05Å; T401-L405 VanDerWaalsContact O-CB 3.29Å; T401-L405 WeakPolarHBondContact O-CB 3.47Å; T401-L405 WeakPolarHBondContact O-CG 3.49Å; T401-L405 PolarHBondContact O-N 3.02Å; Y403-L405 VanDerWaalsContact C-N 3.28Å; Y403-L405 PolarHBondContact O-N 2.64Å; L405-A407 PolarHBondContact O-N 3.32Å
406	S	82.9	Confident	75.8	Confident	54 Å²	54	52.9 Å²	52.9	38%	0.378	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.2	38.4	-173.5	-60.1	0	0	0	0	111.9	V402 Y403 L408 D409 D410	V402-S406 WeakPolarHBondContact O-CA 3.39Å; V402-S406 PolarHBondContact O-N 3.42Å; Y403-S406 PolarHBondContact O-N 2.84Å; S406-L408 PolarHBondContact O-N 3.02Å; S406-L408 VanDerWaalsContact O-N 3.09Å; S406-D409 WeakPolarHBondContact O-CA 3.47Å; S406-D409 PolarHBondContact O-N 2.73Å; S406-D410 PolarHBondContact O-N 2.87Å
407	A	72.3	Confident	73.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-30.9	-162.4	0	0	0	0	0	112.8	P363 L364 V402 L405 C411	P363-A407 HydrophobicContact CB-CB 3.84Å; P363-A407 HydrophobicContact CG-CB 4.3Å; L364-A407 HydrophobicContact CB-CB 4.43Å; V402-A407 HydrophobicContact CB-CB 4.47Å; V402-A407 HydrophobicContact CG1-CB 4.4Å; V402-A407 HydrophobicContact CG2-CB 4.33Å; V402-A407 PolarHBondContact O-N 3.45Å; L405-A407 PolarHBondContact O-N 3.32Å; A407-C411 WeakPolarHBondContact O-CB 3.31Å; A407-C411 PolarHBondContact O-N 3.33Å
408	L	74.7	Confident	71.6	Confident	30 Å²	30	57.9 Å²	57.9	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-74.3	-30.9	176.1	-68.9	167.2	0	0	0	112.6	L364 V402 S406 K438 F441 Y442	L364-L408 HydrophobicContact CD1-CD2 3.99Å; V402-L408 HydrophobicContact CG1-CD1 3.57Å; V402-L408 HydrophobicContact CG1-CG 3.68Å; S406-L408 PolarHBondContact O-N 3.02Å; S406-L408 VanDerWaalsContact O-N 3.09Å; L408-K438 HydrophobicContact CD2-CG 4.1Å; L408-K438 WeakPolarHBondContact O-CE 3.24Å; L408-K438 PolarHBondContact O-NZ 2.97Å; L408-F441 HydrophobicContact CD2-CD1 4.44Å; L408-Y442 WeakPolarHBondContact CD1-OH 3.31Å
409	D	71.3	Confident	69.7	Low	111 Å²	111	58.5 Å²	58.5	59%	0.594	30%	0.299	S	S	*	.	H	α-helix	trans	-78.1	-45.3	177.9	-60.2	-33	0	0	0	109.9	S406 C411 S412	S406-D409 WeakPolarHBondContact O-CA 3.47Å; S406-D409 PolarHBondContact O-N 2.73Å; D409-C411 PolarHBondContact O-N 3.21Å; D409-S412 WeakPolarHBondContact O-CB 3.31Å; D409-S412 PolarHBondContact O-N 2.98Å; D409-S412 VanDerWaalsContact O-N 3.14Å
410	D	66.1	Low	67.9	Low	44 Å²	44	52.2 Å²	52.2	24%	0.235	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-30.1	177.1	-76.5	-7.6	0	0	0	112.5	R142 P363 S406 S412 E413 D414	R142-D410 IonicContact CZ-OD2 3.28Å; R142-D410 IonicContact NH1-OD2 2.65Å; R142-D410 PolarHBondContact NH1-OD2 3.04Å; R142-D410 IonicContact NH2-OD2 3.49Å; R142-D410 PolarHBondContact NH2-OD2 3.49Å; P363-D410 HydrophobicContact CG-CB 3.89Å; S406-D410 PolarHBondContact O-N 2.87Å; D410-S412 PolarHBondContact O-N 3.26Å; D410-S412 VanDerWaalsContact O-N 3.14Å; D410-E413 PolarHBondContact O-N 2.97Å; D410-D414 PolarHBondContact O-N 3.06Å
411	C	61.9	Low	65.8	Low	11 Å²	11	51.4 Å²	51.4	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-31.8	176.2	-178	0	0	0	0	113	L364 A407 D409 E413 E415	L364-C411 HydrophobicContact CB-CB 4.47Å; L364-C411 HydrophobicContact CD2-CB 3.83Å; L364-C411 VanDerWaalsContact CD2-SG 3.51Å; A407-C411 WeakPolarHBondContact O-CB 3.31Å; A407-C411 PolarHBondContact O-N 3.33Å; D409-C411 PolarHBondContact O-N 3.21Å; C411-E413 VanDerWaalsContact C-N 3.32Å; C411-E415 PolarHBondContact O-N 3.28Å
412	S	55.8	Low	63.9	Low	65 Å²	65	53.2 Å²	53.2	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-67.8	-32.3	175.8	-178.9	0	0	0	0	112.5	D409 D410	D409-S412 WeakPolarHBondContact O-CB 3.31Å; D409-S412 PolarHBondContact O-N 2.98Å; D409-S412 VanDerWaalsContact O-N 3.14Å; D410-S412 PolarHBondContact O-N 3.26Å; D410-S412 VanDerWaalsContact O-N 3.14Å
413	E	53.6	Low	62.3	Low	110 Å²	110	60.5 Å²	60.5	51%	0.514	32%	0.319	S	S	.	.	H	α-helix	trans	-85	-37.6	-178.7	-73.1	-155.1	169.9	0	0	112.7	D410 C411 L416 K417	D410-E413 PolarHBondContact O-N 2.97Å; C411-E413 VanDerWaalsContact C-N 3.32Å; E413-L416 WeakPolarHBondContact O-CA 3.43Å; E413-L416 WeakPolarHBondContact O-CB 3.48Å; E413-L416 PolarHBondContact O-N 3.4Å; E413-L416 VanDerWaalsContact O-N 3.11Å; E413-K417 WeakPolarHBondContact O-CG 3.48Å; E413-K417 PolarHBondContact O-N 3.35Å; E413-K417 IonicContact OE2-NZ 3.47Å; E413-K417 PolarHBondContact OE2-NZ 2.9Å
414	D	54.4	Low	60.6	Low	28 Å²	28	58.5 Å²	58.5	15%	0.15	32%	0.32	C	S	.	.	H	α-helix	trans	-69.4	-38	-176.3	-68.4	-26.4	0	0	0	111.6	D410 L416 K417 L418	D410-D414 PolarHBondContact O-N 3.06Å; D414-L416 VanDerWaalsContact C-N 3.27Å; D414-L416 PolarHBondContact O-N 2.74Å; D414-K417 PolarHBondContact O-N 2.93Å; D414-K417 IonicContact OD1-NZ 2.86Å; D414-K417 PolarHBondContact OD1-NZ 3.24Å; D414-L418 WeakPolarHBondContact O-CB 3.33Å; D414-L418 PolarHBondContact O-N 2.85Å
415	E	51.3	Low	59.1	Low	33 Å²	33	61.5 Å²	61.5	15%	0.154	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-33.8	169.1	-72.4	-170.6	177.7	0	0	113	C411 K417 L418 G419 L433 A434 M437	C411-E415 PolarHBondContact O-N 3.28Å; E415-K417 VanDerWaalsContact C-N 3.31Å; E415-L418 PolarHBondContact O-N 3.02Å; E415-G419 PolarHBondContact O-N 3.48Å; E415-L433 HydrophobicContact CG-CD2 4.4Å; E415-L433 WeakPolarHBondContact OE2-CB 3.3Å; E415-L433 WeakPolarHBondContact OE2-CG 3.44Å; E415-A434 VanDerWaalsContact CD-CA 3.46Å; E415-A434 WeakPolarHBondContact OE1-CA 3.41Å; E415-A434 WeakPolarHBondContact OE2-CA 3.23Å; E415-A434 VanDerWaalsContact OE2-CB 3.26Å; E415-A434 WeakPolarHBondContact OE2-CB 3.44Å; E415-A434 PolarHBondContact OE2-N 3.07Å; E415-M437 WeakPolarHBondContact OE1-CB 3.09Å; E415-M437 WeakPolarHBondContact OE1-CG 3.15Å
416	L	48.3	Very low	57.6	Low	107 Å²	107	66.4 Å²	66.4	56%	0.56	36%	0.363	S	S	*	.	H	α-helix	trans	-65.6	-36.9	176.1	-149	86.8	0	0	0	111.4	E413 D414 K430	E413-L416 WeakPolarHBondContact O-CA 3.43Å; E413-L416 WeakPolarHBondContact O-CB 3.48Å; E413-L416 PolarHBondContact O-N 3.4Å; E413-L416 VanDerWaalsContact O-N 3.11Å; D414-L416 VanDerWaalsContact C-N 3.27Å; D414-L416 PolarHBondContact O-N 2.74Å; L416-K430 HydrophobicContact CD1-CD 3.86Å
417	K	50	Low	56.3	Low	109 Å²	109	71.7 Å²	71.7	47%	0.474	39%	0.386	S	S	.	.	H	α-helix	trans	-76.4	-36.5	177.5	-71.3	167.8	-166.3	146.5	0	112.6	E413 D414 E415 P496	E413-K417 WeakPolarHBondContact O-CG 3.48Å; E413-K417 PolarHBondContact O-N 3.35Å; E413-K417 IonicContact OE2-NZ 3.47Å; E413-K417 PolarHBondContact OE2-NZ 2.9Å; D414-K417 PolarHBondContact O-N 2.93Å; D414-K417 IonicContact OD1-NZ 2.86Å; D414-K417 PolarHBondContact OD1-NZ 3.24Å; E415-K417 VanDerWaalsContact C-N 3.31Å; K417-P496 HydrophobicContact CB-CB 4.14Å; K417-P496 HydrophobicContact CB-CG 4.5Å
418	L	52.7	Low	55.6	Low	38 Å²	38	75.3 Å²	75.3	20%	0.199	40%	0.404	C	S	.	.	H	α-helix	trans	-79.2	-27.5	-170	-142.4	69.7	0	0	0	112.9	F362 D414 E415 I420 V490	F362-L418 HydrophobicContact CE1-CD1 4Å; F362-L418 HydrophobicContact CZ-CD1 4.05Å; D414-L418 WeakPolarHBondContact O-CB 3.33Å; D414-L418 PolarHBondContact O-N 2.85Å; E415-L418 PolarHBondContact O-N 3.02Å; L418-I420 HydrophobicContact CB-CD1 4.43Å; L418-I420 HydrophobicContact CB-CG1 4.05Å; L418-I420 HydrophobicContact CD1-CD1 4.46Å; L418-I420 HydrophobicContact CD2-CD1 3.25Å; L418-I420 HydrophobicContact CD2-CG1 3.75Å; L418-I420 HydrophobicContact CG-CD1 3.44Å; L418-I420 VanDerWaalsContact CG-CD1 3.44Å; L418-I420 HydrophobicContact CG-CG1 3.54Å; L418-I420 WeakPolarHBondContact O-CG1 3.45Å; L418-I420 PolarHBondContact O-N 3.22Å; L418-V490 HydrophobicContact CD1-CG2 4.2Å; L418-V490 HydrophobicContact CD2-CG2 3.93Å
419	G	51.6	Low	55	Low	26 Å²	26	77.4 Å²	77.4	27%	0.268	42%	0.42	S	S	.	.			trans	54.9	11.7	172.1	0	0	0	0	0	115.7	E415 K423	E415-G419 PolarHBondContact O-N 3.48Å; G419-K423 PolarHBondContact O-N 3.46Å
420	I	51.6	Low	54.6	Low	31 Å²	31	77.2 Å²	77.2	16%	0.159	41%	0.414	C	S	.	.	H	α-helix	trans	-71.4	-54.3	-170.6	-57.9	-167.2	0	0	0	110	L418 G422 K423 L424 V490 M493	L418-I420 HydrophobicContact CB-CD1 4.43Å; L418-I420 HydrophobicContact CB-CG1 4.05Å; L418-I420 HydrophobicContact CD1-CD1 4.46Å; L418-I420 HydrophobicContact CD2-CD1 3.25Å; L418-I420 HydrophobicContact CD2-CG1 3.75Å; L418-I420 HydrophobicContact CG-CD1 3.44Å; L418-I420 VanDerWaalsContact CG-CD1 3.44Å; L418-I420 HydrophobicContact CG-CG1 3.54Å; L418-I420 WeakPolarHBondContact O-CG1 3.45Å; L418-I420 PolarHBondContact O-N 3.22Å; I420-G422 VanDerWaalsContact C-N 3.34Å; I420-G422 PolarHBondContact O-N 2.9Å; I420-K423 PolarHBondContact O-N 3.22Å; I420-L424 PolarHBondContact O-N 3.49Å; I420-V490 HydrophobicContact CD1-CG2 4.4Å; I420-M493 HydrophobicContact CB-CE 4.14Å; I420-M493 HydrophobicContact CB-SD 4.13Å; I420-M493 HydrophobicContact CD1-SD 3.64Å; I420-M493 HydrophobicContact CG1-CE 3.81Å; I420-M493 HydrophobicContact CG1-SD 3.6Å; I420-M493 VanDerWaalsContact CG1-SD 3.6Å; I420-M493 HydrophobicContact CG2-CE 4.14Å; I420-M493 HydrophobicContact CG2-SD 3.76Å
421	C	46.8	Very low	54.3	Low	34 Å²	34	82 Å²	82	23%	0.23	44%	0.438	C	S	.	.	H	α-helix	trans	-73.1	-29.9	-177.2	-150	0	0	0	0	111.8	K423 L424 F425 L433	C421-K423 VanDerWaalsContact C-N 3.27Å; C421-K423 PolarHBondContact O-N 3.49Å; C421-L424 PolarHBondContact O-N 2.9Å; C421-F425 CarbonylContact O-C 3.6Å; C421-F425 WeakPolarHBondContact O-CA 3.47Å; C421-F425 PolarHBondContact O-N 3.41Å; C421-L433 HydrophobicContact CB-CD1 4.11Å; C421-L433 HydrophobicContact CB-CD2 3.31Å; C421-L433 HydrophobicContact CB-CG 4.35Å
422	G	50.4	Low	54.7	Low	37 Å²	37	87 Å²	87	38%	0.381	46%	0.46	S	S	.	.	H	α-helix	trans	-67.8	-22	175.8	0	0	0	0	0	114.5	I420	I420-G422 VanDerWaalsContact C-N 3.34Å; I420-G422 PolarHBondContact O-N 2.9Å
423	K	52.5	Low	55.3	Low	177 Å²	177	85.6 Å²	85.6	77%	0.77	45%	0.447	S	S	*	.	H	α-helix	trans	-87.6	-34.6	172.8	-77.1	-175.5	178.5	-179	0	113.1	G419 I420 C421	G419-K423 PolarHBondContact O-N 3.46Å; I420-K423 PolarHBondContact O-N 3.22Å; C421-K423 VanDerWaalsContact C-N 3.27Å; C421-K423 PolarHBondContact O-N 3.49Å
424	L	52.6	Low	56.2	Low	135 Å²	135	80.8 Å²	80.8	71%	0.707	43%	0.426	S	S	*	.	H	α-helix	trans	-83	-32.8	180	-130.2	89.7	0	0	0	112.8	I420 C421	I420-L424 PolarHBondContact O-N 3.49Å; C421-L424 PolarHBondContact O-N 2.9Å
425	F	54.5	Low	57.4	Low	111 Å²	111	82.3 Å²	82.3	49%	0.487	44%	0.438	S	S	.	.			trans	-131.4	76.5	-178.8	-67.4	-81.8	0	0	0	110.3	C421 L427 I428	C421-F425 CarbonylContact O-C 3.6Å; C421-F425 WeakPolarHBondContact O-CA 3.47Å; C421-F425 PolarHBondContact O-N 3.41Å; F425-L427 PolarHBondContact O-N 2.69Å; F425-L427 VanDerWaalsContact O-N 3.11Å; F425-I428 HydrophobicContact CB-CD1 4.04Å; F425-I428 HydrophobicContact CB-CG1 4.32Å; F425-I428 HydrophobicContact CG-CD1 4.37Å; F425-I428 PolarHBondContact O-N 3.18Å
426	P	55	Low	58.8	Low	104 Å²	104	84.2 Å²	84.2	68%	0.675	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.9	-174.9	24.1	-32.8	0	0	0	114.4
427	L	54.3	Low	60.5	Low	165 Å²	165	81.7 Å²	81.7	86%	0.864	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-10.6	179.9	-88.6	109.1	0	0	0	115	F425	F425-L427 PolarHBondContact O-N 2.69Å; F425-L427 VanDerWaalsContact O-N 3.11Å
428	I	58.4	Low	62.1	Low	75 Å²	75	79.2 Å²	79.2	39%	0.385	42%	0.424	S	S	.	.	S	Bend	trans	-97.8	120.1	-176.7	-57.1	176.9	0	0	0	109.5	F425 H432	F425-I428 HydrophobicContact CB-CD1 4.04Å; F425-I428 HydrophobicContact CB-CG1 4.32Å; F425-I428 HydrophobicContact CG-CD1 4.37Å; F425-I428 PolarHBondContact O-N 3.18Å; I428-H432 HydrophobicContact CG2-CB 4.08Å
429	P	61.8	Low	63.8	Low	74 Å²	74	85.1 Å²	85.1	48%	0.481	44%	0.444	S	S	.	.			trans	-63.6	140.6	177.1	-16.1	27.7	0	0	0	111.2	I431 H432 L433	P429-I431 PolarHBondContact O-N 3.11Å; P429-I431 VanDerWaalsContact O-N 3.11Å; P429-H432 WeakPolarHBondContact O-CB 2.9Å; P429-H432 PolarHBondContact O-N 3.27Å; P429-L433 PolarHBondContact O-N 3.27Å
430	K	62	Low	65.6	Low	108 Å²	108	89.1 Å²	89.1	47%	0.47	45%	0.454	S	S	.	.	H	α-helix	trans	-55.8	-32.5	-176.6	-63.1	-175.6	-178.3	-178.4	0	114	L416 H432 L433 A434	L416-K430 HydrophobicContact CD1-CD 3.86Å; K430-H432 VanDerWaalsContact C-N 3.3Å; K430-H432 PolarHBondContact O-N 2.99Å; K430-L433 PolarHBondContact O-N 3.38Å; K430-A434 PolarHBondContact O-N 3.32Å
431	I	61.3	Low	67.5	Low	145 Å²	145	88.1 Å²	88.1	74%	0.744	45%	0.448	S	S	*	.	H	α-helix	trans	-66	-34	177.9	-61.5	170.6	0	0	0	111.4	P429 L433 C435	P429-I431 PolarHBondContact O-N 3.11Å; P429-I431 VanDerWaalsContact O-N 3.11Å; I431-L433 VanDerWaalsContact C-N 3.35Å; I431-C435 PolarHBondContact O-N 3.33Å
432	H	69.8	Low	69.6	Low	116 Å²	116	92.1 Å²	92.1	54%	0.537	46%	0.459	S	S	.	.	H	α-helix	trans	-68.3	-35.7	175.6	-80.4	-87.5	0	0	0	111.7	I428 P429 K430 C435 I436	I428-H432 HydrophobicContact CG2-CB 4.08Å; P429-H432 WeakPolarHBondContact O-CB 2.9Å; P429-H432 PolarHBondContact O-N 3.27Å; K430-H432 VanDerWaalsContact C-N 3.3Å; K430-H432 PolarHBondContact O-N 2.99Å; H432-C435 PolarHBondContact O-N 3.16Å; H432-I436 WeakPolarHBondContact O-CB 3.41Å; H432-I436 WeakPolarHBondContact O-CD1 3.5Å; H432-I436 WeakPolarHBondContact O-CG1 3.41Å; H432-I436 PolarHBondContact O-N 3.04Å
433	L	69.3	Low	71.7	Confident	35 Å²	35	95.4 Å²	95.4	18%	0.183	47%	0.467	C	S	.	.	H	α-helix	trans	-65.3	-44.2	179.7	-170.2	70.7	0	0	0	112.1	E415 C421 P429 K430 I431 C435 I436 M437	E415-L433 HydrophobicContact CG-CD2 4.4Å; E415-L433 WeakPolarHBondContact OE2-CB 3.3Å; E415-L433 WeakPolarHBondContact OE2-CG 3.44Å; C421-L433 HydrophobicContact CB-CD1 4.11Å; C421-L433 HydrophobicContact CB-CD2 3.31Å; C421-L433 HydrophobicContact CB-CG 4.35Å; P429-L433 PolarHBondContact O-N 3.27Å; K430-L433 PolarHBondContact O-N 3.38Å; I431-L433 VanDerWaalsContact C-N 3.35Å; L433-C435 VanDerWaalsContact C-N 3.28Å; L433-C435 PolarHBondContact O-N 3.34Å; L433-I436 CarbonylContact O-C 3.58Å; L433-I436 WeakPolarHBondContact O-CA 3.21Å; L433-I436 WeakPolarHBondContact O-CB 3.33Å; L433-I436 PolarHBondContact O-N 3.18Å; L433-M437 PolarHBondContact O-N 2.84Å
434	A	71.8	Confident	73.7	Confident	8 Å²	8	87.2 Å²	87.2	7%	0.066	43%	0.432	C	S	.	.	H	α-helix	trans	-67	-37.2	-178.8	0	0	0	0	0	110.7	E415 K430 M437 K438	E415-A434 VanDerWaalsContact CD-CA 3.46Å; E415-A434 WeakPolarHBondContact OE1-CA 3.41Å; E415-A434 WeakPolarHBondContact OE2-CA 3.23Å; E415-A434 VanDerWaalsContact OE2-CB 3.26Å; E415-A434 WeakPolarHBondContact OE2-CB 3.44Å; E415-A434 PolarHBondContact OE2-N 3.07Å; K430-A434 PolarHBondContact O-N 3.32Å; A434-M437 PolarHBondContact O-N 3.04Å; A434-K438 VanDerWaalsContact O-CG 3.29Å; A434-K438 WeakPolarHBondContact O-CG 3.17Å; A434-K438 PolarHBondContact O-N 3.49Å
435	C	78.7	Confident	75.7	Confident	61 Å²	61	82.3 Å²	82.3	41%	0.412	41%	0.406	S	S	.	.	H	α-helix	trans	-61.6	-45.7	171.7	-168.4	0	0	0	0	111.3	I431 H432 L433 M437 K438 W439	I431-C435 PolarHBondContact O-N 3.33Å; H432-C435 PolarHBondContact O-N 3.16Å; L433-C435 VanDerWaalsContact C-N 3.28Å; L433-C435 PolarHBondContact O-N 3.34Å; C435-M437 PolarHBondContact O-N 3.29Å; C435-K438 PolarHBondContact O-N 3.35Å; C435-W439 VanDerWaalsContact O-CD1 3.32Å; C435-W439 PolarHBondContact O-N 2.93Å
436	I	82.2	Confident	77.6	Confident	72 Å²	72	79.6 Å²	79.6	37%	0.369	40%	0.404	S	S	.	.	H	α-helix	trans	-60.7	-44	176.9	-69.9	161	0	0	0	111.1	H432 L433 W439 K440	H432-I436 WeakPolarHBondContact O-CB 3.41Å; H432-I436 WeakPolarHBondContact O-CD1 3.5Å; H432-I436 WeakPolarHBondContact O-CG1 3.41Å; H432-I436 PolarHBondContact O-N 3.04Å; L433-I436 CarbonylContact O-C 3.58Å; L433-I436 WeakPolarHBondContact O-CA 3.21Å; L433-I436 WeakPolarHBondContact O-CB 3.33Å; L433-I436 PolarHBondContact O-N 3.18Å; I436-W439 PolarHBondContact O-N 3.47Å; I436-K440 HydrophobicContact CG2-CD 4.06Å; I436-K440 HydrophobicContact CG2-CG 4.37Å; I436-K440 WeakPolarHBondContact O-CB 3.39Å; I436-K440 VanDerWaalsContact O-CG 3.28Å; I436-K440 WeakPolarHBondContact O-CG 3.31Å; I436-K440 PolarHBondContact O-N 3.43Å
437	M	82.4	Confident	79.6	Confident	55 Å²	55	78.3 Å²	78.3	27%	0.271	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-44.3	177.3	-78.3	-59	113	0	0	112.1	E415 L433 A434 C435 K440 F441	E415-M437 WeakPolarHBondContact OE1-CB 3.09Å; E415-M437 WeakPolarHBondContact OE1-CG 3.15Å; L433-M437 PolarHBondContact O-N 2.84Å; A434-M437 PolarHBondContact O-N 3.04Å; C435-M437 PolarHBondContact O-N 3.29Å; M437-K440 HydrophobicContact CE-CD 3.69Å; M437-K440 PolarHBondContact O-N 3.48Å; M437-F441 WeakPolarHBondContact O-CB 3.45Å; M437-F441 PolarHBondContact O-N 2.77Å
438	K	85.1	Confident	81.6	Confident	56 Å²	56	70.5 Å²	70.5	24%	0.243	35%	0.35	C	S	.	.	H	α-helix	trans	-60	-46.6	175.8	-70.8	176.4	-173.5	-164.2	0	112	L408 A434 C435 F441 Y442	L408-K438 HydrophobicContact CD2-CG 4.1Å; L408-K438 WeakPolarHBondContact O-CE 3.24Å; L408-K438 PolarHBondContact O-NZ 2.97Å; A434-K438 VanDerWaalsContact O-CG 3.29Å; A434-K438 WeakPolarHBondContact O-CG 3.17Å; A434-K438 PolarHBondContact O-N 3.49Å; C435-K438 PolarHBondContact O-N 3.35Å; K438-F441 WeakPolarHBondContact O-CB 3.21Å; K438-F441 PolarHBondContact O-N 2.81Å; K438-Y442 HydrophobicContact CB-CE2 4.43Å; K438-Y442 WeakPolarHBondContact O-CD2 3.32Å; K438-Y442 PolarHBondContact O-N 2.73Å
439	W	88.1	Confident	83.4	Confident	163 Å²	163	68.5 Å²	68.5	62%	0.617	35%	0.345	S	S	*	.	H	α-helix	trans	-63.3	-42.4	176.7	-87.2	102.3	0	0	0	112.4	C435 I436 F441 Y442 I443	C435-W439 VanDerWaalsContact O-CD1 3.32Å; C435-W439 PolarHBondContact O-N 2.93Å; I436-W439 PolarHBondContact O-N 3.47Å; W439-F441 VanDerWaalsContact C-N 3.3Å; W439-F441 PolarHBondContact O-N 3.45Å; W439-Y442 PolarHBondContact O-N 3.09Å; W439-I443 HydrophobicContact CE3-CD1 4.44Å; W439-I443 WeakPolarHBondContact O-CB 3.31Å; W439-I443 VanDerWaalsContact O-CG1 3.23Å; W439-I443 WeakPolarHBondContact O-CG1 3.49Å; W439-I443 PolarHBondContact O-N 3.11Å
440	K	89.6	Confident	85.1	Confident	110 Å²	110	68.8 Å²	68.8	48%	0.478	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-41.3	174.4	-76.1	178.6	175.6	-176.2	0	112	W368 I436 M437 S444	W368-K440 HydrophobicContact CH2-CB 3.82Å; I436-K440 HydrophobicContact CG2-CD 4.06Å; I436-K440 HydrophobicContact CG2-CG 4.37Å; I436-K440 WeakPolarHBondContact O-CB 3.39Å; I436-K440 VanDerWaalsContact O-CG 3.28Å; I436-K440 WeakPolarHBondContact O-CG 3.31Å; I436-K440 PolarHBondContact O-N 3.43Å; M437-K440 HydrophobicContact CE-CD 3.69Å; M437-K440 PolarHBondContact O-N 3.48Å; K440-S444 VanDerWaalsContact O-CB 3.22Å; K440-S444 WeakPolarHBondContact O-CB 3.29Å; K440-S444 PolarHBondContact O-N 2.87Å
441	F	90.6	Very high	86.7	Confident	9 Å²	9	64.3 Å²	64.3	4%	0.039	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-52.5	174.1	173.2	-100.9	0	0	0	111	L364 W368 V402 L408 M437 K438 W439 I443 S444 M445	L364-F441 HydrophobicContact CD1-CB 4.5Å; L364-F441 HydrophobicContact CD1-CD1 4.08Å; L364-F441 HydrophobicContact CD1-CD2 3.89Å; L364-F441 HydrophobicContact CD1-CE1 4.25Å; L364-F441 HydrophobicContact CD1-CE2 4.08Å; L364-F441 HydrophobicContact CD1-CG 3.89Å; L364-F441 HydrophobicContact CD1-CZ 4.26Å; W368-F441 HydrophobicContact CB-CD2 3.88Å; W368-F441 HydrophobicContact CB-CE2 3.99Å; W368-F441 AromaticContact CD2-CD2 3.93Å; W368-F441 HydrophobicContact CD2-CD2 3.93Å; W368-F441 HydrophobicContact CE3-CB 4.42Å; W368-F441 HydrophobicContact CE3-CD2 4.3Å; W368-F441 AromaticContact CG-CD2 3.75Å; W368-F441 HydrophobicContact CG-CD2 3.75Å; W368-F441 HydrophobicContact CG-CE2 4.19Å; V402-F441 HydrophobicContact CG2-CZ 4.37Å; L408-F441 HydrophobicContact CD2-CD1 4.44Å; M437-F441 WeakPolarHBondContact O-CB 3.45Å; M437-F441 PolarHBondContact O-N 2.77Å; K438-F441 WeakPolarHBondContact O-CB 3.21Å; K438-F441 PolarHBondContact O-N 2.81Å; W439-F441 VanDerWaalsContact C-N 3.3Å; W439-F441 PolarHBondContact O-N 3.45Å; F441-I443 PolarHBondContact O-N 2.78Å; F441-S444 PolarHBondContact O-N 2.91Å; F441-M445 HydrophobicContact CD1-CG 4.28Å; F441-M445 HydrophobicContact CD2-CG 4.2Å; F441-M445 HydrophobicContact CE1-CG 3.91Å; F441-M445 HydrophobicContact CE2-CG 3.82Å; F441-M445 HydrophobicContact CE2-SD 3.96Å; F441-M445 HydrophobicContact CG-CG 4.42Å; F441-M445 HydrophobicContact CZ-CG 3.67Å; F441-M445 HydrophobicContact CZ-SD 4.02Å; F441-M445 VanDerWaalsContact O-CG 3.28Å; F441-M445 WeakPolarHBondContact O-CG 3.41Å; F441-M445 PolarHBondContact O-N 2.91Å
442	Y	91.5	Very high	88.3	Confident	118 Å²	118	58 Å²	58	46%	0.463	30%	0.295	S	S	.	.	H	α-helix	trans	-62.3	-43.1	180	-69.2	-53.9	0	0	0	113.5	L408 K438 W439 S444 M445 A446	L408-Y442 WeakPolarHBondContact CD1-OH 3.31Å; K438-Y442 HydrophobicContact CB-CE2 4.43Å; K438-Y442 WeakPolarHBondContact O-CD2 3.32Å; K438-Y442 PolarHBondContact O-N 2.73Å; W439-Y442 PolarHBondContact O-N 3.09Å; Y442-S444 VanDerWaalsContact C-N 3.32Å; Y442-S444 PolarHBondContact O-N 2.82Å; Y442-M445 PolarHBondContact O-N 3.16Å; Y442-A446 WeakPolarHBondContact O-CB 3.36Å; Y442-A446 PolarHBondContact O-N 3.29Å
443	I	94.2	Very high	89.6	Confident	106 Å²	106	56.8 Å²	56.8	54%	0.544	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-43.3	176.7	-69	165.9	0	0	0	110.2	W439 F441 A446 L447	W439-I443 HydrophobicContact CE3-CD1 4.44Å; W439-I443 WeakPolarHBondContact O-CB 3.31Å; W439-I443 VanDerWaalsContact O-CG1 3.23Å; W439-I443 WeakPolarHBondContact O-CG1 3.49Å; W439-I443 PolarHBondContact O-N 3.11Å; F441-I443 PolarHBondContact O-N 2.78Å; I443-A446 PolarHBondContact O-N 3.49Å; I443-L447 WeakPolarHBondContact O-CB 3.22Å; I443-L447 PolarHBondContact O-N 2.92Å
444	S	94.9	Very high	90.8	Very high	6 Å²	6	57.9 Å²	57.9	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-64.5	-44.6	176.7	169.4	0	0	0	0	112.2	W368 K440 F441 Y442 A446 L447 M448 H479	W368-S444 PolarHBondContact NE1-OG 3.46Å; K440-S444 VanDerWaalsContact O-CB 3.22Å; K440-S444 WeakPolarHBondContact O-CB 3.29Å; K440-S444 PolarHBondContact O-N 2.87Å; F441-S444 PolarHBondContact O-N 2.91Å; Y442-S444 VanDerWaalsContact C-N 3.32Å; Y442-S444 PolarHBondContact O-N 2.82Å; S444-A446 VanDerWaalsContact C-N 3.32Å; S444-A446 PolarHBondContact O-N 2.86Å; S444-L447 PolarHBondContact O-N 3.26Å; S444-M448 WeakPolarHBondContact O-CG 3.31Å; S444-M448 PolarHBondContact O-N 2.94Å; S444-H479 PolarHBondContact OG-CE1 3.36Å; S444-H479 PolarHBondContact OG-NE2 3.04Å
445	M	94.2	Very high	91.9	Very high	31 Å²	31	58.6 Å²	58.6	15%	0.153	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-43.7	175.8	-71.1	-59.4	-56.8	0	0	111.7	Q371 P398 F441 Y442 M448 A449	Q371-M445 HydrophobicContact CB-SD 4.3Å; Q371-M445 HydrophobicContact CG-CE 3.84Å; Q371-M445 HydrophobicContact CG-SD 3.72Å; P398-M445 HydrophobicContact CB-CE 4.05Å; P398-M445 HydrophobicContact CG-CE 3.89Å; F441-M445 HydrophobicContact CD1-CG 4.28Å; F441-M445 HydrophobicContact CD2-CG 4.2Å; F441-M445 HydrophobicContact CE1-CG 3.91Å; F441-M445 HydrophobicContact CE2-CG 3.82Å; F441-M445 HydrophobicContact CE2-SD 3.96Å; F441-M445 HydrophobicContact CG-CG 4.42Å; F441-M445 HydrophobicContact CZ-CG 3.67Å; F441-M445 HydrophobicContact CZ-SD 4.02Å; F441-M445 VanDerWaalsContact O-CG 3.28Å; F441-M445 WeakPolarHBondContact O-CG 3.41Å; F441-M445 PolarHBondContact O-N 2.91Å; Y442-M445 PolarHBondContact O-N 3.16Å; M445-M448 HydrophobicContact CG-CE 4.47Å; M445-M448 HydrophobicContact SD-CE 3.51Å; M445-M448 VanDerWaalsContact SD-CE 3.51Å; M445-A449 WeakPolarHBondContact O-CB 3.2Å; M445-A449 PolarHBondContact O-N 3.03Å
446	A	95.3	Very high	92.6	Very high	54 Å²	54	59 Å²	59	45%	0.446	31%	0.306	S	S	.	.	H	α-helix	trans	-64	-44	175.3	0	0	0	0	0	111.6	Y442 I443 S444 A449 V450	Y442-A446 WeakPolarHBondContact O-CB 3.36Å; Y442-A446 PolarHBondContact O-N 3.29Å; I443-A446 PolarHBondContact O-N 3.49Å; S444-A446 VanDerWaalsContact C-N 3.32Å; S444-A446 PolarHBondContact O-N 2.86Å; A446-A449 PolarHBondContact O-N 2.92Å; A446-V450 WeakPolarHBondContact O-CB 3.31Å; A446-V450 VanDerWaalsContact O-CG2 3.29Å; A446-V450 WeakPolarHBondContact O-CG2 3.12Å; A446-V450 PolarHBondContact O-N 2.75Å
447	L	96.4	Very high	93.2	Very high	78 Å²	78	60.8 Å²	60.8	41%	0.408	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-47.3	177.5	178.5	63	0	0	0	111.8	I443 S444 A449 V450 L451 T475	I443-L447 WeakPolarHBondContact O-CB 3.22Å; I443-L447 PolarHBondContact O-N 2.92Å; S444-L447 PolarHBondContact O-N 3.26Å; L447-A449 VanDerWaalsContact C-N 3.32Å; L447-A449 PolarHBondContact O-N 3.05Å; L447-V450 PolarHBondContact O-N 3.48Å; L447-L451 HydrophobicContact CD1-CD1 4.07Å; L447-L451 HydrophobicContact CD1-CG 4.17Å; L447-L451 HydrophobicContact CG-CD1 4.08Å; L447-L451 WeakPolarHBondContact O-CB 3.24Å; L447-L451 WeakPolarHBondContact O-CG 3.25Å; L447-L451 PolarHBondContact O-N 2.69Å; L447-T475 HydrophobicContact CD2-CG2 3.89Å; L447-T475 HydrophobicContact CG-CG2 4.44Å
448	M	97.1	Very high	93.7	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.1	-40.8	176.8	-69	-175.5	-70.1	0	0	111.3	Q371 A372 F375 F394 S444 M445 S452	Q371-M448 HydrophobicContact CG-CE 3.72Å; Q371-M448 HydrophobicContact CG-SD 4.31Å; A372-M448 HydrophobicContact CB-SD 4.34Å; F375-M448 HydrophobicContact CB-CG 4.3Å; F375-M448 HydrophobicContact CB-SD 3.75Å; F375-M448 HydrophobicContact CD1-CB 4.39Å; F375-M448 HydrophobicContact CD1-CG 3.73Å; F375-M448 HydrophobicContact CD1-SD 3.96Å; F375-M448 HydrophobicContact CD2-CB 3.78Å; F375-M448 HydrophobicContact CD2-CG 4.05Å; F375-M448 HydrophobicContact CE1-CG 4.01Å; F375-M448 HydrophobicContact CE2-CB 4.01Å; F375-M448 HydrophobicContact CE2-CG 4.31Å; F375-M448 WeakPolarHBondContact CE2-O 3.47Å; F375-M448 HydrophobicContact CG-CB 3.98Å; F375-M448 HydrophobicContact CG-CG 3.75Å; F375-M448 HydrophobicContact CG-SD 3.85Å; F375-M448 HydrophobicContact CZ-CB 4.4Å; F375-M448 HydrophobicContact CZ-CG 4.28Å; F394-M448 HydrophobicContact CZ-CB 3.9Å; S444-M448 WeakPolarHBondContact O-CG 3.31Å; S444-M448 PolarHBondContact O-N 2.94Å; M445-M448 HydrophobicContact CG-CE 4.47Å; M445-M448 HydrophobicContact SD-CE 3.51Å; M445-M448 VanDerWaalsContact SD-CE 3.51Å; M448-S452 WeakPolarHBondContact O-CB 3.37Å; M448-S452 PolarHBondContact O-N 2.69Å; M448-S452 PolarHBondContact O-OG 2.98Å
449	A	95.6	Very high	93.9	Very high	34 Å²	34	67.7 Å²	67.7	28%	0.281	36%	0.359	S	S	.	.	H	α-helix	trans	-64.4	-46.8	176.4	0	0	0	0	0	112.1	M445 A446 L447 S452 V453	M445-A449 WeakPolarHBondContact O-CB 3.2Å; M445-A449 PolarHBondContact O-N 3.03Å; A446-A449 PolarHBondContact O-N 2.92Å; L447-A449 VanDerWaalsContact C-N 3.32Å; L447-A449 PolarHBondContact O-N 3.05Å; A449-S452 WeakPolarHBondContact O-CB 3.35Å; A449-S452 PolarHBondContact O-N 2.9Å; A449-V453 WeakPolarHBondContact O-CG2 3.43Å; A449-V453 PolarHBondContact O-N 2.85Å
450	V	96.4	Very high	94.1	Very high	79 Å²	79	62.3 Å²	62.3	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-60.2	-50.1	176.9	169.2	0	0	0	0	110.3	A446 L447 S452 V453 L454	A446-V450 WeakPolarHBondContact O-CB 3.31Å; A446-V450 VanDerWaalsContact O-CG2 3.29Å; A446-V450 WeakPolarHBondContact O-CG2 3.12Å; A446-V450 PolarHBondContact O-N 2.75Å; L447-V450 PolarHBondContact O-N 3.48Å; V450-S452 PolarHBondContact O-N 3.03Å; V450-V453 PolarHBondContact O-N 2.77Å; V450-V453 VanDerWaalsContact O-N 3.15Å; V450-L454 HydrophobicContact CG1-CD1 3.83Å; V450-L454 HydrophobicContact CG1-CG 4.1Å; V450-L454 WeakPolarHBondContact O-CB 3.45Å; V450-L454 VanDerWaalsContact O-CG 3.29Å; V450-L454 WeakPolarHBondContact O-CG 3.28Å; V450-L454 PolarHBondContact O-N 3.41Å
451	L	96.3	Very high	94.2	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-35.5	177.5	-74	174.9	0	0	0	112.3	F375 L447 L454 S455 L471 T475	F375-L451 HydrophobicContact CE2-CB 4.01Å; F375-L451 HydrophobicContact CZ-CB 3.84Å; F375-L451 HydrophobicContact CZ-CD1 3.83Å; L447-L451 HydrophobicContact CD1-CD1 4.07Å; L447-L451 HydrophobicContact CD1-CG 4.17Å; L447-L451 HydrophobicContact CG-CD1 4.08Å; L447-L451 WeakPolarHBondContact O-CB 3.24Å; L447-L451 WeakPolarHBondContact O-CG 3.25Å; L447-L451 PolarHBondContact O-N 2.69Å; L451-L454 PolarHBondContact O-N 3.01Å; L451-S455 WeakPolarHBondContact O-CB 3.5Å; L451-S455 PolarHBondContact O-N 3.19Å; L451-S455 PolarHBondContact O-OG 2.85Å; L451-L471 HydrophobicContact CD2-CB 4.3Å; L451-L471 HydrophobicContact CD2-CD1 4.31Å; L451-T475 HydrophobicContact CD1-CG2 4.32Å
452	S	95.8	Very high	94.2	Very high	14 Å²	14	65.1 Å²	65.1	10%	0.098	38%	0.376	C	S	.	.	H	α-helix	trans	-65.3	-42.3	176.2	-56.9	0	0	0	0	112.2	Y390 M448 A449 V450	Y390-S452 PolarHBondContact OH-OG 2.85Å; M448-S452 WeakPolarHBondContact O-CB 3.37Å; M448-S452 PolarHBondContact O-N 2.69Å; M448-S452 PolarHBondContact O-OG 2.98Å; A449-S452 WeakPolarHBondContact O-CB 3.35Å; A449-S452 PolarHBondContact O-N 2.9Å; V450-S452 PolarHBondContact O-N 3.03Å
453	V	95.8	Very high	94.2	Very high	90 Å²	90	66.5 Å²	66.5	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-46.9	175.2	173.4	0	0	0	0	110.7	A449 V450 S455 V456 V457	A449-V453 WeakPolarHBondContact O-CG2 3.43Å; A449-V453 PolarHBondContact O-N 2.85Å; V450-V453 PolarHBondContact O-N 2.77Å; V450-V453 VanDerWaalsContact O-N 3.15Å; V453-S455 VanDerWaalsContact C-N 3.29Å; V453-S455 PolarHBondContact O-N 3.21Å; V453-V456 PolarHBondContact O-N 3.44Å; V453-V456 VanDerWaalsContact O-N 3.08Å; V453-V457 HydrophobicContact CG1-CG2 3.93Å; V453-V457 WeakPolarHBondContact O-CG2 3.29Å; V453-V457 PolarHBondContact O-N 2.87Å
454	L	95.3	Very high	93.9	Very high	58 Å²	58	65.4 Å²	65.4	30%	0.304	38%	0.381	S	S	.	.	H	α-helix	trans	-60.5	-38.9	-179.9	-69	-177.7	0	0	0	112.1	V450 L451 V456 V457 M458 F468	V450-L454 HydrophobicContact CG1-CD1 3.83Å; V450-L454 HydrophobicContact CG1-CG 4.1Å; V450-L454 WeakPolarHBondContact O-CB 3.45Å; V450-L454 VanDerWaalsContact O-CG 3.29Å; V450-L454 WeakPolarHBondContact O-CG 3.28Å; V450-L454 PolarHBondContact O-N 3.41Å; L451-L454 PolarHBondContact O-N 3.01Å; L454-V456 PolarHBondContact O-N 3.2Å; L454-V456 VanDerWaalsContact O-N 3.12Å; L454-V457 PolarHBondContact O-N 3.01Å; L454-M458 HydrophobicContact CD2-CG 4.21Å; L454-M458 HydrophobicContact CD2-SD 3.58Å; L454-M458 VanDerWaalsContact CD2-SD 3.58Å; L454-M458 PolarHBondContact O-N 2.93Å; L454-F468 HydrophobicContact CB-CD1 4.44Å; L454-F468 HydrophobicContact CB-CE1 3.85Å
455	S	94.2	Very high	93.6	Very high	22 Å²	22	69.3 Å²	69.3	15%	0.154	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-16	178	-58	0	0	0	0	114	L451 V453	L451-S455 WeakPolarHBondContact O-CB 3.5Å; L451-S455 PolarHBondContact O-N 3.19Å; L451-S455 PolarHBondContact O-OG 2.85Å; V453-S455 VanDerWaalsContact C-N 3.29Å; V453-S455 PolarHBondContact O-N 3.21Å
456	V	93.9	Very high	93.3	Very high	70 Å²	70	71.5 Å²	71.5	42%	0.424	42%	0.418	S	S	.	.	H	α-helix	trans	-106.5	-38.5	-179.9	177.2	0	0	0	0	111.6	L382 L387 V453 L454	L382-V456 HydrophobicContact CD1-CG2 4.36Å; L382-V456 HydrophobicContact CD2-CG2 3.77Å; L387-V456 HydrophobicContact CD1-CG2 3.89Å; L387-V456 HydrophobicContact CD2-CG1 3.86Å; L387-V456 HydrophobicContact CD2-CG2 4.1Å; V453-V456 PolarHBondContact O-N 3.44Å; V453-V456 VanDerWaalsContact O-N 3.08Å; L454-V456 PolarHBondContact O-N 3.2Å; L454-V456 VanDerWaalsContact O-N 3.12Å
457	V	94.2	Very high	93.2	Very high	110 Å²	110	71.3 Å²	71.3	67%	0.667	41%	0.41	S	S	*	.	H	α-helix	trans	-87.5	-32.1	-171.5	176	0	0	0	0	112.5	V453 L454	V453-V457 HydrophobicContact CG1-CG2 3.93Å; V453-V457 WeakPolarHBondContact O-CG2 3.29Å; V453-V457 PolarHBondContact O-N 2.87Å; L454-V457 PolarHBondContact O-N 3.01Å
458	M	92.5	Very high	93	Very high	104 Å²	104	68.5 Å²	68.5	51%	0.512	39%	0.394	S	S	.	.	S	Bend	trans	-105.4	133.1	-174.8	-68.4	-172.9	66.8	0	0	111.3	L454 F468	L454-M458 HydrophobicContact CD2-CG 4.21Å; L454-M458 HydrophobicContact CD2-SD 3.58Å; L454-M458 VanDerWaalsContact CD2-SD 3.58Å; L454-M458 PolarHBondContact O-N 2.93Å; M458-F468 HydrophobicContact CB-CE2 4.19Å; M458-F468 HydrophobicContact CB-CZ 3.74Å; M458-F468 VanDerWaalsContact O-CE2 3.25Å; M458-F468 WeakPolarHBondContact O-CE2 3.31Å
459	D	90.1	Very high	92.8	Very high	151 Å²	151	70.3 Å²	70.3	81%	0.807	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-71.6	136	166.4	-67	-50.3	0	0	0	110.1
460	P	91.6	Very high	92.6	Very high	51 Å²	51	70.2 Å²	70.2	33%	0.331	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-64.4	143.1	175.8	26.6	-32.7	0	0	0	110.2	P465 F468	P460-P465 WeakPolarHBondContact CG-O 3.38Å; P460-F468 HydrophobicContact CB-CD2 4.2Å; P460-F468 HydrophobicContact CB-CE2 4.19Å
461	P	92.4	Very high	92.5	Very high	45 Å²	45	69.6 Å²	69.6	29%	0.292	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-55.2	142.2	174.8	-24.7	33.4	0	0	0	111.5	H463 L464 L467	P461-H463 WeakPolarHBondContact CB-CE1 3.48Å; P461-H463 PolarHBondContact O-N 3.19Å; P461-L464 CarbonylContact O-C 3.4Å; P461-L464 VanDerWaalsContact O-C 3.24Å; P461-L464 PolarHBondContact O-N 2.97Å; P461-L467 HydrophobicContact CG-CD2 4.2Å
462	P	89.8	Confident	92.5	Very high	133 Å²	133	69 Å²	69	86%	0.864	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.2	-174.5	-26.1	33.1	0	0	0	114.7	L464	P462-L464 VanDerWaalsContact C-N 3.35Å
463	H	91.9	Very high	92.4	Very high	147 Å²	147	68.5 Å²	68.5	68%	0.681	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.1	178.3	63.1	-79.3	0	0	0	113.5	P461	P461-H463 WeakPolarHBondContact CB-CE1 3.48Å; P461-H463 PolarHBondContact O-N 3.19Å
464	L	88.9	Confident	92.3	Very high	82 Å²	82	66.2 Å²	66.2	43%	0.429	38%	0.375	S	S	.	.			trans	-139.2	68.3	-179.7	-66.5	171.8	0	0	0	110.8	P461 P462 D466 L467	P461-L464 CarbonylContact O-C 3.4Å; P461-L464 VanDerWaalsContact O-C 3.24Å; P461-L464 PolarHBondContact O-N 2.97Å; P462-L464 VanDerWaalsContact C-N 3.35Å; L464-D466 PolarHBondContact O-N 2.95Å; L464-L467 HydrophobicContact CB-CB 4.12Å; L464-L467 HydrophobicContact CD1-CD1 4.38Å; L464-L467 WeakPolarHBondContact O-CB 3.29Å; L464-L467 PolarHBondContact O-N 2.9Å; L464-L467 VanDerWaalsContact O-N 3.15Å
465	P	87.8	Confident	92.3	Very high	88 Å²	88	64.7 Å²	64.7	57%	0.571	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.2	-176.2	24.6	-34.6	0	0	0	113.3	P460	P460-P465 WeakPolarHBondContact CG-O 3.38Å
466	D	88.6	Confident	92.4	Very high	78 Å²	78	63.7 Å²	63.7	42%	0.417	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	16.4	-179.1	-62.1	-27.3	0	0	0	113.6	K274 L464 F468 P469 V470	K274-D466 VanDerWaalsContact CE-OD2 3.28Å; K274-D466 WeakPolarHBondContact CE-OD2 3.26Å; K274-D466 IonicContact NZ-OD2 2.98Å; L464-D466 PolarHBondContact O-N 2.95Å; D466-F468 PolarHBondContact O-N 3.11Å; D466-P469 WeakPolarHBondContact O-CD 3.28Å; D466-V470 HydrophobicContact CB-CG2 4.2Å; D466-V470 WeakPolarHBondContact O-CB 3.37Å; D466-V470 VanDerWaalsContact O-CG2 3.25Å; D466-V470 WeakPolarHBondContact O-CG2 2.91Å; D466-V470 PolarHBondContact O-N 3.31Å
467	L	92.3	Very high	92.5	Very high	50 Å²	50	61.1 Å²	61.1	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-53.7	-52.9	-172.6	179.1	61	0	0	0	112.6	P461 L464 V470 L471	P461-L467 HydrophobicContact CG-CD2 4.2Å; L464-L467 HydrophobicContact CB-CB 4.12Å; L464-L467 HydrophobicContact CD1-CD1 4.38Å; L464-L467 WeakPolarHBondContact O-CB 3.29Å; L464-L467 PolarHBondContact O-N 2.9Å; L464-L467 VanDerWaalsContact O-N 3.15Å; L467-V470 PolarHBondContact O-N 3.29Å; L467-L471 HydrophobicContact CD1-CD1 3.97Å; L467-L471 HydrophobicContact CD1-CG 4.15Å; L467-L471 HydrophobicContact CG-CD1 3.97Å; L467-L471 HydrophobicContact CG-CG 4.5Å; L467-L471 VanDerWaalsContact O-CG 3.31Å; L467-L471 WeakPolarHBondContact O-CG 3.18Å; L467-L471 PolarHBondContact O-N 2.64Å
468	F	93.4	Very high	92.5	Very high	19 Å²	19	61.5 Å²	61.5	8%	0.083	34%	0.34	C	S	.	.	H	α-helix	trans	-67.2	-48.1	-176.9	-62.6	-66.5	0	0	0	113.2	L454 M458 P460 D466 V470 L471 V472	L454-F468 HydrophobicContact CB-CD1 4.44Å; L454-F468 HydrophobicContact CB-CE1 3.85Å; M458-F468 HydrophobicContact CB-CE2 4.19Å; M458-F468 HydrophobicContact CB-CZ 3.74Å; M458-F468 VanDerWaalsContact O-CE2 3.25Å; M458-F468 WeakPolarHBondContact O-CE2 3.31Å; P460-F468 HydrophobicContact CB-CD2 4.2Å; P460-F468 HydrophobicContact CB-CE2 4.19Å; D466-F468 PolarHBondContact O-N 3.11Å; F468-V470 PolarHBondContact O-N 3.45Å; F468-L471 PolarHBondContact O-N 3Å; F468-L471 VanDerWaalsContact O-N 3.16Å; F468-V472 VanDerWaalsContact O-CG2 3.3Å; F468-V472 WeakPolarHBondContact O-CG2 3.25Å; F468-V472 PolarHBondContact O-N 3.49Å
469	P	92.2	Very high	92.6	Very high	38 Å²	38	58.1 Å²	58.1	25%	0.247	32%	0.323	C	S	.	.	H	α-helix	trans	-51.9	-42.6	171.8	-28.8	34.1	0	0	0	113.5	P379 D466 V472 S473	P379-P469 HydrophobicContact CB-CB 4.45Å; P379-P469 HydrophobicContact CG-CB 4.23Å; D466-P469 WeakPolarHBondContact O-CD 3.28Å; P469-V472 PolarHBondContact O-N 3.06Å; P469-S473 WeakPolarHBondContact O-CB 3.41Å; P469-S473 PolarHBondContact O-N 3.45Å; P469-S473 PolarHBondContact O-OG 3.28Å
470	V	92.3	Very high	93	Very high	31 Å²	31	51 Å²	51	19%	0.188	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-40.4	179.1	172.2	0	0	0	0	112.1	K274 T284 D466 L467 F468 S473 T474	K274-V470 HydrophobicContact CD-CG2 4.13Å; T284-V470 HydrophobicContact CG2-CG1 3.61Å; D466-V470 HydrophobicContact CB-CG2 4.2Å; D466-V470 WeakPolarHBondContact O-CB 3.37Å; D466-V470 VanDerWaalsContact O-CG2 3.25Å; D466-V470 WeakPolarHBondContact O-CG2 2.91Å; D466-V470 PolarHBondContact O-N 3.31Å; L467-V470 PolarHBondContact O-N 3.29Å; F468-V470 PolarHBondContact O-N 3.45Å; V470-S473 PolarHBondContact O-N 2.93Å; V470-S473 PolarHBondContact O-OG 2.9Å; V470-T474 VanDerWaalsContact O-CB 3.24Å; V470-T474 WeakPolarHBondContact O-CB 3.25Å; V470-T474 PolarHBondContact O-N 3.45Å; V470-T474 PolarHBondContact O-OG1 3.46Å
471	L	94.3	Very high	93.2	Very high	67 Å²	67	50.7 Å²	50.7	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-41.3	176.1	-73.3	174	0	0	0	111.7	L451 L467 F468 T475	L451-L471 HydrophobicContact CD2-CB 4.3Å; L451-L471 HydrophobicContact CD2-CD1 4.31Å; L467-L471 HydrophobicContact CD1-CD1 3.97Å; L467-L471 HydrophobicContact CD1-CG 4.15Å; L467-L471 HydrophobicContact CG-CD1 3.97Å; L467-L471 HydrophobicContact CG-CG 4.5Å; L467-L471 VanDerWaalsContact O-CG 3.31Å; L467-L471 WeakPolarHBondContact O-CG 3.18Å; L467-L471 PolarHBondContact O-N 2.64Å; F468-L471 PolarHBondContact O-N 3Å; F468-L471 VanDerWaalsContact O-N 3.16Å; L471-T475 VanDerWaalsContact O-CB 3.22Å; L471-T475 WeakPolarHBondContact O-CB 3.28Å; L471-T475 PolarHBondContact O-N 2.68Å; L471-T475 PolarHBondContact O-OG1 3.23Å
472	V	95.4	Very high	93.3	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-51.3	175.3	170.6	0	0	0	0	110.2	F375 L378 P379 F468 P469 T474 T475 A476	F375-V472 HydrophobicContact CD1-CG1 4.15Å; F375-V472 HydrophobicContact CE1-CB 4.21Å; F375-V472 HydrophobicContact CE1-CG1 3.78Å; F375-V472 HydrophobicContact CE1-CG2 4.4Å; F375-V472 HydrophobicContact CE2-CG1 4.29Å; F375-V472 HydrophobicContact CE2-CG2 4.08Å; F375-V472 HydrophobicContact CZ-CB 4.02Å; F375-V472 HydrophobicContact CZ-CG1 3.87Å; F375-V472 HydrophobicContact CZ-CG2 3.71Å; F375-V472 WeakPolarHBondContact O-CG1 3.4Å; L378-V472 HydrophobicContact CD2-CG2 4.24Å; P379-V472 HydrophobicContact CG-CB 4.47Å; P379-V472 HydrophobicContact CG-CG1 4.32Å; F468-V472 VanDerWaalsContact O-CG2 3.3Å; F468-V472 WeakPolarHBondContact O-CG2 3.25Å; F468-V472 PolarHBondContact O-N 3.49Å; P469-V472 PolarHBondContact O-N 3.06Å; V472-T474 PolarHBondContact O-N 3.45Å; V472-T475 PolarHBondContact O-N 2.94Å; V472-A476 WeakPolarHBondContact O-CB 3.49Å; V472-A476 PolarHBondContact O-N 3.45Å
473	S	93.4	Very high	93.5	Very high	4 Å²	4	44 Å²	44	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-42.5	-177.8	71.2	0	0	0	0	112.1	A276 P469 V470 A476 F477	A276-S473 WeakPolarHBondContact CA-O 3.16Å; A276-S473 VanDerWaalsContact CB-O 3.27Å; A276-S473 WeakPolarHBondContact CB-O 3.33Å; P469-S473 WeakPolarHBondContact O-CB 3.41Å; P469-S473 PolarHBondContact O-N 3.45Å; P469-S473 PolarHBondContact O-OG 3.28Å; V470-S473 PolarHBondContact O-N 2.93Å; V470-S473 PolarHBondContact O-OG 2.9Å; S473-A476 PolarHBondContact O-N 2.9Å; S473-F477 VanDerWaalsContact O-CB 3.31Å; S473-F477 WeakPolarHBondContact O-CB 3.4Å; S473-F477 PolarHBondContact O-N 2.95Å
474	T	93.6	Very high	93.7	Very high	42 Å²	42	37.9 Å²	37.9	26%	0.258	21%	0.214	S	C	.	.	H	α-helix	trans	-68.6	-41.1	-179.9	-53.7	0	0	0	0	111.4	V470 V472 F477 M478	V470-T474 VanDerWaalsContact O-CB 3.24Å; V470-T474 WeakPolarHBondContact O-CB 3.25Å; V470-T474 PolarHBondContact O-N 3.45Å; V470-T474 PolarHBondContact O-OG1 3.46Å; V472-T474 PolarHBondContact O-N 3.45Å; T474-F477 PolarHBondContact O-N 3.08Å; T474-M478 WeakPolarHBondContact O-CG 3.48Å; T474-M478 PolarHBondContact O-N 3.34Å
475	T	95.1	Very high	93.9	Very high	26 Å²	26	37.9 Å²	37.9	16%	0.16	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-45.7	176.3	-58.6	0	0	0	0	111.1	F375 L447 L451 L471 V472 M478 H479	F375-T475 HydrophobicContact CE1-CG2 4.13Å; L447-T475 HydrophobicContact CD2-CG2 3.89Å; L447-T475 HydrophobicContact CG-CG2 4.44Å; L451-T475 HydrophobicContact CD1-CG2 4.32Å; L471-T475 VanDerWaalsContact O-CB 3.22Å; L471-T475 WeakPolarHBondContact O-CB 3.28Å; L471-T475 PolarHBondContact O-N 2.68Å; L471-T475 PolarHBondContact O-OG1 3.23Å; V472-T475 PolarHBondContact O-N 2.94Å; T475-M478 PolarHBondContact O-N 3.36Å; T475-H479 PolarHBondContact O-CD2 2.86Å; T475-H479 PolarHBondContact O-N 3.5Å
476	A	96.4	Very high	94.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.6	-41.5	176.5	0	0	0	0	0	112.5	A276 F375 S376 V472 S473 M478 H479 F480	A276-A476 HydrophobicContact CB-CB 3.86Å; F375-A476 HydrophobicContact CD1-CB 4.4Å; S376-A476 VanDerWaalsContact CB-CB 3.49Å; V472-A476 WeakPolarHBondContact O-CB 3.49Å; V472-A476 PolarHBondContact O-N 3.45Å; S473-A476 PolarHBondContact O-N 2.9Å; A476-M478 VanDerWaalsContact C-N 3.31Å; A476-M478 PolarHBondContact O-N 3.26Å; A476-H479 WeakPolarHBondContact O-CB 3.5Å; A476-H479 PolarHBondContact O-N 3.47Å; A476-H479 VanDerWaalsContact O-N 3.08Å; A476-F480 HydrophobicContact CB-CE2 3.94Å; A476-F480 HydrophobicContact CB-CZ 4.01Å; A476-F480 WeakPolarHBondContact O-CD2 3.43Å; A476-F480 VanDerWaalsContact O-CG 3.27Å; A476-F480 WeakPolarHBondContact O-CG 3.42Å; A476-F480 PolarHBondContact O-N 3.37Å
477	F	96.1	Very high	94.3	Very high	17 Å²	17	32.4 Å²	32.4	8%	0.075	18%	0.179	C	C	.	.	H	α-helix	trans	-55.3	-45.1	176.7	165.4	-105.7	0	0	0	111.9	A276 T278 S281 L338 S473 T474 H479 F480 L481	A276-F477 HydrophobicContact CB-CB 4.31Å; T278-F477 VanDerWaalsContact CA-CE2 3.46Å; T278-F477 HydrophobicContact CG2-CZ 4.42Å; T278-F477 WeakPolarHBondContact OG1-CE2 3.32Å; S281-F477 VanDerWaalsContact OG-CB 3.29Å; S281-F477 WeakPolarHBondContact OG-CB 3.34Å; S281-F477 WeakPolarHBondContact OG-CD1 3.48Å; S281-F477 WeakPolarHBondContact OG-CG 3.48Å; L338-F477 HydrophobicContact CD2-CD2 3.76Å; L338-F477 HydrophobicContact CD2-CE2 3.85Å; S473-F477 VanDerWaalsContact O-CB 3.31Å; S473-F477 WeakPolarHBondContact O-CB 3.4Å; S473-F477 PolarHBondContact O-N 2.95Å; T474-F477 PolarHBondContact O-N 3.08Å; F477-H479 VanDerWaalsContact C-N 3.27Å; F477-H479 PolarHBondContact O-N 3.45Å; F477-F480 PolarHBondContact O-N 2.65Å; F477-L481 HydrophobicContact CE1-CD2 4.31Å; F477-L481 HydrophobicContact CE2-CB 4.47Å; F477-L481 HydrophobicContact CZ-CB 4.47Å; F477-L481 HydrophobicContact CZ-CD2 4Å; F477-L481 WeakPolarHBondContact O-CB 3.46Å; F477-L481 PolarHBondContact O-N 3.15Å
478	M	94.8	Very high	94.3	Very high	117 Å²	117	31 Å²	31	58%	0.576	17%	0.173	S	C	*	.	H	α-helix	trans	-60.2	-38	177.9	-68.3	-59.3	-68	0	0	112.3	T474 T475 A476 G482	T474-M478 WeakPolarHBondContact O-CG 3.48Å; T474-M478 PolarHBondContact O-N 3.34Å; T475-M478 PolarHBondContact O-N 3.36Å; A476-M478 VanDerWaalsContact C-N 3.31Å; A476-M478 PolarHBondContact O-N 3.26Å; M478-G482 PolarHBondContact O-N 3.34Å
479	H	94.8	Very high	94.1	Very high	34 Å²	34	34.9 Å²	34.9	16%	0.157	19%	0.193	C	C	.	.	H	α-helix	trans	-67.2	-46.5	174	-73.7	-50.5	0	0	0	112.2	W368 A372 S444 T475 A476 F477 L481 G482 V483	W368-H479 AromaticContact CE2-CE1 3.68Å; W368-H479 AromaticContact CE2-ND1 3.72Å; W368-H479 AromaticContact CZ2-CE1 3.48Å; W368-H479 VanDerWaalsContact CZ2-CE1 3.48Å; W368-H479 WeakPolarHBondContact CZ2-CE1 3.39Å; W368-H479 AromaticContact CZ2-ND1 3.72Å; W368-H479 AromaticContact NE1-CE1 3.48Å; W368-H479 PolarHBondContact NE1-CE1 3.12Å; W368-H479 AromaticContact NE1-ND1 3.58Å; W368-H479 AromaticContact NE1-NE2 3.97Å; A372-H479 HydrophobicContact CB-CB 3.86Å; S444-H479 PolarHBondContact OG-CE1 3.36Å; S444-H479 PolarHBondContact OG-NE2 3.04Å; T475-H479 PolarHBondContact O-CD2 2.86Å; T475-H479 PolarHBondContact O-N 3.5Å; A476-H479 WeakPolarHBondContact O-CB 3.5Å; A476-H479 PolarHBondContact O-N 3.47Å; A476-H479 VanDerWaalsContact O-N 3.08Å; F477-H479 VanDerWaalsContact C-N 3.27Å; F477-H479 PolarHBondContact O-N 3.45Å; H479-L481 PolarHBondContact O-N 3.47Å; H479-G482 PolarHBondContact O-N 2.89Å; H479-V483 WeakPolarHBondContact O-CG2 3.45Å; H479-V483 PolarHBondContact O-N 2.89Å
480	F	97.5	Very high	93.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-41.8	-180	-59	-23.4	0	0	0	112.1	A276 F337 L338 I348 F369 A372 A476 F477 V483 F484	A276-F480 HydrophobicContact CB-CD2 3.95Å; A276-F480 HydrophobicContact CB-CE2 3.64Å; F337-F480 HydrophobicContact CD1-CD2 4.27Å; F337-F480 AromaticContact CE1-CD2 3.61Å; F337-F480 HydrophobicContact CE1-CD2 3.61Å; F337-F480 AromaticContact CE1-CE2 3.82Å; F337-F480 HydrophobicContact CE1-CE2 3.82Å; F337-F480 HydrophobicContact CZ-CD2 4.41Å; F337-F480 HydrophobicContact CZ-CE2 4.17Å; L338-F480 HydrophobicContact CD2-CB 3.9Å; I348-F480 HydrophobicContact CD1-CD1 4.19Å; I348-F480 HydrophobicContact CD1-CD2 3.98Å; I348-F480 HydrophobicContact CD1-CE1 4.02Å; I348-F480 HydrophobicContact CD1-CE2 3.78Å; I348-F480 HydrophobicContact CD1-CG 4.18Å; I348-F480 HydrophobicContact CD1-CZ 3.82Å; I348-F480 HydrophobicContact CG1-CE1 4.14Å; I348-F480 HydrophobicContact CG1-CE2 4.05Å; I348-F480 HydrophobicContact CG1-CZ 3.75Å; F369-F480 AromaticContact CD2-CD1 3.87Å; F369-F480 HydrophobicContact CD2-CD1 3.87Å; F369-F480 HydrophobicContact CD2-CE1 4.28Å; F369-F480 AromaticContact CE2-CD1 3.44Å; F369-F480 HydrophobicContact CE2-CD1 3.44Å; F369-F480 VanDerWaalsContact CE2-CD1 3.44Å; F369-F480 AromaticContact CE2-CE1 3.9Å; F369-F480 HydrophobicContact CE2-CE1 3.9Å; F369-F480 HydrophobicContact CE2-CG 4.29Å; F369-F480 HydrophobicContact CZ-CD1 4.3Å; F369-F480 HydrophobicContact CZ-CE1 4.42Å; A372-F480 HydrophobicContact CB-CE1 3.93Å; A476-F480 HydrophobicContact CB-CE2 3.94Å; A476-F480 HydrophobicContact CB-CZ 4.01Å; A476-F480 WeakPolarHBondContact O-CD2 3.43Å; A476-F480 VanDerWaalsContact O-CG 3.27Å; A476-F480 WeakPolarHBondContact O-CG 3.42Å; A476-F480 PolarHBondContact O-N 3.37Å; F477-F480 PolarHBondContact O-N 2.65Å; F480-V483 PolarHBondContact O-N 3.16Å; F480-F484 WeakPolarHBondContact O-CB 2.99Å; F480-F484 PolarHBondContact O-N 3.33Å
481	L	96.7	Very high	93.8	Very high	45 Å²	45	32 Å²	32	24%	0.236	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-44.7	174.5	-177.3	63.5	0	0	0	111.5	L338 F477 H479 V483 F484 L485	L338-L481 HydrophobicContact CD1-CD1 4.43Å; F477-L481 HydrophobicContact CE1-CD2 4.31Å; F477-L481 HydrophobicContact CE2-CB 4.47Å; F477-L481 HydrophobicContact CZ-CB 4.47Å; F477-L481 HydrophobicContact CZ-CD2 4Å; F477-L481 WeakPolarHBondContact O-CB 3.46Å; F477-L481 PolarHBondContact O-N 3.15Å; H479-L481 PolarHBondContact O-N 3.47Å; L481-V483 VanDerWaalsContact C-N 3.32Å; L481-V483 PolarHBondContact O-N 2.95Å; L481-F484 HydrophobicContact CD1-CD1 4.48Å; L481-F484 PolarHBondContact O-N 2.96Å; L481-L485 HydrophobicContact CD1-CG 4.49Å; L481-L485 HydrophobicContact CG-CD1 4.3Å; L481-L485 VanDerWaalsContact O-CG 3.32Å; L481-L485 WeakPolarHBondContact O-CG 3.41Å; L481-L485 PolarHBondContact O-N 3.49Å
482	G	93.6	Very high	93.5	Very high	35 Å²	35	33.4 Å²	33.4	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-60	-41.5	176.3	0	0	0	0	0	112.9	M478 H479 H486	M478-G482 PolarHBondContact O-N 3.34Å; H479-G482 PolarHBondContact O-N 2.89Å; G482-H486 WeakPolarHBondContact O-CB 3.41Å; G482-H486 PolarHBondContact O-N 3.41Å
483	V	93.9	Very high	92.7	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.024	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-43.1	177.3	175.4	0	0	0	0	111.5	L334 M365 F369 H479 F480 L481 L485 H486 F487	L334-V483 HydrophobicContact CD1-CG1 3.97Å; M365-V483 HydrophobicContact CE-CB 3.87Å; M365-V483 HydrophobicContact CE-CG1 4.31Å; M365-V483 HydrophobicContact CE-CG2 3.29Å; M365-V483 HydrophobicContact SD-CG2 4.32Å; F369-V483 HydrophobicContact CB-CG1 4.44Å; F369-V483 HydrophobicContact CB-CG2 4.15Å; F369-V483 HydrophobicContact CD2-CB 4Å; F369-V483 HydrophobicContact CD2-CG1 3.77Å; F369-V483 HydrophobicContact CD2-CG2 3.84Å; F369-V483 HydrophobicContact CE2-CG1 4.41Å; F369-V483 HydrophobicContact CG-CG1 4.29Å; F369-V483 HydrophobicContact CG-CG2 4.46Å; H479-V483 WeakPolarHBondContact O-CG2 3.45Å; H479-V483 PolarHBondContact O-N 2.89Å; F480-V483 PolarHBondContact O-N 3.16Å; L481-V483 VanDerWaalsContact C-N 3.32Å; L481-V483 PolarHBondContact O-N 2.95Å; V483-L485 PolarHBondContact O-N 3.15Å; V483-H486 PolarHBondContact O-N 2.9Å; V483-F487 HydrophobicContact CG1-CD2 3.55Å; V483-F487 HydrophobicContact CG1-CE2 3.58Å; V483-F487 WeakPolarHBondContact O-CD2 3.2Å; V483-F487 PolarHBondContact O-N 3.07Å
484	F	96.8	Very high	91	Very high	17 Å²	17	43.6 Å²	43.6	8%	0.075	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-47.8	175	171.3	-107.4	0	0	0	111.8	A308 N331 L334 A335 L338 F339 F480 L481 S488	A308-F484 HydrophobicContact CB-CZ 3.87Å; N331-F484 HydrophobicContact CB-CE2 4.46Å; N331-F484 WeakPolarHBondContact O-CE2 3.48Å; L334-F484 HydrophobicContact CB-CB 4.18Å; L334-F484 HydrophobicContact CB-CD2 3.88Å; L334-F484 HydrophobicContact CB-CG 4.42Å; L334-F484 HydrophobicContact CD1-CB 4.05Å; A335-F484 HydrophobicContact CB-CE2 4Å; A335-F484 HydrophobicContact CB-CZ 4.45Å; L338-F484 HydrophobicContact CD1-CB 3.79Å; L338-F484 HydrophobicContact CD1-CD1 4.31Å; L338-F484 HydrophobicContact CD1-CG 4.01Å; F339-F484 HydrophobicContact CE2-CE1 4.12Å; F339-F484 HydrophobicContact CE2-CZ 4.45Å; F480-F484 WeakPolarHBondContact O-CB 2.99Å; F480-F484 PolarHBondContact O-N 3.33Å; L481-F484 HydrophobicContact CD1-CD1 4.48Å; L481-F484 PolarHBondContact O-N 2.96Å; F484-S488 VanDerWaalsContact O-CB 3.22Å; F484-S488 WeakPolarHBondContact O-CB 3.31Å; F484-S488 PolarHBondContact O-N 3Å; F484-S488 PolarHBondContact O-OG 2.98Å
485	L	94.1	Very high	89.2	Confident	82 Å²	82	45.2 Å²	45.2	43%	0.429	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-42.9	177.3	-68	174.5	0	0	0	111.5	L481 V483 S488 M489	L481-L485 HydrophobicContact CD1-CG 4.49Å; L481-L485 HydrophobicContact CG-CD1 4.3Å; L481-L485 VanDerWaalsContact O-CG 3.32Å; L481-L485 WeakPolarHBondContact O-CG 3.41Å; L481-L485 PolarHBondContact O-N 3.49Å; V483-L485 PolarHBondContact O-N 3.15Å; L485-S488 PolarHBondContact O-N 3.43Å; L485-M489 VanDerWaalsContact O-CG 3.29Å; L485-M489 WeakPolarHBondContact O-CG 3.19Å; L485-M489 PolarHBondContact O-N 3.12Å
486	H	90.4	Very high	87	Confident	51 Å²	51	46.9 Å²	46.9	24%	0.236	25%	0.248	C	C	.	.	H	α-helix	trans	-58.5	-55.6	178	177.5	78.8	0	0	0	111.8	M365 G482 V483 S488 M489 V490	M365-H486 HydrophobicContact CE-CB 3.92Å; G482-H486 WeakPolarHBondContact O-CB 3.41Å; G482-H486 PolarHBondContact O-N 3.41Å; V483-H486 PolarHBondContact O-N 2.9Å; H486-S488 VanDerWaalsContact C-N 3.31Å; H486-S488 PolarHBondContact O-N 2.94Å; H486-M489 PolarHBondContact O-N 2.73Å; H486-V490 VanDerWaalsContact O-CG2 3.27Å; H486-V490 WeakPolarHBondContact O-CG2 3.5Å; H486-V490 PolarHBondContact O-N 3.45Å
487	F	93	Very high	84.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.6	-27.1	-177.9	-74.2	-59.2	0	0	0	113.5	L327 V330 N331 L358 F362 M365 V483 Q491	L327-F487 HydrophobicContact CD2-CD1 3.72Å; L327-F487 HydrophobicContact CD2-CE1 4.43Å; L327-F487 HydrophobicContact CD2-CG 4.49Å; V330-F487 HydrophobicContact CG1-CB 4.17Å; V330-F487 HydrophobicContact CG1-CD2 3.6Å; V330-F487 HydrophobicContact CG1-CE2 4.24Å; V330-F487 HydrophobicContact CG1-CG 4.07Å; N331-F487 PolarHBondContact ND2-O 2.85Å; N331-F487 VanDerWaalsContact OD1-CB 3.28Å; N331-F487 WeakPolarHBondContact OD1-CB 3.48Å; L358-F487 HydrophobicContact CD1-CD1 3.9Å; L358-F487 HydrophobicContact CD1-CE1 3.52Å; L358-F487 HydrophobicContact CD1-CZ 3.86Å; F362-F487 HydrophobicContact CB-CE1 4.49Å; F362-F487 AromaticContact CD2-CE1 3.65Å; F362-F487 HydrophobicContact CD2-CE1 3.65Å; F362-F487 HydrophobicContact CD2-CZ 4.43Å; F362-F487 HydrophobicContact CE2-CE1 4.09Å; F362-F487 HydrophobicContact CG-CE1 4.22Å; M365-F487 HydrophobicContact CG-CE2 4.38Å; M365-F487 HydrophobicContact CG-CZ 4.32Å; V483-F487 HydrophobicContact CG1-CD2 3.55Å; V483-F487 HydrophobicContact CG1-CE2 3.58Å; V483-F487 WeakPolarHBondContact O-CD2 3.2Å; V483-F487 PolarHBondContact O-N 3.07Å; F487-Q491 PolarHBondContact O-N 3.22Å; F487-Q491 VanDerWaalsContact O-N 3.09Å
488	S	92.8	Very high	82.1	Confident	21 Å²	21	65.2 Å²	65.2	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-51.2	168.2	-65.3	0	0	0	0	110.4	N331 F484 L485 H486 V490 Q491 F492	N331-S488 WeakPolarHBondContact ND2-CA 3.44Å; N331-S488 PolarHBondContact OD1-N 3.2Å; F484-S488 VanDerWaalsContact O-CB 3.22Å; F484-S488 WeakPolarHBondContact O-CB 3.31Å; F484-S488 PolarHBondContact O-N 3Å; F484-S488 PolarHBondContact O-OG 2.98Å; L485-S488 PolarHBondContact O-N 3.43Å; H486-S488 VanDerWaalsContact C-N 3.31Å; H486-S488 PolarHBondContact O-N 2.94Å; S488-V490 PolarHBondContact O-N 2.92Å; S488-Q491 PolarHBondContact O-N 3.13Å; S488-F492 WeakPolarHBondContact O-CD2 3.48Å; S488-F492 PolarHBondContact O-N 2.86Å
489	M	89.6	Confident	79.2	Confident	100 Å²	100	69 Å²	69	49%	0.493	34%	0.335	S	S	.	.	H	α-helix	trans	-59.1	-45.5	176.5	-70	179	-172.4	0	0	112	L485 H486 Q491 F492 M493	L485-M489 VanDerWaalsContact O-CG 3.29Å; L485-M489 WeakPolarHBondContact O-CG 3.19Å; L485-M489 PolarHBondContact O-N 3.12Å; H486-M489 PolarHBondContact O-N 2.73Å; M489-Q491 PolarHBondContact O-N 2.83Å; M489-F492 PolarHBondContact O-N 3.31Å; M489-M493 WeakPolarHBondContact O-CB 3.49Å; M489-M493 VanDerWaalsContact O-CG 3.27Å; M489-M493 WeakPolarHBondContact O-CG 3.39Å; M489-M493 PolarHBondContact O-N 2.81Å
490	V	87.9	Confident	76.1	Confident	7 Å²	7	72.4 Å²	72.4	4%	0.042	36%	0.362	C	S	.	.	H	α-helix	trans	-57.7	-34.6	178.2	171.7	0	0	0	0	112.5	W323 L327 F362 L418 I420 H486 S488	W323-V490 HydrophobicContact CZ2-CG1 4.19Å; L327-V490 HydrophobicContact CD1-CG1 4.01Å; L327-V490 HydrophobicContact CD2-CG1 4.12Å; F362-V490 HydrophobicContact CE2-CG1 4.03Å; F362-V490 HydrophobicContact CZ-CG1 3.8Å; F362-V490 HydrophobicContact CZ-CG2 4.33Å; L418-V490 HydrophobicContact CD1-CG2 4.2Å; L418-V490 HydrophobicContact CD2-CG2 3.93Å; I420-V490 HydrophobicContact CD1-CG2 4.4Å; H486-V490 VanDerWaalsContact O-CG2 3.27Å; H486-V490 WeakPolarHBondContact O-CG2 3.5Å; H486-V490 PolarHBondContact O-N 3.45Å; S488-V490 PolarHBondContact O-N 2.92Å
491	Q	90.3	Very high	72.9	Confident	2 Å²	2	83.9 Å²	83.9	1%	0.009	41%	0.405	C	S	.	.	H	α-helix	trans	-74.7	-35	179.9	-165.8	-176.6	10.5	0	0	113.3	S312 R315 L327 N331 F487 S488 M489	S312-Q491 PolarHBondContact O-NE2 3.01Å; S312-Q491 VanDerWaalsContact O-NE2 3.15Å; S312-Q491 VanDerWaalsContact OG-CD 3.26Å; S312-Q491 PolarHBondContact OG-NE2 2.95Å; S312-Q491 VanDerWaalsContact OG-NE2 3.16Å; S312-Q491 PolarHBondContact OG-OE1 3.02Å; R315-Q491 HydrophobicContact CG-CG 4.35Å; L327-Q491 HydrophobicContact CB-CB 4.17Å; L327-Q491 HydrophobicContact CB-CG 4.03Å; L327-Q491 HydrophobicContact CD1-CB 3.83Å; L327-Q491 HydrophobicContact CD1-CG 4.02Å; N331-Q491 PolarHBondContact ND2-OE1 2.85Å; F487-Q491 PolarHBondContact O-N 3.22Å; F487-Q491 VanDerWaalsContact O-N 3.09Å; S488-Q491 PolarHBondContact O-N 3.13Å; M489-Q491 PolarHBondContact O-N 2.83Å
492	F	87.3	Confident	69.7	Low	96 Å²	96	90 Å²	90	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-83.2	-29	-179.6	-73.9	-72.5	0	0	0	112.8	P311 R315 S488 M489	P311-F492 HydrophobicContact CB-CE2 4.23Å; P311-F492 HydrophobicContact CB-CZ 3.66Å; P311-F492 WeakPolarHBondContact O-CZ 3.35Å; R315-F492 HydrophobicContact CB-CE1 4.1Å; R315-F492 HydrophobicContact CB-CZ 4.46Å; R315-F492 HydrophobicContact CG-CE1 4.39Å; S488-F492 WeakPolarHBondContact O-CD2 3.48Å; S488-F492 PolarHBondContact O-N 2.86Å; M489-F492 PolarHBondContact O-N 3.31Å
493	M	79.2	Confident	66.9	Low	70 Å²	70	98.1 Å²	98.1	35%	0.345	46%	0.455	S	S	.	.	S	Bend	trans	-81.1	123.7	172.8	-61	-176.2	76.3	0	0	108.9	I420 M489	I420-M493 HydrophobicContact CB-CE 4.14Å; I420-M493 HydrophobicContact CB-SD 4.13Å; I420-M493 HydrophobicContact CD1-SD 3.64Å; I420-M493 HydrophobicContact CG1-CE 3.81Å; I420-M493 HydrophobicContact CG1-SD 3.6Å; I420-M493 VanDerWaalsContact CG1-SD 3.6Å; I420-M493 HydrophobicContact CG2-CE 4.14Å; I420-M493 HydrophobicContact CG2-SD 3.76Å; M489-M493 WeakPolarHBondContact O-CB 3.49Å; M489-M493 VanDerWaalsContact O-CG 3.27Å; M489-M493 WeakPolarHBondContact O-CG 3.39Å; M489-M493 PolarHBondContact O-N 2.81Å
494	E	56.3	Low	63.9	Low	150 Å²	150	104.4 Å²	104.4	70%	0.701	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-53.6	145.2	-173.1	-75.1	-165.3	147.5	0	0	113	K319	K319-E494 IonicContact NZ-OE1 2.9Å
495	P	55.9	Low	60.9	Low	75 Å²	75	114.9 Å²	114.9	49%	0.487	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-60.3	146.8	-173.2	24.3	-34.1	0	0	0	111.2	R497	P495-R497 PolarHBondContact O-N 3.4Å
496	P	50.6	Low	59.2	Low	61 Å²	61	116.6 Å²	116.6	40%	0.396	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-57.7	117.4	166.8	22.7	-29.4	0	0	0	108	K417 K498	K417-P496 HydrophobicContact CB-CB 4.14Å; K417-P496 HydrophobicContact CB-CG 4.5Å; P496-K498 PolarHBondContact O-N 3.17Å
497	R	44.1	Very low	57.6	Low	244 Å²	244	120 Å²	120	92%	0.921	57%	0.568	S	S	*	*			trans	-54.6	108.7	171.9	-86.2	-179.1	171.6	177.9	-2.2	107.5	P495 K499	P495-R497 PolarHBondContact O-N 3.4Å; R497-K499 PolarHBondContact O-N 2.81Å
498	K	44.1	Very low	55.6	Low	158 Å²	158	126.7 Å²	126.7	69%	0.687	60%	0.6	S	S	*	*			trans	-58.3	105.7	158.4	-85.1	180	175.7	168.4	0	105.4	D137 P496 S500	D137-K498 IonicContact OD2-NZ 3.24Å; D137-K498 PolarHBondContact OD2-NZ 2.96Å; P496-K498 PolarHBondContact O-N 3.17Å; K498-S500 PolarHBondContact O-N 2.96Å
499	K	33.4	Very low	53.4	Low	198 Å²	198	132.9 Å²	132.9	86%	0.861	63%	0.627	S	S	*	*			trans	-53.7	111.7	164.4	-83.5	179	174.8	176.2	0	105.1	R497 R501	R497-K499 PolarHBondContact O-N 2.81Å; K499-R501 PolarHBondContact O-N 3.09Å
500	S	30.1	Very low	51.2	Low	105 Å²	105	134.9 Å²	134.9	73%	0.734	64%	0.635	S	S	*	*			trans	-53.8	118.5	164.4	53.5	0	0	0	0	105.5	K498 K502	K498-S500 PolarHBondContact O-N 2.96Å; S500-K502 VanDerWaalsContact C-N 3.27Å; S500-K502 PolarHBondContact O-N 3.26Å
501	R	31.4	Very low	48.7	Very low	240 Å²	240	143.5 Å²	143.5	91%	0.906	67%	0.674	S	S	*	*			trans	-56.8	107.8	159.4	-90.5	-179.2	170.2	177.1	-3.1	103.9	K499 K503	K499-R501 PolarHBondContact O-N 3.09Å; R501-K503 PolarHBondContact O-N 2.92Å
502	K	29.3	Very low	45.7	Very low	174 Å²	174	153.6 Å²	153.6	76%	0.757	72%	0.722	S	S	*	*			trans	-44.4	116.4	163	-82.9	179.6	170.6	-177.9	0	105.4	S500 N504	S500-K502 VanDerWaalsContact C-N 3.27Å; S500-K502 PolarHBondContact O-N 3.26Å; K502-N504 PolarHBondContact O-N 3.13Å
503	K	34.3	Very low	42.5	Very low	205 Å²	205	158 Å²	158	89%	0.891	75%	0.745	S	S	*	*			trans	-60.8	94.6	153.3	-81.2	-178.3	171.7	-176.5	0	104	R501 N505	R501-K503 PolarHBondContact O-N 2.92Å; K503-N505 PolarHBondContact O-N 2.85Å
504	N	30.5	Very low	39.5	Very low	137 Å²	137	165.3 Å²	165.3	73%	0.733	78%	0.778	S	S	*	*			trans	-75.1	117.1	160.1	-84.7	4.3	0	0	0	105.1	K502	K502-N504 PolarHBondContact O-N 3.13Å
505	N	33.9	Very low	38	Very low	237 Å²	237	166.7 Å²	166.7	100%	1.267	79%	0.785	S	S	*	*			trans	0.5	0	170.4	-64.2	-9.1	0	0	0	117.7	K503	K503-N505 PolarHBondContact O-N 2.85Å

Retrieved 505 of 505 residues in 824.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).