A0A087XY72_POEFO Loading...

Transporter

AlphaFold DB , UniProt , Accession A0A087XY72, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 584 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	63.3	Low	84.1	Confident	142 Å²	142	85.5 Å²	85.5	70%	0.7	45%	0.448	S	S	*	.				0	127.3	0	-176.8	169.6	165.3	0	0	105.8	P380 R384	M1-P380 HydrophobicContact CE-CB 3.38Å; M1-P380 HydrophobicContact CE-CG 3.91Å; M1-R384 HydrophobicContact CE-CB 4.28Å; M1-R384 HydrophobicContact CE-CG 4.39Å; M1-R384 HydrophobicContact CG-CB 3.95Å
2	E	69.7	Low	85	Confident	116 Å²	116	78.7 Å²	78.7	54%	0.542	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-67.8	135.6	179.8	-72.9	176.1	-176.2	0	0	109.4	R384	E2-R384 PolarHBondContact N-O 2.94Å
3	E	76	Confident	85.8	Confident	187 Å²	187	72.8 Å²	72.8	87%	0.874	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-61.3	148.3	173.8	-71	-174	168.3	0	0	110.2	G5	E3-G5 PolarHBondContact O-N 2.77Å
4	R	79.4	Confident	86.5	Confident	47 Å²	47	70.2 Å²	70.2	18%	0.177	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-58.9	130.2	175	-168.7	-163.5	-171.9	94.6	14.2	108	S69 S275 Y276 D377	R4-S69 PolarHBondContact NH1-O 3.48Å; R4-S275 PolarHBondContact NE-O 2.87Å; R4-S275 PolarHBondContact NH2-OG 2.85Å; R4-Y276 HydrophobicContact CG-CD1 4.46Å; R4-Y276 HydrophobicContact CG-CE1 4.15Å; R4-D377 IonicContact CZ-OD1 3.69Å; R4-D377 IonicContact CZ-OD2 3.59Å; R4-D377 VanDerWaalsContact NH1-CG 3.31Å; R4-D377 IonicContact NH1-OD1 2.72Å; R4-D377 PolarHBondContact NH1-OD1 3.22Å; R4-D377 IonicContact NH1-OD2 3.61Å; R4-D377 PolarHBondContact NH1-OD2 2.78Å; R4-D377 IonicContact NH2-OD1 3.53Å; R4-D377 IonicContact NH2-OD2 2.98Å; R4-D377 PolarHBondContact NH2-OD2 2.71Å
5	G	82.8	Confident	87.1	Confident	25 Å²	25	67.3 Å²	67.3	26%	0.258	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-59.8	163.4	173.5	0	0	0	0	0	111.9	E3 Y276	E3-G5 PolarHBondContact O-N 2.77Å; G5-Y276 VanDerWaalsContact O-CD1 3.28Å; G5-Y276 WeakPolarHBondContact O-CD1 3.25Å
6	Q	91.7	Very high	87.6	Confident	106 Å²	106	63.1 Å²	63.1	50%	0.495	33%	0.332	S	S	.	.			trans	-133.2	162.5	167.6	-70.4	-177.2	-13.6	0	0	108.1	Y276	Q6-Y276 WeakPolarHBondContact CA-O 3.31Å
7	W	93.6	Very high	88.1	Confident	15 Å²	15	59.4 Å²	59.4	6%	0.057	31%	0.312	C	S	.	.			trans	-58.5	138.3	169.3	-62.7	111.3	0	0	0	110.8	N9 E12 F13 S16 V200 L273 Y276 N277	W7-N9 VanDerWaalsContact C-N 3.29Å; W7-N9 PolarHBondContact O-N 3.13Å; W7-E12 HydrophobicContact CE3-CB 3.99Å; W7-F13 HydrophobicContact CD2-CB 4.09Å; W7-F13 HydrophobicContact CG-CB 3.89Å; W7-F13 HydrophobicContact CZ2-CD2 4.46Å; W7-F13 AromaticContact NE1-CD2 3.5Å; W7-S16 WeakPolarHBondContact CH2-OG 3.36Å; W7-S16 WeakPolarHBondContact CZ3-OG 3.46Å; W7-V200 HydrophobicContact CD2-CB 4.28Å; W7-V200 HydrophobicContact CE3-CB 3.85Å; W7-V200 HydrophobicContact CE3-CG1 4.37Å; W7-V200 HydrophobicContact CH2-CB 3.9Å; W7-V200 HydrophobicContact CH2-CG1 3.62Å; W7-V200 HydrophobicContact CZ2-CB 4.32Å; W7-V200 HydrophobicContact CZ2-CG1 3.78Å; W7-V200 HydrophobicContact CZ3-CB 3.65Å; W7-V200 HydrophobicContact CZ3-CG1 3.94Å; W7-L273 HydrophobicContact CH2-CD2 3.89Å; W7-L273 HydrophobicContact CZ2-CB 4.34Å; W7-L273 HydrophobicContact CZ2-CD2 3.64Å; W7-L273 PolarHBondContact NE1-O 3.37Å; W7-Y276 VanDerWaalsContact CD1-C 3.42Å; W7-Y276 VanDerWaalsContact CD1-O 3.26Å; W7-Y276 PolarHBondContact N-O 2.87Å; W7-N277 PolarHBondContact NE1-OD1 3.25Å
8	G	89.9	Confident	88.5	Confident	61 Å²	61	56.3 Å²	56.3	63%	0.629	30%	0.297	S	S	*	.	S	Bend	trans	-67.4	-34.5	178.8	0	0	0	0	0	111.9	E12	G8-E12 VanDerWaalsContact CA-OE2 3.26Å; G8-E12 WeakPolarHBondContact CA-OE2 3.25Å; G8-E12 PolarHBondContact N-OE2 3.01Å
9	N	92.6	Very high	88.7	Confident	61 Å²	61	53.5 Å²	53.5	33%	0.326	28%	0.283	S	S	.	.	S	Bend	trans	-152.4	172.8	171.9	66.6	52.7	0	0	0	111.1	W7 L11 E12 Y208	W7-N9 VanDerWaalsContact C-N 3.29Å; W7-N9 PolarHBondContact O-N 3.13Å; N9-L11 VanDerWaalsContact C-N 3.32Å; N9-L11 PolarHBondContact O-N 3.01Å; N9-L11 WeakPolarHBondContact OD1-CA 3.28Å; N9-L11 WeakPolarHBondContact OD1-CB 3.4Å; N9-L11 PolarHBondContact OD1-N 3.12Å; N9-E12 PolarHBondContact O-N 3.05Å; N9-E12 WeakPolarHBondContact OD1-CG 3.49Å; N9-E12 PolarHBondContact OD1-N 3.09Å; N9-Y208 PolarHBondContact ND2-OH 2.97Å; N9-Y208 PolarHBondContact OD1-OH 3.38Å
10	K	92.5	Very high	88.9	Confident	93 Å²	93	51.2 Å²	51.2	40%	0.404	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-33.3	-179.5	-179.7	167.7	177.9	144.8	0	113.5	E12 F13 V14 N281 D286	K10-E12 VanDerWaalsContact C-N 3.34Å; K10-F13 PolarHBondContact O-N 3.18Å; K10-V14 HydrophobicContact CG-CG2 4.35Å; K10-V14 WeakPolarHBondContact O-CG2 3.41Å; K10-V14 PolarHBondContact O-N 3.35Å; K10-N281 PolarHBondContact NZ-OD1 3.11Å; K10-D286 WeakPolarHBondContact CE-OD1 3.08Å; K10-D286 WeakPolarHBondContact CE-OD2 3.48Å; K10-D286 IonicContact NZ-OD1 3.87Å; K10-D286 PolarHBondContact NZ-OD1 3.28Å; K10-D286 IonicContact NZ-OD2 3.14Å; K10-D286 PolarHBondContact NZ-OD2 2.98Å
11	L	94.1	Very high	89	Confident	88 Å²	88	48.9 Å²	48.9	46%	0.461	26%	0.259	S	S	.	.	H	α-helix	trans	-68	-35.9	-178.7	-176.4	60.9	0	0	0	111.5	N9 F13 V14 L15 Y208	N9-L11 VanDerWaalsContact C-N 3.32Å; N9-L11 PolarHBondContact O-N 3.01Å; N9-L11 WeakPolarHBondContact OD1-CA 3.28Å; N9-L11 WeakPolarHBondContact OD1-CB 3.4Å; N9-L11 PolarHBondContact OD1-N 3.12Å; L11-F13 VanDerWaalsContact C-N 3.33Å; L11-F13 PolarHBondContact O-N 3.3Å; L11-V14 PolarHBondContact O-N 2.86Å; L11-L15 HydrophobicContact CD1-CD1 4.04Å; L11-L15 HydrophobicContact CD1-CD2 4.46Å; L11-L15 HydrophobicContact CD1-CG 3.9Å; L11-L15 HydrophobicContact CD2-CD1 4.48Å; L11-L15 HydrophobicContact CG-CD1 3.86Å; L11-L15 HydrophobicContact CG-CG 4.16Å; L11-L15 WeakPolarHBondContact O-CB 3.48Å; L11-L15 WeakPolarHBondContact O-CG 3.33Å; L11-L15 PolarHBondContact O-N 2.87Å; L11-Y208 HydrophobicContact CD2-CE1 3.57Å; L11-Y208 HydrophobicContact CG-CE1 4.06Å
12	E	94.8	Very high	90.4	Very high	3 Å²	3	42.6 Å²	42.6	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-43	174.3	-68.6	178.4	-179.8	0	0	111.7	W7 G8 N9 K10 S16 G204 K205 Y208	W7-E12 HydrophobicContact CE3-CB 3.99Å; G8-E12 VanDerWaalsContact CA-OE2 3.26Å; G8-E12 WeakPolarHBondContact CA-OE2 3.25Å; G8-E12 PolarHBondContact N-OE2 3.01Å; N9-E12 PolarHBondContact O-N 3.05Å; N9-E12 WeakPolarHBondContact OD1-CG 3.49Å; N9-E12 PolarHBondContact OD1-N 3.09Å; K10-E12 VanDerWaalsContact C-N 3.34Å; E12-S16 WeakPolarHBondContact O-CB 3.37Å; E12-S16 PolarHBondContact O-N 3.36Å; E12-S16 PolarHBondContact O-OG 3.3Å; E12-G204 WeakPolarHBondContact CG-O 3.37Å; E12-K205 WeakPolarHBondContact OE1-CE 3.34Å; E12-K205 IonicContact OE1-NZ 2.7Å; E12-K205 PolarHBondContact OE1-NZ 2.75Å; E12-Y208 HydrophobicContact CG-CE2 3.76Å
13	F	95.1	Very high	91.3	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-53.3	172.8	167.6	-111.4	0	0	0	111.5	W7 K10 L11 L15 S16 V17 V62 L273 N277 D286	W7-F13 HydrophobicContact CD2-CB 4.09Å; W7-F13 HydrophobicContact CG-CB 3.89Å; W7-F13 HydrophobicContact CZ2-CD2 4.46Å; W7-F13 AromaticContact NE1-CD2 3.5Å; K10-F13 PolarHBondContact O-N 3.18Å; L11-F13 VanDerWaalsContact C-N 3.33Å; L11-F13 PolarHBondContact O-N 3.3Å; F13-L15 PolarHBondContact O-N 3.45Å; F13-S16 PolarHBondContact O-N 3.28Å; F13-V17 HydrophobicContact CD2-CG2 3.8Å; F13-V17 HydrophobicContact CE2-CG2 3.4Å; F13-V17 HydrophobicContact CZ-CG2 3.79Å; F13-V17 WeakPolarHBondContact O-CG2 3.43Å; F13-V17 PolarHBondContact O-N 3.37Å; F13-V62 HydrophobicContact CZ-CG1 3.93Å; F13-L273 HydrophobicContact CE2-CB 4.38Å; F13-N277 WeakPolarHBondContact CD2-OD1 3.39Å; F13-N277 WeakPolarHBondContact CE2-ND2 3.45Å; F13-N277 VanDerWaalsContact CG-OD1 3.22Å; F13-N277 WeakPolarHBondContact CG-OD1 3.44Å; F13-N277 WeakPolarHBondContact CZ-ND2 3.23Å; F13-D286 HydrophobicContact CE1-CB 4.17Å
14	V	96.1	Very high	91.8	Very high	37 Å²	37	28.5 Å²	28.5	22%	0.224	16%	0.164	C	C	.	.	H	α-helix	trans	-59.9	-44.6	-177	172.2	0	0	0	0	111.4	K10 L11 V17 A18 L290	K10-V14 HydrophobicContact CG-CG2 4.35Å; K10-V14 WeakPolarHBondContact O-CG2 3.41Å; K10-V14 PolarHBondContact O-N 3.35Å; L11-V14 PolarHBondContact O-N 2.86Å; V14-V17 PolarHBondContact O-N 3.45Å; V14-A18 VanDerWaalsContact O-CB 3.25Å; V14-A18 WeakPolarHBondContact O-CB 3.34Å; V14-A18 PolarHBondContact O-N 3.2Å; V14-L290 HydrophobicContact CG1-CD2 4.04Å
15	L	95.6	Very high	92.1	Very high	26 Å²	26	27.2 Å²	27.2	14%	0.136	17%	0.165	C	C	.	.	H	α-helix	trans	-69	-36.7	178.2	-70	177.4	0	0	0	112.3	L11 F13 A18 G19 V207 Y208 T212	L11-L15 HydrophobicContact CD1-CD1 4.04Å; L11-L15 HydrophobicContact CD1-CD2 4.46Å; L11-L15 HydrophobicContact CD1-CG 3.9Å; L11-L15 HydrophobicContact CD2-CD1 4.48Å; L11-L15 HydrophobicContact CG-CD1 3.86Å; L11-L15 HydrophobicContact CG-CG 4.16Å; L11-L15 WeakPolarHBondContact O-CB 3.48Å; L11-L15 WeakPolarHBondContact O-CG 3.33Å; L11-L15 PolarHBondContact O-N 2.87Å; F13-L15 PolarHBondContact O-N 3.45Å; L15-A18 PolarHBondContact O-N 3.06Å; L15-G19 PolarHBondContact O-N 3.27Å; L15-V207 HydrophobicContact CB-CB 4.17Å; L15-V207 HydrophobicContact CB-CG2 3.83Å; L15-Y208 HydrophobicContact CD1-CD1 3.81Å; L15-Y208 HydrophobicContact CD1-CE1 4.04Å; L15-Y208 HydrophobicContact CD1-CG 4.25Å; L15-T212 HydrophobicContact CD2-CG2 4.15Å
16	S	95.1	Very high	92.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-41.1	176.2	-64	0	0	0	0	111.8	W7 E12 F13 S20	W7-S16 WeakPolarHBondContact CH2-OG 3.36Å; W7-S16 WeakPolarHBondContact CZ3-OG 3.46Å; E12-S16 WeakPolarHBondContact O-CB 3.37Å; E12-S16 PolarHBondContact O-N 3.36Å; E12-S16 PolarHBondContact O-OG 3.3Å; F13-S16 PolarHBondContact O-N 3.28Å; S16-S20 WeakPolarHBondContact O-CB 3.47Å; S16-S20 PolarHBondContact O-N 3.37Å; S16-S20 VanDerWaalsContact O-N 3.1Å
17	V	95.8	Very high	92.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70.1	-41.3	174.2	-178.4	0	0	0	0	110.8	F13 V14 G19 S20 I21 F58 L270 L273 L290	F13-V17 HydrophobicContact CD2-CG2 3.8Å; F13-V17 HydrophobicContact CE2-CG2 3.4Å; F13-V17 HydrophobicContact CZ-CG2 3.79Å; F13-V17 WeakPolarHBondContact O-CG2 3.43Å; F13-V17 PolarHBondContact O-N 3.37Å; V14-V17 PolarHBondContact O-N 3.45Å; V17-G19 PolarHBondContact O-N 2.95Å; V17-S20 WeakPolarHBondContact O-CB 3.4Å; V17-S20 PolarHBondContact O-N 3.01Å; V17-S20 VanDerWaalsContact O-N 3.16Å; V17-I21 HydrophobicContact CG1-CD1 4.47Å; V17-I21 HydrophobicContact CG1-CG2 4.23Å; V17-I21 WeakPolarHBondContact O-CG1 3.44Å; V17-I21 WeakPolarHBondContact O-CG2 3.17Å; V17-I21 PolarHBondContact O-N 2.95Å; V17-F58 HydrophobicContact CG1-CE1 4.41Å; V17-F58 HydrophobicContact CG1-CE2 4.46Å; V17-F58 HydrophobicContact CG1-CZ 3.59Å; V17-L270 HydrophobicContact CG1-CD2 3.95Å; V17-L273 HydrophobicContact CB-CD1 4.5Å; V17-L273 HydrophobicContact CG2-CB 4.28Å; V17-L273 HydrophobicContact CG2-CD1 3.76Å; V17-L290 HydrophobicContact CB-CD1 3.86Å; V17-L290 HydrophobicContact CB-CD2 4.36Å; V17-L290 HydrophobicContact CG1-CD1 3.65Å; V17-L290 HydrophobicContact CG1-CD2 4.34Å; V17-L290 HydrophobicContact CG1-CG 4.46Å
18	A	95.3	Very high	91.7	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-59	-47.9	176.1	0	0	0	0	0	111.8	V14 L15 S20 I21 I22 L290 L293	V14-A18 VanDerWaalsContact O-CB 3.25Å; V14-A18 WeakPolarHBondContact O-CB 3.34Å; V14-A18 PolarHBondContact O-N 3.2Å; L15-A18 PolarHBondContact O-N 3.06Å; A18-S20 VanDerWaalsContact C-N 3.27Å; A18-S20 PolarHBondContact O-N 3.18Å; A18-I21 PolarHBondContact O-N 2.67Å; A18-I22 VanDerWaalsContact O-CB 3.22Å; A18-I22 WeakPolarHBondContact O-CB 3.45Å; A18-I22 WeakPolarHBondContact O-CG1 3.43Å; A18-I22 PolarHBondContact O-N 3.21Å; A18-L290 HydrophobicContact CB-CD2 3.96Å; A18-L293 HydrophobicContact CB-CD2 4.18Å
19	G	92.6	Very high	91.6	Very high	3 Å²	3	23.1 Å²	23.1	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-64.8	-28.4	175.9	0	0	0	0	0	113.5	L15 V17 D362	L15-G19 PolarHBondContact O-N 3.27Å; V17-G19 PolarHBondContact O-N 2.95Å; G19-D362 VanDerWaalsContact O-CB 3.27Å; G19-D362 WeakPolarHBondContact O-CB 3.47Å
20	S	91.5	Very high	91.6	Very high	8 Å²	8	20.3 Å²	20.3	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-71.6	-37.9	175.3	-173.6	0	0	0	0	113.7	S16 V17 A18 S363 V366	S16-S20 WeakPolarHBondContact O-CB 3.47Å; S16-S20 PolarHBondContact O-N 3.37Å; S16-S20 VanDerWaalsContact O-N 3.1Å; V17-S20 WeakPolarHBondContact O-CB 3.4Å; V17-S20 PolarHBondContact O-N 3.01Å; V17-S20 VanDerWaalsContact O-N 3.16Å; A18-S20 VanDerWaalsContact C-N 3.27Å; A18-S20 PolarHBondContact O-N 3.18Å; S20-S363 PolarHBondContact O-OG 3.49Å; S20-V366 WeakPolarHBondContact OG-CG1 3.49Å
21	I	92.9	Very high	91.6	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.015	9%	0.085	C	C	.	.	H	α-helix	trans	-94.7	-20.1	-172.7	72.3	-171.9	0	0	0	111	V17 A18 N26 F58 S262 L270 L290 N294	V17-I21 HydrophobicContact CG1-CD1 4.47Å; V17-I21 HydrophobicContact CG1-CG2 4.23Å; V17-I21 WeakPolarHBondContact O-CG1 3.44Å; V17-I21 WeakPolarHBondContact O-CG2 3.17Å; V17-I21 PolarHBondContact O-N 2.95Å; A18-I21 PolarHBondContact O-N 2.67Å; I21-N26 PolarHBondContact O-OD1 2.85Å; I21-N26 VanDerWaalsContact O-OD1 3.11Å; I21-F58 HydrophobicContact CD1-CE2 4.43Å; I21-F58 HydrophobicContact CD1-CZ 4.37Å; I21-F58 HydrophobicContact CG2-CE2 3.79Å; I21-F58 HydrophobicContact CG2-CZ 4.3Å; I21-S262 CarbonylContact C-O 3.59Å; I21-L270 HydrophobicContact CG2-CD2 4.39Å; I21-L290 HydrophobicContact CD1-CB 4.05Å; I21-L290 HydrophobicContact CD1-CD2 4.41Å; I21-N294 HydrophobicContact CD1-CB 3.84Å; I21-N294 HydrophobicContact CG1-CB 4.03Å; I21-N294 PolarHBondContact O-OD1 3.37Å
22	I	91.6	Very high	91.3	Very high	10 Å²	10	13.8 Å²	13.8	5%	0.051	7%	0.071	C	C	.	.	S	Bend	trans	-104.7	94	177.8	-58.7	175	0	0	0	107.6	A18 N26 Y215 L293 T297 L359	A18-I22 VanDerWaalsContact O-CB 3.22Å; A18-I22 WeakPolarHBondContact O-CB 3.45Å; A18-I22 WeakPolarHBondContact O-CG1 3.43Å; A18-I22 PolarHBondContact O-N 3.21Å; I22-N26 WeakPolarHBondContact CA-OD1 3.26Å; I22-Y215 HydrophobicContact CD1-CE2 4.4Å; I22-Y215 WeakPolarHBondContact CD1-OH 3.48Å; I22-L293 HydrophobicContact CD1-CD2 4.31Å; I22-L293 HydrophobicContact CD1-CG 4.06Å; I22-T297 HydrophobicContact CD1-CG2 4.41Å; I22-T297 HydrophobicContact CG2-CG2 3.77Å; I22-L359 HydrophobicContact CG2-CD2 4.08Å; I22-L359 VanDerWaalsContact O-CD2 3.29Å; I22-L359 WeakPolarHBondContact O-CD2 3.31Å
23	G	88.8	Confident	91.1	Very high	4 Å²	4	14.1 Å²	14.1	4%	0.041	7%	0.073	C	C	.	.	S	Bend	trans	-128.6	-160.8	-179.7	0	0	0	0	0	111.7	G25 N26	G23-G25 PolarHBondContact O-N 2.7Å; G23-N26 PolarHBondContact N-OD1 3.16Å; G23-N26 WeakPolarHBondContact O-CB 3.3Å; G23-N26 PolarHBondContact O-N 2.84Å; G23-N26 VanDerWaalsContact O-N 3.15Å; G23-N26 PolarHBondContact O-OD1 3.48Å
24	L	86.6	Confident	90.9	Very high	3 Å²	3	14 Å²	14	2%	0.016	7%	0.072	C	C	.	.	H	α-helix	trans	-57.7	-34.9	-179.8	-60.8	168.5	0	0	0	112.5	N26 M27 W28 V104 I356 L359	L24-N26 PolarHBondContact O-N 3.06Å; L24-M27 PolarHBondContact O-N 3.02Å; L24-W28 VanDerWaalsContact C-CD1 3.43Å; L24-W28 HydrophobicContact CB-CD2 4.32Å; L24-W28 HydrophobicContact CB-CZ2 3.78Å; L24-W28 HydrophobicContact CD1-CH2 4.22Å; L24-W28 HydrophobicContact CD1-CZ2 4.02Å; L24-W28 HydrophobicContact CG-CZ2 4.47Å; L24-W28 PolarHBondContact O-N 2.86Å; L24-W28 PolarHBondContact O-NE1 2.9Å; L24-V104 HydrophobicContact CD1-CB 4.07Å; L24-V104 HydrophobicContact CD1-CG1 3.43Å; L24-V104 VanDerWaalsContact CD1-CG1 3.43Å; L24-I356 HydrophobicContact CD2-CB 4.21Å; L24-I356 HydrophobicContact CD2-CG1 4.07Å; L24-I356 HydrophobicContact CD2-CG2 3.87Å; L24-L359 HydrophobicContact CD2-CB 4.38Å
25	G	86.4	Confident	90.6	Very high	20 Å²	20	14.3 Å²	14.3	21%	0.206	7%	0.07	C	C	.	.	I	π-helix	trans	-55.8	-35.7	178.2	0	0	0	0	0	114	G23 M27 R29 F30	G23-G25 PolarHBondContact O-N 2.7Å; G25-M27 VanDerWaalsContact C-N 3.31Å; G25-R29 VanDerWaalsContact O-CB 3.32Å; G25-R29 WeakPolarHBondContact O-CB 3.42Å; G25-R29 PolarHBondContact O-N 2.93Å; G25-R29 VanDerWaalsContact O-N 3.14Å; G25-F30 PolarHBondContact O-N 3.23Å
26	N	91.1	Very high	90.3	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.016	8%	0.078	C	C	.	.	I	π-helix	trans	-68.8	-33.7	177.2	-56.7	82.3	0	0	0	112.1	I21 I22 G23 L24 S262 N294 S298	I21-N26 PolarHBondContact O-OD1 2.85Å; I21-N26 VanDerWaalsContact O-OD1 3.11Å; I22-N26 WeakPolarHBondContact CA-OD1 3.26Å; G23-N26 PolarHBondContact N-OD1 3.16Å; G23-N26 WeakPolarHBondContact O-CB 3.3Å; G23-N26 PolarHBondContact O-N 2.84Å; G23-N26 VanDerWaalsContact O-N 3.15Å; G23-N26 PolarHBondContact O-OD1 3.48Å; L24-N26 PolarHBondContact O-N 3.06Å; N26-S262 PolarHBondContact ND2-OG 2.98Å; N26-S262 VanDerWaalsContact ND2-OG 3.17Å; N26-N294 PolarHBondContact ND2-OD1 3.25Å; N26-S298 PolarHBondContact ND2-OG 3Å
27	M	84.9	Confident	90.2	Very high	14 Å²	14	16.6 Å²	16.6	7%	0.069	8%	0.078	C	C	.	.	I	π-helix	trans	-82.3	-47.7	-177.2	-73.8	-160.5	72.5	0	0	113.1	L24 G25 P31 A301 I305 F352 M355 L359	L24-M27 PolarHBondContact O-N 3.02Å; G25-M27 VanDerWaalsContact C-N 3.31Å; M27-P31 WeakPolarHBondContact O-CD 3.37Å; M27-P31 VanDerWaalsContact O-CG 3.29Å; M27-P31 WeakPolarHBondContact O-CG 3.28Å; M27-A301 HydrophobicContact CG-CB 4.5Å; M27-I305 HydrophobicContact CE-CD1 4.3Å; M27-F352 HydrophobicContact CE-CE2 4.16Å; M27-M355 HydrophobicContact CE-CE 3.12Å; M27-M355 HydrophobicContact CE-SD 3.86Å; M27-M355 HydrophobicContact SD-CE 3.62Å; M27-M355 HydrophobicContact SD-CG 4.31Å; M27-M355 HydrophobicContact SD-SD 3.89Å; M27-L359 HydrophobicContact CG-CD1 3.94Å; M27-L359 HydrophobicContact SD-CD1 3.19Å; M27-L359 WeakPolarHBondContact SD-CD1 3.32Å
28	W	81.8	Confident	89.9	Confident	31 Å²	31	16.9 Å²	16.9	12%	0.117	8%	0.081	C	C	.	.	I	π-helix	trans	-110.1	-19.2	-169.1	63.9	8.9	0	0	0	115.3	L24 Y32 V104 P328 L330 A331 F332	L24-W28 VanDerWaalsContact C-CD1 3.43Å; L24-W28 HydrophobicContact CB-CD2 4.32Å; L24-W28 HydrophobicContact CB-CZ2 3.78Å; L24-W28 HydrophobicContact CD1-CH2 4.22Å; L24-W28 HydrophobicContact CD1-CZ2 4.02Å; L24-W28 HydrophobicContact CG-CZ2 4.47Å; L24-W28 PolarHBondContact O-N 2.86Å; L24-W28 PolarHBondContact O-NE1 2.9Å; W28-Y32 VanDerWaalsContact O-CB 3.26Å; W28-Y32 WeakPolarHBondContact O-CB 3.33Å; W28-V104 HydrophobicContact CH2-CG1 3.52Å; W28-V104 HydrophobicContact CH2-CG2 4.31Å; W28-V104 HydrophobicContact CZ2-CG1 4.28Å; W28-V104 HydrophobicContact CZ3-CG1 4.3Å; W28-P328 HydrophobicContact CH2-CB 4.41Å; W28-P328 HydrophobicContact CH2-CG 4.34Å; W28-P328 HydrophobicContact CZ3-CB 4.36Å; W28-L330 HydrophobicContact CB-CB 4.33Å; W28-L330 HydrophobicContact CB-CD2 3.91Å; W28-L330 HydrophobicContact CB-CG 4.42Å; W28-L330 VanDerWaalsContact O-CD2 3.23Å; W28-L330 WeakPolarHBondContact O-CD2 3.45Å; W28-A331 HydrophobicContact CE3-CB 3.37Å; W28-A331 HydrophobicContact CZ3-CB 3.65Å; W28-F332 HydrophobicContact CH2-CE2 4.16Å; W28-F332 HydrophobicContact CZ3-CD2 4.16Å; W28-F332 AromaticContact CZ3-CE2 3.72Å; W28-F332 HydrophobicContact CZ3-CE2 3.72Å
29	R	89	Confident	89.8	Confident	73 Å²	73	16.8 Å²	16.8	28%	0.275	8%	0.081	S	C	.	.	I	π-helix	trans	-103	-48.7	-171	-173.8	-178.5	173	167.1	-1.9	109.7	G25 Y32 L33 Q258	G25-R29 VanDerWaalsContact O-CB 3.32Å; G25-R29 WeakPolarHBondContact O-CB 3.42Å; G25-R29 PolarHBondContact O-N 2.93Å; G25-R29 VanDerWaalsContact O-N 3.14Å; R29-Y32 PolarHBondContact O-N 2.83Å; R29-L33 HydrophobicContact CG-CD1 4Å; R29-L33 HydrophobicContact CG-CG 4.29Å; R29-L33 WeakPolarHBondContact O-CB 3.22Å; R29-L33 VanDerWaalsContact O-CG 3.31Å; R29-L33 WeakPolarHBondContact O-CG 3.22Å; R29-L33 PolarHBondContact O-N 3.43Å; R29-Q258 VanDerWaalsContact CD-OE1 3.24Å; R29-Q258 VanDerWaalsContact CG-OE1 3.31Å
30	F	93	Very high	89.9	Confident	1 Å²	1	17.4 Å²	17.4	0%	0.004	9%	0.087	C	C	.	.	H	α-helix	trans	-56.6	-49.8	176.4	176.8	-92.3	0	0	0	112.5	G25 Y32 L33 C34 F42 L43 Y46 Y238 Q258 S298	G25-F30 PolarHBondContact O-N 3.23Å; F30-Y32 VanDerWaalsContact C-N 3.32Å; F30-Y32 PolarHBondContact O-N 3.4Å; F30-L33 PolarHBondContact O-N 3.48Å; F30-C34 WeakPolarHBondContact O-CB 3.41Å; F30-C34 PolarHBondContact O-N 3.16Å; F30-F42 HydrophobicContact CE2-CE1 4.31Å; F30-L43 HydrophobicContact CZ-CD2 3.88Å; F30-Y46 HydrophobicContact CD2-CD2 4.18Å; F30-Y46 AromaticContact CD2-CE2 3.69Å; F30-Y46 HydrophobicContact CD2-CE2 3.69Å; F30-Y46 HydrophobicContact CE2-CD1 4.19Å; F30-Y46 AromaticContact CE2-CD2 3.7Å; F30-Y46 HydrophobicContact CE2-CD2 3.7Å; F30-Y46 AromaticContact CE2-CE1 3.99Å; F30-Y46 HydrophobicContact CE2-CE1 3.99Å; F30-Y46 AromaticContact CE2-CE2 3.46Å; F30-Y46 HydrophobicContact CE2-CE2 3.46Å; F30-Y46 VanDerWaalsContact CE2-CE2 3.46Å; F30-Y46 HydrophobicContact CE2-CG 4.05Å; F30-Y46 AromaticContact CE2-CZ 3.62Å; F30-Y238 WeakPolarHBondContact CE1-OH 3.39Å; F30-Q258 HydrophobicContact CD2-CG 4.12Å; F30-S298 WeakPolarHBondContact CD1-O 3.37Å
31	P	91.3	Very high	90.1	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.8	-39.2	-179.7	-25	39.7	0	0	0	112.1	M27 C34 Y35 G302 F306	M27-P31 WeakPolarHBondContact O-CD 3.37Å; M27-P31 VanDerWaalsContact O-CG 3.29Å; M27-P31 WeakPolarHBondContact O-CG 3.28Å; P31-C34 PolarHBondContact O-N 2.86Å; P31-Y35 PolarHBondContact O-N 3.24Å; P31-G302 VanDerWaalsContact CG-CA 3.45Å; P31-F306 HydrophobicContact CB-CD2 3.84Å; P31-F306 HydrophobicContact CB-CE2 3.48Å; P31-F306 VanDerWaalsContact CB-CE2 3.48Å; P31-F306 WeakPolarHBondContact O-CE2 3.5Å
32	Y	88	Confident	90.2	Very high	45 Å²	45	16.9 Å²	16.9	18%	0.176	8%	0.084	C	C	.	.	H	α-helix	trans	-58.5	-48.5	174.5	175.9	-90	0	0	0	111.9	W28 R29 F30 C34 Y35 K36 E325	W28-Y32 VanDerWaalsContact O-CB 3.26Å; W28-Y32 WeakPolarHBondContact O-CB 3.33Å; R29-Y32 PolarHBondContact O-N 2.83Å; F30-Y32 VanDerWaalsContact C-N 3.32Å; F30-Y32 PolarHBondContact O-N 3.4Å; Y32-C34 VanDerWaalsContact C-N 3.33Å; Y32-C34 PolarHBondContact O-N 3.12Å; Y32-Y35 HydrophobicContact CD2-CD1 4.39Å; Y32-Y35 AromaticContact CD2-CE1 3.35Å; Y32-Y35 HydrophobicContact CD2-CE1 3.35Å; Y32-Y35 AromaticContact CD2-CZ 3.96Å; Y32-Y35 AromaticContact CE2-CE1 3.63Å; Y32-Y35 HydrophobicContact CE2-CE1 3.63Å; Y32-Y35 AromaticContact CE2-CZ 3.73Å; Y32-Y35 WeakPolarHBondContact CE2-OH 3.37Å; Y32-Y35 AromaticContact CG-CE1 3.91Å; Y32-Y35 HydrophobicContact CG-CE1 3.91Å; Y32-Y35 WeakPolarHBondContact O-CD1 3.46Å; Y32-Y35 WeakPolarHBondContact O-CE1 3.26Å; Y32-K36 HydrophobicContact CE1-CB 4.43Å; Y32-K36 HydrophobicContact CE1-CD 3.71Å; Y32-K36 VanDerWaalsContact O-CB 3.28Å; Y32-K36 WeakPolarHBondContact O-CB 3.33Å; Y32-K36 PolarHBondContact O-N 3.27Å; Y32-E325 WeakPolarHBondContact CD2-O 3.31Å
33	L	90.6	Very high	90.4	Very high	10 Å²	10	18.4 Å²	18.4	5%	0.052	9%	0.092	C	C	.	.	H	α-helix	trans	-66.1	-36.6	179.1	-69.7	179.2	0	0	0	112.1	R29 F30 N37 F42 D254 Q258	R29-L33 HydrophobicContact CG-CD1 4Å; R29-L33 HydrophobicContact CG-CG 4.29Å; R29-L33 WeakPolarHBondContact O-CB 3.22Å; R29-L33 VanDerWaalsContact O-CG 3.31Å; R29-L33 WeakPolarHBondContact O-CG 3.22Å; R29-L33 PolarHBondContact O-N 3.43Å; F30-L33 PolarHBondContact O-N 3.48Å; L33-N37 WeakPolarHBondContact O-CB 3.48Å; L33-N37 PolarHBondContact O-N 3.42Å; L33-N37 PolarHBondContact O-ND2 2.89Å; L33-F42 HydrophobicContact CB-CE1 4.1Å; L33-F42 HydrophobicContact CB-CZ 3.9Å; L33-D254 HydrophobicContact CD2-CB 4.07Å; L33-Q258 HydrophobicContact CD1-CB 3.79Å; L33-Q258 HydrophobicContact CD1-CG 4.1Å
34	C	92.3	Very high	90.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.3	-52.6	178	-161	0	0	0	0	111.1	F30 P31 Y32 N37 G39 F42 Y238	F30-C34 WeakPolarHBondContact O-CB 3.41Å; F30-C34 PolarHBondContact O-N 3.16Å; P31-C34 PolarHBondContact O-N 2.86Å; Y32-C34 VanDerWaalsContact C-N 3.33Å; Y32-C34 PolarHBondContact O-N 3.12Å; C34-N37 PolarHBondContact O-N 3.08Å; C34-G39 WeakPolarHBondContact O-CA 3.41Å; C34-G39 PolarHBondContact O-N 3.41Å; C34-G39 PolarHBondContact SG-O 2.82Å; C34-F42 HydrophobicContact CB-CD1 4.11Å; C34-Y238 HydrophobicContact CB-CD2 3.95Å; C34-Y238 HydrophobicContact CB-CE2 3.53Å; C34-Y238 VanDerWaalsContact SG-CE2 3.54Å
35	Y	88.1	Confident	91.1	Very high	42 Å²	42	21.9 Å²	21.9	17%	0.165	11%	0.109	C	C	.	.	H	α-helix	trans	-67.3	-45.3	179.7	94.6	-93.9	0	0	0	111.6	P31 Y32 N37 G38 F237 F306 A324	P31-Y35 PolarHBondContact O-N 3.24Å; Y32-Y35 HydrophobicContact CD2-CD1 4.39Å; Y32-Y35 AromaticContact CD2-CE1 3.35Å; Y32-Y35 HydrophobicContact CD2-CE1 3.35Å; Y32-Y35 AromaticContact CD2-CZ 3.96Å; Y32-Y35 AromaticContact CE2-CE1 3.63Å; Y32-Y35 HydrophobicContact CE2-CE1 3.63Å; Y32-Y35 AromaticContact CE2-CZ 3.73Å; Y32-Y35 WeakPolarHBondContact CE2-OH 3.37Å; Y32-Y35 AromaticContact CG-CE1 3.91Å; Y32-Y35 HydrophobicContact CG-CE1 3.91Å; Y32-Y35 WeakPolarHBondContact O-CD1 3.46Å; Y32-Y35 WeakPolarHBondContact O-CE1 3.26Å; Y35-N37 PolarHBondContact O-N 3.11Å; Y35-N37 VanDerWaalsContact O-N 3.13Å; Y35-G38 PolarHBondContact O-N 3.38Å; Y35-F237 HydrophobicContact CD2-CD1 4.1Å; Y35-F237 AromaticContact CD2-CE1 3.37Å; Y35-F237 HydrophobicContact CD2-CE1 3.37Å; Y35-F237 HydrophobicContact CD2-CZ 4.2Å; Y35-F237 AromaticContact CE2-CE1 3.94Å; Y35-F237 HydrophobicContact CE2-CE1 3.94Å; Y35-F237 HydrophobicContact CG-CD1 4.29Å; Y35-F237 HydrophobicContact CG-CE1 4Å; Y35-F306 HydrophobicContact CD1-CE1 4.2Å; Y35-F306 HydrophobicContact CD1-CE2 4.46Å; Y35-F306 AromaticContact CD1-CZ 3.49Å; Y35-F306 HydrophobicContact CD1-CZ 3.49Å; Y35-F306 VanDerWaalsContact CD1-CZ 3.49Å; Y35-F306 HydrophobicContact CE1-CZ 4.34Å; Y35-F306 HydrophobicContact CG-CE1 4.25Å; Y35-F306 AromaticContact CG-CZ 3.91Å; Y35-F306 HydrophobicContact CG-CZ 3.91Å; Y35-A324 HydrophobicContact CE1-CB 4.13Å; Y35-A324 PolarHBondContact OH-O 3.5Å
36	K	89.3	Confident	91.5	Very high	74 Å²	74	21.2 Å²	21.2	32%	0.322	10%	0.1	S	C	.	.	H	α-helix	trans	-56.7	-35.4	-177.1	178.6	-171	169.7	-155.8	0	111.2	Y32 R245 D254	Y32-K36 HydrophobicContact CE1-CB 4.43Å; Y32-K36 HydrophobicContact CE1-CD 3.71Å; Y32-K36 VanDerWaalsContact O-CB 3.28Å; Y32-K36 WeakPolarHBondContact O-CB 3.33Å; Y32-K36 PolarHBondContact O-N 3.27Å; K36-R245 PolarHBondContact O-NE 3.34Å; K36-R245 PolarHBondContact O-NH2 3.16Å; K36-D254 IonicContact NZ-OD2 2.81Å; K36-D254 PolarHBondContact NZ-OD2 3.37Å
37	N	92.6	Very high	91.7	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	31	-171	-65.3	-37.7	0	0	0	113.8	L33 C34 Y35 F42 R245 V251 D254	L33-N37 WeakPolarHBondContact O-CB 3.48Å; L33-N37 PolarHBondContact O-N 3.42Å; L33-N37 PolarHBondContact O-ND2 2.89Å; C34-N37 PolarHBondContact O-N 3.08Å; Y35-N37 PolarHBondContact O-N 3.11Å; Y35-N37 VanDerWaalsContact O-N 3.13Å; N37-F42 HydrophobicContact CB-CB 4.24Å; N37-F42 HydrophobicContact CB-CD2 3.49Å; N37-F42 VanDerWaalsContact CB-CD2 3.49Å; N37-F42 HydrophobicContact CB-CE2 4.11Å; N37-F42 HydrophobicContact CB-CG 4.1Å; N37-R245 PolarHBondContact OD1-NH2 3.19Å; N37-V251 HydrophobicContact CB-CB 4.36Å; N37-V251 HydrophobicContact CB-CG1 4.09Å; N37-V251 HydrophobicContact CB-CG2 3.87Å; N37-D254 VanDerWaalsContact ND2-CB 3.27Å; N37-D254 WeakPolarHBondContact ND2-CB 3.4Å; N37-D254 PolarHBondContact ND2-OD2 3.17Å
38	G	91.1	Very high	92.2	Very high	6 Å²	6	27.7 Å²	27.7	6%	0.062	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	97	28.5	171	0	0	0	0	0	114.5	Y35 G40 A41 D242	Y35-G38 PolarHBondContact O-N 3.38Å; G38-G40 PolarHBondContact O-N 3.4Å; G38-A41 VanDerWaalsContact O-CB 3.3Å; G38-A41 WeakPolarHBondContact O-CB 3.09Å; G38-A41 PolarHBondContact O-N 2.66Å; G38-A41 VanDerWaalsContact O-N 3.1Å; G38-D242 PolarHBondContact O-N 3.45Å
39	G	93.3	Very high	92.8	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	57.9	-125.1	176.6	0	0	0	0	0	111.8	C34 A41 F42 Y238	C34-G39 WeakPolarHBondContact O-CA 3.41Å; C34-G39 PolarHBondContact O-N 3.41Å; C34-G39 PolarHBondContact SG-O 2.82Å; G39-A41 PolarHBondContact O-N 2.73Å; G39-A41 VanDerWaalsContact O-N 3.14Å; G39-F42 WeakPolarHBondContact O-CB 3.39Å; G39-F42 PolarHBondContact O-N 2.89Å; G39-F42 VanDerWaalsContact O-N 3.15Å; G39-Y238 CarbonylContact C-O 3.57Å; G39-Y238 WeakPolarHBondContact CA-O 3.33Å
40	G	93.6	Very high	93.1	Very high	16 Å²	16	23.2 Å²	23.2	17%	0.165	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-61.5	-21.7	-180	0	0	0	0	0	114.5	G38 F42 L43 L239	G38-G40 PolarHBondContact O-N 3.4Å; G40-F42 VanDerWaalsContact C-N 3.25Å; G40-F42 PolarHBondContact O-N 2.91Å; G40-L43 WeakPolarHBondContact O-CB 3.26Å; G40-L43 PolarHBondContact O-N 2.82Å; G40-L239 WeakPolarHBondContact CA-O 3.35Å; G40-L239 PolarHBondContact N-O 2.97Å; G40-L239 VanDerWaalsContact N-O 3.08Å
41	A	95.6	Very high	93.2	Very high	1 Å²	1	27 Å²	27	1%	0.008	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-63.8	-32.6	177	0	0	0	0	0	112	G38 G39 L43 I44 P45 P241 D242 L243 L246	G38-A41 VanDerWaalsContact O-CB 3.3Å; G38-A41 WeakPolarHBondContact O-CB 3.09Å; G38-A41 PolarHBondContact O-N 2.66Å; G38-A41 VanDerWaalsContact O-N 3.1Å; G39-A41 PolarHBondContact O-N 2.73Å; G39-A41 VanDerWaalsContact O-N 3.14Å; A41-L43 PolarHBondContact O-N 2.8Å; A41-L43 VanDerWaalsContact O-N 3.13Å; A41-I44 WeakPolarHBondContact O-CB 3.3Å; A41-I44 PolarHBondContact O-N 2.72Å; A41-I44 VanDerWaalsContact O-N 3.08Å; A41-P45 WeakPolarHBondContact O-CD 3.37Å; A41-P241 HydrophobicContact CB-CB 4.36Å; A41-D242 WeakPolarHBondContact CB-O 3.26Å; A41-L243 HydrophobicContact CB-CD2 4.1Å; A41-L246 HydrophobicContact CB-CD2 4.35Å; A41-L246 HydrophobicContact CB-CG 4.32Å
42	F	96.1	Very high	93.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-59.3	-24.2	177.6	179.3	-108.4	0	0	0	113.4	F30 L33 C34 N37 G39 G40 I44 P45 Y46 V251 D254 A255	F30-F42 HydrophobicContact CE2-CE1 4.31Å; L33-F42 HydrophobicContact CB-CE1 4.1Å; L33-F42 HydrophobicContact CB-CZ 3.9Å; C34-F42 HydrophobicContact CB-CD1 4.11Å; N37-F42 HydrophobicContact CB-CB 4.24Å; N37-F42 HydrophobicContact CB-CD2 3.49Å; N37-F42 VanDerWaalsContact CB-CD2 3.49Å; N37-F42 HydrophobicContact CB-CE2 4.11Å; N37-F42 HydrophobicContact CB-CG 4.1Å; G39-F42 WeakPolarHBondContact O-CB 3.39Å; G39-F42 PolarHBondContact O-N 2.89Å; G39-F42 VanDerWaalsContact O-N 3.15Å; G40-F42 VanDerWaalsContact C-N 3.25Å; G40-F42 PolarHBondContact O-N 2.91Å; F42-I44 PolarHBondContact O-N 2.71Å; F42-P45 WeakPolarHBondContact O-CD 3.46Å; F42-P45 VanDerWaalsContact O-CG 3.3Å; F42-P45 WeakPolarHBondContact O-CG 3.48Å; F42-Y46 HydrophobicContact CE1-CD2 4.3Å; F42-Y46 WeakPolarHBondContact O-CB 3.22Å; F42-Y46 PolarHBondContact O-N 2.68Å; F42-Y46 VanDerWaalsContact O-N 3.15Å; F42-V251 HydrophobicContact CD2-CG1 4.06Å; F42-D254 HydrophobicContact CE2-CB 4.26Å; F42-A255 HydrophobicContact CD2-CB 4.43Å; F42-A255 HydrophobicContact CE2-CB 3.66Å; F42-A255 HydrophobicContact CZ-CB 3.95Å
43	L	95.5	Very high	93.6	Very high	41 Å²	41	25.8 Å²	25.8	22%	0.215	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-25.9	177.5	-61	178.1	0	0	0	112.5	F30 G40 A41 L47 F299	F30-L43 HydrophobicContact CZ-CD2 3.88Å; G40-L43 WeakPolarHBondContact O-CB 3.26Å; G40-L43 PolarHBondContact O-N 2.82Å; A41-L43 PolarHBondContact O-N 2.8Å; A41-L43 VanDerWaalsContact O-N 3.13Å; L43-L47 VanDerWaalsContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CB 3.36Å; L43-L47 WeakPolarHBondContact O-CG 3.35Å; L43-L47 PolarHBondContact O-N 3.08Å; L43-F299 HydrophobicContact CD1-CE2 3.99Å; L43-F299 HydrophobicContact CD2-CD2 4.48Å
44	I	95.5	Very high	93.8	Very high	81 Å²	81	25.3 Å²	25.3	42%	0.415	13%	0.129	S	C	.	.	H	α-helix	trans	-63.3	-61.5	178	-63.4	169.1	0	0	0	111.1	A41 F42 Y46 L47 I48 L243 L246	A41-I44 WeakPolarHBondContact O-CB 3.3Å; A41-I44 PolarHBondContact O-N 2.72Å; A41-I44 VanDerWaalsContact O-N 3.08Å; F42-I44 PolarHBondContact O-N 2.71Å; I44-Y46 VanDerWaalsContact C-N 3.28Å; I44-Y46 PolarHBondContact O-N 3.27Å; I44-L47 PolarHBondContact O-N 2.64Å; I44-I48 HydrophobicContact CG2-CD1 4.09Å; I44-I48 WeakPolarHBondContact O-CG1 3.43Å; I44-I48 PolarHBondContact O-N 2.74Å; I44-L243 HydrophobicContact CD1-CD2 4.48Å; I44-L246 HydrophobicContact CD1-CD1 3.98Å
45	P	94.4	Very high	94	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-36.7	176.9	23.3	-32.4	0	0	0	111.6	A41 F42 L47 I48 F49 L246 V251 W252 A255	A41-P45 WeakPolarHBondContact O-CD 3.37Å; F42-P45 WeakPolarHBondContact O-CD 3.46Å; F42-P45 VanDerWaalsContact O-CG 3.3Å; F42-P45 WeakPolarHBondContact O-CG 3.48Å; P45-L47 PolarHBondContact O-N 3.33Å; P45-I48 PolarHBondContact O-N 3.4Å; P45-F49 VanDerWaalsContact O-CD2 3.32Å; P45-F49 WeakPolarHBondContact O-CD2 3.25Å; P45-F49 PolarHBondContact O-N 2.89Å; P45-L246 HydrophobicContact CG-CD2 4.13Å; P45-V251 HydrophobicContact CG-CG1 3.85Å; P45-W252 HydrophobicContact CB-CD2 3.78Å; P45-W252 HydrophobicContact CB-CE3 3.55Å; P45-W252 HydrophobicContact CB-CG 4.39Å; P45-W252 HydrophobicContact CB-CH2 4.21Å; P45-W252 HydrophobicContact CB-CZ2 4.41Å; P45-W252 HydrophobicContact CB-CZ3 3.78Å; P45-A255 HydrophobicContact CB-CB 3.83Å; P45-A255 HydrophobicContact CG-CB 4.18Å
46	Y	95.5	Very high	94.5	Very high	5 Å²	5	23.6 Å²	23.6	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-57.7	-47.5	176.1	-179.3	-92.7	0	0	0	112.5	F30 F42 I44 F49 L50 Q258 I259 S295	F30-Y46 HydrophobicContact CD2-CD2 4.18Å; F30-Y46 AromaticContact CD2-CE2 3.69Å; F30-Y46 HydrophobicContact CD2-CE2 3.69Å; F30-Y46 HydrophobicContact CE2-CD1 4.19Å; F30-Y46 AromaticContact CE2-CD2 3.7Å; F30-Y46 HydrophobicContact CE2-CD2 3.7Å; F30-Y46 AromaticContact CE2-CE1 3.99Å; F30-Y46 HydrophobicContact CE2-CE1 3.99Å; F30-Y46 AromaticContact CE2-CE2 3.46Å; F30-Y46 HydrophobicContact CE2-CE2 3.46Å; F30-Y46 VanDerWaalsContact CE2-CE2 3.46Å; F30-Y46 HydrophobicContact CE2-CG 4.05Å; F30-Y46 AromaticContact CE2-CZ 3.62Å; F42-Y46 HydrophobicContact CE1-CD2 4.3Å; F42-Y46 WeakPolarHBondContact O-CB 3.22Å; F42-Y46 PolarHBondContact O-N 2.68Å; F42-Y46 VanDerWaalsContact O-N 3.15Å; I44-Y46 VanDerWaalsContact C-N 3.28Å; I44-Y46 PolarHBondContact O-N 3.27Å; Y46-F49 PolarHBondContact O-N 3.31Å; Y46-L50 WeakPolarHBondContact O-CB 3.39Å; Y46-L50 PolarHBondContact O-N 3.42Å; Y46-Q258 HydrophobicContact CD2-CG 4.48Å; Y46-Q258 HydrophobicContact CE2-CG 4.07Å; Y46-I259 HydrophobicContact CD1-CD1 4.35Å; Y46-I259 HydrophobicContact CD2-CD1 3.76Å; Y46-I259 HydrophobicContact CD2-CG1 3.97Å; Y46-I259 HydrophobicContact CE1-CD1 3.96Å; Y46-I259 HydrophobicContact CE2-CD1 3.31Å; Y46-I259 HydrophobicContact CE2-CG1 3.89Å; Y46-I259 HydrophobicContact CG-CD1 4.26Å; Y46-I259 VanDerWaalsContact CZ-CD1 3.42Å; Y46-S295 PolarHBondContact OH-OG 3.45Å
47	L	95.3	Very high	94.8	Very high	82 Å²	82	20 Å²	20	43%	0.429	11%	0.107	S	C	.	.	H	α-helix	trans	-67.9	-34.6	177.6	-71.6	173.4	0	0	0	112.4	L43 I44 P45 L50 F51	L43-L47 VanDerWaalsContact O-CB 3.29Å; L43-L47 WeakPolarHBondContact O-CB 3.36Å; L43-L47 WeakPolarHBondContact O-CG 3.35Å; L43-L47 PolarHBondContact O-N 3.08Å; I44-L47 PolarHBondContact O-N 2.64Å; P45-L47 PolarHBondContact O-N 3.33Å; L47-L50 HydrophobicContact CD2-CD2 3.9Å; L47-L50 WeakPolarHBondContact O-CB 3.35Å; L47-L50 PolarHBondContact O-N 3.2Å; L47-F51 HydrophobicContact CD2-CE2 4.29Å; L47-F51 WeakPolarHBondContact O-CD2 3.23Å; L47-F51 PolarHBondContact O-N 3.45Å; L47-F51 VanDerWaalsContact O-N 3.08Å
48	I	93.9	Very high	95.1	Very high	71 Å²	71	20 Å²	20	36%	0.364	11%	0.107	S	C	.	.	H	α-helix	trans	-62.1	-50.3	174.1	-69.2	166.6	0	0	0	109.9	I44 P45 L50 F51 T52 W252	I44-I48 HydrophobicContact CG2-CD1 4.09Å; I44-I48 WeakPolarHBondContact O-CG1 3.43Å; I44-I48 PolarHBondContact O-N 2.74Å; P45-I48 PolarHBondContact O-N 3.4Å; I48-L50 VanDerWaalsContact C-N 3.29Å; I48-L50 PolarHBondContact O-N 3.41Å; I48-F51 PolarHBondContact O-N 3.41Å; I48-T52 HydrophobicContact CG2-CG2 4.31Å; I48-T52 VanDerWaalsContact O-CB 3.32Å; I48-T52 WeakPolarHBondContact O-CB 3.46Å; I48-T52 VanDerWaalsContact O-CG2 3.32Å; I48-T52 WeakPolarHBondContact O-CG2 3.49Å; I48-T52 PolarHBondContact O-N 2.99Å; I48-T52 PolarHBondContact O-OG1 3.48Å; I48-W252 HydrophobicContact CD1-CH2 3.69Å; I48-W252 HydrophobicContact CD1-CZ3 3.74Å; I48-W252 HydrophobicContact CG2-CZ3 4.47Å
49	F	94.4	Very high	95.4	Very high	6 Å²	6	19.9 Å²	19.9	3%	0.026	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-34.5	176.9	-84.2	-77.9	0	0	0	112.4	P45 Y46 C53 G54 W252 A255 I259 T480	P45-F49 VanDerWaalsContact O-CD2 3.32Å; P45-F49 WeakPolarHBondContact O-CD2 3.25Å; P45-F49 PolarHBondContact O-N 2.89Å; Y46-F49 PolarHBondContact O-N 3.31Å; F49-C53 HydrophobicContact CD1-CB 4.42Å; F49-C53 CarbonylContact O-C 3.38Å; F49-C53 WeakPolarHBondContact O-CA 3.37Å; F49-C53 WeakPolarHBondContact O-CB 3.5Å; F49-C53 PolarHBondContact O-N 3.18Å; F49-G54 PolarHBondContact O-N 3.36Å; F49-W252 HydrophobicContact CE2-CB 4.43Å; F49-W252 HydrophobicContact CE2-CE3 4.13Å; F49-W252 WeakPolarHBondContact CE2-O 3.45Å; F49-A255 HydrophobicContact CD2-CB 4.09Å; F49-I259 HydrophobicContact CB-CB 4.35Å; F49-I259 HydrophobicContact CB-CG1 3.89Å; F49-T480 WeakPolarHBondContact CZ-OG1 3.43Å
50	L	95.4	Very high	95.6	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.021	10%	0.104	C	C	.	.	I	π-helix	trans	-56.6	-54.1	174.7	173.5	60.2	0	0	0	111.7	Y46 L47 I48 G54 V55 I259 Y263	Y46-L50 WeakPolarHBondContact O-CB 3.39Å; Y46-L50 PolarHBondContact O-N 3.42Å; L47-L50 HydrophobicContact CD2-CD2 3.9Å; L47-L50 WeakPolarHBondContact O-CB 3.35Å; L47-L50 PolarHBondContact O-N 3.2Å; I48-L50 VanDerWaalsContact C-N 3.29Å; I48-L50 PolarHBondContact O-N 3.41Å; L50-G54 PolarHBondContact O-N 2.91Å; L50-V55 HydrophobicContact CD1-CG2 3.9Å; L50-V55 HydrophobicContact CG-CG2 4.36Å; L50-V55 PolarHBondContact O-N 2.89Å; L50-I259 HydrophobicContact CB-CD1 3.94Å; L50-I259 HydrophobicContact CD1-CD1 4.27Å; L50-Y263 HydrophobicContact CD1-CE1 3.86Å; L50-Y263 HydrophobicContact CD1-CE2 4.28Å; L50-Y263 VanDerWaalsContact CD1-CZ 3.45Å; L50-Y263 WeakPolarHBondContact CD1-OH 3.37Å
51	F	95.3	Very high	95.7	Very high	81 Å²	81	19 Å²	19	36%	0.355	10%	0.096	S	C	.	.	I	π-helix	trans	-79.6	-31.8	-175	-69.2	-65.5	0	0	0	113.3	L47 I48 P56 F292 Y464	L47-F51 HydrophobicContact CD2-CE2 4.29Å; L47-F51 WeakPolarHBondContact O-CD2 3.23Å; L47-F51 PolarHBondContact O-N 3.45Å; L47-F51 VanDerWaalsContact O-N 3.08Å; I48-F51 PolarHBondContact O-N 3.41Å; F51-P56 VanDerWaalsContact O-CD 3.28Å; F51-P56 WeakPolarHBondContact O-CD 3.21Å; F51-P56 VanDerWaalsContact O-CG 3.3Å; F51-P56 WeakPolarHBondContact O-CG 3.14Å; F51-F292 HydrophobicContact CE1-CE1 4.3Å; F51-F292 AromaticContact CE1-CZ 3.92Å; F51-F292 HydrophobicContact CE1-CZ 3.92Å; F51-F292 HydrophobicContact CZ-CE1 4.12Å; F51-F292 HydrophobicContact CZ-CZ 4.14Å; F51-Y464 VanDerWaalsContact C-OH 3.3Å; F51-Y464 WeakPolarHBondContact CB-OH 3.44Å; F51-Y464 WeakPolarHBondContact O-CE1 3.37Å; F51-Y464 PolarHBondContact O-OH 3.21Å
52	T	93.6	Very high	95.8	Very high	19 Å²	19	19 Å²	19	12%	0.117	10%	0.096	C	C	.	.	I	π-helix	trans	-88.5	-24.8	-177.4	61.1	0	0	0	0	114.3	I48 F472 T473	I48-T52 HydrophobicContact CG2-CG2 4.31Å; I48-T52 VanDerWaalsContact O-CB 3.32Å; I48-T52 WeakPolarHBondContact O-CB 3.46Å; I48-T52 VanDerWaalsContact O-CG2 3.32Å; I48-T52 WeakPolarHBondContact O-CG2 3.49Å; I48-T52 PolarHBondContact O-N 2.99Å; I48-T52 PolarHBondContact O-OG1 3.48Å; T52-F472 HydrophobicContact CG2-CB 4.49Å; T52-T473 PolarHBondContact O-OG1 3.22Å
53	C	94.3	Very high	95.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	I	π-helix	trans	-127.4	-57.4	-176.3	-56.6	0	0	0	0	112.4	F49 P56 V57 F260 T473 T476	F49-C53 HydrophobicContact CD1-CB 4.42Å; F49-C53 CarbonylContact O-C 3.38Å; F49-C53 WeakPolarHBondContact O-CA 3.37Å; F49-C53 WeakPolarHBondContact O-CB 3.5Å; F49-C53 PolarHBondContact O-N 3.18Å; C53-P56 WeakPolarHBondContact O-CD 3.44Å; C53-V57 WeakPolarHBondContact O-CB 3.3Å; C53-V57 VanDerWaalsContact O-CG2 3.23Å; C53-V57 WeakPolarHBondContact O-CG2 3.34Å; C53-V57 PolarHBondContact O-N 2.94Å; C53-F260 HydrophobicContact CB-CE2 3.7Å; C53-F260 HydrophobicContact CB-CZ 4.14Å; C53-T473 HydrophobicContact CB-CG2 4.23Å; C53-T476 PolarHBondContact SG-OG1 3.2Å
54	G	95.3	Very high	95.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.	I	π-helix	trans	-55.1	-64.7	-172.9	0	0	0	0	0	112.7	F49 L50 V57 F58	F49-G54 PolarHBondContact O-N 3.36Å; L50-G54 PolarHBondContact O-N 2.91Å; G54-V57 PolarHBondContact O-N 3.07Å; G54-F58 WeakPolarHBondContact O-CB 3.4Å; G54-F58 PolarHBondContact O-N 2.84Å
55	V	96.7	Very high	96	Very high	6 Å²	6	13.2 Å²	13.2	4%	0.036	7%	0.066	C	C	.	.	H	α-helix	trans	-59	-48.3	-179.5	172.4	0	0	0	0	112.3	L50 F59 L288 C291 I465	L50-V55 HydrophobicContact CD1-CG2 3.9Å; L50-V55 HydrophobicContact CG-CG2 4.36Å; L50-V55 PolarHBondContact O-N 2.89Å; V55-F59 WeakPolarHBondContact O-CB 3.39Å; V55-F59 PolarHBondContact O-N 3.07Å; V55-L288 HydrophobicContact CG1-CD2 3.59Å; V55-C291 HydrophobicContact CG2-CB 3.75Å; V55-I465 HydrophobicContact CG1-CD1 4.1Å
56	P	96.9	Very high	96.1	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.9	-49.7	177.9	-26.6	35	0	0	0	113.9	F51 C53 F59 L60 I465 C468 W469	F51-P56 VanDerWaalsContact O-CD 3.28Å; F51-P56 WeakPolarHBondContact O-CD 3.21Å; F51-P56 VanDerWaalsContact O-CG 3.3Å; F51-P56 WeakPolarHBondContact O-CG 3.14Å; C53-P56 WeakPolarHBondContact O-CD 3.44Å; P56-F59 PolarHBondContact O-N 3.28Å; P56-L60 WeakPolarHBondContact O-CB 3.28Å; P56-L60 PolarHBondContact O-N 2.72Å; P56-I465 HydrophobicContact CB-CD1 4.4Å; P56-I465 HydrophobicContact CB-CG2 4.32Å; P56-I465 HydrophobicContact CG-CD1 3.95Å; P56-C468 HydrophobicContact CB-CB 3.68Å; P56-C468 HydrophobicContact CG-CB 3.44Å; P56-C468 VanDerWaalsContact CG-CB 3.44Å; P56-W469 VanDerWaalsContact C-NE1 3.26Å; P56-W469 PolarHBondContact O-NE1 3.4Å
57	V	97.1	Very high	96.1	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-70.7	-39	-176.3	178.9	0	0	0	0	110.8	C53 G54 F59 L60 E61 I265 T437 T473	C53-V57 WeakPolarHBondContact O-CB 3.3Å; C53-V57 VanDerWaalsContact O-CG2 3.23Å; C53-V57 WeakPolarHBondContact O-CG2 3.34Å; C53-V57 PolarHBondContact O-N 2.94Å; G54-V57 PolarHBondContact O-N 3.07Å; V57-F59 VanDerWaalsContact C-N 3.33Å; V57-F59 PolarHBondContact O-N 3.49Å; V57-L60 WeakPolarHBondContact O-CB 3.44Å; V57-L60 PolarHBondContact O-N 3.4Å; V57-L60 VanDerWaalsContact O-N 3.14Å; V57-E61 PolarHBondContact O-N 3.38Å; V57-I265 HydrophobicContact CB-CD1 3.97Å; V57-I265 HydrophobicContact CG1-CB 3.94Å; V57-I265 HydrophobicContact CG1-CD1 3.99Å; V57-I265 HydrophobicContact CG1-CG2 4.27Å; V57-T437 HydrophobicContact CG2-CG2 4.19Å; V57-T473 HydrophobicContact CG2-CG2 3.56Å
58	F	97.6	Very high	96.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-56.8	-48.6	174.2	-168.6	-80.6	0	0	0	111.7	V17 I21 G54 L60 E61 V62 Y263 I265 L270 C287 L290	V17-F58 HydrophobicContact CG1-CE1 4.41Å; V17-F58 HydrophobicContact CG1-CE2 4.46Å; V17-F58 HydrophobicContact CG1-CZ 3.59Å; I21-F58 HydrophobicContact CD1-CE2 4.43Å; I21-F58 HydrophobicContact CD1-CZ 4.37Å; I21-F58 HydrophobicContact CG2-CE2 3.79Å; I21-F58 HydrophobicContact CG2-CZ 4.3Å; G54-F58 WeakPolarHBondContact O-CB 3.4Å; G54-F58 PolarHBondContact O-N 2.84Å; F58-L60 VanDerWaalsContact C-N 3.33Å; F58-L60 PolarHBondContact O-N 2.69Å; F58-E61 PolarHBondContact O-N 2.97Å; F58-V62 HydrophobicContact CD1-CG2 4.21Å; F58-V62 HydrophobicContact CE1-CG2 3.98Å; F58-V62 WeakPolarHBondContact O-CG2 3.45Å; F58-V62 PolarHBondContact O-N 3.07Å; F58-Y263 HydrophobicContact CB-CD1 4.47Å; F58-Y263 AromaticContact CD2-CD1 3.85Å; F58-Y263 HydrophobicContact CD2-CD1 3.85Å; F58-Y263 HydrophobicContact CD2-CG 4.49Å; F58-Y263 HydrophobicContact CE2-CD1 4.49Å; F58-Y263 HydrophobicContact CG-CD1 4.41Å; F58-I265 HydrophobicContact CB-CG2 3.95Å; F58-I265 HydrophobicContact CD2-CG2 3.93Å; F58-I265 HydrophobicContact CG-CG2 4.42Å; F58-L270 HydrophobicContact CD1-CD1 4.5Å; F58-L270 HydrophobicContact CD2-CD1 3.27Å; F58-L270 HydrophobicContact CD2-CD2 4.45Å; F58-L270 HydrophobicContact CD2-CG 4.5Å; F58-L270 HydrophobicContact CE2-CD1 3.34Å; F58-L270 HydrophobicContact CE2-CD2 3.67Å; F58-L270 HydrophobicContact CE2-CG 4.17Å; F58-L270 HydrophobicContact CG-CD1 3.9Å; F58-L270 HydrophobicContact CZ-CD1 4.04Å; F58-L270 HydrophobicContact CZ-CD2 3.79Å; F58-C287 HydrophobicContact CD1-CB 3.78Å; F58-C287 HydrophobicContact CE1-CB 4.07Å; F58-L290 HydrophobicContact CE1-CB 4.39Å; F58-L290 HydrophobicContact CZ-CB 4.34Å
59	F	97.6	Very high	96	Very high	3 Å²	3	8.1 Å²	8.1	1%	0.013	4%	0.043	C	C	.	.	H	α-helix	trans	-64.7	-38.5	177	177.1	-124	0	0	0	112	V55 P56 V57 A63 Y284 C287 I453 P461 I465 W469	V55-F59 WeakPolarHBondContact O-CB 3.39Å; V55-F59 PolarHBondContact O-N 3.07Å; P56-F59 PolarHBondContact O-N 3.28Å; V57-F59 VanDerWaalsContact C-N 3.33Å; V57-F59 PolarHBondContact O-N 3.49Å; F59-A63 HydrophobicContact CD2-CB 4.36Å; F59-A63 HydrophobicContact CE2-CB 4.02Å; F59-A63 HydrophobicContact CZ-CB 4.29Å; F59-A63 WeakPolarHBondContact O-CB 3.41Å; F59-A63 PolarHBondContact O-N 2.82Å; F59-Y284 HydrophobicContact CD1-CD2 4.13Å; F59-Y284 HydrophobicContact CD2-CD2 4.16Å; F59-Y284 AromaticContact CE1-CD2 3.83Å; F59-Y284 HydrophobicContact CE1-CD2 3.83Å; F59-Y284 VanDerWaalsContact CE2-CA 3.4Å; F59-Y284 AromaticContact CE2-CD2 3.89Å; F59-Y284 HydrophobicContact CE2-CD2 3.89Å; F59-Y284 HydrophobicContact CE2-CG 4.28Å; F59-Y284 HydrophobicContact CG-CD2 4.28Å; F59-Y284 AromaticContact CZ-CD2 3.71Å; F59-Y284 HydrophobicContact CZ-CD2 3.71Å; F59-Y284 HydrophobicContact CZ-CG 4.26Å; F59-C287 HydrophobicContact CB-CB 4.24Å; F59-C287 HydrophobicContact CD2-CB 4.15Å; F59-I453 HydrophobicContact CE1-CD1 3.87Å; F59-I453 HydrophobicContact CZ-CD1 3.97Å; F59-I453 HydrophobicContact CZ-CG1 4.43Å; F59-I453 HydrophobicContact CZ-CG2 3.88Å; F59-P461 HydrophobicContact CE1-CG 4.22Å; F59-P461 HydrophobicContact CZ-CG 4.18Å; F59-I465 HydrophobicContact CD1-CG2 4Å; F59-W469 AromaticContact CD1-CH2 3.83Å; F59-W469 HydrophobicContact CD1-CH2 3.83Å; F59-W469 AromaticContact CD1-CZ2 3.65Å; F59-W469 HydrophobicContact CD1-CZ2 3.65Å; F59-W469 AromaticContact CE1-CH2 3.9Å; F59-W469 HydrophobicContact CE1-CH2 3.9Å; F59-W469 HydrophobicContact CE1-CZ2 4.21Å
60	L	97.2	Very high	95.9	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-57.4	-53.6	176.4	-177.8	159.1	0	0	0	111	P56 V57 F58 A63 L64 T437 I440 F449 W469	P56-L60 WeakPolarHBondContact O-CB 3.28Å; P56-L60 PolarHBondContact O-N 2.72Å; V57-L60 WeakPolarHBondContact O-CB 3.44Å; V57-L60 PolarHBondContact O-N 3.4Å; V57-L60 VanDerWaalsContact O-N 3.14Å; F58-L60 VanDerWaalsContact C-N 3.33Å; F58-L60 PolarHBondContact O-N 2.69Å; L60-A63 PolarHBondContact O-N 2.95Å; L60-L64 HydrophobicContact CD2-CD2 4.34Å; L60-L64 WeakPolarHBondContact O-CB 3.38Å; L60-L64 PolarHBondContact O-N 2.75Å; L60-T437 HydrophobicContact CD1-CG2 4.39Å; L60-I440 HydrophobicContact CD1-CB 4.03Å; L60-I440 HydrophobicContact CD1-CG1 4.11Å; L60-I440 HydrophobicContact CD1-CG2 4.15Å; L60-I440 HydrophobicContact CD2-CG1 4.1Å; L60-I440 HydrophobicContact CG-CG1 4.27Å; L60-I440 HydrophobicContact CG-CG2 4.5Å; L60-F449 HydrophobicContact CG-CE1 4.4Å; L60-W469 HydrophobicContact CB-CZ2 3.77Å; L60-W469 HydrophobicContact CD1-CD2 4.25Å; L60-W469 HydrophobicContact CD1-CG 4.21Å; L60-W469 HydrophobicContact CG-CZ2 4.47Å
61	E	97.1	Very high	95.6	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.5	-44.6	-177.1	-74.8	-170	126.9	0	0	112.2	V57 F58 L64 G65 I265 C266 G268 L270 T271	V57-E61 PolarHBondContact O-N 3.38Å; F58-E61 PolarHBondContact O-N 2.97Å; E61-L64 PolarHBondContact O-N 3.04Å; E61-G65 PolarHBondContact O-N 2.88Å; E61-I265 WeakPolarHBondContact OE2-CA 3.26Å; E61-C266 VanDerWaalsContact CD-N 3.29Å; E61-C266 VanDerWaalsContact OE1-CA 3.22Å; E61-C266 WeakPolarHBondContact OE1-CA 3.41Å; E61-C266 PolarHBondContact OE1-N 3.26Å; E61-C266 PolarHBondContact OE2-N 2.95Å; E61-C266 VanDerWaalsContact OE2-N 3.14Å; E61-G268 PolarHBondContact OE1-N 3.03Å; E61-L270 HydrophobicContact CB-CB 3.92Å; E61-L270 WeakPolarHBondContact OE2-CD1 3.36Å; E61-T271 WeakPolarHBondContact O-CA 3.41Å
62	V	97.4	Very high	95.3	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.006	3%	0.032	C	C	.	.	H	α-helix	trans	-65.7	-45.7	179.1	176.4	0	0	0	0	111.2	F13 F58 L64 G65 Q66 L270 C283	F13-V62 HydrophobicContact CZ-CG1 3.93Å; F58-V62 HydrophobicContact CD1-CG2 4.21Å; F58-V62 HydrophobicContact CE1-CG2 3.98Å; F58-V62 WeakPolarHBondContact O-CG2 3.45Å; F58-V62 PolarHBondContact O-N 3.07Å; V62-L64 VanDerWaalsContact C-N 3.33Å; V62-G65 PolarHBondContact O-N 2.86Å; V62-Q66 WeakPolarHBondContact O-CB 3.22Å; V62-Q66 PolarHBondContact O-N 3.44Å; V62-L270 HydrophobicContact CG2-CB 4.01Å; V62-C283 HydrophobicContact CG1-CB 4.01Å
63	A	97.3	Very high	95.4	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-64.6	-39.9	178.4	0	0	0	0	0	111.4	F59 L60 Q66 Y67 F449 I453 M456	F59-A63 HydrophobicContact CD2-CB 4.36Å; F59-A63 HydrophobicContact CE2-CB 4.02Å; F59-A63 HydrophobicContact CZ-CB 4.29Å; F59-A63 WeakPolarHBondContact O-CB 3.41Å; F59-A63 PolarHBondContact O-N 2.82Å; L60-A63 PolarHBondContact O-N 2.95Å; A63-Q66 PolarHBondContact O-N 3.43Å; A63-Y67 WeakPolarHBondContact O-CB 3.26Å; A63-Y67 PolarHBondContact O-N 3.14Å; A63-F449 HydrophobicContact CB-CZ 4.07Å; A63-I453 HydrophobicContact CB-CD1 4.38Å; A63-I453 HydrophobicContact CB-CG1 4.29Å; A63-M456 HydrophobicContact CB-CE 4.31Å
64	L	96.8	Very high	95.3	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-64.6	-44.1	177.6	175.8	61.8	0	0	0	111.6	L60 E61 V62 T68 C75 W76 I79 I440 F449	L60-L64 HydrophobicContact CD2-CD2 4.34Å; L60-L64 WeakPolarHBondContact O-CB 3.38Å; L60-L64 PolarHBondContact O-N 2.75Å; E61-L64 PolarHBondContact O-N 3.04Å; V62-L64 VanDerWaalsContact C-N 3.33Å; L64-T68 HydrophobicContact CD1-CG2 4.05Å; L64-T68 WeakPolarHBondContact O-CG2 3.19Å; L64-T68 PolarHBondContact O-N 3.47Å; L64-T68 PolarHBondContact O-OG1 3.13Å; L64-C75 WeakPolarHBondContact CD1-SG 3.49Å; L64-C75 WeakPolarHBondContact CG-SG 3.35Å; L64-W76 HydrophobicContact CD2-CH2 3.69Å; L64-W76 HydrophobicContact CD2-CZ2 3.73Å; L64-W76 HydrophobicContact CD2-CZ3 4.12Å; L64-I79 HydrophobicContact CD1-CD1 3.9Å; L64-I79 HydrophobicContact CD1-CG1 3.7Å; L64-I440 HydrophobicContact CD1-CD1 4.18Å; L64-I440 HydrophobicContact CD2-CD1 4.29Å; L64-F449 HydrophobicContact CB-CE2 4.4Å; L64-F449 HydrophobicContact CB-CZ 4.08Å; L64-F449 HydrophobicContact CD1-CE2 4.29Å
65	G	96.3	Very high	95.3	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-59.2	-50.5	173.2	0	0	0	0	0	111.9	E61 V62 Y67 S69 T271 S275	E61-G65 PolarHBondContact O-N 2.88Å; V62-G65 PolarHBondContact O-N 2.86Å; G65-Y67 PolarHBondContact O-N 2.9Å; G65-S69 WeakPolarHBondContact O-CA 3.39Å; G65-S69 PolarHBondContact O-N 3.13Å; G65-T271 VanDerWaalsContact CA-O 3.3Å; G65-T271 WeakPolarHBondContact CA-O 3.32Å; G65-S275 VanDerWaalsContact O-CA 3.23Å; G65-S275 WeakPolarHBondContact O-CA 3.33Å
66	Q	96.8	Very high	95.3	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-62.2	-43.6	179.8	-175.6	173.5	-59.1	0	0	112.3	V62 A63 S69 G274 N277 K278 Y279 N281 M456	V62-Q66 WeakPolarHBondContact O-CB 3.22Å; V62-Q66 PolarHBondContact O-N 3.44Å; A63-Q66 PolarHBondContact O-N 3.43Å; Q66-S69 PolarHBondContact O-OG 3.08Å; Q66-G274 VanDerWaalsContact CA-O 3.28Å; Q66-G274 WeakPolarHBondContact CA-O 3.23Å; Q66-G274 PolarHBondContact N-O 3.48Å; Q66-N277 HydrophobicContact CB-CB 4.42Å; Q66-N277 HydrophobicContact CG-CB 3.92Å; Q66-N277 PolarHBondContact OE1-ND2 3.06Å; Q66-K278 PolarHBondContact NE2-O 3.35Å; Q66-Y279 PolarHBondContact NE2-O 3Å; Q66-N281 PolarHBondContact NE2-O 3.5Å; Q66-M456 HydrophobicContact CB-SD 4.29Å; Q66-M456 HydrophobicContact CG-SD 4.08Å
67	Y	95.9	Very high	95.2	Very high	4 Å²	4	9.1 Å²	9.1	2%	0.016	4%	0.043	C	C	.	.	H	α-helix	trans	-62.6	-49.9	179.4	172.2	-115.8	0	0	0	112	A63 G65 I79 Y279 Y444 N452 M456 L547 P548	A63-Y67 WeakPolarHBondContact O-CB 3.26Å; A63-Y67 PolarHBondContact O-N 3.14Å; G65-Y67 PolarHBondContact O-N 2.9Å; Y67-I79 HydrophobicContact CD1-CD1 4.43Å; Y67-I79 HydrophobicContact CE1-CD1 4.16Å; Y67-Y279 HydrophobicContact CD2-CE2 4.12Å; Y67-Y444 PolarHBondContact OH-OH 2.91Å; Y67-N452 HydrophobicContact CD2-CB 3.93Å; Y67-N452 HydrophobicContact CE2-CB 3.8Å; Y67-N452 HydrophobicContact CG-CB 4.48Å; Y67-N452 VanDerWaalsContact CZ-ND2 3.27Å; Y67-N452 PolarHBondContact OH-ND2 2.96Å; Y67-M456 VanDerWaalsContact CA-SD 3.5Å; Y67-M456 HydrophobicContact CD2-SD 4.39Å; Y67-L547 HydrophobicContact CE1-CD1 4.32Å; Y67-L547 HydrophobicContact CE1-CD2 4.1Å; Y67-P548 HydrophobicContact CE2-CB 4.15Å; Y67-P548 HydrophobicContact CE2-CG 4.34Å; Y67-P548 PolarHBondContact OH-O 3.46Å; Y67-P548 VanDerWaalsContact OH-O 3.11Å
68	T	94.3	Very high	95	Very high	6 Å²	6	10.4 Å²	10.4	4%	0.037	5%	0.049	C	C	.	.	H	α-helix	trans	-79.5	-25.3	-176.6	61.5	0	0	0	0	112.6	L64 Q70 C75 I79 L547	L64-T68 HydrophobicContact CD1-CG2 4.05Å; L64-T68 WeakPolarHBondContact O-CG2 3.19Å; L64-T68 PolarHBondContact O-N 3.47Å; L64-T68 PolarHBondContact O-OG1 3.13Å; T68-Q70 WeakPolarHBondContact O-CG 3.46Å; T68-Q70 PolarHBondContact O-N 2.98Å; T68-Q70 PolarHBondContact OG1-N 3.12Å; T68-C75 VanDerWaalsContact CG2-SG 3.57Å; T68-C75 PolarHBondContact OG1-SG 2.81Å; T68-C75 VanDerWaalsContact OG1-SG 3.35Å; T68-I79 HydrophobicContact CG2-CD1 4.21Å; T68-I79 HydrophobicContact CG2-CG1 4.32Å; T68-L547 HydrophobicContact CG2-CD2 3.92Å
69	S	93.6	Very high	94.9	Very high	40 Å²	40	10.4 Å²	10.4	28%	0.28	5%	0.049	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	41.2	-169.4	-62.1	0	0	0	0	111.5	R4 G65 Q66	R4-S69 PolarHBondContact NH1-O 3.48Å; G65-S69 WeakPolarHBondContact O-CA 3.39Å; G65-S69 PolarHBondContact O-N 3.13Å; Q66-S69 PolarHBondContact O-OG 3.08Å
70	Q	91.6	Very high	94.7	Very high	34 Å²	34	10.3 Å²	10.3	16%	0.159	5%	0.048	C	C	.	.			trans	-134.2	154.6	179.2	-61.4	-61.7	-43.7	0	0	111.3	T68 T74 C75 K78 S275	T68-Q70 WeakPolarHBondContact O-CG 3.46Å; T68-Q70 PolarHBondContact O-N 2.98Å; T68-Q70 PolarHBondContact OG1-N 3.12Å; Q70-T74 HydrophobicContact CB-CG2 4.08Å; Q70-T74 HydrophobicContact CG-CG2 3.86Å; Q70-C75 HydrophobicContact CB-CB 4.3Å; Q70-K78 HydrophobicContact CG-CD 4.22Å; Q70-S275 VanDerWaalsContact O-CB 3.31Å; Q70-S275 WeakPolarHBondContact O-CB 3.27Å
71	G	90.1	Very high	94.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.057	C	C	.	.			trans	-71.1	176	173	0	0	0	0	0	113.3	I73 T74 C75 D377	G71-I73 VanDerWaalsContact C-N 3.34Å; G71-I73 PolarHBondContact O-N 3.33Å; G71-I73 VanDerWaalsContact O-N 3.15Å; G71-T74 PolarHBondContact O-N 3.22Å; G71-C75 WeakPolarHBondContact O-CB 3.4Å; G71-C75 PolarHBondContact O-N 3.08Å; G71-D377 PolarHBondContact N-OD2 3.44Å
72	G	87.9	Confident	94.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-53.1	-39.3	-167.7	0	0	0	0	0	115.7
73	I	95	Very high	94.4	Very high	6 Å²	6	13.2 Å²	13.2	3%	0.031	7%	0.065	C	C	.	.	H	α-helix	trans	-79.3	-54.8	-179.1	-59.9	168.8	0	0	0	111.7	G71 C75 W76 R77 E84 Y88 Q91 A374 M378	G71-I73 VanDerWaalsContact C-N 3.34Å; G71-I73 PolarHBondContact O-N 3.33Å; G71-I73 VanDerWaalsContact O-N 3.15Å; I73-C75 PolarHBondContact O-N 3Å; I73-W76 PolarHBondContact O-N 2.95Å; I73-R77 PolarHBondContact O-N 2.88Å; I73-R77 VanDerWaalsContact O-N 3.13Å; I73-E84 HydrophobicContact CG2-CG 4.33Å; I73-Y88 HydrophobicContact CD1-CD1 3.9Å; I73-Y88 HydrophobicContact CD1-CE1 3.94Å; I73-Y88 HydrophobicContact CG1-CD1 4.49Å; I73-Y88 HydrophobicContact CG2-CE1 4.11Å; I73-Y88 HydrophobicContact CG2-CE2 4.06Å; I73-Q91 HydrophobicContact CD1-CB 4.45Å; I73-Q91 HydrophobicContact CD1-CG 3.72Å; I73-Q91 HydrophobicContact CG1-CG 3.75Å; I73-A374 HydrophobicContact CD1-CB 4.27Å; I73-A374 HydrophobicContact CG1-CB 4.31Å; I73-M378 HydrophobicContact CB-CG 4.29Å; I73-M378 HydrophobicContact CB-SD 4.02Å; I73-M378 HydrophobicContact CD1-SD 3.45Å; I73-M378 WeakPolarHBondContact CD1-SD 3.3Å; I73-M378 HydrophobicContact CG1-SD 4.32Å; I73-M378 HydrophobicContact CG2-CE 4.46Å; I73-M378 HydrophobicContact CG2-CG 4.2Å; I73-M378 HydrophobicContact CG2-SD 3.75Å
74	T	93.9	Very high	94.3	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-62.5	-30.5	-175.2	-58.2	0	0	0	0	112.2	Q70 G71 R77 K78	Q70-T74 HydrophobicContact CB-CG2 4.08Å; Q70-T74 HydrophobicContact CG-CG2 3.86Å; G71-T74 PolarHBondContact O-N 3.22Å; T74-R77 PolarHBondContact O-N 3.03Å; T74-K78 WeakPolarHBondContact O-CG 3.1Å; T74-K78 PolarHBondContact O-N 3.45Å; T74-K78 VanDerWaalsContact O-N 3.12Å
75	C	94.7	Very high	94.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.4	-54.3	174	178.7	0	0	0	0	112.1	L64 T68 Q70 G71 I73 R77 K78 I79 T271	L64-C75 WeakPolarHBondContact CD1-SG 3.49Å; L64-C75 WeakPolarHBondContact CG-SG 3.35Å; T68-C75 VanDerWaalsContact CG2-SG 3.57Å; T68-C75 PolarHBondContact OG1-SG 2.81Å; T68-C75 VanDerWaalsContact OG1-SG 3.35Å; Q70-C75 HydrophobicContact CB-CB 4.3Å; G71-C75 WeakPolarHBondContact O-CB 3.4Å; G71-C75 PolarHBondContact O-N 3.08Å; I73-C75 PolarHBondContact O-N 3Å; C75-R77 VanDerWaalsContact C-N 3.32Å; C75-R77 PolarHBondContact O-N 3.49Å; C75-K78 PolarHBondContact O-N 3.17Å; C75-K78 VanDerWaalsContact O-N 3.12Å; C75-I79 WeakPolarHBondContact O-CG1 3.23Å; C75-I79 PolarHBondContact O-N 3.08Å; C75-T271 HydrophobicContact CB-CG2 4.22Å
76	W	95.8	Very high	94.2	Very high	1 Å²	1	13.5 Å²	13.5	0%	0.004	7%	0.066	C	C	.	.	H	α-helix	trans	-63.1	-38.3	178	-66.9	117.9	0	0	0	112.3	L64 I73 K78 I79 S80 L86 E436 C439 I440	L64-W76 HydrophobicContact CD2-CH2 3.69Å; L64-W76 HydrophobicContact CD2-CZ2 3.73Å; L64-W76 HydrophobicContact CD2-CZ3 4.12Å; I73-W76 PolarHBondContact O-N 2.95Å; W76-K78 PolarHBondContact O-N 2.98Å; W76-I79 PolarHBondContact O-N 3.1Å; W76-S80 CarbonylContact O-C 3.56Å; W76-S80 VanDerWaalsContact O-C 3.24Å; W76-S80 PolarHBondContact O-N 3.37Å; W76-L86 HydrophobicContact CD2-CB 4.1Å; W76-L86 HydrophobicContact CD2-CD1 3.95Å; W76-L86 HydrophobicContact CE3-CD1 3.87Å; W76-L86 HydrophobicContact CG-CB 4.02Å; W76-L86 HydrophobicContact CH2-CD1 4.11Å; W76-L86 HydrophobicContact CZ2-CD1 4.18Å; W76-L86 HydrophobicContact CZ3-CD1 3.94Å; W76-E436 HydrophobicContact CH2-CB 3.87Å; W76-E436 HydrophobicContact CH2-CG 3.81Å; W76-E436 HydrophobicContact CZ2-CB 4.08Å; W76-E436 HydrophobicContact CZ2-CG 3.51Å; W76-C439 HydrophobicContact CZ3-CB 3.99Å; W76-I440 HydrophobicContact CH2-CD1 4.28Å; W76-I440 HydrophobicContact CH2-CG1 3.99Å; W76-I440 HydrophobicContact CZ3-CD1 3.87Å; W76-I440 HydrophobicContact CZ3-CG1 3.94Å
77	R	94.7	Very high	94.2	Very high	95 Å²	95	13.5 Å²	13.5	36%	0.358	7%	0.066	S	C	.	.	H	α-helix	trans	-55.9	-36.8	173.9	-173.5	176.4	68	-174.2	0.5	112.9	I73 T74 C75 P81 E84	I73-R77 PolarHBondContact O-N 2.88Å; I73-R77 VanDerWaalsContact O-N 3.13Å; T74-R77 PolarHBondContact O-N 3.03Å; C75-R77 VanDerWaalsContact C-N 3.32Å; C75-R77 PolarHBondContact O-N 3.49Å; R77-P81 WeakPolarHBondContact O-CD 3.46Å; R77-P81 WeakPolarHBondContact O-CG 3.39Å; R77-E84 HydrophobicContact CB-CB 4.35Å; R77-E84 HydrophobicContact CB-CG 3.96Å; R77-E84 HydrophobicContact CG-CG 4.45Å
78	K	93.6	Very high	94.2	Very high	28 Å²	28	16 Å²	16	12%	0.122	8%	0.076	C	C	.	.	H	α-helix	trans	-81.3	-34.6	179	-70.7	-168.2	178.2	-148.9	0	113.4	Q70 T74 C75 W76 P543 S544 D546 L547	Q70-K78 HydrophobicContact CG-CD 4.22Å; T74-K78 WeakPolarHBondContact O-CG 3.1Å; T74-K78 PolarHBondContact O-N 3.45Å; T74-K78 VanDerWaalsContact O-N 3.12Å; C75-K78 PolarHBondContact O-N 3.17Å; C75-K78 VanDerWaalsContact O-N 3.12Å; W76-K78 PolarHBondContact O-N 2.98Å; K78-P543 CarbonylContact O-C 3.24Å; K78-P543 WeakPolarHBondContact O-CA 3.35Å; K78-S544 PolarHBondContact O-N 3.47Å; K78-D546 WeakPolarHBondContact CD-OD1 3.39Å; K78-D546 WeakPolarHBondContact CE-OD2 3.15Å; K78-D546 IonicContact NZ-OD1 3.2Å; K78-D546 PolarHBondContact NZ-OD1 3.09Å; K78-D546 VanDerWaalsContact NZ-OD1 3.08Å; K78-D546 IonicContact NZ-OD2 2.8Å; K78-D546 PolarHBondContact NZ-OD2 2.98Å; K78-L547 HydrophobicContact CB-CD1 4.36Å; K78-L547 HydrophobicContact CB-CD2 3.96Å; K78-L547 HydrophobicContact CB-CG 4.22Å; K78-L547 HydrophobicContact CD-CD2 3.95Å
79	I	94.6	Very high	94.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-73.5	-52	179	-68.8	-63.1	0	0	0	111.4	L64 Y67 T68 C75 W76 I440 Y444 P543 L547	L64-I79 HydrophobicContact CD1-CD1 3.9Å; L64-I79 HydrophobicContact CD1-CG1 3.7Å; Y67-I79 HydrophobicContact CD1-CD1 4.43Å; Y67-I79 HydrophobicContact CE1-CD1 4.16Å; T68-I79 HydrophobicContact CG2-CD1 4.21Å; T68-I79 HydrophobicContact CG2-CG1 4.32Å; C75-I79 WeakPolarHBondContact O-CG1 3.23Å; C75-I79 PolarHBondContact O-N 3.08Å; W76-I79 PolarHBondContact O-N 3.1Å; I79-I440 HydrophobicContact CG2-CD1 3.94Å; I79-Y444 HydrophobicContact CD1-CD2 4.26Å; I79-Y444 HydrophobicContact CD1-CE1 4.47Å; I79-Y444 HydrophobicContact CD1-CE2 3.95Å; I79-Y444 HydrophobicContact CG2-CD2 3.77Å; I79-Y444 HydrophobicContact CG2-CE2 4.49Å; I79-Y444 HydrophobicContact CG2-CG 3.9Å; I79-P543 WeakPolarHBondContact O-CA 3.47Å; I79-P543 WeakPolarHBondContact O-CB 3.27Å; I79-L547 HydrophobicContact CD1-CD1 4.18Å
80	S	94.8	Very high	94.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.061	C	C	.	.			trans	-154.9	105.5	176.2	176.1	0	0	0	0	109.3	W76 L82 F83 E84 L540	W76-S80 CarbonylContact O-C 3.56Å; W76-S80 VanDerWaalsContact O-C 3.24Å; W76-S80 PolarHBondContact O-N 3.37Å; S80-L82 PolarHBondContact O-N 3.07Å; S80-F83 PolarHBondContact O-N 3.4Å; S80-E84 PolarHBondContact O-N 3.45Å; S80-L540 CarbonylContact C-O 3.33Å; S80-L540 PolarHBondContact OG-O 3.15Å
81	P	94.1	Very high	94.6	Very high	28 Å²	28	12.7 Å²	12.7	18%	0.182	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-51.2	-28.1	175.4	-28.9	32.5	0	0	0	114.9	R77 F83 E84 L540	R77-P81 WeakPolarHBondContact O-CD 3.46Å; R77-P81 WeakPolarHBondContact O-CG 3.39Å; P81-F83 VanDerWaalsContact C-N 3.29Å; P81-F83 PolarHBondContact O-N 3.32Å; P81-E84 WeakPolarHBondContact O-CB 3.28Å; P81-E84 PolarHBondContact O-N 3.12Å; P81-L540 HydrophobicContact CB-CD2 3.87Å; P81-L540 WeakPolarHBondContact CD-O 3.44Å
82	L	95.3	Very high	94.8	Very high	20 Å²	20	14.7 Å²	14.7	11%	0.105	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-61	-38.3	174.9	-172.6	61.8	0	0	0	112.3	S80 M522 L526 L540 V541	S80-L82 PolarHBondContact O-N 3.07Å; L82-M522 HydrophobicContact CD1-CB 4.17Å; L82-M522 HydrophobicContact CD1-CG 4.04Å; L82-M522 HydrophobicContact CG-CG 4.17Å; L82-M522 WeakPolarHBondContact O-CG 3.34Å; L82-L526 HydrophobicContact CD1-CD1 4.34Å; L82-L526 HydrophobicContact CD1-CD2 4.38Å; L82-L526 HydrophobicContact CD1-CG 4.1Å; L82-L540 HydrophobicContact CB-CB 3.88Å; L82-L540 WeakPolarHBondContact CB-O 3.5Å; L82-L540 HydrophobicContact CD1-CB 4.45Å; L82-L540 HydrophobicContact CD1-CD1 4.19Å; L82-L540 PolarHBondContact N-O 2.98Å; L82-V541 HydrophobicContact CD2-CG2 4.03Å
83	F	95.8	Very high	95.2	Very high	14 Å²	14	14.7 Å²	14.7	6%	0.061	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-97.2	8.8	-175.6	-75.9	-95.1	0	0	0	113.4	S80 P81 G85 L86 F435 C439 V443 M522	S80-F83 PolarHBondContact O-N 3.4Å; P81-F83 VanDerWaalsContact C-N 3.29Å; P81-F83 PolarHBondContact O-N 3.32Å; F83-G85 PolarHBondContact O-N 3.24Å; F83-L86 HydrophobicContact CB-CD1 4.04Å; F83-L86 HydrophobicContact CD1-CD1 4.01Å; F83-L86 HydrophobicContact CG-CD1 4.49Å; F83-L86 VanDerWaalsContact O-CB 3.24Å; F83-L86 WeakPolarHBondContact O-CB 3.21Å; F83-L86 PolarHBondContact O-N 2.99Å; F83-F435 HydrophobicContact CE1-CD1 4.07Å; F83-C439 HydrophobicContact CB-CB 4.29Å; F83-C439 VanDerWaalsContact CB-SG 3.58Å; F83-C439 HydrophobicContact CD1-CB 3.77Å; F83-C439 HydrophobicContact CD2-CB 4.3Å; F83-C439 HydrophobicContact CE1-CB 4.1Å; F83-C439 HydrophobicContact CG-CB 3.87Å; F83-C439 VanDerWaalsContact CG-SG 3.56Å; F83-V443 HydrophobicContact CD2-CG1 4.4Å; F83-V443 HydrophobicContact CE2-CB 4.28Å; F83-V443 HydrophobicContact CE2-CG1 4.03Å; F83-V443 HydrophobicContact CE2-CG2 3.74Å; F83-V443 HydrophobicContact CZ-CG2 3.97Å; F83-M522 HydrophobicContact CD1-CE 3.53Å; F83-M522 HydrophobicContact CD2-CE 4.34Å; F83-M522 HydrophobicContact CE1-CE 3.34Å; F83-M522 HydrophobicContact CE2-CE 4.15Å; F83-M522 HydrophobicContact CG-CE 4.05Å; F83-M522 HydrophobicContact CZ-CE 3.67Å
84	E	95.5	Very high	95.1	Very high	5 Å²	5	14.4 Å²	14.4	2%	0.023	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.1	176.4	173.6	-171.6	-178.6	0	0	112.7	I73 R77 S80 P81 L86 G87 Y88 W521 K525	I73-E84 HydrophobicContact CG2-CG 4.33Å; R77-E84 HydrophobicContact CB-CB 4.35Å; R77-E84 HydrophobicContact CB-CG 3.96Å; R77-E84 HydrophobicContact CG-CG 4.45Å; S80-E84 PolarHBondContact O-N 3.45Å; P81-E84 WeakPolarHBondContact O-CB 3.28Å; P81-E84 PolarHBondContact O-N 3.12Å; E84-L86 PolarHBondContact O-N 3.36Å; E84-G87 PolarHBondContact O-N 3.43Å; E84-Y88 HydrophobicContact CG-CD2 4.42Å; E84-Y88 HydrophobicContact CG-CE2 3.8Å; E84-Y88 WeakPolarHBondContact O-CD2 3.44Å; E84-Y88 PolarHBondContact O-N 3.23Å; E84-Y88 PolarHBondContact OE1-OH 2.95Å; E84-W521 HydrophobicContact CG-CZ2 4.02Å; E84-W521 WeakPolarHBondContact OE1-CZ2 3.42Å; E84-W521 VanDerWaalsContact OE2-CZ2 3.27Å; E84-W521 WeakPolarHBondContact OE2-CZ2 3.36Å; E84-W521 PolarHBondContact OE2-NE1 3.39Å; E84-K525 WeakPolarHBondContact OE2-CE 3.41Å; E84-K525 IonicContact OE2-NZ 2.72Å; E84-K525 PolarHBondContact OE2-NZ 3.06Å
85	G	95.8	Very high	95.2	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.01	8%	0.077	C	C	.	.	H	α-helix	trans	-56.2	-27.1	169.6	0	0	0	0	0	115.2	F83 G87 Y88 G89 W521	F83-G85 PolarHBondContact O-N 3.24Å; G85-G87 VanDerWaalsContact C-N 3.29Å; G85-G87 PolarHBondContact O-N 3.46Å; G85-Y88 PolarHBondContact O-N 2.85Å; G85-G89 PolarHBondContact O-N 3.41Å; G85-W521 VanDerWaalsContact N-CD1 3.34Å
86	L	95.8	Very high	95.2	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-58.3	-43.4	171.1	-79.4	170.9	0	0	0	111.3	W76 F83 E84 G89 T90 M432 F435 E436 C439 I518	W76-L86 HydrophobicContact CD2-CB 4.1Å; W76-L86 HydrophobicContact CD2-CD1 3.95Å; W76-L86 HydrophobicContact CE3-CD1 3.87Å; W76-L86 HydrophobicContact CG-CB 4.02Å; W76-L86 HydrophobicContact CH2-CD1 4.11Å; W76-L86 HydrophobicContact CZ2-CD1 4.18Å; W76-L86 HydrophobicContact CZ3-CD1 3.94Å; F83-L86 HydrophobicContact CB-CD1 4.04Å; F83-L86 HydrophobicContact CD1-CD1 4.01Å; F83-L86 HydrophobicContact CG-CD1 4.49Å; F83-L86 VanDerWaalsContact O-CB 3.24Å; F83-L86 WeakPolarHBondContact O-CB 3.21Å; F83-L86 PolarHBondContact O-N 2.99Å; E84-L86 PolarHBondContact O-N 3.36Å; L86-G89 PolarHBondContact O-N 3.43Å; L86-T90 WeakPolarHBondContact O-CG2 3.3Å; L86-T90 PolarHBondContact O-N 3.48Å; L86-T90 PolarHBondContact O-OG1 2.91Å; L86-M432 HydrophobicContact CD2-SD 4.13Å; L86-F435 HydrophobicContact CD1-CB 4.42Å; L86-F435 HydrophobicContact CD2-CB 3.59Å; L86-F435 HydrophobicContact CG-CB 4.31Å; L86-E436 HydrophobicContact CD1-CG 4.03Å; L86-E436 HydrophobicContact CD2-CG 3.85Å; L86-E436 HydrophobicContact CG-CG 4.5Å; L86-C439 HydrophobicContact CD1-CB 4.25Å; L86-I518 HydrophobicContact CD2-CD1 3.71Å; L86-I518 HydrophobicContact CD2-CG1 4.2Å; L86-I518 HydrophobicContact CG-CD1 4.49Å
87	G	95.8	Very high	95.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.5	-50.5	176.7	0	0	0	0	0	111.6	E84 G85 G89 T90 Q91	E84-G87 PolarHBondContact O-N 3.43Å; G85-G87 VanDerWaalsContact C-N 3.29Å; G85-G87 PolarHBondContact O-N 3.46Å; G87-G89 PolarHBondContact O-N 2.59Å; G87-T90 PolarHBondContact O-OG1 3.43Å; G87-Q91 VanDerWaalsContact O-CG 3.3Å; G87-Q91 WeakPolarHBondContact O-CG 3.31Å; G87-Q91 PolarHBondContact O-N 3.27Å; G87-Q91 VanDerWaalsContact O-N 3.08Å
88	Y	96.4	Very high	95.1	Very high	57 Å²	57	13.2 Å²	13.2	22%	0.224	7%	0.068	C	C	.	.	H	α-helix	trans	-63.2	-43.5	178.6	-66.1	-72.2	0	0	0	112	I73 E84 G85 T90 Q91 V92 M378 W521	I73-Y88 HydrophobicContact CD1-CD1 3.9Å; I73-Y88 HydrophobicContact CD1-CE1 3.94Å; I73-Y88 HydrophobicContact CG1-CD1 4.49Å; I73-Y88 HydrophobicContact CG2-CE1 4.11Å; I73-Y88 HydrophobicContact CG2-CE2 4.06Å; E84-Y88 HydrophobicContact CG-CD2 4.42Å; E84-Y88 HydrophobicContact CG-CE2 3.8Å; E84-Y88 WeakPolarHBondContact O-CD2 3.44Å; E84-Y88 PolarHBondContact O-N 3.23Å; E84-Y88 PolarHBondContact OE1-OH 2.95Å; G85-Y88 PolarHBondContact O-N 2.85Å; Y88-T90 PolarHBondContact O-N 2.85Å; Y88-Q91 PolarHBondContact O-N 2.92Å; Y88-V92 WeakPolarHBondContact O-CG2 3.28Å; Y88-V92 PolarHBondContact O-N 3.35Å; Y88-M378 HydrophobicContact CE1-CE 4.05Å; Y88-M378 HydrophobicContact CE1-SD 4.29Å; Y88-M378 VanDerWaalsContact OH-CE 3.25Å; Y88-M378 WeakPolarHBondContact OH-CE 3.11Å; Y88-W521 HydrophobicContact CD2-CD2 4.14Å; Y88-W521 AromaticContact CD2-CE3 3.93Å; Y88-W521 HydrophobicContact CD2-CE3 3.93Å; Y88-W521 HydrophobicContact CD2-CH2 4.35Å; Y88-W521 HydrophobicContact CD2-CZ3 4.04Å; Y88-W521 AromaticContact CE2-CD2 3.99Å; Y88-W521 HydrophobicContact CE2-CD2 3.99Å; Y88-W521 AromaticContact CE2-CE2 3.89Å; Y88-W521 AromaticContact CE2-CE3 3.78Å; Y88-W521 HydrophobicContact CE2-CE3 3.78Å; Y88-W521 AromaticContact CE2-CH2 3.4Å; Y88-W521 HydrophobicContact CE2-CH2 3.4Å; Y88-W521 AromaticContact CE2-CZ2 3.61Å; Y88-W521 HydrophobicContact CE2-CZ2 3.61Å; Y88-W521 AromaticContact CE2-CZ3 3.49Å; Y88-W521 HydrophobicContact CE2-CZ3 3.49Å; Y88-W521 VanDerWaalsContact CE2-CZ3 3.49Å; Y88-W521 AromaticContact CZ-CH2 3.75Å; Y88-W521 AromaticContact CZ-CZ3 3.97Å
89	G	96.1	Very high	95.2	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.8	-48.7	178.2	0	0	0	0	0	112.7	G85 L86 G87 Q91 V92 I93	G85-G89 PolarHBondContact O-N 3.41Å; L86-G89 PolarHBondContact O-N 3.43Å; G87-G89 PolarHBondContact O-N 2.59Å; G89-Q91 VanDerWaalsContact C-N 3.35Å; G89-Q91 PolarHBondContact O-N 3.17Å; G89-V92 PolarHBondContact O-N 3.41Å; G89-I93 WeakPolarHBondContact O-CG1 3.25Å; G89-I93 PolarHBondContact O-N 2.92Å; G89-I93 VanDerWaalsContact O-N 3.08Å
90	T	94.8	Very high	95.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.6	-38.4	176.7	54.8	0	0	0	0	112.5	L86 G87 Y88 I93 V94 C266 M432	L86-T90 WeakPolarHBondContact O-CG2 3.3Å; L86-T90 PolarHBondContact O-N 3.48Å; L86-T90 PolarHBondContact O-OG1 2.91Å; G87-T90 PolarHBondContact O-OG1 3.43Å; Y88-T90 PolarHBondContact O-N 2.85Å; T90-I93 PolarHBondContact O-N 3.24Å; T90-V94 WeakPolarHBondContact O-CG2 3.18Å; T90-V94 PolarHBondContact O-N 3.25Å; T90-C266 WeakPolarHBondContact CG2-O 3.37Å; T90-M432 HydrophobicContact CG2-CG 4.44Å; T90-M432 HydrophobicContact CG2-SD 4.25Å
91	Q	95.4	Very high	95	Very high	10 Å²	10	14.5 Å²	14.5	5%	0.047	7%	0.073	C	C	.	.	H	α-helix	trans	-68.7	-32.3	175.3	-65.1	-42	-64.1	0	0	113.5	I73 G87 Y88 G89 T95 L371 A374	I73-Q91 HydrophobicContact CD1-CB 4.45Å; I73-Q91 HydrophobicContact CD1-CG 3.72Å; I73-Q91 HydrophobicContact CG1-CG 3.75Å; G87-Q91 VanDerWaalsContact O-CG 3.3Å; G87-Q91 WeakPolarHBondContact O-CG 3.31Å; G87-Q91 PolarHBondContact O-N 3.27Å; G87-Q91 VanDerWaalsContact O-N 3.08Å; Y88-Q91 PolarHBondContact O-N 2.92Å; G89-Q91 VanDerWaalsContact C-N 3.35Å; G89-Q91 PolarHBondContact O-N 3.17Å; Q91-T95 WeakPolarHBondContact O-CB 3.49Å; Q91-T95 PolarHBondContact O-N 2.83Å; Q91-T95 PolarHBondContact O-OG1 2.81Å; Q91-L371 HydrophobicContact CB-CD1 4.37Å; Q91-L371 VanDerWaalsContact OE1-CA 3.28Å; Q91-A374 HydrophobicContact CG-CB 3.9Å
92	V	96.2	Very high	95.1	Very high	42 Å²	42	13.1 Å²	13.1	26%	0.255	7%	0.065	S	C	.	.	H	α-helix	trans	-63.3	-46.6	171.1	171.4	0	0	0	0	110	Y88 G89 V94 T95 L96 S513	Y88-V92 WeakPolarHBondContact O-CG2 3.28Å; Y88-V92 PolarHBondContact O-N 3.35Å; G89-V92 PolarHBondContact O-N 3.41Å; V92-V94 PolarHBondContact O-N 2.84Å; V92-T95 PolarHBondContact O-N 2.71Å; V92-L96 HydrophobicContact CG1-CD1 4.06Å; V92-L96 HydrophobicContact CG1-CG 4.49Å; V92-L96 WeakPolarHBondContact O-CG 3.27Å; V92-L96 PolarHBondContact O-N 3.39Å; V92-S513 WeakPolarHBondContact CG1-OG 3.35Å
93	I	94.9	Very high	95.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-57.9	-49.5	177	-61.5	170.4	0	0	0	110.5	G89 T90 T95 L96 L97 L267 A424 C428 L429 M432 S514	G89-I93 WeakPolarHBondContact O-CG1 3.25Å; G89-I93 PolarHBondContact O-N 2.92Å; G89-I93 VanDerWaalsContact O-N 3.08Å; T90-I93 PolarHBondContact O-N 3.24Å; I93-T95 VanDerWaalsContact C-N 3.31Å; I93-T95 PolarHBondContact O-N 2.86Å; I93-L96 PolarHBondContact O-N 3.47Å; I93-L97 WeakPolarHBondContact O-CB 3.3Å; I93-L97 PolarHBondContact O-N 3.35Å; I93-L267 HydrophobicContact CB-CD2 4.27Å; I93-L267 HydrophobicContact CG2-CD2 3.41Å; I93-L267 VanDerWaalsContact CG2-CD2 3.41Å; I93-A424 HydrophobicContact CG2-CB 3.76Å; I93-C428 HydrophobicContact CD1-CB 4.04Å; I93-L429 HydrophobicContact CD1-CD2 4.23Å; I93-L429 HydrophobicContact CG2-CD2 4.37Å; I93-M432 HydrophobicContact CD1-CE 4.08Å; I93-M432 HydrophobicContact CD1-CG 3.93Å; I93-S514 VanDerWaalsContact CG1-CB 3.44Å
94	V	94.6	Very high	95.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-60.5	-39.5	178.3	167.1	0	0	0	0	112.1	T90 V92 L97 N98 L267 C367 L371	T90-V94 WeakPolarHBondContact O-CG2 3.18Å; T90-V94 PolarHBondContact O-N 3.25Å; V92-V94 PolarHBondContact O-N 2.84Å; V94-L97 PolarHBondContact O-N 3.42Å; V94-N98 WeakPolarHBondContact O-CB 3.3Å; V94-N98 VanDerWaalsContact O-CG 3.23Å; V94-N98 PolarHBondContact O-N 3.3Å; V94-N98 PolarHBondContact O-ND2 3.04Å; V94-L267 HydrophobicContact CG2-CB 3.99Å; V94-L267 HydrophobicContact CG2-CD2 4.47Å; V94-L267 WeakPolarHBondContact CG2-O 3.27Å; V94-C367 HydrophobicContact CG1-CB 4.17Å; V94-C367 WeakPolarHBondContact CG1-O 3.2Å; V94-L371 HydrophobicContact CG1-CB 4.17Å
95	T	95.4	Very high	95.1	Very high	37 Å²	37	11.6 Å²	11.6	23%	0.227	6%	0.057	C	C	.	.	H	α-helix	trans	-63.6	-45.4	177.7	-60.3	0	0	0	0	111.3	Q91 V92 I93 N98 F99	Q91-T95 WeakPolarHBondContact O-CB 3.49Å; Q91-T95 PolarHBondContact O-N 2.83Å; Q91-T95 PolarHBondContact O-OG1 2.81Å; V92-T95 PolarHBondContact O-N 2.71Å; I93-T95 VanDerWaalsContact C-N 3.31Å; I93-T95 PolarHBondContact O-N 2.86Å; T95-N98 PolarHBondContact O-N 3.45Å; T95-F99 HydrophobicContact CG2-CE1 4.17Å; T95-F99 HydrophobicContact CG2-CE2 3.99Å; T95-F99 HydrophobicContact CG2-CZ 3.56Å; T95-F99 WeakPolarHBondContact O-CG 3.4Å; T95-F99 PolarHBondContact O-N 3.42Å
96	L	95.2	Very high	95.2	Very high	19 Å²	19	11.6 Å²	11.6	10%	0.099	6%	0.057	C	C	.	.	H	α-helix	trans	-65.9	-40.4	177.1	-62.5	172.5	0	0	0	111.3	V92 I93 N98 F99 Y100 F419 A423 L510	V92-L96 HydrophobicContact CG1-CD1 4.06Å; V92-L96 HydrophobicContact CG1-CG 4.49Å; V92-L96 WeakPolarHBondContact O-CG 3.27Å; V92-L96 PolarHBondContact O-N 3.39Å; I93-L96 PolarHBondContact O-N 3.47Å; L96-N98 VanDerWaalsContact C-N 3.34Å; L96-N98 PolarHBondContact O-N 2.91Å; L96-F99 HydrophobicContact CD2-CD2 4.37Å; L96-F99 HydrophobicContact CD2-CE2 4.39Å; L96-F99 PolarHBondContact O-N 2.82Å; L96-Y100 WeakPolarHBondContact O-CD1 3.31Å; L96-F419 HydrophobicContact CB-CD1 4.39Å; L96-F419 HydrophobicContact CB-CE1 4.38Å; L96-F419 HydrophobicContact CD2-CE1 3.81Å; L96-A423 HydrophobicContact CB-CB 3.85Å; L96-A423 HydrophobicContact CD1-CB 3.8Å; L96-A423 HydrophobicContact CG-CB 4.36Å; L96-L510 HydrophobicContact CD1-CD2 4.37Å; L96-L510 HydrophobicContact CD2-CD2 4.02Å
97	L	93.3	Very high	95.3	Very high	16 Å²	16	11.8 Å²	11.8	8%	0.084	6%	0.058	C	C	.	.	H	α-helix	trans	-60.1	-43.9	175.5	-167.8	155.2	0	0	0	111.5	I93 V94 F99 Y100 Y101 L267 C367 A424	I93-L97 WeakPolarHBondContact O-CB 3.3Å; I93-L97 PolarHBondContact O-N 3.35Å; V94-L97 PolarHBondContact O-N 3.42Å; L97-F99 PolarHBondContact O-N 3.43Å; L97-Y100 HydrophobicContact CB-CE1 4.21Å; L97-Y100 HydrophobicContact CG-CE1 4.12Å; L97-Y100 PolarHBondContact O-N 3.42Å; L97-Y101 HydrophobicContact CD2-CD2 4.35Å; L97-Y101 HydrophobicContact CD2-CG 4.07Å; L97-Y101 WeakPolarHBondContact O-CB 3.42Å; L97-Y101 PolarHBondContact O-N 2.93Å; L97-L267 HydrophobicContact CD1-CD1 4.32Å; L97-C367 HydrophobicContact CD2-CB 4.32Å; L97-A424 HydrophobicContact CD1-CB 4.22Å
98	N	94.3	Very high	95.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-58.2	-30.7	177.3	-78.5	-32.1	0	0	0	113.2	V94 T95 L96 I102 Q364 C367 V368	V94-N98 WeakPolarHBondContact O-CB 3.3Å; V94-N98 VanDerWaalsContact O-CG 3.23Å; V94-N98 PolarHBondContact O-N 3.3Å; V94-N98 PolarHBondContact O-ND2 3.04Å; T95-N98 PolarHBondContact O-N 3.45Å; L96-N98 VanDerWaalsContact C-N 3.34Å; L96-N98 PolarHBondContact O-N 2.91Å; N98-I102 WeakPolarHBondContact O-CG2 3.2Å; N98-Q364 PolarHBondContact O-NE2 3.48Å; N98-Q364 VanDerWaalsContact O-NE2 3.16Å; N98-C367 WeakPolarHBondContact OD1-CB 3.18Å; N98-V368 WeakPolarHBondContact OD1-CG2 3.32Å
99	F	94.8	Very high	95.4	Very high	12 Å²	12	10.2 Å²	10.2	5%	0.053	5%	0.053	C	C	.	.	H	α-helix	trans	-73.1	-41.1	180	-61.4	-26.4	0	0	0	113.1	T95 L96 L97 F399 S400 M403 M407 F419	T95-F99 HydrophobicContact CG2-CE1 4.17Å; T95-F99 HydrophobicContact CG2-CE2 3.99Å; T95-F99 HydrophobicContact CG2-CZ 3.56Å; T95-F99 WeakPolarHBondContact O-CG 3.4Å; T95-F99 PolarHBondContact O-N 3.42Å; L96-F99 HydrophobicContact CD2-CD2 4.37Å; L96-F99 HydrophobicContact CD2-CE2 4.39Å; L96-F99 PolarHBondContact O-N 2.82Å; L97-F99 PolarHBondContact O-N 3.43Å; F99-F399 HydrophobicContact CE1-CD1 4.11Å; F99-F399 AromaticContact CE1-CE1 3.97Å; F99-F399 HydrophobicContact CE1-CE1 3.97Å; F99-F399 HydrophobicContact CZ-CD1 4.17Å; F99-F399 AromaticContact CZ-CE1 3.57Å; F99-F399 HydrophobicContact CZ-CE1 3.57Å; F99-F399 HydrophobicContact CZ-CZ 4.26Å; F99-S400 WeakPolarHBondContact CE1-OG 3.31Å; F99-M403 HydrophobicContact CD1-CB 3.83Å; F99-M403 HydrophobicContact CD1-CG 4.24Å; F99-M403 HydrophobicContact CD2-CB 4.3Å; F99-M403 HydrophobicContact CE1-CB 4.06Å; F99-M403 HydrophobicContact CE1-CG 3.95Å; F99-M403 HydrophobicContact CE2-CE 4.4Å; F99-M403 HydrophobicContact CE2-CG 4.24Å; F99-M403 HydrophobicContact CG-CB 3.98Å; F99-M403 HydrophobicContact CZ-CB 4.4Å; F99-M403 HydrophobicContact CZ-CG 3.96Å; F99-M407 HydrophobicContact CB-CE 4.39Å; F99-F419 HydrophobicContact CB-CE1 4.41Å; F99-F419 HydrophobicContact CD2-CE1 4.07Å
100	Y	93.5	Very high	95.5	Very high	10 Å²	10	10.5 Å²	10.5	4%	0.039	5%	0.054	C	C	.	.	H	α-helix	trans	-98.1	-35.8	-173.1	87.3	-93.7	0	0	0	113.2	L96 L97 I102 I103 M407 F416 F419 D420 A424	L96-Y100 WeakPolarHBondContact O-CD1 3.31Å; L97-Y100 HydrophobicContact CB-CE1 4.21Å; L97-Y100 HydrophobicContact CG-CE1 4.12Å; L97-Y100 PolarHBondContact O-N 3.42Å; Y100-I102 VanDerWaalsContact C-N 3.29Å; Y100-I102 PolarHBondContact O-N 3.31Å; Y100-I103 WeakPolarHBondContact O-CB 3.5Å; Y100-I103 WeakPolarHBondContact O-CG1 3.49Å; Y100-I103 PolarHBondContact O-N 2.93Å; Y100-M407 VanDerWaalsContact CB-SD 3.57Å; Y100-F416 HydrophobicContact CD2-CD2 4.19Å; Y100-F416 AromaticContact CD2-CE2 3.72Å; Y100-F416 HydrophobicContact CD2-CE2 3.72Å; Y100-F416 HydrophobicContact CD2-CZ 4.05Å; Y100-F416 WeakPolarHBondContact O-CE2 3.46Å; Y100-F419 HydrophobicContact CD1-CB 3.88Å; Y100-F419 HydrophobicContact CD1-CD1 4.37Å; Y100-F419 HydrophobicContact CG-CB 3.87Å; Y100-D420 HydrophobicContact CD2-CB 4.16Å; Y100-D420 HydrophobicContact CE2-CB 3.72Å; Y100-D420 WeakPolarHBondContact CE2-OD1 3.44Å; Y100-D420 PolarHBondContact OH-OD1 3.29Å; Y100-D420 VanDerWaalsContact OH-OD1 3.05Å; Y100-A424 HydrophobicContact CE1-CB 4.5Å
101	Y	93.1	Very high	95.6	Very high	33 Å²	33	10.5 Å²	10.5	13%	0.129	5%	0.054	C	C	.	.	H	α-helix	trans	-62.9	-38.2	-173.5	-171.7	-87.7	0	0	0	112	L97 I103 V104 L105 G360 S363 Q364	L97-Y101 HydrophobicContact CD2-CD2 4.35Å; L97-Y101 HydrophobicContact CD2-CG 4.07Å; L97-Y101 WeakPolarHBondContact O-CB 3.42Å; L97-Y101 PolarHBondContact O-N 2.93Å; Y101-I103 PolarHBondContact O-N 3.5Å; Y101-V104 WeakPolarHBondContact O-CB 3.48Å; Y101-V104 PolarHBondContact O-N 3.49Å; Y101-V104 VanDerWaalsContact O-N 3.1Å; Y101-L105 HydrophobicContact CD1-CD1 4.08Å; Y101-L105 HydrophobicContact CE1-CD1 3.96Å; Y101-G360 WeakPolarHBondContact CE1-O 3.46Å; Y101-S363 WeakPolarHBondContact OH-CB 3.03Å; Y101-S363 PolarHBondContact OH-OG 3.23Å; Y101-Q364 HydrophobicContact CD1-CB 4.31Å
102	I	96	Very high	95.7	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.5	-21.8	177.2	-164.4	143.7	0	0	0	114	N98 Y100 V104 L105 A106 L185 A188 W189 Q364	N98-I102 WeakPolarHBondContact O-CG2 3.2Å; Y100-I102 VanDerWaalsContact C-N 3.29Å; Y100-I102 PolarHBondContact O-N 3.31Å; I102-V104 PolarHBondContact O-N 3.41Å; I102-L105 HydrophobicContact CG1-CD2 4.44Å; I102-L105 WeakPolarHBondContact O-CB 3.36Å; I102-L105 PolarHBondContact O-N 3.23Å; I102-L105 VanDerWaalsContact O-N 3.11Å; I102-A106 PolarHBondContact O-N 3.2Å; I102-A106 VanDerWaalsContact O-N 3.09Å; I102-L185 HydrophobicContact CB-CD1 4.47Å; I102-L185 HydrophobicContact CG1-CD1 4.04Å; I102-L185 HydrophobicContact CG2-CD1 3.77Å; I102-A188 HydrophobicContact CD1-CB 4.15Å; I102-A188 HydrophobicContact CG1-CB 3.94Å; I102-W189 HydrophobicContact CB-CZ2 4.17Å; I102-W189 HydrophobicContact CD1-CD2 3.35Å; I102-W189 HydrophobicContact CD1-CE3 3.66Å; I102-W189 HydrophobicContact CD1-CG 3.79Å; I102-W189 HydrophobicContact CD1-CH2 4.01Å; I102-W189 HydrophobicContact CD1-CZ2 3.69Å; I102-W189 HydrophobicContact CD1-CZ3 4Å; I102-W189 HydrophobicContact CG1-CD2 4.47Å; I102-W189 HydrophobicContact CG1-CZ2 4.36Å; I102-W189 HydrophobicContact CG2-CZ2 3.66Å; I102-Q364 HydrophobicContact CB-CG 4.31Å; I102-Q364 HydrophobicContact CD1-CG 3.85Å; I102-Q364 HydrophobicContact CG1-CG 4.39Å
103	I	96.6	Very high	95.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.3	-33.9	176.1	-55.5	-58.8	0	0	0	110.2	Y100 Y101 L105 A106 W107 L185 G404 M407 L408 F416	Y100-I103 WeakPolarHBondContact O-CB 3.5Å; Y100-I103 WeakPolarHBondContact O-CG1 3.49Å; Y100-I103 PolarHBondContact O-N 2.93Å; Y101-I103 PolarHBondContact O-N 3.5Å; I103-L105 VanDerWaalsContact C-N 3.34Å; I103-L105 PolarHBondContact O-N 3.15Å; I103-A106 WeakPolarHBondContact O-CB 3.34Å; I103-A106 PolarHBondContact O-N 3.22Å; I103-A106 VanDerWaalsContact O-N 3.17Å; I103-W107 HydrophobicContact CG2-CD2 4.34Å; I103-W107 HydrophobicContact CG2-CH2 4.32Å; I103-W107 HydrophobicContact CG2-CZ2 3.63Å; I103-W107 PolarHBondContact O-N 3.44Å; I103-L185 HydrophobicContact CD1-CD1 4.04Å; I103-L185 HydrophobicContact CD1-CD2 4.1Å; I103-G404 WeakPolarHBondContact CD1-O 3.4Å; I103-M407 HydrophobicContact CD1-CB 4.12Å; I103-M407 HydrophobicContact CG1-CB 4.01Å; I103-M407 HydrophobicContact CG1-SD 3.91Å; I103-L408 HydrophobicContact CD1-CD2 3.93Å; I103-L408 HydrophobicContact CD1-CG 4.3Å; I103-L408 HydrophobicContact CG2-CD2 3.83Å; I103-F416 HydrophobicContact CB-CD2 4.06Å; I103-F416 HydrophobicContact CB-CE2 4.18Å; I103-F416 HydrophobicContact CG1-CD2 4.47Å; I103-F416 HydrophobicContact CG2-CD2 4.18Å
104	V	94.8	Very high	95.7	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.024	8%	0.084	C	C	.	.	H	α-helix	trans	-65.8	-37.5	175.6	-174.7	0	0	0	0	112.1	L24 W28 Y101 I102 A106 W107 G108 F332 F416	L24-V104 HydrophobicContact CD1-CB 4.07Å; L24-V104 HydrophobicContact CD1-CG1 3.43Å; L24-V104 VanDerWaalsContact CD1-CG1 3.43Å; W28-V104 HydrophobicContact CH2-CG1 3.52Å; W28-V104 HydrophobicContact CH2-CG2 4.31Å; W28-V104 HydrophobicContact CZ2-CG1 4.28Å; W28-V104 HydrophobicContact CZ3-CG1 4.3Å; Y101-V104 WeakPolarHBondContact O-CB 3.48Å; Y101-V104 PolarHBondContact O-N 3.49Å; Y101-V104 VanDerWaalsContact O-N 3.1Å; I102-V104 PolarHBondContact O-N 3.41Å; V104-A106 VanDerWaalsContact C-N 3.3Å; V104-W107 HydrophobicContact CB-CE3 4.23Å; V104-W107 HydrophobicContact CG1-CE3 4.28Å; V104-W107 HydrophobicContact CG2-CE3 4.06Å; V104-W107 HydrophobicContact CG2-CZ3 3.91Å; V104-W107 WeakPolarHBondContact O-CB 3.36Å; V104-W107 PolarHBondContact O-N 3.31Å; V104-G108 PolarHBondContact O-N 3.12Å; V104-F332 HydrophobicContact CG1-CE2 3.94Å; V104-F332 HydrophobicContact CG1-CZ 4.02Å; V104-F416 HydrophobicContact CG2-CE2 3.82Å; V104-F416 HydrophobicContact CG2-CZ 3.73Å
105	L	95.6	Very high	95.7	Very high	3 Å²	3	19 Å²	19	2%	0.016	9%	0.085	C	C	.	.	H	α-helix	trans	-64.8	-39	174.1	-75.2	61.3	0	0	0	110.3	Y101 I102 I103 W107 G108 I109 A188 G360 L361 Q364	Y101-L105 HydrophobicContact CD1-CD1 4.08Å; Y101-L105 HydrophobicContact CE1-CD1 3.96Å; I102-L105 HydrophobicContact CG1-CD2 4.44Å; I102-L105 WeakPolarHBondContact O-CB 3.36Å; I102-L105 PolarHBondContact O-N 3.23Å; I102-L105 VanDerWaalsContact O-N 3.11Å; I103-L105 VanDerWaalsContact C-N 3.34Å; I103-L105 PolarHBondContact O-N 3.15Å; L105-W107 VanDerWaalsContact C-N 3.34Å; L105-W107 PolarHBondContact O-N 3Å; L105-G108 PolarHBondContact O-N 3.39Å; L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.06Å; L105-A188 HydrophobicContact CB-CB 4.17Å; L105-G360 VanDerWaalsContact CD1-CA 3.47Å; L105-L361 HydrophobicContact CD2-CB 4.32Å; L105-L361 HydrophobicContact CD2-CD1 4.46Å; L105-Q364 HydrophobicContact CD2-CB 4.23Å
106	A	97.4	Very high	95.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.8	-43.5	175.1	0	0	0	0	0	111.3	I102 I103 V104 I109 F110 M181 C184 L185	I102-A106 PolarHBondContact O-N 3.2Å; I102-A106 VanDerWaalsContact O-N 3.09Å; I103-A106 WeakPolarHBondContact O-CB 3.34Å; I103-A106 PolarHBondContact O-N 3.22Å; I103-A106 VanDerWaalsContact O-N 3.17Å; V104-A106 VanDerWaalsContact C-N 3.3Å; A106-I109 PolarHBondContact O-N 3.25Å; A106-F110 WeakPolarHBondContact O-CB 3.49Å; A106-F110 PolarHBondContact O-N 3.4Å; A106-M181 HydrophobicContact CB-SD 4.19Å; A106-C184 HydrophobicContact CB-CB 4.22Å; A106-C184 WeakPolarHBondContact O-CB 3.4Å; A106-L185 HydrophobicContact CB-CB 3.97Å; A106-L185 HydrophobicContact CB-CD1 4.35Å
107	W	97.4	Very high	95.4	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.015	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-43.9	171.7	-59.6	-27.6	0	0	0	112	I103 V104 L105 I109 F110 Y111 W160 L165 P328 F332 M413 F416	I103-W107 HydrophobicContact CG2-CD2 4.34Å; I103-W107 HydrophobicContact CG2-CH2 4.32Å; I103-W107 HydrophobicContact CG2-CZ2 3.63Å; I103-W107 PolarHBondContact O-N 3.44Å; V104-W107 HydrophobicContact CB-CE3 4.23Å; V104-W107 HydrophobicContact CG1-CE3 4.28Å; V104-W107 HydrophobicContact CG2-CE3 4.06Å; V104-W107 HydrophobicContact CG2-CZ3 3.91Å; V104-W107 WeakPolarHBondContact O-CB 3.36Å; V104-W107 PolarHBondContact O-N 3.31Å; L105-W107 VanDerWaalsContact C-N 3.34Å; L105-W107 PolarHBondContact O-N 3Å; W107-I109 PolarHBondContact O-N 3.12Å; W107-F110 WeakPolarHBondContact O-CB 3.45Å; W107-F110 PolarHBondContact O-N 3.39Å; W107-Y111 WeakPolarHBondContact O-CD2 3.3Å; W107-Y111 PolarHBondContact O-N 2.85Å; W107-W160 HydrophobicContact CB-CZ3 4.45Å; W107-W160 AromaticContact CD2-CH2 3.66Å; W107-W160 HydrophobicContact CD2-CH2 3.66Å; W107-W160 HydrophobicContact CD2-CZ3 4.2Å; W107-W160 AromaticContact CE2-CH2 3.98Å; W107-W160 AromaticContact CE3-CH2 3.68Å; W107-W160 HydrophobicContact CE3-CH2 3.68Å; W107-W160 HydrophobicContact CE3-CZ3 4.5Å; W107-W160 HydrophobicContact CG-CH2 4.14Å; W107-W160 HydrophobicContact CG-CZ3 4.18Å; W107-W160 HydrophobicContact CH2-CH2 4.33Å; W107-W160 HydrophobicContact CZ2-CH2 4.31Å; W107-W160 HydrophobicContact CZ3-CH2 4.03Å; W107-L165 HydrophobicContact CZ2-CD2 3.95Å; W107-P328 HydrophobicContact CZ3-CB 3.99Å; W107-P328 HydrophobicContact CZ3-CG 4.01Å; W107-F332 HydrophobicContact CB-CD1 4.33Å; W107-F332 HydrophobicContact CB-CE1 3.66Å; W107-F332 HydrophobicContact CB-CE2 4.15Å; W107-F332 HydrophobicContact CB-CZ 3.56Å; W107-F332 HydrophobicContact CE3-CD2 4.23Å; W107-F332 AromaticContact CE3-CE2 3.76Å; W107-F332 HydrophobicContact CE3-CE2 3.76Å; W107-F332 HydrophobicContact CE3-CZ 4.3Å; W107-M413 HydrophobicContact CH2-CE 4.25Å; W107-M413 HydrophobicContact CH2-SD 3.67Å; W107-M413 HydrophobicContact CZ2-SD 3.87Å; W107-F416 AromaticContact CH2-CD1 3.86Å; W107-F416 HydrophobicContact CH2-CD1 3.86Å; W107-F416 AromaticContact CH2-CD2 3.85Å; W107-F416 HydrophobicContact CH2-CD2 3.85Å; W107-F416 AromaticContact CH2-CE1 3.78Å; W107-F416 HydrophobicContact CH2-CE1 3.78Å; W107-F416 AromaticContact CH2-CE2 3.74Å; W107-F416 HydrophobicContact CH2-CE2 3.74Å; W107-F416 AromaticContact CH2-CG 3.91Å; W107-F416 HydrophobicContact CH2-CG 3.91Å; W107-F416 AromaticContact CH2-CZ 3.72Å; W107-F416 HydrophobicContact CH2-CZ 3.72Å; W107-F416 HydrophobicContact CZ2-CD2 4.37Å; W107-F416 HydrophobicContact CZ2-CG 4.48Å; W107-F416 HydrophobicContact CZ3-CE1 4.12Å; W107-F416 HydrophobicContact CZ3-CE2 4.04Å; W107-F416 AromaticContact CZ3-CZ 3.8Å; W107-F416 HydrophobicContact CZ3-CZ 3.8Å
108	G	96.4	Very high	95.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.5	-45.9	175.9	0	0	0	0	0	113	V104 L105 Y111 L112	V104-G108 PolarHBondContact O-N 3.12Å; L105-G108 PolarHBondContact O-N 3.39Å; G108-Y111 PolarHBondContact O-N 3.44Å; G108-L112 VanDerWaalsContact O-CB 3.27Å; G108-L112 WeakPolarHBondContact O-CB 3.46Å; G108-L112 PolarHBondContact O-N 3.06Å
109	I	97.9	Very high	94.9	Very high	25 Å²	25	42.6 Å²	42.6	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-41.4	176.6	-67.8	166.4	0	0	0	110.8	L105 A106 W107 L112 Y113 C184 V187 A188 M191 V357	L105-I109 WeakPolarHBondContact O-CG1 3.48Å; L105-I109 PolarHBondContact O-N 3.06Å; A106-I109 PolarHBondContact O-N 3.25Å; W107-I109 PolarHBondContact O-N 3.12Å; I109-L112 PolarHBondContact O-N 3.25Å; I109-Y113 PolarHBondContact O-N 3.41Å; I109-C184 HydrophobicContact CB-CB 4.27Å; I109-C184 HydrophobicContact CG2-CB 4.07Å; I109-V187 HydrophobicContact CD1-CB 4.44Å; I109-V187 HydrophobicContact CD1-CG1 4.14Å; I109-A188 HydrophobicContact CD1-CB 3.78Å; I109-M191 HydrophobicContact CD1-SD 4.41Å; I109-V357 HydrophobicContact CG1-CG1 4.35Å; I109-V357 HydrophobicContact CG1-CG2 3.83Å
110	F	97.6	Very high	94.7	Very high	5 Å²	5	42 Å²	42	2%	0.022	19%	0.188	C	C	.	.	H	α-helix	trans	-60.9	-48.7	177.5	-177.9	-93.8	0	0	0	111.6	A106 W107 Y113 Y114 F159 R163 A164 D180 M181	A106-F110 WeakPolarHBondContact O-CB 3.49Å; A106-F110 PolarHBondContact O-N 3.4Å; W107-F110 WeakPolarHBondContact O-CB 3.45Å; W107-F110 PolarHBondContact O-N 3.39Å; F110-Y113 WeakPolarHBondContact O-CB 3.42Å; F110-Y113 PolarHBondContact O-N 3.12Å; F110-Y114 HydrophobicContact CD1-CD2 4.12Å; F110-Y114 HydrophobicContact CD1-CE2 4.18Å; F110-Y114 HydrophobicContact CD2-CE2 4.25Å; F110-Y114 AromaticContact CE1-CD2 3.88Å; F110-Y114 HydrophobicContact CE1-CD2 3.88Å; F110-Y114 AromaticContact CE1-CE2 3.63Å; F110-Y114 HydrophobicContact CE1-CE2 3.63Å; F110-Y114 AromaticContact CE2-CE2 3.71Å; F110-Y114 HydrophobicContact CE2-CE2 3.71Å; F110-Y114 HydrophobicContact CG-CE2 4.48Å; F110-Y114 HydrophobicContact CZ-CD2 4.12Å; F110-Y114 AromaticContact CZ-CE2 3.38Å; F110-Y114 HydrophobicContact CZ-CE2 3.38Å; F110-Y114 VanDerWaalsContact O-CD2 3.3Å; F110-Y114 WeakPolarHBondContact O-CD2 3.4Å; F110-Y114 PolarHBondContact O-N 3Å; F110-F159 HydrophobicContact CD1-CZ 4.48Å; F110-F159 HydrophobicContact CE1-CE1 4.17Å; F110-F159 AromaticContact CE1-CZ 3.8Å; F110-F159 HydrophobicContact CE1-CZ 3.8Å; F110-R163 HydrophobicContact CZ-CG 4.36Å; F110-A164 HydrophobicContact CD1-CB 4.19Å; F110-A164 HydrophobicContact CE1-CB 3.75Å; F110-D180 HydrophobicContact CE2-CB 3.98Å; F110-M181 HydrophobicContact CB-CE 3.81Å; F110-M181 HydrophobicContact CB-SD 3.85Å; F110-M181 HydrophobicContact CD1-CE 3.91Å; F110-M181 HydrophobicContact CD2-CE 3.8Å; F110-M181 HydrophobicContact CD2-SD 4.32Å; F110-M181 HydrophobicContact CE1-CE 4.38Å; F110-M181 HydrophobicContact CE2-CE 4.28Å; F110-M181 HydrophobicContact CG-CE 3.57Å; F110-M181 HydrophobicContact CG-SD 4.19Å
111	Y	97.2	Very high	94.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.1	-35.3	176.5	-88.1	-104.3	0	0	0	112.7	W107 G108 Y113 Y114 S115 W122 F159 W160 A164 F332 P336 F353	W107-Y111 WeakPolarHBondContact O-CD2 3.3Å; W107-Y111 PolarHBondContact O-N 2.85Å; G108-Y111 PolarHBondContact O-N 3.44Å; Y111-Y113 VanDerWaalsContact C-N 3.34Å; Y111-Y113 PolarHBondContact O-N 2.9Å; Y111-Y114 PolarHBondContact O-N 3.22Å; Y111-S115 PolarHBondContact O-N 3.49Å; Y111-S115 PolarHBondContact O-OG 2.9Å; Y111-W122 AromaticContact CD1-CE3 3.94Å; Y111-W122 HydrophobicContact CD1-CE3 3.94Å; Y111-W122 AromaticContact CD1-CH2 3.89Å; Y111-W122 HydrophobicContact CD1-CH2 3.89Å; Y111-W122 HydrophobicContact CD1-CZ2 4.49Å; Y111-W122 AromaticContact CD1-CZ3 3.57Å; Y111-W122 HydrophobicContact CD1-CZ3 3.57Å; Y111-W122 HydrophobicContact CE1-CD2 4.46Å; Y111-W122 HydrophobicContact CE1-CE3 4.04Å; Y111-W122 HydrophobicContact CE1-CZ3 4.16Å; Y111-W122 HydrophobicContact CG-CZ3 4.35Å; Y111-F159 HydrophobicContact CD1-CE1 4.01Å; Y111-F159 HydrophobicContact CD2-CE1 4.31Å; Y111-F159 AromaticContact CE1-CD1 3.82Å; Y111-F159 HydrophobicContact CE1-CD1 3.82Å; Y111-F159 AromaticContact CE1-CE1 3.58Å; Y111-F159 HydrophobicContact CE1-CE1 3.58Å; Y111-F159 HydrophobicContact CE2-CD1 4.39Å; Y111-F159 AromaticContact CE2-CE1 3.87Å; Y111-F159 HydrophobicContact CE2-CE1 3.87Å; Y111-F159 HydrophobicContact CG-CE1 4.4Å; Y111-F159 AromaticContact CZ-CD1 3.67Å; Y111-F159 AromaticContact CZ-CE1 3.5Å; Y111-W160 AromaticContact CE2-CE3 3.85Å; Y111-W160 HydrophobicContact CE2-CE3 3.85Å; Y111-W160 AromaticContact CE2-CZ3 3.98Å; Y111-W160 HydrophobicContact CE2-CZ3 3.98Å; Y111-W160 AromaticContact CZ-CE3 3.99Å; Y111-W160 VanDerWaalsContact OH-CE3 3.27Å; Y111-A164 HydrophobicContact CE2-CB 4.21Å; Y111-F332 AromaticContact CD2-CD1 3.69Å; Y111-F332 HydrophobicContact CD2-CD1 3.69Å; Y111-F332 HydrophobicContact CD2-CE1 4.11Å; Y111-F332 HydrophobicContact CE1-CD1 4.48Å; Y111-F332 HydrophobicContact CE2-CB 4.3Å; Y111-F332 AromaticContact CE2-CD1 3.65Å; Y111-F332 HydrophobicContact CE2-CD1 3.65Å; Y111-F332 HydrophobicContact CE2-CE1 4.45Å; Y111-F332 HydrophobicContact CE2-CG 4.34Å; Y111-F332 HydrophobicContact CG-CD1 4.14Å; Y111-F332 PolarHBondContact OH-O 3.32Å; Y111-P336 HydrophobicContact CD1-CG 4.49Å; Y111-P336 HydrophobicContact CE1-CB 4.48Å; Y111-P336 HydrophobicContact CE1-CG 4.13Å; Y111-F353 VanDerWaalsContact CB-CE1 3.46Å; Y111-F353 VanDerWaalsContact CB-CZ 3.46Å; Y111-F353 AromaticContact CD1-CE1 3.84Å; Y111-F353 HydrophobicContact CD1-CE1 3.84Å; Y111-F353 AromaticContact CD1-CE2 3.66Å; Y111-F353 HydrophobicContact CD1-CE2 3.66Å; Y111-F353 AromaticContact CD1-CZ 3.17Å; Y111-F353 HydrophobicContact CD1-CZ 3.17Å; Y111-F353 HydrophobicContact CE1-CZ 4Å; Y111-F353 HydrophobicContact CG-CD1 4.38Å; Y111-F353 AromaticContact CG-CE1 3.73Å; Y111-F353 HydrophobicContact CG-CE1 3.73Å; Y111-F353 HydrophobicContact CG-CE2 4.07Å; Y111-F353 AromaticContact CG-CZ 3.55Å; Y111-F353 HydrophobicContact CG-CZ 3.55Å
112	L	96.7	Very high	94.7	Very high	30 Å²	30	40.7 Å²	40.7	16%	0.157	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-44	174.7	178.1	56.9	0	0	0	111.3	G108 I109 Y114 S115 F116 A350 F353 V354	G108-L112 VanDerWaalsContact O-CB 3.27Å; G108-L112 WeakPolarHBondContact O-CB 3.46Å; G108-L112 PolarHBondContact O-N 3.06Å; I109-L112 PolarHBondContact O-N 3.25Å; L112-Y114 VanDerWaalsContact C-N 3.31Å; L112-Y114 PolarHBondContact O-N 3.48Å; L112-S115 WeakPolarHBondContact O-CB 3.21Å; L112-S115 PolarHBondContact O-N 3.13Å; L112-F116 HydrophobicContact CD1-CE2 3.84Å; L112-F116 HydrophobicContact CD1-CZ 3.97Å; L112-F116 HydrophobicContact CG-CE2 3.96Å; L112-F116 HydrophobicContact CG-CZ 4.48Å; L112-F116 WeakPolarHBondContact O-CD2 3.5Å; L112-F116 WeakPolarHBondContact O-CE2 3.47Å; L112-A350 HydrophobicContact CD1-CB 4.29Å; L112-F353 HydrophobicContact CB-CB 3.96Å; L112-F353 HydrophobicContact CD1-CB 4.4Å; L112-V354 HydrophobicContact CD1-CG2 3.71Å; L112-V354 HydrophobicContact CD2-CG2 3.88Å; L112-V354 HydrophobicContact CG-CG2 4.47Å
113	Y	96.3	Very high	94.4	Very high	161 Å²	161	42.1 Å²	42.1	63%	0.631	19%	0.194	S	C	*	.	H	α-helix	trans	-55.9	-45.8	175.5	170.3	-101	0	0	0	112	I109 F110 Y111 S115 F116	I109-Y113 PolarHBondContact O-N 3.41Å; F110-Y113 WeakPolarHBondContact O-CB 3.42Å; F110-Y113 PolarHBondContact O-N 3.12Å; Y111-Y113 VanDerWaalsContact C-N 3.34Å; Y111-Y113 PolarHBondContact O-N 2.9Å; Y113-S115 VanDerWaalsContact C-N 3.26Å; Y113-S115 PolarHBondContact O-N 3.41Å; Y113-F116 PolarHBondContact O-N 3.03Å
114	Y	95.1	Very high	94	Very high	37 Å²	37	43.6 Å²	43.6	15%	0.145	21%	0.205	C	C	.	.	H	α-helix	trans	-74.3	-12.4	178.1	-79	-70.6	0	0	0	114.6	F110 Y111 L112 F116 P121 F159 R163	F110-Y114 HydrophobicContact CD1-CD2 4.12Å; F110-Y114 HydrophobicContact CD1-CE2 4.18Å; F110-Y114 HydrophobicContact CD2-CE2 4.25Å; F110-Y114 AromaticContact CE1-CD2 3.88Å; F110-Y114 HydrophobicContact CE1-CD2 3.88Å; F110-Y114 AromaticContact CE1-CE2 3.63Å; F110-Y114 HydrophobicContact CE1-CE2 3.63Å; F110-Y114 AromaticContact CE2-CE2 3.71Å; F110-Y114 HydrophobicContact CE2-CE2 3.71Å; F110-Y114 HydrophobicContact CG-CE2 4.48Å; F110-Y114 HydrophobicContact CZ-CD2 4.12Å; F110-Y114 AromaticContact CZ-CE2 3.38Å; F110-Y114 HydrophobicContact CZ-CE2 3.38Å; F110-Y114 VanDerWaalsContact O-CD2 3.3Å; F110-Y114 WeakPolarHBondContact O-CD2 3.4Å; F110-Y114 PolarHBondContact O-N 3Å; Y111-Y114 PolarHBondContact O-N 3.22Å; L112-Y114 VanDerWaalsContact C-N 3.31Å; L112-Y114 PolarHBondContact O-N 3.48Å; Y114-F116 PolarHBondContact O-N 2.88Å; Y114-P121 HydrophobicContact CD1-CB 4.35Å; Y114-P121 HydrophobicContact CD1-CG 3.44Å; Y114-P121 VanDerWaalsContact CD1-CG 3.44Å; Y114-P121 HydrophobicContact CE1-CG 4.26Å; Y114-P121 HydrophobicContact CG-CG 3.98Å; Y114-F159 HydrophobicContact CD2-CE2 4.45Å; Y114-F159 AromaticContact CD2-CZ 3.89Å; Y114-F159 HydrophobicContact CD2-CZ 3.89Å; Y114-F159 HydrophobicContact CE2-CZ 4.34Å; Y114-F159 HydrophobicContact CG-CZ 4.16Å; Y114-R163 PolarHBondContact OH-NE 2.81Å; Y114-R163 PolarHBondContact OH-NH2 3.3Å
115	S	95.8	Very high	93.7	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.8	176.5	-57.8	0	0	0	0	112.9	Y111 L112 Y113 S117	Y111-S115 PolarHBondContact O-N 3.49Å; Y111-S115 PolarHBondContact O-OG 2.9Å; L112-S115 WeakPolarHBondContact O-CB 3.21Å; L112-S115 PolarHBondContact O-N 3.13Å; Y113-S115 VanDerWaalsContact C-N 3.26Å; Y113-S115 PolarHBondContact O-N 3.41Å; S115-S117 PolarHBondContact O-N 2.95Å
116	F	93.9	Very high	93.4	Very high	155 Å²	155	51.6 Å²	51.6	68%	0.68	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	23	177.1	-64.6	-69.6	0	0	0	113.8	L112 Y113 Y114	L112-F116 HydrophobicContact CD1-CE2 3.84Å; L112-F116 HydrophobicContact CD1-CZ 3.97Å; L112-F116 HydrophobicContact CG-CE2 3.96Å; L112-F116 HydrophobicContact CG-CZ 4.48Å; L112-F116 WeakPolarHBondContact O-CD2 3.5Å; L112-F116 WeakPolarHBondContact O-CE2 3.47Å; Y113-F116 PolarHBondContact O-N 3.03Å; Y114-F116 PolarHBondContact O-N 2.88Å
117	S	90.3	Very high	93.2	Very high	53 Å²	53	53.7 Å²	53.7	37%	0.371	26%	0.261	S	S	.	.	S	Bend	trans	-110.5	145.4	173.9	-64.3	0	0	0	0	110.3	S115 D119 P346	S115-S117 PolarHBondContact O-N 2.95Å; S117-D119 WeakPolarHBondContact CB-O 3.44Å; S117-P346 WeakPolarHBondContact O-CB 3.45Å; S117-P346 WeakPolarHBondContact O-CG 3.38Å
118	W	87.2	Confident	93	Very high	226 Å²	226	60.2 Å²	60.2	86%	0.856	30%	0.301	S	S	*	.	S	Bend	trans	-63.4	-47.2	177.1	-74.8	116.8	0	0	0	112.2	P346	W118-P346 VanDerWaalsContact O-CG 3.25Å; W118-P346 WeakPolarHBondContact O-CG 3.27Å
119	D	88.4	Confident	92.8	Very high	134 Å²	134	62.3 Å²	62.3	72%	0.717	31%	0.309	S	S	*	.	S	Bend	trans	-94.4	118.7	169.9	-63.1	-51.6	0	0	0	108.4	S117	S117-D119 WeakPolarHBondContact CB-O 3.44Å
120	L	92.4	Very high	92.6	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.31	C	S	.	.			trans	-68.5	131.6	178.9	-68.6	176.6	0	0	0	109.3	W122 S123 V339 P346 A349	L120-W122 HydrophobicContact CB-CD2 4.37Å; L120-W122 HydrophobicContact CB-CZ2 4.24Å; L120-W122 HydrophobicContact CD1-CZ2 3.95Å; L120-W122 HydrophobicContact CD2-CH2 4.13Å; L120-W122 HydrophobicContact CD2-CZ2 3.7Å; L120-W122 HydrophobicContact CG-CZ2 4.18Å; L120-W122 PolarHBondContact O-N 3.48Å; L120-S123 WeakPolarHBondContact O-CB 3.19Å; L120-S123 PolarHBondContact O-N 2.96Å; L120-S123 PolarHBondContact O-OG 3.43Å; L120-V339 HydrophobicContact CD1-CG1 4.37Å; L120-P346 HydrophobicContact CD2-CB 4.43Å; L120-P346 HydrophobicContact CD2-CG 4.48Å; L120-A349 HydrophobicContact CD1-CB 4.11Å; L120-A349 HydrophobicContact CD2-CB 4.16Å
121	P	92.3	Very high	92.3	Very high	14 Å²	14	64 Å²	64	9%	0.091	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.9	-175.3	-22.3	30	0	0	0	114.3	Y114 N127 W129 F159	Y114-P121 HydrophobicContact CD1-CB 4.35Å; Y114-P121 HydrophobicContact CD1-CG 3.44Å; Y114-P121 VanDerWaalsContact CD1-CG 3.44Å; Y114-P121 HydrophobicContact CE1-CG 4.26Å; Y114-P121 HydrophobicContact CG-CG 3.98Å; P121-N127 PolarHBondContact O-ND2 3Å; P121-W129 HydrophobicContact CB-CH2 4.08Å; P121-W129 HydrophobicContact CB-CZ2 3.83Å; P121-F159 HydrophobicContact CB-CD2 4.14Å; P121-F159 HydrophobicContact CB-CE2 3.84Å
122	W	93.1	Very high	91.8	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	2.3	177.4	55.3	76.4	0	0	0	113.7	Y111 L120 V156 F159 P336 S340 A349 F353	Y111-W122 AromaticContact CD1-CE3 3.94Å; Y111-W122 HydrophobicContact CD1-CE3 3.94Å; Y111-W122 AromaticContact CD1-CH2 3.89Å; Y111-W122 HydrophobicContact CD1-CH2 3.89Å; Y111-W122 HydrophobicContact CD1-CZ2 4.49Å; Y111-W122 AromaticContact CD1-CZ3 3.57Å; Y111-W122 HydrophobicContact CD1-CZ3 3.57Å; Y111-W122 HydrophobicContact CE1-CD2 4.46Å; Y111-W122 HydrophobicContact CE1-CE3 4.04Å; Y111-W122 HydrophobicContact CE1-CZ3 4.16Å; Y111-W122 HydrophobicContact CG-CZ3 4.35Å; L120-W122 HydrophobicContact CB-CD2 4.37Å; L120-W122 HydrophobicContact CB-CZ2 4.24Å; L120-W122 HydrophobicContact CD1-CZ2 3.95Å; L120-W122 HydrophobicContact CD2-CH2 4.13Å; L120-W122 HydrophobicContact CD2-CZ2 3.7Å; L120-W122 HydrophobicContact CG-CZ2 4.18Å; L120-W122 PolarHBondContact O-N 3.48Å; W122-V156 HydrophobicContact CB-CB 4.39Å; W122-V156 HydrophobicContact CB-CG1 4.33Å; W122-V156 HydrophobicContact CB-CG2 4.11Å; W122-V156 WeakPolarHBondContact O-CG2 3.49Å; W122-F159 HydrophobicContact CB-CB 3.86Å; W122-F159 HydrophobicContact CB-CD1 4.18Å; W122-F159 HydrophobicContact CB-CD2 4.47Å; W122-F159 HydrophobicContact CB-CG 3.91Å; W122-F159 AromaticContact CE3-CD1 3.92Å; W122-F159 HydrophobicContact CE3-CD1 3.92Å; W122-F159 AromaticContact CE3-CE1 3.59Å; W122-F159 HydrophobicContact CE3-CE1 3.59Å; W122-F159 HydrophobicContact CE3-CE2 4.26Å; W122-F159 HydrophobicContact CE3-CG 4.39Å; W122-F159 AromaticContact CE3-CZ 3.77Å; W122-F159 HydrophobicContact CE3-CZ 3.77Å; W122-F159 HydrophobicContact CZ3-CE1 4.05Å; W122-F159 HydrophobicContact CZ3-CZ 4.08Å; W122-P336 HydrophobicContact CD2-CB 4.37Å; W122-P336 HydrophobicContact CG-CB 4.33Å; W122-P336 HydrophobicContact CZ2-CB 4.47Å; W122-P336 PolarHBondContact NE1-O 3.32Å; W122-S340 PolarHBondContact NE1-OG 2.81Å; W122-A349 HydrophobicContact CZ2-CB 4.01Å; W122-F353 HydrophobicContact CH2-CE2 4.03Å; W122-F353 HydrophobicContact CZ2-CE2 4.1Å
123	S	90.3	Very high	91.3	Very high	30 Å²	30	76.2 Å²	76.2	21%	0.21	38%	0.379	C	S	.	.	S	Bend	trans	-91.1	-12	177.6	73	0	0	0	0	114.1	L120	L120-S123 WeakPolarHBondContact O-CB 3.19Å; L120-S123 PolarHBondContact O-N 2.96Å; L120-S123 PolarHBondContact O-OG 3.43Å
124	S	88.4	Confident	90.9	Very high	31 Å²	31	69.3 Å²	69.3	22%	0.217	35%	0.354	C	S	.	.			trans	-132.6	158	-178.4	68.2	0	0	0	0	112.5	N126 N127 E136 P155	S124-N126 VanDerWaalsContact C-N 3.34Å; S124-N127 PolarHBondContact O-ND2 3.24Å; S124-E136 VanDerWaalsContact CA-OE1 3.23Å; S124-E136 WeakPolarHBondContact CA-OE1 3.41Å; S124-E136 VanDerWaalsContact CB-OE1 3.3Å; S124-E136 WeakPolarHBondContact CB-OE1 3.36Å; S124-P155 VanDerWaalsContact O-CB 3.3Å; S124-P155 WeakPolarHBondContact O-CB 3.31Å
125	C	88.8	Confident	90.3	Very high	29 Å²	29	69.4 Å²	69.4	20%	0.196	36%	0.358	C	S	.	.	S	Bend	trans	-92.1	6.7	174.8	-71.1	0	0	0	0	113.1	N127 N130 C134 V135 E136	C125-N127 VanDerWaalsContact C-N 3.34Å; C125-N127 PolarHBondContact O-N 3.25Å; C125-N130 WeakPolarHBondContact CA-OD1 3.28Å; C125-N130 VanDerWaalsContact O-CB 3.24Å; C125-N130 WeakPolarHBondContact O-CB 3.34Å; C125-N130 PolarHBondContact O-OD1 2.65Å; C125-C134 HydrophobicContact CB-CB 3.68Å; C125-C134 WeakPolarHBondContact CB-SG 3.21Å; C125-C134 WeakPolarHBondContact SG-CB 3.47Å; C125-C134 PolarHBondContact SG-O 3.11Å; C125-C134 CovalentContact SG-SG 2.04Å; C125-C134 PolarHBondContact SG-SG 3.5Å; C125-V135 PolarHBondContact SG-N 3.5Å; C125-V135 VanDerWaalsContact SG-N 3.42Å; C125-E136 HydrophobicContact CB-CG 4.28Å; C125-E136 PolarHBondContact N-OE1 3.44Å
126	N	89.6	Confident	89.6	Confident	147 Å²	147	71.7 Å²	71.7	79%	0.786	37%	0.369	S	S	*	.			trans	-94.8	51.9	-175.1	-168.7	24.5	0	0	0	112.3	S124	S124-N126 VanDerWaalsContact C-N 3.34Å
127	N	92.1	Very high	88.2	Confident	44 Å²	44	67.7 Å²	67.7	24%	0.235	35%	0.351	C	S	.	.	S	Bend	trans	-125.2	161.8	177.6	-52	-85.7	0	0	0	111.9	P121 S124 C125 W129 N130	P121-N127 PolarHBondContact O-ND2 3Å; S124-N127 PolarHBondContact O-ND2 3.24Å; C125-N127 VanDerWaalsContact C-N 3.34Å; C125-N127 PolarHBondContact O-N 3.25Å; N127-W129 HydrophobicContact CB-CD2 3.69Å; N127-W129 HydrophobicContact CB-CE3 4.05Å; N127-W129 HydrophobicContact CB-CG 4.3Å; N127-W129 HydrophobicContact CB-CH2 3.82Å; N127-W129 HydrophobicContact CB-CZ2 3.41Å; N127-W129 VanDerWaalsContact CB-CZ2 3.41Å; N127-W129 HydrophobicContact CB-CZ3 4.12Å; N127-W129 PolarHBondContact O-N 3Å; N127-W129 VanDerWaalsContact O-N 3.13Å; N127-W129 WeakPolarHBondContact OD1-CZ2 3.23Å; N127-N130 VanDerWaalsContact CB-OD1 3.23Å; N127-N130 WeakPolarHBondContact CB-OD1 3.31Å; N127-N130 PolarHBondContact N-OD1 3.02Å; N127-N130 PolarHBondContact ND2-OD1 3.43Å; N127-N130 PolarHBondContact O-N 3.33Å; N127-N130 VanDerWaalsContact O-N 3.11Å
128	T	93.1	Very high	86.7	Confident	140 Å²	140	70 Å²	70	86%	0.859	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.1	-177.4	61.2	0	0	0	0	114.4
129	W	92.9	Very high	85	Confident	44 Å²	44	68.6 Å²	68.6	17%	0.167	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-7.2	179	54	79.2	0	0	0	113.2	P121 N127 F159 R162 R163	P121-W129 HydrophobicContact CB-CH2 4.08Å; P121-W129 HydrophobicContact CB-CZ2 3.83Å; N127-W129 HydrophobicContact CB-CD2 3.69Å; N127-W129 HydrophobicContact CB-CE3 4.05Å; N127-W129 HydrophobicContact CB-CG 4.3Å; N127-W129 HydrophobicContact CB-CH2 3.82Å; N127-W129 HydrophobicContact CB-CZ2 3.41Å; N127-W129 VanDerWaalsContact CB-CZ2 3.41Å; N127-W129 HydrophobicContact CB-CZ3 4.12Å; N127-W129 PolarHBondContact O-N 3Å; N127-W129 VanDerWaalsContact O-N 3.13Å; N127-W129 WeakPolarHBondContact OD1-CZ2 3.23Å; W129-F159 AromaticContact CE2-CD2 3.91Å; W129-F159 AromaticContact CZ2-CD2 3.71Å; W129-F159 HydrophobicContact CZ2-CD2 3.71Å; W129-F159 HydrophobicContact CZ2-CE2 4.03Å; W129-F159 AromaticContact NE1-CD2 3.98Å; W129-R162 HydrophobicContact CB-CB 4.35Å; W129-R162 VanDerWaalsContact O-CD 3.25Å; W129-R162 WeakPolarHBondContact O-CD 3.27Å; W129-R163 HydrophobicContact CB-CB 4.2Å; W129-R163 HydrophobicContact CD2-CB 3.7Å; W129-R163 HydrophobicContact CD2-CG 3.87Å; W129-R163 HydrophobicContact CE3-CB 4.17Å; W129-R163 HydrophobicContact CE3-CG 3.87Å; W129-R163 HydrophobicContact CG-CB 3.72Å; W129-R163 HydrophobicContact CG-CG 4.41Å; W129-R163 HydrophobicContact CH2-CG 4.4Å; W129-R163 HydrophobicContact CZ2-CG 4.42Å; W129-R163 HydrophobicContact CZ3-CG 4.14Å
130	N	93.9	Very high	83.2	Confident	27 Å²	27	68.2 Å²	68.2	14%	0.144	34%	0.339	C	S	.	.			trans	-78.7	152.1	-177.3	-70.4	124.8	0	0	0	112.2	C125 N127 C134 E158	C125-N130 WeakPolarHBondContact CA-OD1 3.28Å; C125-N130 VanDerWaalsContact O-CB 3.24Å; C125-N130 WeakPolarHBondContact O-CB 3.34Å; C125-N130 PolarHBondContact O-OD1 2.65Å; N127-N130 VanDerWaalsContact CB-OD1 3.23Å; N127-N130 WeakPolarHBondContact CB-OD1 3.31Å; N127-N130 PolarHBondContact N-OD1 3.02Å; N127-N130 PolarHBondContact ND2-OD1 3.43Å; N127-N130 PolarHBondContact O-N 3.33Å; N127-N130 VanDerWaalsContact O-N 3.11Å; N130-C134 HydrophobicContact CB-CB 4.33Å; N130-E158 WeakPolarHBondContact CA-OE2 3.4Å; N130-E158 WeakPolarHBondContact CB-OE2 3.48Å; N130-E158 PolarHBondContact ND2-OE2 3.43Å
131	T	91.3	Very high	80.9	Confident	38 Å²	38	74.5 Å²	74.5	23%	0.233	37%	0.373	C	S	.	.			trans	-101.4	166.9	173.1	72.1	0	0	0	0	112.2	N133 C134 E158 R162	T131-N133 PolarHBondContact O-N 3.35Å; T131-N133 VanDerWaalsContact O-N 3.14Å; T131-N133 PolarHBondContact OG1-N 2.95Å; T131-C134 VanDerWaalsContact O-CB 3.24Å; T131-C134 WeakPolarHBondContact O-CB 3.34Å; T131-C134 PolarHBondContact O-N 2.88Å; T131-C134 VanDerWaalsContact O-N 3.08Å; T131-E158 PolarHBondContact N-OE2 2.85Å; T131-E158 PolarHBondContact OG1-OE1 2.88Å; T131-R162 VanDerWaalsContact CG2-NH1 3.31Å
132	E	86.8	Confident	78.8	Confident	202 Å²	202	79.1 Å²	79.1	94%	0.944	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.2	172.7	-62.2	-178.9	179.1	0	0	112.9	C134	E132-C134 VanDerWaalsContact C-N 3.33Å
133	N	86.2	Confident	76.4	Confident	85 Å²	85	83.9 Å²	83.9	46%	0.455	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.1	178.3	-62.5	-33.9	0	0	0	113.7	T131 T153	T131-N133 PolarHBondContact O-N 3.35Å; T131-N133 VanDerWaalsContact O-N 3.14Å; T131-N133 PolarHBondContact OG1-N 2.95Å; N133-T153 PolarHBondContact O-N 3.42Å; N133-T153 VanDerWaalsContact O-N 3.11Å; N133-T153 PolarHBondContact O-OG1 2.95Å
134	C	86.6	Confident	74.3	Confident	16 Å²	16	86.4 Å²	86.4	11%	0.108	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-71.8	128.2	178.3	-172.5	0	0	0	0	110.9	C125 N130 T131 E132 E158	C125-C134 HydrophobicContact CB-CB 3.68Å; C125-C134 WeakPolarHBondContact CB-SG 3.21Å; C125-C134 WeakPolarHBondContact SG-CB 3.47Å; C125-C134 PolarHBondContact SG-O 3.11Å; C125-C134 CovalentContact SG-SG 2.04Å; C125-C134 PolarHBondContact SG-SG 3.5Å; N130-C134 HydrophobicContact CB-CB 4.33Å; T131-C134 VanDerWaalsContact O-CB 3.24Å; T131-C134 WeakPolarHBondContact O-CB 3.34Å; T131-C134 PolarHBondContact O-N 2.88Å; T131-C134 VanDerWaalsContact O-N 3.08Å; E132-C134 VanDerWaalsContact C-N 3.33Å; C134-E158 WeakPolarHBondContact CB-OE2 3.19Å
135	V	83.9	Confident	72.1	Confident	39 Å²	39	89.9 Å²	89.9	24%	0.236	49%	0.49	C	S	.	.			trans	-124.5	129.1	-179.7	-175.3	0	0	0	0	111.7	C125 F137 T152 T153 P155	C125-V135 PolarHBondContact SG-N 3.5Å; C125-V135 VanDerWaalsContact SG-N 3.42Å; V135-F137 VanDerWaalsContact O-CD2 3.26Å; V135-F137 WeakPolarHBondContact O-CD2 3.48Å; V135-F137 PolarHBondContact O-N 3.29Å; V135-T152 HydrophobicContact CG2-CG2 3.85Å; V135-T153 PolarHBondContact N-O 2.94Å; V135-P155 VanDerWaalsContact O-CD 3.28Å; V135-P155 WeakPolarHBondContact O-CD 3.14Å
136	E	79.5	Confident	70	Confident	50 Å²	50	95.7 Å²	95.7	23%	0.234	52%	0.515	C	S	.	.			trans	-79.1	92.9	170.7	-67.4	-179.8	-175.2	0	0	110.3	S124 C125 Q138 R139	S124-E136 VanDerWaalsContact CA-OE1 3.23Å; S124-E136 WeakPolarHBondContact CA-OE1 3.41Å; S124-E136 VanDerWaalsContact CB-OE1 3.3Å; S124-E136 WeakPolarHBondContact CB-OE1 3.36Å; C125-E136 HydrophobicContact CB-CG 4.28Å; C125-E136 PolarHBondContact N-OE1 3.44Å; E136-Q138 PolarHBondContact O-N 3.09Å; E136-R139 PolarHBondContact O-N 2.88Å; E136-R139 IonicContact OE2-CZ 3.59Å; E136-R139 IonicContact OE2-NE 3.64Å; E136-R139 IonicContact OE2-NH1 2.81Å; E136-R139 PolarHBondContact OE2-NH1 3.46Å
137	F	65.6	Low	68	Low	71 Å²	71	97.6 Å²	97.6	31%	0.311	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-58.4	-18.5	-177.6	-69.1	-85.8	0	0	0	114.8	V135	V135-F137 VanDerWaalsContact O-CD2 3.26Å; V135-F137 WeakPolarHBondContact O-CD2 3.48Å; V135-F137 PolarHBondContact O-N 3.29Å
138	Q	57.5	Low	66.1	Low	103 Å²	103	99.3 Å²	99.3	48%	0.481	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-79	-18.9	-178.8	-74.1	176.8	-62.3	0	0	114.9	E136 M341	E136-Q138 PolarHBondContact O-N 3.09Å; Q138-M341 HydrophobicContact CG-CE 4.35Å; Q138-M341 HydrophobicContact CG-CG 4.47Å; Q138-M341 VanDerWaalsContact NE2-CA 3.34Å; Q138-M341 VanDerWaalsContact NE2-CG 3.35Å
139	R	52	Low	64.2	Low	195 Å²	195	98.4 Å²	98.4	74%	0.736	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-103.1	16.1	-172.4	-80.8	-175.9	175.1	153.8	-8.4	114.7	E136 N141	E136-R139 PolarHBondContact O-N 2.88Å; E136-R139 IonicContact OE2-CZ 3.59Å; E136-R139 IonicContact OE2-NE 3.64Å; E136-R139 IonicContact OE2-NH1 2.81Å; E136-R139 PolarHBondContact OE2-NH1 3.46Å; R139-N141 PolarHBondContact O-N 3.46Å
140	R	51.8	Low	62.6	Low	126 Å²	126	104.6 Å²	104.6	48%	0.475	56%	0.556	S	S	.	*			trans	-74.4	100.7	174.7	-81.8	-171.8	180	179	-0.7	110.6	A142	R140-A142 PolarHBondContact O-N 2.99Å
141	N	43.2	Very low	61.3	Low	133 Å²	133	109.3 Å²	109.3	71%	0.711	58%	0.581	S	S	*	*			trans	-60.3	129.5	150.1	-74.9	-21.1	0	0	0	107.2	R139 S143	R139-N141 PolarHBondContact O-N 3.46Å; N141-S143 PolarHBondContact O-N 3.45Å
142	A	48.8	Very low	60.6	Low	111 Å²	111	109.5 Å²	109.5	92%	0.917	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	10.4	-174.6	0	0	0	0	0	115.7	R140	R140-A142 PolarHBondContact O-N 2.99Å
143	S	42	Very low	60.4	Low	101 Å²	101	102 Å²	102	71%	0.706	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-3.8	-176	54.9	0	0	0	0	114.9	N141	N141-S143 PolarHBondContact O-N 3.45Å
144	V	46	Very low	60.5	Low	82 Å²	82	98.2 Å²	98.2	50%	0.497	53%	0.531	S	S	.	.			trans	-122.4	75.7	174.7	-169.7	0	0	0	0	109.2	E146	V144-E146 HydrophobicContact CG1-CB 3.83Å; V144-E146 HydrophobicContact CG1-CG 3.76Å; V144-E146 PolarHBondContact O-N 3.46Å; V144-E146 VanDerWaalsContact O-N 3.07Å
145	A	42.7	Very low	60.7	Low	104 Å²	104	98 Å²	98	86%	0.86	53%	0.529	S	S	*	.			trans	-76.5	56.6	158.7	0	0	0	0	0	109
146	E	45.5	Very low	61.1	Low	152 Å²	152	96.3 Å²	96.3	71%	0.71	52%	0.519	S	S	*	.			trans	-74.2	139.1	162.1	-87.5	-177.8	154.6	0	0	108.3	V144 V148	V144-E146 HydrophobicContact CG1-CB 3.83Å; V144-E146 HydrophobicContact CG1-CG 3.76Å; V144-E146 PolarHBondContact O-N 3.46Å; V144-E146 VanDerWaalsContact O-N 3.07Å; E146-V148 PolarHBondContact O-N 3Å; E146-V148 VanDerWaalsContact O-N 3.09Å
147	E	46.8	Very low	61.6	Low	186 Å²	186	96 Å²	96	87%	0.869	52%	0.518	S	S	*	.			trans	-37.9	113.7	177.5	-64	178.7	159.9	0	0	110.3	N149	E147-N149 VanDerWaalsContact C-N 3.32Å; E147-N149 PolarHBondContact O-N 3.15Å
148	V	51.2	Low	62.9	Low	81 Å²	81	92.7 Å²	92.7	49%	0.491	50%	0.503	S	S	.	.			trans	-62.9	102.5	171.3	179.1	0	0	0	0	106.1	E146 L150	E146-V148 PolarHBondContact O-N 3Å; E146-V148 VanDerWaalsContact O-N 3.09Å; V148-L150 PolarHBondContact O-N 2.89Å; V148-L150 VanDerWaalsContact O-N 3.14Å
149	N	54.1	Low	64.7	Low	120 Å²	120	87.8 Å²	87.8	64%	0.642	48%	0.481	S	S	*	.			trans	-50.8	124.7	165.8	-97.6	-36	0	0	0	107.3	E147 N151 T152	E147-N149 VanDerWaalsContact C-N 3.32Å; E147-N149 PolarHBondContact O-N 3.15Å; N149-N151 PolarHBondContact O-N 3.17Å; N149-T152 HydrophobicContact CB-CG2 4.16Å; N149-T152 WeakPolarHBondContact O-CG2 3.36Å; N149-T152 PolarHBondContact O-N 3.41Å; N149-T152 VanDerWaalsContact O-N 3.12Å; N149-T152 PolarHBondContact O-OG1 2.76Å
150	L	58.8	Low	66.7	Low	174 Å²	174	78.8 Å²	78.8	91%	0.911	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-12.6	-178.8	-78.8	151.5	0	0	0	113.3	V148	V148-L150 PolarHBondContact O-N 2.89Å; V148-L150 VanDerWaalsContact O-N 3.14Å
151	N	66.8	Low	68.7	Low	126 Å²	126	75.1 Å²	75.1	67%	0.674	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	19.9	-178.7	-68.8	-9.4	0	0	0	114.4	N149	N149-N151 PolarHBondContact O-N 3.17Å
152	T	76.7	Confident	71.1	Confident	43 Å²	43	75.1 Å²	75.1	26%	0.264	43%	0.425	S	S	.	.			trans	-78.4	139.3	177.8	46.2	0	0	0	0	112.2	V135 N149	V135-T152 HydrophobicContact CG2-CG2 3.85Å; N149-T152 HydrophobicContact CB-CG2 4.16Å; N149-T152 WeakPolarHBondContact O-CG2 3.36Å; N149-T152 PolarHBondContact O-N 3.41Å; N149-T152 VanDerWaalsContact O-N 3.12Å; N149-T152 PolarHBondContact O-OG1 2.76Å
153	T	83.7	Confident	73.3	Confident	44 Å²	44	71.3 Å²	71.3	27%	0.27	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-119.5	155.6	-177	49.3	0	0	0	0	111.3	N133 V135 E158	N133-T153 PolarHBondContact O-N 3.42Å; N133-T153 VanDerWaalsContact O-N 3.11Å; N133-T153 PolarHBondContact O-OG1 2.95Å; V135-T153 PolarHBondContact N-O 2.94Å; T153-E158 PolarHBondContact OG1-OE1 3.08Å
154	S	87.6	Confident	75.8	Confident	6 Å²	6	66.6 Å²	66.6	4%	0.042	35%	0.354	C	S	.	.			trans	-92.9	152	175.7	75.8	0	0	0	0	111.7	V156 M157 E158	S154-V156 PolarHBondContact O-N 3.25Å; S154-M157 WeakPolarHBondContact O-CB 3.37Å; S154-M157 PolarHBondContact O-N 3.02Å; S154-M157 VanDerWaalsContact O-N 3.12Å; S154-M157 WeakPolarHBondContact OG-CB 3.4Å; S154-M157 VanDerWaalsContact OG-CG 3.23Å; S154-M157 WeakPolarHBondContact OG-CG 2.92Å; S154-M157 PolarHBondContact OG-N 2.63Å; S154-E158 PolarHBondContact O-N 2.82Å
155	P	91.3	Very high	78.1	Confident	11 Å²	11	63.4 Å²	63.4	7%	0.071	33%	0.334	C	S	.	.	H	α-helix	trans	-59.5	-31.4	179	22.5	-34.1	0	0	0	112.7	S124 V135 F159	S124-P155 VanDerWaalsContact O-CB 3.3Å; S124-P155 WeakPolarHBondContact O-CB 3.31Å; V135-P155 VanDerWaalsContact O-CD 3.28Å; V135-P155 WeakPolarHBondContact O-CD 3.14Å; P155-F159 WeakPolarHBondContact O-CB 3.38Å; P155-F159 PolarHBondContact O-N 3.29Å
156	V	91.4	Very high	80.6	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.024	31%	0.308	C	S	.	.	H	α-helix	trans	-72.1	-41.1	177.4	-168.9	0	0	0	0	111.9	W122 S154 F159 W160 I333 P336 R337	W122-V156 HydrophobicContact CB-CB 4.39Å; W122-V156 HydrophobicContact CB-CG1 4.33Å; W122-V156 HydrophobicContact CB-CG2 4.11Å; W122-V156 WeakPolarHBondContact O-CG2 3.49Å; S154-V156 PolarHBondContact O-N 3.25Å; V156-F159 PolarHBondContact O-N 3.45Å; V156-W160 PolarHBondContact O-N 2.88Å; V156-I333 HydrophobicContact CG1-CG2 4.31Å; V156-I333 WeakPolarHBondContact CG1-O 3.4Å; V156-P336 HydrophobicContact CG1-CB 4.23Å; V156-R337 HydrophobicContact CB-CB 4.43Å; V156-R337 HydrophobicContact CG2-CB 3.84Å; V156-R337 HydrophobicContact CG2-CG 4.21Å
157	M	89.4	Confident	82.8	Confident	42 Å²	42	57.2 Å²	57.2	21%	0.207	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-46.8	173.6	-75.1	-64	-62.4	0	0	110.8	S154 F159 W160 E161 I333	S154-M157 WeakPolarHBondContact O-CB 3.37Å; S154-M157 PolarHBondContact O-N 3.02Å; S154-M157 VanDerWaalsContact O-N 3.12Å; S154-M157 WeakPolarHBondContact OG-CB 3.4Å; S154-M157 VanDerWaalsContact OG-CG 3.23Å; S154-M157 WeakPolarHBondContact OG-CG 2.92Å; S154-M157 PolarHBondContact OG-N 2.63Å; M157-F159 PolarHBondContact O-N 3.05Å; M157-W160 PolarHBondContact O-N 2.67Å; M157-E161 WeakPolarHBondContact CE-OE1 3.25Å; M157-E161 WeakPolarHBondContact O-CB 3.17Å; M157-E161 PolarHBondContact O-N 3.3Å; M157-I333 HydrophobicContact CE-CD1 4.35Å; M157-I333 HydrophobicContact CG-CG2 4.1Å; M157-I333 HydrophobicContact SD-CB 4.39Å; M157-I333 HydrophobicContact SD-CD1 3.61Å; M157-I333 HydrophobicContact SD-CG1 4.27Å; M157-I333 HydrophobicContact SD-CG2 3.36Å; M157-I333 WeakPolarHBondContact SD-CG2 3.18Å
158	E	93.1	Very high	85.1	Confident	3 Å²	3	49.1 Å²	49.1	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-67.4	-35.5	178.7	-67.8	-162.4	162.1	0	0	112.6	N130 T131 C134 T153 S154 R162 R163	N130-E158 WeakPolarHBondContact CA-OE2 3.4Å; N130-E158 WeakPolarHBondContact CB-OE2 3.48Å; N130-E158 PolarHBondContact ND2-OE2 3.43Å; T131-E158 PolarHBondContact N-OE2 2.85Å; T131-E158 PolarHBondContact OG1-OE1 2.88Å; C134-E158 WeakPolarHBondContact CB-OE2 3.19Å; T153-E158 PolarHBondContact OG1-OE1 3.08Å; S154-E158 PolarHBondContact O-N 2.82Å; E158-R162 WeakPolarHBondContact O-CA 3.38Å; E158-R162 WeakPolarHBondContact O-CB 3.44Å; E158-R162 PolarHBondContact O-N 3.41Å; E158-R163 PolarHBondContact O-N 2.88Å
159	F	95.1	Very high	87	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-60.4	-46	171.9	-177.7	-95.2	0	0	0	111.3	F110 Y111 Y114 P121 W122 W129 P155 V156 M157 R163 A164	F110-F159 HydrophobicContact CD1-CZ 4.48Å; F110-F159 HydrophobicContact CE1-CE1 4.17Å; F110-F159 AromaticContact CE1-CZ 3.8Å; F110-F159 HydrophobicContact CE1-CZ 3.8Å; Y111-F159 HydrophobicContact CD1-CE1 4.01Å; Y111-F159 HydrophobicContact CD2-CE1 4.31Å; Y111-F159 AromaticContact CE1-CD1 3.82Å; Y111-F159 HydrophobicContact CE1-CD1 3.82Å; Y111-F159 AromaticContact CE1-CE1 3.58Å; Y111-F159 HydrophobicContact CE1-CE1 3.58Å; Y111-F159 HydrophobicContact CE2-CD1 4.39Å; Y111-F159 AromaticContact CE2-CE1 3.87Å; Y111-F159 HydrophobicContact CE2-CE1 3.87Å; Y111-F159 HydrophobicContact CG-CE1 4.4Å; Y111-F159 AromaticContact CZ-CD1 3.67Å; Y111-F159 AromaticContact CZ-CE1 3.5Å; Y114-F159 HydrophobicContact CD2-CE2 4.45Å; Y114-F159 AromaticContact CD2-CZ 3.89Å; Y114-F159 HydrophobicContact CD2-CZ 3.89Å; Y114-F159 HydrophobicContact CE2-CZ 4.34Å; Y114-F159 HydrophobicContact CG-CZ 4.16Å; P121-F159 HydrophobicContact CB-CD2 4.14Å; P121-F159 HydrophobicContact CB-CE2 3.84Å; W122-F159 HydrophobicContact CB-CB 3.86Å; W122-F159 HydrophobicContact CB-CD1 4.18Å; W122-F159 HydrophobicContact CB-CD2 4.47Å; W122-F159 HydrophobicContact CB-CG 3.91Å; W122-F159 AromaticContact CE3-CD1 3.92Å; W122-F159 HydrophobicContact CE3-CD1 3.92Å; W122-F159 AromaticContact CE3-CE1 3.59Å; W122-F159 HydrophobicContact CE3-CE1 3.59Å; W122-F159 HydrophobicContact CE3-CE2 4.26Å; W122-F159 HydrophobicContact CE3-CG 4.39Å; W122-F159 AromaticContact CE3-CZ 3.77Å; W122-F159 HydrophobicContact CE3-CZ 3.77Å; W122-F159 HydrophobicContact CZ3-CE1 4.05Å; W122-F159 HydrophobicContact CZ3-CZ 4.08Å; W129-F159 AromaticContact CE2-CD2 3.91Å; W129-F159 AromaticContact CZ2-CD2 3.71Å; W129-F159 HydrophobicContact CZ2-CD2 3.71Å; W129-F159 HydrophobicContact CZ2-CE2 4.03Å; W129-F159 AromaticContact NE1-CD2 3.98Å; P155-F159 WeakPolarHBondContact O-CB 3.38Å; P155-F159 PolarHBondContact O-N 3.29Å; V156-F159 PolarHBondContact O-N 3.45Å; M157-F159 PolarHBondContact O-N 3.05Å; F159-R163 HydrophobicContact CD2-CB 4.09Å; F159-R163 HydrophobicContact CD2-CG 4.06Å; F159-R163 HydrophobicContact CE2-CB 4.37Å; F159-R163 HydrophobicContact CE2-CG 3.85Å; F159-R163 WeakPolarHBondContact O-CA 3.07Å; F159-R163 WeakPolarHBondContact O-CB 3.22Å; F159-R163 PolarHBondContact O-N 3.35Å; F159-R163 VanDerWaalsContact O-N 3.15Å; F159-A164 PolarHBondContact O-N 2.95Å
160	W	94.6	Very high	88.8	Confident	5 Å²	5	43.7 Å²	43.7	2%	0.019	22%	0.224	C	C	.	.	I	π-helix	trans	-64.1	-54.9	178.2	177	-114.2	0	0	0	112.2	W107 Y111 V156 M157 A164 L165 P328 F332 I333	W107-W160 HydrophobicContact CB-CZ3 4.45Å; W107-W160 AromaticContact CD2-CH2 3.66Å; W107-W160 HydrophobicContact CD2-CH2 3.66Å; W107-W160 HydrophobicContact CD2-CZ3 4.2Å; W107-W160 AromaticContact CE2-CH2 3.98Å; W107-W160 AromaticContact CE3-CH2 3.68Å; W107-W160 HydrophobicContact CE3-CH2 3.68Å; W107-W160 HydrophobicContact CE3-CZ3 4.5Å; W107-W160 HydrophobicContact CG-CH2 4.14Å; W107-W160 HydrophobicContact CG-CZ3 4.18Å; W107-W160 HydrophobicContact CH2-CH2 4.33Å; W107-W160 HydrophobicContact CZ2-CH2 4.31Å; W107-W160 HydrophobicContact CZ3-CH2 4.03Å; Y111-W160 AromaticContact CE2-CE3 3.85Å; Y111-W160 HydrophobicContact CE2-CE3 3.85Å; Y111-W160 AromaticContact CE2-CZ3 3.98Å; Y111-W160 HydrophobicContact CE2-CZ3 3.98Å; Y111-W160 AromaticContact CZ-CE3 3.99Å; Y111-W160 VanDerWaalsContact OH-CE3 3.27Å; V156-W160 PolarHBondContact O-N 2.88Å; M157-W160 PolarHBondContact O-N 2.67Å; W160-A164 HydrophobicContact CE3-CB 4.11Å; W160-L165 HydrophobicContact CD2-CD1 4.05Å; W160-L165 HydrophobicContact CD2-CG 4.14Å; W160-L165 VanDerWaalsContact CE2-CD1 3.44Å; W160-L165 HydrophobicContact CE3-CG 4.37Å; W160-L165 HydrophobicContact CG-CD1 4.45Å; W160-L165 HydrophobicContact CH2-CD1 4.42Å; W160-L165 HydrophobicContact CH2-CD2 4.1Å; W160-L165 HydrophobicContact CH2-CG 4.36Å; W160-L165 HydrophobicContact CZ2-CD1 3.67Å; W160-L165 HydrophobicContact CZ2-CD2 4.13Å; W160-L165 HydrophobicContact CZ2-CG 4.08Å; W160-L165 HydrophobicContact CZ3-CD2 4.43Å; W160-L165 HydrophobicContact CZ3-CG 4.5Å; W160-L165 WeakPolarHBondContact O-CB 3.17Å; W160-L165 WeakPolarHBondContact O-CG 3.44Å; W160-L165 PolarHBondContact O-N 3.15Å; W160-P328 HydrophobicContact CZ2-CB 4.27Å; W160-F332 HydrophobicContact CD2-CB 4.15Å; W160-F332 HydrophobicContact CE3-CB 3.63Å; W160-F332 HydrophobicContact CE3-CG 4.23Å; W160-F332 HydrophobicContact CH2-CB 3.96Å; W160-F332 AromaticContact CH2-CD2 3.84Å; W160-F332 HydrophobicContact CH2-CD2 3.84Å; W160-F332 AromaticContact CH2-CG 3.94Å; W160-F332 HydrophobicContact CH2-CG 3.94Å; W160-F332 HydrophobicContact CZ2-CB 4.47Å; W160-F332 HydrophobicContact CZ3-CB 3.51Å; W160-F332 HydrophobicContact CZ3-CD1 4.11Å; W160-F332 AromaticContact CZ3-CD2 3.99Å; W160-F332 HydrophobicContact CZ3-CD2 3.99Å; W160-F332 AromaticContact CZ3-CG 3.61Å; W160-F332 HydrophobicContact CZ3-CG 3.61Å; W160-I333 HydrophobicContact CB-CD1 4.48Å; W160-I333 HydrophobicContact CB-CG1 4.1Å; W160-I333 HydrophobicContact CG-CD1 4.04Å; W160-I333 HydrophobicContact CG-CG1 3.93Å
161	E	93.3	Very high	90.5	Very high	49 Å²	49	35.8 Å²	35.8	23%	0.229	18%	0.183	C	C	.	.	I	π-helix	trans	-74.9	-43.1	-172.7	-68.1	-177	166.3	0	0	112.5	M157 R166 I167	M157-E161 WeakPolarHBondContact CE-OE1 3.25Å; M157-E161 WeakPolarHBondContact O-CB 3.17Å; M157-E161 PolarHBondContact O-N 3.3Å; E161-R166 CarbonylContact O-C 3.4Å; E161-R166 VanDerWaalsContact O-CA 3.24Å; E161-R166 WeakPolarHBondContact O-CA 3.37Å; E161-R166 PolarHBondContact O-N 3.12Å; E161-I167 HydrophobicContact CB-CG2 3.88Å; E161-I167 HydrophobicContact CG-CG2 4.28Å; E161-I167 PolarHBondContact O-N 3.4Å
162	R	94.3	Very high	91.7	Very high	134 Å²	134	34.9 Å²	34.9	51%	0.506	18%	0.178	S	C	.	.	I	π-helix	trans	-96.8	-31.3	-171.2	-58.6	179.6	165.4	-102.6	-6.3	113.9	W129 T131 E158 R166	W129-R162 HydrophobicContact CB-CB 4.35Å; W129-R162 VanDerWaalsContact O-CD 3.25Å; W129-R162 WeakPolarHBondContact O-CD 3.27Å; T131-R162 VanDerWaalsContact CG2-NH1 3.31Å; E158-R162 WeakPolarHBondContact O-CA 3.38Å; E158-R162 WeakPolarHBondContact O-CB 3.44Å; E158-R162 PolarHBondContact O-N 3.41Å; R162-R166 WeakPolarHBondContact O-CG 3.36Å
163	R	95	Very high	92.5	Very high	31 Å²	31	38.3 Å²	38.3	12%	0.117	19%	0.191	C	C	.	.	I	π-helix	trans	-99.8	-49.7	-178	176.6	58.4	-169.7	114.5	-15	113.5	F110 Y114 W129 E158 F159 D180	F110-R163 HydrophobicContact CZ-CG 4.36Å; Y114-R163 PolarHBondContact OH-NE 2.81Å; Y114-R163 PolarHBondContact OH-NH2 3.3Å; W129-R163 HydrophobicContact CB-CB 4.2Å; W129-R163 HydrophobicContact CD2-CB 3.7Å; W129-R163 HydrophobicContact CD2-CG 3.87Å; W129-R163 HydrophobicContact CE3-CB 4.17Å; W129-R163 HydrophobicContact CE3-CG 3.87Å; W129-R163 HydrophobicContact CG-CB 3.72Å; W129-R163 HydrophobicContact CG-CG 4.41Å; W129-R163 HydrophobicContact CH2-CG 4.4Å; W129-R163 HydrophobicContact CZ2-CG 4.42Å; W129-R163 HydrophobicContact CZ3-CG 4.14Å; E158-R163 PolarHBondContact O-N 2.88Å; F159-R163 HydrophobicContact CD2-CB 4.09Å; F159-R163 HydrophobicContact CD2-CG 4.06Å; F159-R163 HydrophobicContact CE2-CB 4.37Å; F159-R163 HydrophobicContact CE2-CG 3.85Å; F159-R163 WeakPolarHBondContact O-CA 3.07Å; F159-R163 WeakPolarHBondContact O-CB 3.22Å; F159-R163 PolarHBondContact O-N 3.35Å; F159-R163 VanDerWaalsContact O-N 3.15Å; R163-D180 IonicContact CZ-OD2 2.95Å; R163-D180 IonicContact NH1-OD2 3.92Å; R163-D180 PolarHBondContact NH1-OD2 2.84Å; R163-D180 IonicContact NH2-OD2 2.67Å; R163-D180 PolarHBondContact NH2-OD2 2.55Å
164	A	94.6	Very high	92.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	19%	0.19	C	C	.	.	I	π-helix	trans	-77.5	-54.1	-176.2	0	0	0	0	0	111.3	F110 Y111 F159 W160 N178 M181	F110-A164 HydrophobicContact CD1-CB 4.19Å; F110-A164 HydrophobicContact CE1-CB 3.75Å; Y111-A164 HydrophobicContact CE2-CB 4.21Å; F159-A164 PolarHBondContact O-N 2.95Å; W160-A164 HydrophobicContact CE3-CB 4.11Å; A164-N178 PolarHBondContact O-ND2 3.24Å; A164-M181 HydrophobicContact CB-CE 4.44Å; A164-M181 WeakPolarHBondContact O-CE 3.47Å
165	L	94	Very high	93.2	Very high	15 Å²	15	40.5 Å²	40.5	8%	0.079	21%	0.21	C	C	.	.	I	π-helix	trans	-87.1	-37	-179.5	-64.3	-176.9	0	0	0	113.4	W107 W160 I167 M413	W107-L165 HydrophobicContact CZ2-CD2 3.95Å; W160-L165 HydrophobicContact CD2-CD1 4.05Å; W160-L165 HydrophobicContact CD2-CG 4.14Å; W160-L165 VanDerWaalsContact CE2-CD1 3.44Å; W160-L165 HydrophobicContact CE3-CG 4.37Å; W160-L165 HydrophobicContact CG-CD1 4.45Å; W160-L165 HydrophobicContact CH2-CD1 4.42Å; W160-L165 HydrophobicContact CH2-CD2 4.1Å; W160-L165 HydrophobicContact CH2-CG 4.36Å; W160-L165 HydrophobicContact CZ2-CD1 3.67Å; W160-L165 HydrophobicContact CZ2-CD2 4.13Å; W160-L165 HydrophobicContact CZ2-CG 4.08Å; W160-L165 HydrophobicContact CZ3-CD2 4.43Å; W160-L165 HydrophobicContact CZ3-CG 4.5Å; W160-L165 WeakPolarHBondContact O-CB 3.17Å; W160-L165 WeakPolarHBondContact O-CG 3.44Å; W160-L165 PolarHBondContact O-N 3.15Å; L165-I167 VanDerWaalsContact C-N 3.27Å; L165-I167 HydrophobicContact CB-CB 4.21Å; L165-M413 HydrophobicContact CD1-CB 4.2Å; L165-M413 HydrophobicContact CD1-CG 3.97Å; L165-M413 HydrophobicContact CD1-SD 4.1Å; L165-M413 HydrophobicContact CD2-SD 4.43Å
166	R	94.9	Very high	93.4	Very high	86 Å²	86	42.8 Å²	42.8	33%	0.325	23%	0.226	S	C	.	.			trans	54.1	46.7	-166.1	-58	178.6	-176.8	-179.7	4.7	110.8	E161 R162 S168 D180 E410	E161-R166 CarbonylContact O-C 3.4Å; E161-R166 VanDerWaalsContact O-CA 3.24Å; E161-R166 WeakPolarHBondContact O-CA 3.37Å; E161-R166 PolarHBondContact O-N 3.12Å; R162-R166 WeakPolarHBondContact O-CG 3.36Å; R166-S168 PolarHBondContact O-N 2.68Å; R166-D180 IonicContact NH2-OD2 3.86Å; R166-D180 PolarHBondContact NH2-OD2 3.43Å; R166-E410 HydrophobicContact CB-CG 4.06Å; R166-E410 VanDerWaalsContact O-CA 3.31Å; R166-E410 WeakPolarHBondContact O-CA 3.39Å; R166-E410 WeakPolarHBondContact O-CB 3.08Å; R166-E410 WeakPolarHBondContact O-CG 3.39Å
167	I	93.1	Very high	93.7	Very high	40 Å²	40	44.4 Å²	44.4	21%	0.205	23%	0.234	C	C	.	.			trans	-62.8	131.9	-166.7	-163.5	167.2	0	0	0	111.9	E161 L165 E410 M413 Y414 Y493	E161-I167 HydrophobicContact CB-CG2 3.88Å; E161-I167 HydrophobicContact CG-CG2 4.28Å; E161-I167 PolarHBondContact O-N 3.4Å; L165-I167 VanDerWaalsContact C-N 3.27Å; L165-I167 HydrophobicContact CB-CB 4.21Å; I167-E410 WeakPolarHBondContact CA-O 3.19Å; I167-M413 HydrophobicContact CD1-CB 3.96Å; I167-M413 HydrophobicContact CD1-CG 4.16Å; I167-M413 HydrophobicContact CG1-CB 4.45Å; I167-Y414 HydrophobicContact CD1-CE2 4.49Å; I167-Y414 HydrophobicContact CG1-CE2 4.23Å; I167-Y493 HydrophobicContact CD1-CD1 4.5Å; I167-Y493 HydrophobicContact CD1-CE1 3.49Å; I167-Y493 VanDerWaalsContact CD1-CE1 3.49Å; I167-Y493 WeakPolarHBondContact CD1-OH 3.23Å
168	S	94.4	Very high	94	Very high	17 Å²	17	42.6 Å²	42.6	12%	0.119	23%	0.226	C	C	.	.			trans	-81.2	175.7	174.2	73.6	0	0	0	0	111.7	R166 G170 Q173 E410 G411 Y414	R166-S168 PolarHBondContact O-N 2.68Å; S168-G170 PolarHBondContact O-N 3.2Å; S168-G170 PolarHBondContact OG-O 3.39Å; S168-Q173 WeakPolarHBondContact CB-O 3.39Å; S168-Q173 PolarHBondContact OG-O 3.4Å; S168-E410 PolarHBondContact N-O 3.02Å; S168-G411 VanDerWaalsContact OG-CA 3.31Å; S168-G411 WeakPolarHBondContact OG-CA 3.09Å; S168-Y414 PolarHBondContact O-OH 3Å
169	S	91.3	Very high	94.1	Very high	82 Å²	82	51.4 Å²	51.4	57%	0.573	26%	0.259	S	S	*	.	S	Bend	trans	-72.3	-13.4	179.4	64.1	0	0	0	0	114.3	Q173 Y497	S169-Q173 PolarHBondContact OG-OE1 3.39Å; S169-Y497 WeakPolarHBondContact O-CE2 3.49Å
170	G	91.8	Very high	94.2	Very high	5 Å²	5	54.5 Å²	54.5	5%	0.052	28%	0.275	C	S	.	.	S	Bend	trans	177.1	167.7	-176.1	0	0	0	0	0	113.9	S168 D172 Q173	S168-G170 PolarHBondContact O-N 3.2Å; S168-G170 PolarHBondContact OG-O 3.39Å; G170-D172 PolarHBondContact O-N 2.9Å; G170-Q173 PolarHBondContact O-N 3.25Å
171	I	93.4	Very high	94.2	Very high	7 Å²	7	54.3 Å²	54.3	4%	0.036	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.4	-177.1	-162.5	177.5	0	0	0	113.8	Q173 Y414 V415 L418 Y497 Y499 P500 W502	I171-Q173 PolarHBondContact O-N 2.89Å; I171-Y414 HydrophobicContact CB-CD2 4.36Å; I171-Y414 HydrophobicContact CB-CG 4.21Å; I171-V415 HydrophobicContact CD1-CG2 4.15Å; I171-V415 HydrophobicContact CG1-CG2 4.15Å; I171-L418 HydrophobicContact CD1-CD1 3.52Å; I171-Y497 WeakPolarHBondContact CG2-OH 3.42Å; I171-Y497 PolarHBondContact N-OH 2.83Å; I171-Y497 VanDerWaalsContact N-OH 3.11Å; I171-Y499 HydrophobicContact CD1-CD1 4.46Å; I171-Y499 HydrophobicContact CD1-CE1 4.37Å; I171-P500 HydrophobicContact CG2-CG 3.76Å; I171-W502 HydrophobicContact CB-CH2 4.24Å; I171-W502 HydrophobicContact CD1-CH2 3.84Å; I171-W502 HydrophobicContact CD1-CZ3 4.04Å; I171-W502 HydrophobicContact CG1-CH2 3.81Å; I171-W502 HydrophobicContact CG1-CZ3 4.48Å; I171-W502 HydrophobicContact CG2-CH2 3.58Å; I171-W502 HydrophobicContact CG2-CZ2 3.6Å; I171-W502 HydrophobicContact CG2-CZ3 4.49Å
172	D	92.4	Very high	94.4	Very high	107 Å²	107	52.3 Å²	52.3	57%	0.572	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-20.1	174.3	-55.6	-80.5	0	0	0	112.5	G170 W502	G170-D172 PolarHBondContact O-N 2.9Å; D172-W502 WeakPolarHBondContact OD1-CZ2 3.47Å; D172-W502 PolarHBondContact OD1-NE1 3.4Å
173	Q	93.4	Very high	94.6	Very high	116 Å²	116	51.1 Å²	51.1	54%	0.542	27%	0.27	S	S	.	.			trans	-110.8	80.2	179.5	-64.3	-176.1	5.4	0	0	109.7	S168 S169 G170 I171 G175	S168-Q173 WeakPolarHBondContact CB-O 3.39Å; S168-Q173 PolarHBondContact OG-O 3.4Å; S169-Q173 PolarHBondContact OG-OE1 3.39Å; G170-Q173 PolarHBondContact O-N 3.25Å; I171-Q173 PolarHBondContact O-N 2.89Å; Q173-G175 VanDerWaalsContact C-N 3.26Å; Q173-G175 PolarHBondContact O-N 3.33Å
174	M	91.9	Very high	94.8	Very high	51 Å²	51	50.4 Å²	50.4	25%	0.251	27%	0.269	S	S	.	.			trans	-66.6	-27.3	-179.2	-70.3	-65	-78.8	0	0	113.1	I406 M409 E410 G411 V415	M174-I406 HydrophobicContact CE-CG2 3.57Å; M174-I406 WeakPolarHBondContact CE-O 3.2Å; M174-M409 HydrophobicContact CB-CE 3.94Å; M174-M409 HydrophobicContact CB-SD 4.19Å; M174-M409 HydrophobicContact CE-CB 4.36Å; M174-M409 HydrophobicContact CE-SD 3.94Å; M174-M409 VanDerWaalsContact O-CB 3.23Å; M174-M409 WeakPolarHBondContact O-CB 3.46Å; M174-E410 PolarHBondContact O-N 2.84Å; M174-G411 PolarHBondContact O-N 2.97Å; M174-V415 HydrophobicContact CE-CG2 3.83Å; M174-V415 HydrophobicContact SD-CG2 4.02Å
175	G	94.1	Very high	94.9	Very high	45 Å²	45	50.3 Å²	50.3	46%	0.464	27%	0.269	S	S	.	.			trans	67.5	-151.5	173.4	0	0	0	0	0	114.1	Q173 M409 E410	Q173-G175 VanDerWaalsContact C-N 3.26Å; Q173-G175 PolarHBondContact O-N 3.33Å; G175-M409 WeakPolarHBondContact O-CE 3.37Å; G175-E410 WeakPolarHBondContact CA-OE2 3.15Å
176	S	95.9	Very high	95.1	Very high	58 Å²	58	53.4 Å²	53.4	41%	0.406	29%	0.285	S	S	.	.			trans	-92.8	160.3	-179	76.6	0	0	0	0	113.1	M409 E410	S176-M409 WeakPolarHBondContact O-CA 3.09Å; S176-E410 WeakPolarHBondContact CB-OE1 3.29Å; S176-E410 VanDerWaalsContact N-CD 3.34Å; S176-E410 PolarHBondContact N-OE1 3.17Å; S176-E410 PolarHBondContact O-N 2.85Å; S176-E410 PolarHBondContact OG-OE1 3.48Å
177	L	96.8	Very high	95.3	Very high	38 Å²	38	52.1 Å²	52.1	20%	0.199	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-78.4	129.9	175.1	-178.6	67.8	0	0	0	110.6	W179 A182 L405 L408 M409	L177-W179 HydrophobicContact CD2-CD2 4.25Å; L177-W179 HydrophobicContact CD2-CE3 4.12Å; L177-W179 HydrophobicContact CD2-CH2 4.02Å; L177-W179 HydrophobicContact CD2-CZ2 4.14Å; L177-W179 HydrophobicContact CD2-CZ3 4Å; L177-W179 PolarHBondContact O-N 2.98Å; L177-W179 VanDerWaalsContact O-N 3.11Å; L177-A182 HydrophobicContact CD2-CB 4.42Å; L177-L405 HydrophobicContact CD1-CB 4.32Å; L177-L405 HydrophobicContact CD1-CD2 4.39Å; L177-L405 WeakPolarHBondContact CD1-O 3.12Å; L177-L405 HydrophobicContact CD2-CD2 4.45Å; L177-L408 HydrophobicContact CD1-CB 3.91Å; L177-M409 HydrophobicContact CD1-CG 4.35Å
178	N	96.3	Very high	95.5	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.021	28%	0.277	C	S	.	.			trans	-78	94.6	171.6	-171.8	-11.7	0	0	0	111.1	A164 D180 M181 A182 L408	A164-N178 PolarHBondContact O-ND2 3.24Å; N178-D180 VanDerWaalsContact C-N 3.3Å; N178-D180 PolarHBondContact O-N 2.89Å; N178-D180 PolarHBondContact OD1-N 3.5Å; N178-M181 HydrophobicContact CB-CB 4.12Å; N178-M181 PolarHBondContact O-N 2.91Å; N178-M181 VanDerWaalsContact O-N 3.14Å; N178-A182 PolarHBondContact O-N 3.46Å; N178-L408 WeakPolarHBondContact CB-O 3.47Å; N178-L408 PolarHBondContact N-O 3.26Å; N178-L408 VanDerWaalsContact N-O 3.09Å
179	W	96.3	Very high	95.7	Very high	189 Å²	189	49.6 Å²	49.6	72%	0.716	27%	0.272	S	S	*	.	H	α-helix	trans	-59.6	-34	-177.6	-70.7	105.5	0	0	0	114.5	L177 M181 A182 L183	L177-W179 HydrophobicContact CD2-CD2 4.25Å; L177-W179 HydrophobicContact CD2-CE3 4.12Å; L177-W179 HydrophobicContact CD2-CH2 4.02Å; L177-W179 HydrophobicContact CD2-CZ2 4.14Å; L177-W179 HydrophobicContact CD2-CZ3 4Å; L177-W179 PolarHBondContact O-N 2.98Å; L177-W179 VanDerWaalsContact O-N 3.11Å; W179-M181 VanDerWaalsContact C-N 3.3Å; W179-M181 PolarHBondContact O-N 2.83Å; W179-A182 PolarHBondContact O-N 3.39Å; W179-L183 PolarHBondContact O-N 3.42Å
180	D	95.7	Very high	96	Very high	64 Å²	64	48.9 Å²	48.9	34%	0.342	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-41.5	177.7	-54	-35.3	0	0	0	110.5	F110 R163 R166 N178 L183 C184	F110-D180 HydrophobicContact CE2-CB 3.98Å; R163-D180 IonicContact CZ-OD2 2.95Å; R163-D180 IonicContact NH1-OD2 3.92Å; R163-D180 PolarHBondContact NH1-OD2 2.84Å; R163-D180 IonicContact NH2-OD2 2.67Å; R163-D180 PolarHBondContact NH2-OD2 2.55Å; R166-D180 IonicContact NH2-OD2 3.86Å; R166-D180 PolarHBondContact NH2-OD2 3.43Å; N178-D180 VanDerWaalsContact C-N 3.3Å; N178-D180 PolarHBondContact O-N 2.89Å; N178-D180 PolarHBondContact OD1-N 3.5Å; D180-L183 PolarHBondContact O-N 3Å; D180-C184 PolarHBondContact O-N 3.44Å; D180-C184 PolarHBondContact O-SG 3.44Å
181	M	96.3	Very high	96.2	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-72.5	-35.3	177.2	-161.2	61.5	70	0	0	111.6	A106 F110 A164 N178 W179 L183 C184 L185 L408	A106-M181 HydrophobicContact CB-SD 4.19Å; F110-M181 HydrophobicContact CB-CE 3.81Å; F110-M181 HydrophobicContact CB-SD 3.85Å; F110-M181 HydrophobicContact CD1-CE 3.91Å; F110-M181 HydrophobicContact CD2-CE 3.8Å; F110-M181 HydrophobicContact CD2-SD 4.32Å; F110-M181 HydrophobicContact CE1-CE 4.38Å; F110-M181 HydrophobicContact CE2-CE 4.28Å; F110-M181 HydrophobicContact CG-CE 3.57Å; F110-M181 HydrophobicContact CG-SD 4.19Å; A164-M181 HydrophobicContact CB-CE 4.44Å; A164-M181 WeakPolarHBondContact O-CE 3.47Å; N178-M181 HydrophobicContact CB-CB 4.12Å; N178-M181 PolarHBondContact O-N 2.91Å; N178-M181 VanDerWaalsContact O-N 3.14Å; W179-M181 VanDerWaalsContact C-N 3.3Å; W179-M181 PolarHBondContact O-N 2.83Å; M181-L183 VanDerWaalsContact C-N 3.28Å; M181-L183 PolarHBondContact O-N 3.36Å; M181-C184 WeakPolarHBondContact O-CB 3.39Å; M181-C184 PolarHBondContact O-N 3.19Å; M181-C184 VanDerWaalsContact O-N 3.13Å; M181-C184 HydrophobicContact SD-CB 4.35Å; M181-L185 PolarHBondContact O-N 3.29Å; M181-L408 HydrophobicContact CB-CD1 4.28Å; M181-L408 HydrophobicContact CB-CD2 4.38Å; M181-L408 HydrophobicContact CG-CD1 4.12Å; M181-L408 HydrophobicContact CG-CD2 3.56Å; M181-L408 HydrophobicContact CG-CG 4.35Å
182	A	97.7	Very high	96.3	Very high	7 Å²	7	51.3 Å²	51.3	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-37.1	175.3	0	0	0	0	0	111.9	L177 N178 W179 L185 L186 L405 L408	L177-A182 HydrophobicContact CD2-CB 4.42Å; N178-A182 PolarHBondContact O-N 3.46Å; W179-A182 PolarHBondContact O-N 3.39Å; A182-L185 PolarHBondContact O-N 2.94Å; A182-L186 PolarHBondContact O-N 3.47Å; A182-L405 HydrophobicContact CB-CD2 3.92Å; A182-L408 HydrophobicContact CB-CD1 4.2Å
183	L	97.9	Very high	96.5	Very high	108 Å²	108	48.2 Å²	48.2	57%	0.565	26%	0.255	S	S	*	.	H	α-helix	trans	-65.4	-43.1	171.9	-178	62.7	0	0	0	111.7	W179 D180 M181 L185 L186 V187	W179-L183 PolarHBondContact O-N 3.42Å; D180-L183 PolarHBondContact O-N 3Å; M181-L183 VanDerWaalsContact C-N 3.28Å; M181-L183 PolarHBondContact O-N 3.36Å; L183-L185 VanDerWaalsContact C-N 3.3Å; L183-L185 PolarHBondContact O-N 2.99Å; L183-L186 HydrophobicContact CD1-CD2 4.45Å; L183-L186 WeakPolarHBondContact O-CB 3.41Å; L183-L186 PolarHBondContact O-N 3.22Å; L183-V187 WeakPolarHBondContact O-CG2 3.36Å; L183-V187 PolarHBondContact O-N 2.89Å
184	C	98.2	Very high	96.6	Very high	16 Å²	16	47.7 Å²	47.7	11%	0.108	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-39.6	175.9	-62.6	0	0	0	0	111.8	A106 I109 D180 M181 V187 A188	A106-C184 HydrophobicContact CB-CB 4.22Å; A106-C184 WeakPolarHBondContact O-CB 3.4Å; I109-C184 HydrophobicContact CB-CB 4.27Å; I109-C184 HydrophobicContact CG2-CB 4.07Å; D180-C184 PolarHBondContact O-N 3.44Å; D180-C184 PolarHBondContact O-SG 3.44Å; M181-C184 WeakPolarHBondContact O-CB 3.39Å; M181-C184 PolarHBondContact O-N 3.19Å; M181-C184 VanDerWaalsContact O-N 3.13Å; M181-C184 HydrophobicContact SD-CB 4.35Å; C184-V187 PolarHBondContact O-N 2.98Å; C184-A188 PolarHBondContact O-N 3.37Å
185	L	98.2	Very high	96.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-41	174.2	179.1	63.1	0	0	0	111.9	I102 I103 A106 M181 A182 L183 V187 A188 W189 F401 L405 L408	I102-L185 HydrophobicContact CB-CD1 4.47Å; I102-L185 HydrophobicContact CG1-CD1 4.04Å; I102-L185 HydrophobicContact CG2-CD1 3.77Å; I103-L185 HydrophobicContact CD1-CD1 4.04Å; I103-L185 HydrophobicContact CD1-CD2 4.1Å; A106-L185 HydrophobicContact CB-CB 3.97Å; A106-L185 HydrophobicContact CB-CD1 4.35Å; M181-L185 PolarHBondContact O-N 3.29Å; A182-L185 PolarHBondContact O-N 2.94Å; L183-L185 VanDerWaalsContact C-N 3.3Å; L183-L185 PolarHBondContact O-N 2.99Å; L185-V187 VanDerWaalsContact C-N 3.34Å; L185-V187 PolarHBondContact O-N 3.07Å; L185-A188 PolarHBondContact O-N 3.32Å; L185-W189 PolarHBondContact O-N 3.48Å; L185-F401 HydrophobicContact CB-CE2 4.47Å; L185-F401 HydrophobicContact CD2-CD2 4.02Å; L185-F401 HydrophobicContact CD2-CE2 4.21Å; L185-F401 HydrophobicContact CG-CD2 3.93Å; L185-F401 HydrophobicContact CG-CE2 4.15Å; L185-L405 HydrophobicContact CD2-CD2 4.32Å; L185-L408 HydrophobicContact CB-CD1 3.8Å; L185-L408 HydrophobicContact CD2-CD1 3.59Å; L185-L408 HydrophobicContact CD2-CG 4.26Å; L185-L408 HydrophobicContact CG-CD1 4.29Å
186	L	98.3	Very high	96.7	Very high	79 Å²	79	43.7 Å²	43.7	41%	0.414	22%	0.221	S	C	.	.	H	α-helix	trans	-60.1	-45.6	174.4	-179.7	64.7	0	0	0	110.8	A182 L183 A188 W189 V190 F401	A182-L186 PolarHBondContact O-N 3.47Å; L183-L186 HydrophobicContact CD1-CD2 4.45Å; L183-L186 WeakPolarHBondContact O-CB 3.41Å; L183-L186 PolarHBondContact O-N 3.22Å; L186-A188 PolarHBondContact O-N 3.15Å; L186-W189 PolarHBondContact O-N 3.41Å; L186-V190 HydrophobicContact CD1-CG2 4.42Å; L186-V190 HydrophobicContact CG-CG2 4.5Å; L186-V190 VanDerWaalsContact O-CG2 3.27Å; L186-V190 WeakPolarHBondContact O-CG2 3.4Å; L186-V190 PolarHBondContact O-N 3.37Å; L186-F401 HydrophobicContact CB-CE2 3.87Å; L186-F401 HydrophobicContact CB-CZ 4.41Å; L186-F401 HydrophobicContact CD1-CE2 4.23Å; L186-F401 HydrophobicContact CD1-CZ 4.42Å
187	V	98.2	Very high	96.6	Very high	59 Å²	59	45.1 Å²	45.1	36%	0.358	22%	0.218	S	C	.	.	H	α-helix	trans	-59.7	-45.1	175.9	174.3	0	0	0	0	111	I109 L183 C184 L185 W189 V190 M191	I109-V187 HydrophobicContact CD1-CB 4.44Å; I109-V187 HydrophobicContact CD1-CG1 4.14Å; L183-V187 WeakPolarHBondContact O-CG2 3.36Å; L183-V187 PolarHBondContact O-N 2.89Å; C184-V187 PolarHBondContact O-N 2.98Å; L185-V187 VanDerWaalsContact C-N 3.34Å; L185-V187 PolarHBondContact O-N 3.07Å; V187-W189 VanDerWaalsContact C-N 3.35Å; V187-W189 PolarHBondContact O-N 3.28Å; V187-V190 PolarHBondContact O-N 3.45Å; V187-M191 HydrophobicContact CG1-CG 4.46Å; V187-M191 HydrophobicContact CG1-SD 4.1Å; V187-M191 WeakPolarHBondContact O-CG 3.34Å; V187-M191 PolarHBondContact O-N 3.23Å
188	A	97.8	Very high	96.3	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-44.5	177.2	0	0	0	0	0	112.2	I102 L105 I109 C184 L185 L186 M191 C192	I102-A188 HydrophobicContact CD1-CB 4.15Å; I102-A188 HydrophobicContact CG1-CB 3.94Å; L105-A188 HydrophobicContact CB-CB 4.17Å; I109-A188 HydrophobicContact CD1-CB 3.78Å; C184-A188 PolarHBondContact O-N 3.37Å; L185-A188 PolarHBondContact O-N 3.32Å; L186-A188 PolarHBondContact O-N 3.15Å; A188-M191 PolarHBondContact O-N 3.37Å; A188-C192 WeakPolarHBondContact O-CB 3.47Å; A188-C192 PolarHBondContact O-N 3.41Å
189	W	97.8	Very high	96	Very high	3 Å²	3	49.4 Å²	49.4	1%	0.011	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-36.7	177.9	-84.4	112.8	0	0	0	113.3	I102 L185 L186 V187 C192 Y193 V368 V397 F401	I102-W189 HydrophobicContact CB-CZ2 4.17Å; I102-W189 HydrophobicContact CD1-CD2 3.35Å; I102-W189 HydrophobicContact CD1-CE3 3.66Å; I102-W189 HydrophobicContact CD1-CG 3.79Å; I102-W189 HydrophobicContact CD1-CH2 4.01Å; I102-W189 HydrophobicContact CD1-CZ2 3.69Å; I102-W189 HydrophobicContact CD1-CZ3 4Å; I102-W189 HydrophobicContact CG1-CD2 4.47Å; I102-W189 HydrophobicContact CG1-CZ2 4.36Å; I102-W189 HydrophobicContact CG2-CZ2 3.66Å; L185-W189 PolarHBondContact O-N 3.48Å; L186-W189 PolarHBondContact O-N 3.41Å; V187-W189 VanDerWaalsContact C-N 3.35Å; V187-W189 PolarHBondContact O-N 3.28Å; W189-C192 HydrophobicContact CE3-CB 4.29Å; W189-C192 PolarHBondContact O-N 3.43Å; W189-Y193 WeakPolarHBondContact O-CB 3.45Å; W189-Y193 PolarHBondContact O-N 2.89Å; W189-V368 HydrophobicContact CH2-CG2 4.23Å; W189-V368 HydrophobicContact CZ3-CG2 3.93Å; W189-V397 HydrophobicContact CB-CG1 3.81Å; W189-V397 HydrophobicContact CD2-CG1 3.89Å; W189-V397 HydrophobicContact CE3-CB 4Å; W189-V397 HydrophobicContact CE3-CG1 3.52Å; W189-V397 HydrophobicContact CE3-CG2 3.8Å; W189-V397 HydrophobicContact CG-CG1 4.06Å; W189-V397 HydrophobicContact CZ3-CB 4.38Å; W189-V397 HydrophobicContact CZ3-CG1 4.37Å; W189-V397 HydrophobicContact CZ3-CG2 3.94Å; W189-F401 AromaticContact CD1-CD2 3.82Å; W189-F401 HydrophobicContact CG-CB 4.27Å
190	V	97.3	Very high	95.6	Very high	68 Å²	68	40.6 Å²	40.6	41%	0.412	20%	0.203	S	C	.	.	H	α-helix	trans	-62.9	-45.7	173.6	169.4	0	0	0	0	110.4	L186 V187 Y193 F194	L186-V190 HydrophobicContact CD1-CG2 4.42Å; L186-V190 HydrophobicContact CG-CG2 4.5Å; L186-V190 VanDerWaalsContact O-CG2 3.27Å; L186-V190 WeakPolarHBondContact O-CG2 3.4Å; L186-V190 PolarHBondContact O-N 3.37Å; V187-V190 PolarHBondContact O-N 3.45Å; V190-Y193 PolarHBondContact O-N 3.49Å; V190-F194 HydrophobicContact CG1-CD2 3.82Å; V190-F194 HydrophobicContact CG1-CE2 3.69Å; V190-F194 VanDerWaalsContact O-CD2 3.22Å; V190-F194 WeakPolarHBondContact O-CD2 3.1Å; V190-F194 PolarHBondContact O-N 3.02Å
191	M	96.1	Very high	95.4	Very high	63 Å²	63	44.3 Å²	44.3	31%	0.31	22%	0.216	S	C	.	.	H	α-helix	trans	-58.3	-50.4	174.1	-72.1	175.4	61.3	0	0	110.9	I109 V187 A188 Y193 F194 C195 V357 L361	I109-M191 HydrophobicContact CD1-SD 4.41Å; V187-M191 HydrophobicContact CG1-CG 4.46Å; V187-M191 HydrophobicContact CG1-SD 4.1Å; V187-M191 WeakPolarHBondContact O-CG 3.34Å; V187-M191 PolarHBondContact O-N 3.23Å; A188-M191 PolarHBondContact O-N 3.37Å; M191-Y193 PolarHBondContact O-N 3.13Å; M191-F194 PolarHBondContact O-N 2.95Å; M191-C195 PolarHBondContact O-N 2.96Å; M191-C195 VanDerWaalsContact O-N 3.1Å; M191-C195 PolarHBondContact O-SG 3.41Å; M191-V357 HydrophobicContact CE-CG1 4.05Å; M191-L361 HydrophobicContact CB-CD1 4.14Å; M191-L361 HydrophobicContact CE-CD2 3.9Å
192	C	96.3	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56.7	-50.2	178.3	-174.9	0	0	0	0	111.5	A188 W189 F194 C195 I196 L361	A188-C192 WeakPolarHBondContact O-CB 3.47Å; A188-C192 PolarHBondContact O-N 3.41Å; W189-C192 HydrophobicContact CE3-CB 4.29Å; W189-C192 PolarHBondContact O-N 3.43Å; C192-F194 PolarHBondContact O-N 3.21Å; C192-C195 WeakPolarHBondContact O-CB 3.48Å; C192-C195 PolarHBondContact O-N 3.19Å; C192-C195 VanDerWaalsContact O-N 3.07Å; C192-I196 VanDerWaalsContact O-CG1 3.28Å; C192-I196 WeakPolarHBondContact O-CG1 3.11Å; C192-I196 PolarHBondContact O-N 3.48Å; C192-L361 HydrophobicContact CB-CD1 4.35Å
193	Y	96.5	Very high	94.9	Very high	41 Å²	41	44.8 Å²	44.8	16%	0.161	22%	0.219	C	C	.	.	H	α-helix	trans	-53.5	-51.2	179.7	176.5	-98.4	0	0	0	112.4	W189 V190 M191 C195 I196 W197 L393 L394 V397	W189-Y193 WeakPolarHBondContact O-CB 3.45Å; W189-Y193 PolarHBondContact O-N 2.89Å; V190-Y193 PolarHBondContact O-N 3.49Å; M191-Y193 PolarHBondContact O-N 3.13Å; Y193-C195 VanDerWaalsContact C-N 3.28Å; Y193-C195 PolarHBondContact O-N 3.42Å; Y193-I196 PolarHBondContact O-N 3.02Å; Y193-W197 HydrophobicContact CE1-CB 4.29Å; Y193-W197 WeakPolarHBondContact O-CA 3.02Å; Y193-W197 WeakPolarHBondContact O-CB 3.47Å; Y193-W197 PolarHBondContact O-N 3.5Å; Y193-L393 HydrophobicContact CD2-CD2 3.9Å; Y193-L393 HydrophobicContact CD2-CG 3.87Å; Y193-L393 HydrophobicContact CE2-CD2 3.95Å; Y193-L393 HydrophobicContact CE2-CG 3.98Å; Y193-L394 HydrophobicContact CD2-CD1 4.41Å; Y193-L394 HydrophobicContact CE2-CB 3.87Å; Y193-L394 HydrophobicContact CE2-CD1 4.16Å; Y193-V397 HydrophobicContact CD2-CG2 4.42Å
194	F	95.4	Very high	94.6	Very high	105 Å²	105	39.7 Å²	39.7	46%	0.461	19%	0.192	S	C	.	.	H	α-helix	trans	-69.5	-24.4	-179.2	-73.3	-61.7	0	0	0	113.4	V190 M191 C192 I196 W197 S202	V190-F194 HydrophobicContact CG1-CD2 3.82Å; V190-F194 HydrophobicContact CG1-CE2 3.69Å; V190-F194 VanDerWaalsContact O-CD2 3.22Å; V190-F194 WeakPolarHBondContact O-CD2 3.1Å; V190-F194 PolarHBondContact O-N 3.02Å; M191-F194 PolarHBondContact O-N 2.95Å; C192-F194 PolarHBondContact O-N 3.21Å; F194-I196 VanDerWaalsContact C-N 3.35Å; F194-W197 HydrophobicContact CD1-CD2 4.07Å; F194-W197 AromaticContact CD1-CE3 3.72Å; F194-W197 HydrophobicContact CD1-CE3 3.72Å; F194-W197 HydrophobicContact CD1-CH2 4.4Å; F194-W197 AromaticContact CD1-CZ3 3.9Å; F194-W197 HydrophobicContact CD1-CZ3 3.9Å; F194-W197 AromaticContact CE1-CE3 3.9Å; F194-W197 HydrophobicContact CE1-CE3 3.9Å; F194-W197 AromaticContact CE1-CZ3 3.8Å; F194-W197 HydrophobicContact CE1-CZ3 3.8Å; F194-W197 PolarHBondContact O-NE1 3.13Å; F194-S202 PolarHBondContact O-OG 3.24Å
195	C	94.6	Very high	94.3	Very high	12 Å²	12	44.9 Å²	44.9	8%	0.081	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-38.5	173.4	-66.4	0	0	0	0	111.8	M191 C192 Y193 S202 T203 F365	M191-C195 PolarHBondContact O-N 2.96Å; M191-C195 VanDerWaalsContact O-N 3.1Å; M191-C195 PolarHBondContact O-SG 3.41Å; C192-C195 WeakPolarHBondContact O-CB 3.48Å; C192-C195 PolarHBondContact O-N 3.19Å; C192-C195 VanDerWaalsContact O-N 3.07Å; Y193-C195 VanDerWaalsContact C-N 3.28Å; Y193-C195 PolarHBondContact O-N 3.42Å; C195-S202 CarbonylContact O-C 3.56Å; C195-S202 WeakPolarHBondContact O-CB 3.46Å; C195-S202 PolarHBondContact O-OG 3.02Å; C195-T203 PolarHBondContact O-N 3.46Å; C195-F365 HydrophobicContact CB-CB 4.48Å; C195-F365 HydrophobicContact CB-CD1 3.99Å; C195-F365 HydrophobicContact CB-CG 4.39Å
196	I	94	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-113	2.6	-173	52.6	164.2	0	0	0	115.5	C192 Y193 F194 K198 G199 T203 F365 V368 E369 R389 L393	C192-I196 VanDerWaalsContact O-CG1 3.28Å; C192-I196 WeakPolarHBondContact O-CG1 3.11Å; C192-I196 PolarHBondContact O-N 3.48Å; Y193-I196 PolarHBondContact O-N 3.02Å; F194-I196 VanDerWaalsContact C-N 3.35Å; I196-K198 VanDerWaalsContact C-N 3.29Å; I196-K198 PolarHBondContact O-N 2.95Å; I196-K198 VanDerWaalsContact O-N 3.16Å; I196-G199 WeakPolarHBondContact O-CA 3.05Å; I196-G199 PolarHBondContact O-N 2.86Å; I196-T203 WeakPolarHBondContact CG2-OG1 3.36Å; I196-F365 HydrophobicContact CG2-CB 3.64Å; I196-F365 HydrophobicContact CG2-CD2 3.88Å; I196-F365 HydrophobicContact CG2-CG 3.96Å; I196-V368 HydrophobicContact CD1-CB 3.73Å; I196-V368 HydrophobicContact CD1-CG1 3.39Å; I196-E369 HydrophobicContact CG2-CB 4.39Å; I196-R389 PolarHBondContact O-NH1 3Å; I196-L393 HydrophobicContact CD1-CD1 3.38Å; I196-L393 HydrophobicContact CD1-CD2 4.05Å; I196-L393 HydrophobicContact CD1-CG 4.35Å; I196-L393 HydrophobicContact CG1-CD1 4.12Å; I196-L393 HydrophobicContact CG1-CD2 3.87Å
197	W	92.4	Very high	94	Very high	89 Å²	89	43 Å²	43	34%	0.337	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-42.2	-175.2	69.9	-28.6	0	0	0	114	Y193 F194 S202 R389 E390	Y193-W197 HydrophobicContact CE1-CB 4.29Å; Y193-W197 WeakPolarHBondContact O-CA 3.02Å; Y193-W197 WeakPolarHBondContact O-CB 3.47Å; Y193-W197 PolarHBondContact O-N 3.5Å; F194-W197 HydrophobicContact CD1-CD2 4.07Å; F194-W197 AromaticContact CD1-CE3 3.72Å; F194-W197 HydrophobicContact CD1-CE3 3.72Å; F194-W197 HydrophobicContact CD1-CH2 4.4Å; F194-W197 AromaticContact CD1-CZ3 3.9Å; F194-W197 HydrophobicContact CD1-CZ3 3.9Å; F194-W197 AromaticContact CE1-CE3 3.9Å; F194-W197 HydrophobicContact CE1-CE3 3.9Å; F194-W197 AromaticContact CE1-CZ3 3.8Å; F194-W197 HydrophobicContact CE1-CZ3 3.8Å; F194-W197 PolarHBondContact O-NE1 3.13Å; W197-S202 PolarHBondContact NE1-OG 3.28Å; W197-R389 PolarHBondContact O-NH1 3.33Å; W197-E390 WeakPolarHBondContact O-CG 3.21Å
198	K	90.6	Very high	93.8	Very high	126 Å²	126	44 Å²	44	55%	0.548	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	19.8	175.4	-58.9	-179.6	178.1	-179.4	0	113.7	I196	I196-K198 VanDerWaalsContact C-N 3.29Å; I196-K198 PolarHBondContact O-N 2.95Å; I196-K198 VanDerWaalsContact O-N 3.16Å
199	G	89.9	Confident	93.6	Very high	5 Å²	5	49.4 Å²	49.4	5%	0.052	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	-148.7	-176.6	0	0	0	0	0	112.7	I196 K201 S202 T203	I196-G199 WeakPolarHBondContact O-CA 3.05Å; I196-G199 PolarHBondContact O-N 2.86Å; G199-K201 PolarHBondContact O-N 3.16Å; G199-S202 PolarHBondContact O-N 3.2Å; G199-T203 PolarHBondContact O-N 3.14Å; G199-T203 VanDerWaalsContact O-N 3.08Å; G199-T203 PolarHBondContact O-OG1 3.43Å; G199-T203 VanDerWaalsContact O-OG1 3.12Å
200	V	89.3	Confident	93.4	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-52.9	-23.7	-176	-64	0	0	0	0	115.2	W7 G204 Y276	W7-V200 HydrophobicContact CD2-CB 4.28Å; W7-V200 HydrophobicContact CE3-CB 3.85Å; W7-V200 HydrophobicContact CE3-CG1 4.37Å; W7-V200 HydrophobicContact CH2-CB 3.9Å; W7-V200 HydrophobicContact CH2-CG1 3.62Å; W7-V200 HydrophobicContact CZ2-CB 4.32Å; W7-V200 HydrophobicContact CZ2-CG1 3.78Å; W7-V200 HydrophobicContact CZ3-CB 3.65Å; W7-V200 HydrophobicContact CZ3-CG1 3.94Å; V200-G204 PolarHBondContact O-N 3.19Å; V200-Y276 HydrophobicContact CG1-CD1 4.1Å; V200-Y276 HydrophobicContact CG1-CD2 3.4Å; V200-Y276 VanDerWaalsContact CG1-CD2 3.4Å; V200-Y276 HydrophobicContact CG1-CE1 4.25Å; V200-Y276 HydrophobicContact CG1-CE2 3.58Å; V200-Y276 HydrophobicContact CG1-CG 3.67Å; V200-Y276 HydrophobicContact CG2-CD1 3.99Å; V200-Y276 HydrophobicContact CG2-CE1 4.29Å; V200-Y276 HydrophobicContact CG2-CG 4.21Å
201	K	89.8	Confident	93.1	Very high	142 Å²	142	46.6 Å²	46.6	62%	0.617	21%	0.21	S	C	*	.	H	α-helix	trans	-69.6	-33.5	175.1	-66.8	-175.9	-179.9	177.9	0	113.3	G199 K205	G199-K201 PolarHBondContact O-N 3.16Å; K201-K205 WeakPolarHBondContact O-CG 3.24Å
202	S	92.1	Very high	93	Very high	17 Å²	17	46.5 Å²	46.5	12%	0.119	21%	0.213	C	C	.	.	H	α-helix	trans	-82.8	-48.1	173.9	-173.8	0	0	0	0	109.9	F194 C195 W197 G199 G204 K205 V206	F194-S202 PolarHBondContact O-OG 3.24Å; C195-S202 CarbonylContact O-C 3.56Å; C195-S202 WeakPolarHBondContact O-CB 3.46Å; C195-S202 PolarHBondContact O-OG 3.02Å; W197-S202 PolarHBondContact NE1-OG 3.28Å; G199-S202 PolarHBondContact O-N 3.2Å; S202-G204 VanDerWaalsContact C-N 3.33Å; S202-G204 PolarHBondContact O-N 2.81Å; S202-K205 PolarHBondContact O-N 2.95Å; S202-V206 PolarHBondContact O-N 3.4Å; S202-V206 VanDerWaalsContact O-N 3.13Å
203	T	92.1	Very high	92.8	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-53	-50.5	179.3	-49.2	0	0	0	0	111.5	C195 I196 G199 K205 V206 V207 F365	C195-T203 PolarHBondContact O-N 3.46Å; I196-T203 WeakPolarHBondContact CG2-OG1 3.36Å; G199-T203 PolarHBondContact O-N 3.14Å; G199-T203 VanDerWaalsContact O-N 3.08Å; G199-T203 PolarHBondContact O-OG1 3.43Å; G199-T203 VanDerWaalsContact O-OG1 3.12Å; T203-K205 PolarHBondContact O-N 3.5Å; T203-K205 VanDerWaalsContact O-N 3.08Å; T203-V206 PolarHBondContact O-N 3.37Å; T203-V206 VanDerWaalsContact O-N 3.13Å; T203-V207 HydrophobicContact CG2-CG1 4.37Å; T203-V207 WeakPolarHBondContact O-CG1 3.43Å; T203-V207 WeakPolarHBondContact O-CG2 3.5Å; T203-V207 PolarHBondContact O-N 3.44Å; T203-V207 VanDerWaalsContact O-N 3.12Å; T203-F365 HydrophobicContact CG2-CD2 3.62Å; T203-F365 HydrophobicContact CG2-CE2 3.16Å; T203-F365 HydrophobicContact CG2-CZ 3.85Å
204	G	90.9	Very high	92.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.6	-26.4	179.5	0	0	0	0	0	113.9	E12 V200 S202 V207 Y208	E12-G204 WeakPolarHBondContact CG-O 3.37Å; V200-G204 PolarHBondContact O-N 3.19Å; S202-G204 VanDerWaalsContact C-N 3.33Å; S202-G204 PolarHBondContact O-N 2.81Å; G204-V207 VanDerWaalsContact O-CG2 3.3Å; G204-V207 WeakPolarHBondContact O-CG2 3.34Å; G204-Y208 WeakPolarHBondContact O-CD2 3.35Å; G204-Y208 WeakPolarHBondContact O-CE2 3.17Å
205	K	93.7	Very high	92.3	Very high	126 Å²	126	44.8 Å²	44.8	55%	0.548	21%	0.206	S	C	.	.	H	α-helix	trans	-84	-40.1	176.8	-61.9	-53.1	-175.6	-162.6	0	112.9	E12 K201 S202 T203	E12-K205 WeakPolarHBondContact OE1-CE 3.34Å; E12-K205 IonicContact OE1-NZ 2.7Å; E12-K205 PolarHBondContact OE1-NZ 2.75Å; K201-K205 WeakPolarHBondContact O-CG 3.24Å; S202-K205 PolarHBondContact O-N 2.95Å; T203-K205 PolarHBondContact O-N 3.5Å; T203-K205 VanDerWaalsContact O-N 3.08Å
206	V	94.1	Very high	92.1	Very high	40 Å²	40	49.3 Å²	49.3	24%	0.242	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-40	-178.8	176	0	0	0	0	111.3	S202 T203 Y208 F209 T210	S202-V206 PolarHBondContact O-N 3.4Å; S202-V206 VanDerWaalsContact O-N 3.13Å; T203-V206 PolarHBondContact O-N 3.37Å; T203-V206 VanDerWaalsContact O-N 3.13Å; V206-Y208 PolarHBondContact O-N 3.2Å; V206-Y208 VanDerWaalsContact O-N 3.08Å; V206-F209 PolarHBondContact O-N 2.89Å; V206-T210 HydrophobicContact CG1-CG2 3.58Å; V206-T210 PolarHBondContact O-N 3.26Å; V206-T210 VanDerWaalsContact O-N 3.15Å; V206-T210 PolarHBondContact O-OG1 3.08Å
207	V	94.3	Very high	91.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-19.1	-177.1	-65.3	0	0	0	0	114.9	L15 T203 G204 F209 T210 A211 F365	L15-V207 HydrophobicContact CB-CB 4.17Å; L15-V207 HydrophobicContact CB-CG2 3.83Å; T203-V207 HydrophobicContact CG2-CG1 4.37Å; T203-V207 WeakPolarHBondContact O-CG1 3.43Å; T203-V207 WeakPolarHBondContact O-CG2 3.5Å; T203-V207 PolarHBondContact O-N 3.44Å; T203-V207 VanDerWaalsContact O-N 3.12Å; G204-V207 VanDerWaalsContact O-CG2 3.3Å; G204-V207 WeakPolarHBondContact O-CG2 3.34Å; V207-F209 PolarHBondContact O-N 3.44Å; V207-T210 WeakPolarHBondContact CA-OG1 3.49Å; V207-A211 HydrophobicContact CB-CB 4.36Å; V207-A211 VanDerWaalsContact O-CB 3.22Å; V207-A211 WeakPolarHBondContact O-CB 3.36Å; V207-A211 PolarHBondContact O-N 3.38Å; V207-A211 VanDerWaalsContact O-N 3.12Å; V207-F365 HydrophobicContact CG1-CE1 4.31Å; V207-F365 HydrophobicContact CG1-CE2 4.24Å; V207-F365 HydrophobicContact CG1-CZ 3.48Å; V207-F365 VanDerWaalsContact CG1-CZ 3.48Å
208	Y	94.3	Very high	91.8	Very high	78 Å²	78	46 Å²	46	31%	0.306	22%	0.218	S	C	.	.	H	α-helix	trans	-58.7	-33.4	172.7	-81.8	-81.3	0	0	0	112.4	N9 L11 E12 L15 G204 V206 T212	N9-Y208 PolarHBondContact ND2-OH 2.97Å; N9-Y208 PolarHBondContact OD1-OH 3.38Å; L11-Y208 HydrophobicContact CD2-CE1 3.57Å; L11-Y208 HydrophobicContact CG-CE1 4.06Å; E12-Y208 HydrophobicContact CG-CE2 3.76Å; L15-Y208 HydrophobicContact CD1-CD1 3.81Å; L15-Y208 HydrophobicContact CD1-CE1 4.04Å; L15-Y208 HydrophobicContact CD1-CG 4.25Å; G204-Y208 WeakPolarHBondContact O-CD2 3.35Å; G204-Y208 WeakPolarHBondContact O-CE2 3.17Å; V206-Y208 PolarHBondContact O-N 3.2Å; V206-Y208 VanDerWaalsContact O-N 3.08Å; Y208-T212 WeakPolarHBondContact O-CB 3.37Å; Y208-T212 WeakPolarHBondContact O-CG2 3.49Å; Y208-T212 PolarHBondContact O-OG1 2.92Å
209	F	93.6	Very high	91.9	Very high	115 Å²	115	44.3 Å²	44.3	50%	0.504	22%	0.218	S	C	.	.	H	α-helix	trans	-97.8	-50.8	177.8	-177.9	-108.8	0	0	0	111.4	V206 V207 A211 T212 F213 F358	V206-F209 PolarHBondContact O-N 2.89Å; V207-F209 PolarHBondContact O-N 3.44Å; F209-A211 VanDerWaalsContact C-N 3.35Å; F209-A211 PolarHBondContact O-N 3Å; F209-T212 PolarHBondContact O-N 3.22Å; F209-T212 PolarHBondContact O-OG1 2.94Å; F209-F213 HydrophobicContact CE2-CB 4.38Å; F209-F213 AromaticContact CE2-CD2 3.99Å; F209-F213 HydrophobicContact CE2-CD2 3.99Å; F209-F213 HydrophobicContact CE2-CG 4.48Å; F209-F213 HydrophobicContact CZ-CB 4.48Å; F209-F213 HydrophobicContact CZ-CD2 4.02Å; F209-F213 HydrophobicContact CZ-CG 4.33Å; F209-F213 VanDerWaalsContact O-CB 3.29Å; F209-F213 WeakPolarHBondContact O-CB 3.22Å; F209-F213 PolarHBondContact O-N 3.44Å; F209-F358 HydrophobicContact CD1-CE2 4.21Å; F209-F358 HydrophobicContact CD1-CZ 4.21Å; F209-F358 HydrophobicContact CE1-CD2 4.37Å; F209-F358 HydrophobicContact CE1-CE1 4.39Å; F209-F358 AromaticContact CE1-CE2 3.42Å; F209-F358 HydrophobicContact CE1-CE2 3.42Å; F209-F358 VanDerWaalsContact CE1-CE2 3.42Å; F209-F358 AromaticContact CE1-CZ 3.46Å; F209-F358 HydrophobicContact CE1-CZ 3.46Å; F209-F358 VanDerWaalsContact CE1-CZ 3.46Å; F209-F358 AromaticContact CZ-CE2 3.98Å; F209-F358 HydrophobicContact CZ-CE2 3.98Å; F209-F358 HydrophobicContact CZ-CZ 4.32Å
210	T	93.7	Very high	92.1	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-66.9	-34.4	-171.5	56	0	0	0	0	112.8	V206 V207 P214 F358 L361 D362	V206-T210 HydrophobicContact CG1-CG2 3.58Å; V206-T210 PolarHBondContact O-N 3.26Å; V206-T210 VanDerWaalsContact O-N 3.15Å; V206-T210 PolarHBondContact O-OG1 3.08Å; V207-T210 WeakPolarHBondContact CA-OG1 3.49Å; T210-P214 WeakPolarHBondContact O-CD 3.35Å; T210-P214 VanDerWaalsContact O-CG 3.28Å; T210-P214 WeakPolarHBondContact O-CG 3.4Å; T210-F358 HydrophobicContact CG2-CD1 4.04Å; T210-F358 HydrophobicContact CG2-CE1 4.43Å; T210-F358 HydrophobicContact CG2-CG 4.45Å; T210-L361 HydrophobicContact CG2-CD2 4.21Å; T210-D362 WeakPolarHBondContact CB-OD1 3.4Å; T210-D362 PolarHBondContact OG1-OD1 2.97Å
211	A	92.2	Very high	92	Very high	6 Å²	6	46.6 Å²	46.6	5%	0.05	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-24.8	178.6	0	0	0	0	0	113.3	V207 F209 Y215 D362	V207-A211 HydrophobicContact CB-CB 4.36Å; V207-A211 VanDerWaalsContact O-CB 3.22Å; V207-A211 WeakPolarHBondContact O-CB 3.36Å; V207-A211 PolarHBondContact O-N 3.38Å; V207-A211 VanDerWaalsContact O-N 3.12Å; F209-A211 VanDerWaalsContact C-N 3.35Å; F209-A211 PolarHBondContact O-N 3Å; A211-Y215 VanDerWaalsContact O-CD2 3.23Å; A211-Y215 WeakPolarHBondContact O-CD2 3.29Å; A211-D362 WeakPolarHBondContact CA-OD2 3.48Å; A211-D362 PolarHBondContact N-OD2 3.36Å; A211-D362 VanDerWaalsContact N-OD2 3.12Å
212	T	92.8	Very high	92.2	Very high	61 Å²	61	41.5 Å²	41.5	37%	0.374	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-33.9	-176.4	63.9	0	0	0	0	112.9	L15 Y208 F209 Y215 L216	L15-T212 HydrophobicContact CD2-CG2 4.15Å; Y208-T212 WeakPolarHBondContact O-CB 3.37Å; Y208-T212 WeakPolarHBondContact O-CG2 3.49Å; Y208-T212 PolarHBondContact O-OG1 2.92Å; F209-T212 PolarHBondContact O-N 3.22Å; F209-T212 PolarHBondContact O-OG1 2.94Å; T212-Y215 WeakPolarHBondContact O-CB 3.34Å; T212-Y215 PolarHBondContact O-N 3.01Å; T212-Y215 VanDerWaalsContact O-N 3.17Å; T212-L216 PolarHBondContact O-N 3.5Å
213	F	91.6	Very high	92.3	Very high	38 Å²	38	44.9 Å²	44.9	17%	0.167	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-42.2	-178.8	-175.8	-89.2	0	0	0	113.4	F209 Y215 L216 M217 V354 F358	F209-F213 HydrophobicContact CE2-CB 4.38Å; F209-F213 AromaticContact CE2-CD2 3.99Å; F209-F213 HydrophobicContact CE2-CD2 3.99Å; F209-F213 HydrophobicContact CE2-CG 4.48Å; F209-F213 HydrophobicContact CZ-CB 4.48Å; F209-F213 HydrophobicContact CZ-CD2 4.02Å; F209-F213 HydrophobicContact CZ-CG 4.33Å; F209-F213 VanDerWaalsContact O-CB 3.29Å; F209-F213 WeakPolarHBondContact O-CB 3.22Å; F209-F213 PolarHBondContact O-N 3.44Å; F213-Y215 PolarHBondContact O-N 3.29Å; F213-L216 WeakPolarHBondContact O-CB 3.43Å; F213-L216 PolarHBondContact O-N 2.92Å; F213-L216 VanDerWaalsContact O-N 3.16Å; F213-M217 HydrophobicContact CD1-CG 3.84Å; F213-M217 HydrophobicContact CE1-CG 3.31Å; F213-M217 HydrophobicContact CE1-SD 4.14Å; F213-M217 HydrophobicContact CZ-CG 3.74Å; F213-M217 HydrophobicContact CZ-SD 3.97Å; F213-M217 PolarHBondContact O-N 3.34Å; F213-V354 HydrophobicContact CD1-CG1 4.12Å; F213-V354 HydrophobicContact CE1-CB 4.31Å; F213-V354 HydrophobicContact CE1-CG1 3.48Å; F213-V354 VanDerWaalsContact CE1-CG1 3.48Å; F213-V354 HydrophobicContact CZ-CG1 4.08Å; F213-F358 HydrophobicContact CB-CD2 4.18Å; F213-F358 HydrophobicContact CB-CE2 4.48Å; F213-F358 AromaticContact CD1-CD2 3.65Å; F213-F358 HydrophobicContact CD1-CD2 3.65Å; F213-F358 AromaticContact CD1-CE2 3.88Å; F213-F358 HydrophobicContact CD1-CE2 3.88Å; F213-F358 HydrophobicContact CE1-CD2 4.38Å; F213-F358 HydrophobicContact CE1-CE2 4.34Å; F213-F358 HydrophobicContact CG-CD2 4.13Å; F213-F358 HydrophobicContact CG-CE2 4.18Å
214	P	90.8	Very high	92.3	Very high	8 Å²	8	47.4 Å²	47.4	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-57.4	-32.1	175.1	-28.9	37.4	0	0	0	114.1	T210 M217 L218 M355 F358 L359	T210-P214 WeakPolarHBondContact O-CD 3.35Å; T210-P214 VanDerWaalsContact O-CG 3.28Å; T210-P214 WeakPolarHBondContact O-CG 3.4Å; P214-M217 PolarHBondContact O-N 3.49Å; P214-L218 VanDerWaalsContact O-CB 3.32Å; P214-L218 WeakPolarHBondContact O-CB 3.28Å; P214-L218 PolarHBondContact O-N 2.9Å; P214-M355 HydrophobicContact CB-CG 4.02Å; P214-F358 HydrophobicContact CG-CB 4.09Å; P214-L359 HydrophobicContact CB-CD1 4.22Å; P214-L359 HydrophobicContact CB-CD2 3.59Å; P214-L359 HydrophobicContact CB-CG 3.72Å; P214-L359 HydrophobicContact CG-CD2 3.87Å; P214-L359 HydrophobicContact CG-CG 3.83Å
215	Y	91	Very high	92.3	Very high	65 Å²	65	47.4 Å²	47.4	26%	0.255	24%	0.239	S	C	.	.	H	α-helix	trans	-69.3	-44.7	175.3	-76.5	-77.1	0	0	0	112.9	I22 A211 T212 F213 M217 L218 V219 L293 T297	I22-Y215 HydrophobicContact CD1-CE2 4.4Å; I22-Y215 WeakPolarHBondContact CD1-OH 3.48Å; A211-Y215 VanDerWaalsContact O-CD2 3.23Å; A211-Y215 WeakPolarHBondContact O-CD2 3.29Å; T212-Y215 WeakPolarHBondContact O-CB 3.34Å; T212-Y215 PolarHBondContact O-N 3.01Å; T212-Y215 VanDerWaalsContact O-N 3.17Å; F213-Y215 PolarHBondContact O-N 3.29Å; Y215-M217 PolarHBondContact O-N 3.39Å; Y215-L218 PolarHBondContact O-N 3.02Å; Y215-V219 WeakPolarHBondContact O-CG2 3.25Å; Y215-V219 PolarHBondContact O-N 3.46Å; Y215-L293 HydrophobicContact CE1-CD1 4.33Å; Y215-L293 WeakPolarHBondContact OH-CD1 3.38Å; Y215-L293 VanDerWaalsContact OH-CD2 3.32Å; Y215-L293 WeakPolarHBondContact OH-CD2 3.34Å; Y215-L293 WeakPolarHBondContact OH-CG 3.49Å; Y215-T297 HydrophobicContact CE1-CG2 3.9Å; Y215-T297 WeakPolarHBondContact CE1-OG1 3.49Å; Y215-T297 PolarHBondContact OH-OG1 2.95Å
216	L	91.9	Very high	92.4	Very high	107 Å²	107	45.3 Å²	45.3	56%	0.56	23%	0.233	S	C	*	.	H	α-helix	trans	-55.7	-44.7	173.4	178.1	66.5	0	0	0	109.4	T212 F213 V219 V220	T212-L216 PolarHBondContact O-N 3.5Å; F213-L216 WeakPolarHBondContact O-CB 3.43Å; F213-L216 PolarHBondContact O-N 2.92Å; F213-L216 VanDerWaalsContact O-N 3.16Å; L216-V219 PolarHBondContact O-N 3.45Å; L216-V220 WeakPolarHBondContact O-CG2 3.39Å; L216-V220 PolarHBondContact O-N 3.37Å
217	M	89.6	Confident	92.4	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-66.4	-40.9	178.7	-76	-49.6	-37.7	0	0	113.6	F213 P214 Y215 V219 V220 L221 L351 M355	F213-M217 HydrophobicContact CD1-CG 3.84Å; F213-M217 HydrophobicContact CE1-CG 3.31Å; F213-M217 HydrophobicContact CE1-SD 4.14Å; F213-M217 HydrophobicContact CZ-CG 3.74Å; F213-M217 HydrophobicContact CZ-SD 3.97Å; F213-M217 PolarHBondContact O-N 3.34Å; P214-M217 PolarHBondContact O-N 3.49Å; Y215-M217 PolarHBondContact O-N 3.39Å; M217-V219 VanDerWaalsContact C-N 3.28Å; M217-V219 PolarHBondContact O-N 3.35Å; M217-V220 HydrophobicContact CE-CB 4.14Å; M217-V220 HydrophobicContact CE-CG1 4.12Å; M217-V220 PolarHBondContact O-N 3.36Å; M217-L221 HydrophobicContact CE-CG 4.18Å; M217-L221 WeakPolarHBondContact O-CB 3.16Å; M217-L221 WeakPolarHBondContact O-CG 2.92Å; M217-L221 PolarHBondContact O-N 3.47Å; M217-L351 HydrophobicContact CE-CB 3.5Å; M217-L351 VanDerWaalsContact CE-CB 3.5Å; M217-L351 HydrophobicContact CE-CD1 3.97Å; M217-L351 HydrophobicContact CE-CD2 4.39Å; M217-L351 HydrophobicContact CE-CG 4.15Å; M217-L351 HydrophobicContact SD-CB 3.94Å; M217-L351 HydrophobicContact SD-CD1 4.31Å; M217-L351 HydrophobicContact SD-CD2 3.8Å; M217-L351 HydrophobicContact SD-CG 4.23Å; M217-M355 HydrophobicContact CB-CB 4.09Å; M217-M355 HydrophobicContact CB-CG 4.15Å; M217-M355 HydrophobicContact CB-SD 3.7Å; M217-M355 HydrophobicContact CG-CB 4.27Å
218	L	90.6	Very high	92.4	Very high	14 Å²	14	48.3 Å²	48.3	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-42.1	176.3	-167.4	65.4	0	0	0	111.4	P214 Y215 L221 L222 T297 V300 A301 A304	P214-L218 VanDerWaalsContact O-CB 3.32Å; P214-L218 WeakPolarHBondContact O-CB 3.28Å; P214-L218 PolarHBondContact O-N 2.9Å; Y215-L218 PolarHBondContact O-N 3.02Å; L218-L221 PolarHBondContact O-N 2.91Å; L218-L222 WeakPolarHBondContact O-CB 3.33Å; L218-L222 PolarHBondContact O-N 3.45Å; L218-T297 HydrophobicContact CD2-CG2 3.93Å; L218-V300 HydrophobicContact CD2-CG1 4.11Å; L218-V300 HydrophobicContact CG-CG1 4.44Å; L218-A301 HydrophobicContact CD1-CB 3.9Å; L218-A301 HydrophobicContact CD2-CB 4.36Å; L218-A304 HydrophobicContact CD1-CB 4.14Å
219	V	92.7	Very high	92.3	Very high	90 Å²	90	47.4 Å²	47.4	55%	0.545	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-45.6	176.2	172.7	0	0	0	0	111	Y215 L216 M217 L221 L222 V223	Y215-V219 WeakPolarHBondContact O-CG2 3.25Å; Y215-V219 PolarHBondContact O-N 3.46Å; L216-V219 PolarHBondContact O-N 3.45Å; M217-V219 VanDerWaalsContact C-N 3.28Å; M217-V219 PolarHBondContact O-N 3.35Å; V219-L221 PolarHBondContact O-N 3.03Å; V219-L222 PolarHBondContact O-N 3.4Å; V219-V223 WeakPolarHBondContact O-CG2 3.46Å; V219-V223 PolarHBondContact O-N 3.42Å
220	V	92.3	Very high	92.3	Very high	53 Å²	53	42.8 Å²	42.8	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-46.8	177.7	168.4	0	0	0	0	111.2	L216 M217 V223 R224 W348	L216-V220 WeakPolarHBondContact O-CG2 3.39Å; L216-V220 PolarHBondContact O-N 3.37Å; M217-V220 HydrophobicContact CE-CB 4.14Å; M217-V220 HydrophobicContact CE-CG1 4.12Å; M217-V220 PolarHBondContact O-N 3.36Å; V220-V223 PolarHBondContact O-N 3.22Å; V220-R224 WeakPolarHBondContact O-CB 3.38Å; V220-R224 PolarHBondContact O-N 3.03Å; V220-W348 HydrophobicContact CG1-CZ3 3.9Å
221	L	88.3	Confident	92.3	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-67.8	-35.2	178.7	-69	179.9	0	0	0	112.5	M217 L218 V219 G225 Y335 W348 F352 M355	M217-L221 HydrophobicContact CE-CG 4.18Å; M217-L221 WeakPolarHBondContact O-CB 3.16Å; M217-L221 WeakPolarHBondContact O-CG 2.92Å; M217-L221 PolarHBondContact O-N 3.47Å; L218-L221 PolarHBondContact O-N 2.91Å; V219-L221 PolarHBondContact O-N 3.03Å; L221-G225 WeakPolarHBondContact O-CA 3.25Å; L221-G225 PolarHBondContact O-N 3.26Å; L221-Y335 WeakPolarHBondContact CD1-OH 3.36Å; L221-Y335 WeakPolarHBondContact CD2-OH 3.47Å; L221-W348 HydrophobicContact CD2-CE3 4.21Å; L221-F352 HydrophobicContact CD1-CD2 4.14Å; L221-M355 HydrophobicContact CD1-CE 3.52Å; L221-M355 HydrophobicContact CD1-SD 4.17Å
222	L	93.1	Very high	92.4	Very high	35 Å²	35	44.9 Å²	44.9	18%	0.183	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-51.8	174.6	178.6	67.2	0	0	0	110.9	L218 V219 R224 G225 L226 V300 F303 A304	L218-L222 WeakPolarHBondContact O-CB 3.33Å; L218-L222 PolarHBondContact O-N 3.45Å; V219-L222 PolarHBondContact O-N 3.4Å; L222-R224 VanDerWaalsContact C-N 3.3Å; L222-R224 PolarHBondContact O-N 2.99Å; L222-G225 PolarHBondContact O-N 2.98Å; L222-L226 HydrophobicContact CD1-CD1 3.81Å; L222-L226 HydrophobicContact CD1-CG 4.05Å; L222-L226 HydrophobicContact CG-CD1 3.94Å; L222-L226 HydrophobicContact CG-CG 4.45Å; L222-L226 WeakPolarHBondContact O-CB 3.27Å; L222-L226 VanDerWaalsContact O-CG 3.23Å; L222-L226 WeakPolarHBondContact O-CG 3.48Å; L222-L226 PolarHBondContact O-N 3.32Å; L222-V300 HydrophobicContact CD2-CG1 3.9Å; L222-F303 HydrophobicContact CD1-CB 3.52Å; L222-A304 HydrophobicContact CB-CB 4.21Å; L222-A304 HydrophobicContact CD1-CB 4.3Å
223	V	94.5	Very high	92.4	Very high	88 Å²	88	45.5 Å²	45.5	53%	0.533	26%	0.262	S	S	.	.	H	α-helix	trans	-58.8	-46.9	177.7	172.9	0	0	0	0	109.7	V219 V220 T227	V219-V223 WeakPolarHBondContact O-CG2 3.46Å; V219-V223 PolarHBondContact O-N 3.42Å; V220-V223 PolarHBondContact O-N 3.22Å; V223-T227 VanDerWaalsContact O-CG2 3.23Å; V223-T227 WeakPolarHBondContact O-CG2 3.42Å; V223-T227 PolarHBondContact O-N 3.07Å; V223-T227 PolarHBondContact O-OG1 3.02Å
224	R	91.8	Very high	92.4	Very high	55 Å²	55	43.7 Å²	43.7	21%	0.208	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-51.8	178.3	180	56.2	-179.3	154.2	-0.1	111.6	V220 L222 L226 T227 L228 M342 W348	V220-R224 WeakPolarHBondContact O-CB 3.38Å; V220-R224 PolarHBondContact O-N 3.03Å; L222-R224 VanDerWaalsContact C-N 3.3Å; L222-R224 PolarHBondContact O-N 2.99Å; R224-L226 PolarHBondContact O-N 3.35Å; R224-T227 PolarHBondContact O-N 3.44Å; R224-T227 VanDerWaalsContact O-N 3.12Å; R224-T227 PolarHBondContact O-OG1 3.37Å; R224-L228 WeakPolarHBondContact O-CG 3.41Å; R224-L228 PolarHBondContact O-N 3.37Å; R224-M342 HydrophobicContact CG-SD 4.42Å; R224-W348 HydrophobicContact CB-CH2 3.92Å; R224-W348 HydrophobicContact CB-CZ3 3.91Å; R224-W348 HydrophobicContact CG-CE3 4.32Å; R224-W348 HydrophobicContact CG-CH2 3.67Å; R224-W348 HydrophobicContact CG-CZ2 4Å; R224-W348 HydrophobicContact CG-CZ3 3.83Å
225	G	92.1	Very high	92.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.6	-45.2	-178.5	0	0	0	0	0	112.6	L221 L222 T227 L228 A231 S307	L221-G225 WeakPolarHBondContact O-CA 3.25Å; L221-G225 PolarHBondContact O-N 3.26Å; L222-G225 PolarHBondContact O-N 2.98Å; G225-T227 VanDerWaalsContact C-N 3.27Å; G225-T227 PolarHBondContact O-N 3.4Å; G225-L228 WeakPolarHBondContact O-CB 3.28Å; G225-L228 PolarHBondContact O-N 3.37Å; G225-A231 WeakPolarHBondContact O-CB 3.18Å; G225-S307 WeakPolarHBondContact CA-OG 3.18Å
226	L	95.2	Very high	92.7	Very high	82 Å²	82	48.1 Å²	48.1	43%	0.429	28%	0.278	S	S	.	.	H	α-helix	trans	-67.5	-24	178.6	-66.8	177.9	0	0	0	113.7	L222 R224 I235	L222-L226 HydrophobicContact CD1-CD1 3.81Å; L222-L226 HydrophobicContact CD1-CG 4.05Å; L222-L226 HydrophobicContact CG-CD1 3.94Å; L222-L226 HydrophobicContact CG-CG 4.45Å; L222-L226 WeakPolarHBondContact O-CB 3.27Å; L222-L226 VanDerWaalsContact O-CG 3.23Å; L222-L226 WeakPolarHBondContact O-CG 3.48Å; L222-L226 PolarHBondContact O-N 3.32Å; R224-L226 PolarHBondContact O-N 3.35Å; L226-I235 HydrophobicContact CD2-CD1 3.48Å; L226-I235 VanDerWaalsContact CD2-CD1 3.48Å
227	T	94.5	Very high	92.6	Very high	90 Å²	90	46.6 Å²	46.6	55%	0.552	27%	0.267	S	S	*	.	H	α-helix	trans	-84.5	-9.1	176.4	61.7	0	0	0	0	114.1	V223 R224 G225	V223-T227 VanDerWaalsContact O-CG2 3.23Å; V223-T227 WeakPolarHBondContact O-CG2 3.42Å; V223-T227 PolarHBondContact O-N 3.07Å; V223-T227 PolarHBondContact O-OG1 3.02Å; R224-T227 PolarHBondContact O-N 3.44Å; R224-T227 VanDerWaalsContact O-N 3.12Å; R224-T227 PolarHBondContact O-OG1 3.37Å; G225-T227 VanDerWaalsContact C-N 3.27Å; G225-T227 PolarHBondContact O-N 3.4Å
228	L	93.3	Very high	92.8	Very high	12 Å²	12	46.3 Å²	46.3	6%	0.063	27%	0.265	C	S	.	.	S	Bend	trans	-76.9	148	-179.8	-70.6	168.5	0	0	0	111.5	R224 G225 A231 I308 F311 M342	R224-L228 WeakPolarHBondContact O-CG 3.41Å; R224-L228 PolarHBondContact O-N 3.37Å; G225-L228 WeakPolarHBondContact O-CB 3.28Å; G225-L228 PolarHBondContact O-N 3.37Å; L228-A231 WeakPolarHBondContact O-CB 3.38Å; L228-A231 PolarHBondContact O-N 3.15Å; L228-I308 HydrophobicContact CD1-CG1 4.35Å; L228-F311 HydrophobicContact CB-CB 3.79Å; L228-F311 HydrophobicContact CB-CD2 3.87Å; L228-F311 HydrophobicContact CB-CG 3.85Å; L228-F311 HydrophobicContact CD1-CB 3.98Å; L228-F311 HydrophobicContact CD1-CD1 3.78Å; L228-F311 HydrophobicContact CD1-CD2 4.44Å; L228-F311 HydrophobicContact CD1-CE1 4.36Å; L228-F311 HydrophobicContact CD1-CG 3.81Å; L228-F311 HydrophobicContact CD2-CD1 4.45Å; L228-F311 HydrophobicContact CD2-CD2 4.12Å; L228-F311 HydrophobicContact CD2-CE1 4.41Å; L228-F311 HydrophobicContact CD2-CE2 4.1Å; L228-F311 HydrophobicContact CD2-CG 4.29Å; L228-F311 HydrophobicContact CD2-CZ 4.25Å; L228-F311 HydrophobicContact CG-CB 4.45Å; L228-F311 HydrophobicContact CG-CD2 4.36Å; L228-F311 HydrophobicContact CG-CG 4.2Å; L228-M342 HydrophobicContact CD1-CE 3.62Å; L228-M342 HydrophobicContact CD1-SD 4.11Å
229	P	93.2	Very high	93	Very high	60 Å²	60	47.8 Å²	47.8	39%	0.39	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	145.6	173.4	27.8	-32.5	0	0	0	110	A231 F311 Y314	P229-A231 PolarHBondContact O-N 3.02Å; P229-F311 HydrophobicContact CG-CD2 3.79Å; P229-F311 HydrophobicContact CG-CE2 3.89Å; P229-F311 VanDerWaalsContact O-CA 3.26Å; P229-F311 WeakPolarHBondContact O-CA 3.49Å; P229-F311 WeakPolarHBondContact O-CB 3.35Å; P229-F311 WeakPolarHBondContact O-CD2 3.48Å; P229-Y314 HydrophobicContact CB-CD1 3.98Å; P229-Y314 HydrophobicContact CB-CE1 3.79Å; P229-Y314 HydrophobicContact CG-CD1 4.3Å; P229-Y314 HydrophobicContact CG-CE1 4.29Å
230	G	92.4	Very high	93	Very high	18 Å²	18	51.3 Å²	51.3	19%	0.186	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-3.5	-179.5	0	0	0	0	0	116.1	G232 I233 G310	G230-G232 PolarHBondContact O-N 3.38Å; G230-G232 VanDerWaalsContact O-N 3.1Å; G230-I233 WeakPolarHBondContact O-CB 3.39Å; G230-I233 PolarHBondContact O-N 2.84Å; G230-G310 CarbonylContact O-C 3.49Å
231	A	94	Very high	93.1	Very high	6 Å²	6	52.2 Å²	52.2	5%	0.05	29%	0.285	C	S	.	.	H	α-helix	trans	-53.5	-35.4	179	0	0	0	0	0	113.6	G225 L228 P229 I233 G234 I235	G225-A231 WeakPolarHBondContact O-CB 3.18Å; L228-A231 WeakPolarHBondContact O-CB 3.38Å; L228-A231 PolarHBondContact O-N 3.15Å; P229-A231 PolarHBondContact O-N 3.02Å; A231-I233 VanDerWaalsContact C-N 3.29Å; A231-I233 PolarHBondContact O-N 3.12Å; A231-G234 PolarHBondContact O-N 2.85Å; A231-I235 WeakPolarHBondContact O-CG1 3.4Å; A231-I235 PolarHBondContact O-N 3.49Å; A231-I235 VanDerWaalsContact O-N 3.11Å
232	G	93.9	Very high	93.4	Very high	49 Å²	49	55.9 Å²	55.9	51%	0.505	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-33.9	177.2	0	0	0	0	0	114.1	G230 G234 I235 Q236	G230-G232 PolarHBondContact O-N 3.38Å; G230-G232 VanDerWaalsContact O-N 3.1Å; G232-G234 VanDerWaalsContact C-N 3.32Å; G232-G234 PolarHBondContact O-N 3.48Å; G232-I235 PolarHBondContact O-N 2.88Å; G232-Q236 WeakPolarHBondContact O-CB 3.3Å; G232-Q236 PolarHBondContact O-N 3.08Å
233	I	93.1	Very high	93.4	Very high	74 Å²	74	59.7 Å²	59.7	38%	0.379	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-45.2	177	-61.2	169.1	0	0	0	109.5	G230 A231 Q236 F237 Y314	G230-I233 WeakPolarHBondContact O-CB 3.39Å; G230-I233 PolarHBondContact O-N 2.84Å; A231-I233 VanDerWaalsContact C-N 3.29Å; A231-I233 PolarHBondContact O-N 3.12Å; I233-Q236 PolarHBondContact O-N 2.72Å; I233-F237 WeakPolarHBondContact O-CB 3.41Å; I233-F237 PolarHBondContact O-N 3.35Å; I233-Y314 HydrophobicContact CD1-CD2 4.34Å
234	G	92.8	Very high	93.4	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-41.6	179.4	0	0	0	0	0	113.4	A231 G232 Q236 F237 Y238 F306	A231-G234 PolarHBondContact O-N 2.85Å; G232-G234 VanDerWaalsContact C-N 3.32Å; G232-G234 PolarHBondContact O-N 3.48Å; G234-Q236 VanDerWaalsContact C-N 3.35Å; G234-F237 PolarHBondContact O-N 3.41Å; G234-Y238 WeakPolarHBondContact O-CB 3.48Å; G234-Y238 PolarHBondContact O-N 3Å; G234-F306 VanDerWaalsContact CA-O 3.31Å; G234-F306 WeakPolarHBondContact CA-O 3.48Å
235	I	94.8	Very high	93.4	Very high	42 Å²	42	58.6 Å²	58.6	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-41.2	176.8	-62.3	169.5	0	0	0	111	L226 A231 G232 F237 Y238 L239 F303	L226-I235 HydrophobicContact CD2-CD1 3.48Å; L226-I235 VanDerWaalsContact CD2-CD1 3.48Å; A231-I235 WeakPolarHBondContact O-CG1 3.4Å; A231-I235 PolarHBondContact O-N 3.49Å; A231-I235 VanDerWaalsContact O-N 3.11Å; G232-I235 PolarHBondContact O-N 2.88Å; I235-F237 VanDerWaalsContact C-N 3.3Å; I235-F237 PolarHBondContact O-N 2.93Å; I235-Y238 PolarHBondContact O-N 3.49Å; I235-L239 HydrophobicContact CG2-CD1 4.45Å; I235-L239 PolarHBondContact O-N 3.05Å; I235-F303 HydrophobicContact CD1-CD1 4.27Å; I235-F303 HydrophobicContact CG1-CD1 4.2Å; I235-F303 HydrophobicContact CG2-CD1 4.19Å; I235-F303 HydrophobicContact CG2-CE1 3.84Å
236	Q	93.6	Very high	93.4	Very high	124 Å²	124	60.5 Å²	60.5	58%	0.579	34%	0.337	S	S	*	.	H	α-helix	trans	-59.2	-45.7	173.9	-175.4	178.1	0.4	0	0	110.2	G232 I233 G234 Y238 L239 Y240	G232-Q236 WeakPolarHBondContact O-CB 3.3Å; G232-Q236 PolarHBondContact O-N 3.08Å; I233-Q236 PolarHBondContact O-N 2.72Å; G234-Q236 VanDerWaalsContact C-N 3.35Å; Q236-Y238 VanDerWaalsContact C-N 3.28Å; Q236-Y238 PolarHBondContact O-N 2.85Å; Q236-L239 PolarHBondContact O-N 3.48Å; Q236-Y240 HydrophobicContact CG-CD2 4.47Å; Q236-Y240 WeakPolarHBondContact O-CB 3.48Å; Q236-Y240 PolarHBondContact O-N 3.49Å
237	F	89.4	Confident	93.2	Very high	75 Å²	75	60.9 Å²	60.9	33%	0.329	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-32.2	178.5	-157	-101.9	0	0	0	113.5	Y35 I233 G234 I235 F306 I320	Y35-F237 HydrophobicContact CD2-CD1 4.1Å; Y35-F237 AromaticContact CD2-CE1 3.37Å; Y35-F237 HydrophobicContact CD2-CE1 3.37Å; Y35-F237 HydrophobicContact CD2-CZ 4.2Å; Y35-F237 AromaticContact CE2-CE1 3.94Å; Y35-F237 HydrophobicContact CE2-CE1 3.94Å; Y35-F237 HydrophobicContact CG-CD1 4.29Å; Y35-F237 HydrophobicContact CG-CE1 4Å; I233-F237 WeakPolarHBondContact O-CB 3.41Å; I233-F237 PolarHBondContact O-N 3.35Å; G234-F237 PolarHBondContact O-N 3.41Å; I235-F237 VanDerWaalsContact C-N 3.3Å; I235-F237 PolarHBondContact O-N 2.93Å; F237-F306 HydrophobicContact CD1-CE1 4.04Å; F237-I320 HydrophobicContact CB-CD1 4.12Å; F237-I320 HydrophobicContact CB-CG2 3.83Å; F237-I320 HydrophobicContact CD1-CD1 4.41Å; F237-I320 HydrophobicContact CD1-CG2 3.57Å; F237-I320 HydrophobicContact CD2-CG2 3.24Å; F237-I320 HydrophobicContact CE1-CG2 3.8Å; F237-I320 HydrophobicContact CE2-CG2 3.52Å; F237-I320 HydrophobicContact CG-CD1 4.41Å; F237-I320 HydrophobicContact CG-CG2 3.26Å; F237-I320 HydrophobicContact CZ-CG2 3.79Å
238	Y	93.3	Very high	93	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-71.3	-42	177.3	175.1	-140.7	0	0	0	113.1	F30 C34 G39 G234 I235 Q236 F299 F303 F306	F30-Y238 WeakPolarHBondContact CE1-OH 3.39Å; C34-Y238 HydrophobicContact CB-CD2 3.95Å; C34-Y238 HydrophobicContact CB-CE2 3.53Å; C34-Y238 VanDerWaalsContact SG-CE2 3.54Å; G39-Y238 CarbonylContact C-O 3.57Å; G39-Y238 WeakPolarHBondContact CA-O 3.33Å; G234-Y238 WeakPolarHBondContact O-CB 3.48Å; G234-Y238 PolarHBondContact O-N 3Å; I235-Y238 PolarHBondContact O-N 3.49Å; Q236-Y238 VanDerWaalsContact C-N 3.28Å; Q236-Y238 PolarHBondContact O-N 2.85Å; Y238-F299 WeakPolarHBondContact OH-CD2 3.49Å; Y238-F299 PolarHBondContact OH-O 3.36Å; Y238-F299 VanDerWaalsContact OH-O 3.06Å; Y238-F303 HydrophobicContact CE1-CD2 4.02Å; Y238-F303 HydrophobicContact CE1-CE2 4.16Å; Y238-F303 HydrophobicContact CE1-CG 4.43Å; Y238-F306 AromaticContact CD2-CD2 3.97Å; Y238-F306 HydrophobicContact CD2-CD2 3.97Å; Y238-F306 HydrophobicContact CD2-CE2 4.17Å; Y238-F306 HydrophobicContact CD2-CG 4.49Å; Y238-F306 HydrophobicContact CG-CB 4.36Å; Y238-F306 AromaticContact CG-CD2 3.97Å; Y238-F306 HydrophobicContact CG-CD2 3.97Å; Y238-F306 HydrophobicContact CG-CG 4.1Å
239	L	94.2	Very high	92.6	Very high	46 Å²	46	61.4 Å²	61.4	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-113.5	-12.9	-167.7	-66.4	-179	0	0	0	115.7	G40 I235 Q236 P241 F299 F303	G40-L239 WeakPolarHBondContact CA-O 3.35Å; G40-L239 PolarHBondContact N-O 2.97Å; G40-L239 VanDerWaalsContact N-O 3.08Å; I235-L239 HydrophobicContact CG2-CD1 4.45Å; I235-L239 PolarHBondContact O-N 3.05Å; Q236-L239 PolarHBondContact O-N 3.48Å; L239-P241 VanDerWaalsContact O-CD 3.29Å; L239-P241 WeakPolarHBondContact O-CD 3.43Å; L239-P241 VanDerWaalsContact O-N 3.11Å; L239-F299 HydrophobicContact CD1-CZ 4.49Å; L239-F299 HydrophobicContact CD2-CE2 3.83Å; L239-F299 HydrophobicContact CD2-CZ 4.42Å; L239-F303 HydrophobicContact CD1-CE1 3.93Å; L239-F303 HydrophobicContact CD1-CE2 4.21Å; L239-F303 HydrophobicContact CD1-CZ 3.47Å; L239-F303 VanDerWaalsContact CD1-CZ 3.47Å
240	Y	93.8	Very high	92.3	Very high	163 Å²	163	60.9 Å²	60.9	64%	0.639	35%	0.347	S	S	*	.			trans	-60.8	117.9	179.9	-169	-92	0	0	0	110	Q236 D242	Q236-Y240 HydrophobicContact CG-CD2 4.47Å; Q236-Y240 WeakPolarHBondContact O-CB 3.48Å; Q236-Y240 PolarHBondContact O-N 3.49Å; Y240-D242 PolarHBondContact O-N 3Å
241	P	94.6	Very high	92.2	Very high	73 Å²	73	60 Å²	60	47%	0.474	34%	0.338	S	S	.	.			trans	-82.1	123.4	-169	30.7	-33	0	0	0	111.4	A41 L239	A41-P241 HydrophobicContact CB-CB 4.36Å; L239-P241 VanDerWaalsContact O-CD 3.29Å; L239-P241 WeakPolarHBondContact O-CD 3.43Å; L239-P241 VanDerWaalsContact O-N 3.11Å
242	D	93	Very high	92	Very high	82 Å²	82	63.8 Å²	63.8	44%	0.439	35%	0.351	S	S	.	.			trans	-105.8	95.9	165.9	-179.4	5.1	0	0	0	109.8	G38 A41 Y240 G244 R245	G38-D242 PolarHBondContact O-N 3.45Å; A41-D242 WeakPolarHBondContact CB-O 3.26Å; Y240-D242 PolarHBondContact O-N 3Å; D242-G244 PolarHBondContact O-N 3.38Å; D242-G244 PolarHBondContact OD1-N 3.41Å; D242-R245 HydrophobicContact CB-CG 4.17Å; D242-R245 PolarHBondContact O-N 2.96Å; D242-R245 WeakPolarHBondContact OD2-CG 3.44Å
243	L	93.9	Very high	91.6	Very high	115 Å²	115	62.3 Å²	62.3	60%	0.602	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-66.3	-21.1	-179.1	-63.1	176.5	0	0	0	112.8	A41 I44 R245 L246	A41-L243 HydrophobicContact CB-CD2 4.1Å; I44-L243 HydrophobicContact CD1-CD2 4.48Å; L243-R245 PolarHBondContact O-N 3.42Å; L243-L246 HydrophobicContact CD2-CD1 3.99Å; L243-L246 WeakPolarHBondContact O-CB 3.49Å; L243-L246 PolarHBondContact O-N 3.18Å; L243-L246 VanDerWaalsContact O-N 3.16Å
244	G	94.1	Very high	91.4	Very high	53 Å²	53	59.5 Å²	59.5	55%	0.546	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-62.7	-30.2	177.2	0	0	0	0	0	112.3	D242 L246 A247	D242-G244 PolarHBondContact O-N 3.38Å; D242-G244 PolarHBondContact OD1-N 3.41Å; G244-L246 PolarHBondContact O-N 3.48Å; G244-A247 PolarHBondContact O-N 2.95Å
245	R	92.3	Very high	91.3	Very high	67 Å²	67	59.5 Å²	59.5	25%	0.253	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-65.1	-23.8	177.5	-63.3	-71.9	-79.7	129.5	-1.2	112.7	K36 N37 D242 L243 A247 D248 V251	K36-R245 PolarHBondContact O-NE 3.34Å; K36-R245 PolarHBondContact O-NH2 3.16Å; N37-R245 PolarHBondContact OD1-NH2 3.19Å; D242-R245 HydrophobicContact CB-CG 4.17Å; D242-R245 PolarHBondContact O-N 2.96Å; D242-R245 WeakPolarHBondContact OD2-CG 3.44Å; L243-R245 PolarHBondContact O-N 3.42Å; R245-A247 PolarHBondContact O-N 3.06Å; R245-D248 IonicContact CZ-OD2 3.59Å; R245-D248 IonicContact NH1-OD2 3.7Å; R245-D248 PolarHBondContact NH1-OD2 3.1Å; R245-D248 WeakPolarHBondContact O-CB 3.44Å; R245-D248 PolarHBondContact O-N 3.48Å; R245-V251 HydrophobicContact CB-CG2 4.22Å; R245-V251 WeakPolarHBondContact O-CG2 3.47Å
246	L	92.3	Very high	91	Very high	40 Å²	40	57.5 Å²	57.5	21%	0.209	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-65.6	-20	179.1	-62.9	177.9	0	0	0	113.8	A41 I44 P45 L243 G244 D248 V251 W252	A41-L246 HydrophobicContact CB-CD2 4.35Å; A41-L246 HydrophobicContact CB-CG 4.32Å; I44-L246 HydrophobicContact CD1-CD1 3.98Å; P45-L246 HydrophobicContact CG-CD2 4.13Å; L243-L246 HydrophobicContact CD2-CD1 3.99Å; L243-L246 WeakPolarHBondContact O-CB 3.49Å; L243-L246 PolarHBondContact O-N 3.18Å; L243-L246 VanDerWaalsContact O-N 3.16Å; G244-L246 PolarHBondContact O-N 3.48Å; L246-D248 VanDerWaalsContact C-N 3.28Å; L246-V251 HydrophobicContact CD2-CG1 4.27Å; L246-W252 PolarHBondContact O-NE1 2.61Å
247	A	91.2	Very high	90.7	Very high	89 Å²	89	52.6 Å²	52.6	74%	0.736	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-73.9	-20.5	173.4	0	0	0	0	0	112.7	G244 R245 P249	G244-A247 PolarHBondContact O-N 2.95Å; R245-A247 PolarHBondContact O-N 3.06Å; A247-P249 WeakPolarHBondContact O-CD 3.33Å
248	D	88.9	Confident	90.8	Very high	57 Å²	57	49 Å²	49	31%	0.305	27%	0.269	S	S	.	.	S	Bend	trans	-79.7	114.3	175.7	-179.3	-0.5	0	0	0	109.4	R245 L246 Q250 V251	R245-D248 IonicContact CZ-OD2 3.59Å; R245-D248 IonicContact NH1-OD2 3.7Å; R245-D248 PolarHBondContact NH1-OD2 3.1Å; R245-D248 WeakPolarHBondContact O-CB 3.44Å; R245-D248 PolarHBondContact O-N 3.48Å; L246-D248 VanDerWaalsContact C-N 3.28Å; D248-Q250 PolarHBondContact O-N 3.14Å; D248-Q250 VanDerWaalsContact O-N 3.15Å; D248-Q250 VanDerWaalsContact OD1-CB 3.25Å; D248-Q250 WeakPolarHBondContact OD1-CB 3.37Å; D248-Q250 PolarHBondContact OD1-N 3.44Å; D248-V251 HydrophobicContact CB-CG2 4.19Å; D248-V251 VanDerWaalsContact O-CB 3.31Å; D248-V251 WeakPolarHBondContact O-CB 3.45Å; D248-V251 PolarHBondContact O-N 3.5Å
249	P	85.5	Confident	90.8	Very high	56 Å²	56	49 Å²	49	36%	0.364	27%	0.269	S	S	.	.	H	α-helix	trans	-71.3	-11.3	-176.5	0.3	14.1	0	0	0	113	A247 V251 W252 M253 F483	A247-P249 WeakPolarHBondContact O-CD 3.33Å; P249-V251 PolarHBondContact O-N 2.98Å; P249-W252 PolarHBondContact O-N 3.14Å; P249-M253 PolarHBondContact O-N 3.26Å; P249-F483 HydrophobicContact CB-CD1 4.07Å; P249-F483 HydrophobicContact CB-CD2 4.17Å; P249-F483 HydrophobicContact CB-CE1 3.55Å; P249-F483 HydrophobicContact CB-CE2 3.62Å; P249-F483 HydrophobicContact CB-CG 4.38Å; P249-F483 HydrophobicContact CB-CZ 3.3Å; P249-F483 HydrophobicContact CG-CD2 4.48Å; P249-F483 HydrophobicContact CG-CE1 4.23Å; P249-F483 HydrophobicContact CG-CE2 3.59Å; P249-F483 HydrophobicContact CG-CZ 3.46Å; P249-F483 VanDerWaalsContact CG-CZ 3.46Å
250	Q	86.8	Confident	90.6	Very high	50 Å²	50	46.9 Å²	46.9	23%	0.234	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-34.3	168.2	-173.1	65.3	40.5	0	0	111.9	D248 W252 M253 D254	D248-Q250 PolarHBondContact O-N 3.14Å; D248-Q250 VanDerWaalsContact O-N 3.15Å; D248-Q250 VanDerWaalsContact OD1-CB 3.25Å; D248-Q250 WeakPolarHBondContact OD1-CB 3.37Å; D248-Q250 PolarHBondContact OD1-N 3.44Å; Q250-W252 VanDerWaalsContact C-N 3.27Å; Q250-W252 PolarHBondContact O-N 3.03Å; Q250-M253 PolarHBondContact O-N 3.41Å; Q250-D254 PolarHBondContact NE2-OD1 3.48Å; Q250-D254 WeakPolarHBondContact O-CB 3.21Å; Q250-D254 PolarHBondContact O-N 2.86Å
251	V	90.9	Very high	90.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-41.4	177.1	171.4	0	0	0	0	110.9	N37 F42 P45 R245 L246 D248 P249 A255	N37-V251 HydrophobicContact CB-CB 4.36Å; N37-V251 HydrophobicContact CB-CG1 4.09Å; N37-V251 HydrophobicContact CB-CG2 3.87Å; F42-V251 HydrophobicContact CD2-CG1 4.06Å; P45-V251 HydrophobicContact CG-CG1 3.85Å; R245-V251 HydrophobicContact CB-CG2 4.22Å; R245-V251 WeakPolarHBondContact O-CG2 3.47Å; L246-V251 HydrophobicContact CD2-CG1 4.27Å; D248-V251 HydrophobicContact CB-CG2 4.19Å; D248-V251 VanDerWaalsContact O-CB 3.31Å; D248-V251 WeakPolarHBondContact O-CB 3.45Å; D248-V251 PolarHBondContact O-N 3.5Å; P249-V251 PolarHBondContact O-N 2.98Å; V251-A255 WeakPolarHBondContact O-CB 3.37Å; V251-A255 PolarHBondContact O-N 3.5Å
252	W	88.8	Confident	90.2	Very high	85 Å²	85	38 Å²	38	32%	0.322	22%	0.216	S	C	.	.	H	α-helix	trans	-70.9	-38.5	179.4	-65.6	82.2	0	0	0	111.7	P45 I48 F49 L246 P249 Q250 A255 G256	P45-W252 HydrophobicContact CB-CD2 3.78Å; P45-W252 HydrophobicContact CB-CE3 3.55Å; P45-W252 HydrophobicContact CB-CG 4.39Å; P45-W252 HydrophobicContact CB-CH2 4.21Å; P45-W252 HydrophobicContact CB-CZ2 4.41Å; P45-W252 HydrophobicContact CB-CZ3 3.78Å; I48-W252 HydrophobicContact CD1-CH2 3.69Å; I48-W252 HydrophobicContact CD1-CZ3 3.74Å; I48-W252 HydrophobicContact CG2-CZ3 4.47Å; F49-W252 HydrophobicContact CE2-CB 4.43Å; F49-W252 HydrophobicContact CE2-CE3 4.13Å; F49-W252 WeakPolarHBondContact CE2-O 3.45Å; L246-W252 PolarHBondContact O-NE1 2.61Å; P249-W252 PolarHBondContact O-N 3.14Å; Q250-W252 VanDerWaalsContact C-N 3.27Å; Q250-W252 PolarHBondContact O-N 3.03Å; W252-A255 PolarHBondContact O-N 2.95Å; W252-G256 PolarHBondContact O-N 3.33Å
253	M	85.4	Confident	90.1	Very high	18 Å²	18	34.1 Å²	34.1	9%	0.089	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-47.7	172.6	-65.3	-147.8	-69	0	0	112.4	P249 Q250 A255 G256 T257 T480 F483 S484	P249-M253 PolarHBondContact O-N 3.26Å; Q250-M253 PolarHBondContact O-N 3.41Å; M253-A255 VanDerWaalsContact C-N 3.26Å; M253-A255 PolarHBondContact O-N 2.92Å; M253-G256 PolarHBondContact O-N 3.14Å; M253-T257 WeakPolarHBondContact O-CB 3.22Å; M253-T257 VanDerWaalsContact O-CG2 3.27Å; M253-T257 WeakPolarHBondContact O-CG2 3.38Å; M253-T257 PolarHBondContact O-N 3.27Å; M253-T257 PolarHBondContact O-OG1 2.92Å; M253-T480 HydrophobicContact CB-CG2 4.34Å; M253-T480 HydrophobicContact CG-CG2 3.98Å; M253-F483 HydrophobicContact CE-CD1 3.77Å; M253-F483 HydrophobicContact CE-CE1 3.7Å; M253-F483 HydrophobicContact CG-CD1 3.5Å; M253-F483 HydrophobicContact CG-CE1 3.98Å; M253-F483 HydrophobicContact SD-CD1 3.41Å; M253-F483 WeakPolarHBondContact SD-CD1 3.23Å; M253-F483 HydrophobicContact SD-CE1 3.98Å; M253-F483 HydrophobicContact SD-CG 4.43Å; M253-S484 WeakPolarHBondContact SD-CA 3.35Å; M253-S484 WeakPolarHBondContact SD-CB 3.5Å; M253-S484 PolarHBondContact SD-N 3.32Å; M253-S484 VanDerWaalsContact SD-N 3.43Å
254	D	88.9	Confident	90	Very high	15 Å²	15	29 Å²	29	8%	0.08	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-39	179.2	-76.6	5.5	0	0	0	110.2	L33 K36 N37 F42 Q250 T257 Q258	L33-D254 HydrophobicContact CD2-CB 4.07Å; K36-D254 IonicContact NZ-OD2 2.81Å; K36-D254 PolarHBondContact NZ-OD2 3.37Å; N37-D254 VanDerWaalsContact ND2-CB 3.27Å; N37-D254 WeakPolarHBondContact ND2-CB 3.4Å; N37-D254 PolarHBondContact ND2-OD2 3.17Å; F42-D254 HydrophobicContact CE2-CB 4.26Å; Q250-D254 PolarHBondContact NE2-OD1 3.48Å; Q250-D254 WeakPolarHBondContact O-CB 3.21Å; Q250-D254 PolarHBondContact O-N 2.86Å; D254-T257 PolarHBondContact O-OG1 3.25Å; D254-Q258 WeakPolarHBondContact O-CB 3.34Å; D254-Q258 PolarHBondContact O-N 3.17Å
255	A	91.7	Very high	89.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.1	-50.3	175.4	0	0	0	0	0	112.9	F42 P45 F49 V251 W252 M253 Q258 I259	F42-A255 HydrophobicContact CD2-CB 4.43Å; F42-A255 HydrophobicContact CE2-CB 3.66Å; F42-A255 HydrophobicContact CZ-CB 3.95Å; P45-A255 HydrophobicContact CB-CB 3.83Å; P45-A255 HydrophobicContact CG-CB 4.18Å; F49-A255 HydrophobicContact CD2-CB 4.09Å; V251-A255 WeakPolarHBondContact O-CB 3.37Å; V251-A255 PolarHBondContact O-N 3.5Å; W252-A255 PolarHBondContact O-N 2.95Å; M253-A255 VanDerWaalsContact C-N 3.26Å; M253-A255 PolarHBondContact O-N 2.92Å; A255-Q258 PolarHBondContact O-N 3.48Å; A255-I259 PolarHBondContact O-N 3.09Å; A255-I259 VanDerWaalsContact O-N 3.08Å
256	G	89.1	Confident	90	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-49.9	179.5	0	0	0	0	0	111.8	W252 M253 Q258 I259 F260	W252-G256 PolarHBondContact O-N 3.33Å; M253-G256 PolarHBondContact O-N 3.14Å; G256-Q258 VanDerWaalsContact C-N 3.32Å; G256-Q258 PolarHBondContact O-N 2.97Å; G256-I259 PolarHBondContact O-N 3.11Å; G256-F260 WeakPolarHBondContact O-CD2 3.31Å; G256-F260 PolarHBondContact O-N 3.19Å; G256-F260 VanDerWaalsContact O-N 3.08Å
257	T	86.6	Confident	89.9	Confident	20 Å²	20	21.8 Å²	21.8	12%	0.123	12%	0.124	C	C	.	.	H	α-helix	trans	-61.4	-40.5	177.9	58.9	0	0	0	0	111.8	M253 D254 I259 F260 F261	M253-T257 WeakPolarHBondContact O-CB 3.22Å; M253-T257 VanDerWaalsContact O-CG2 3.27Å; M253-T257 WeakPolarHBondContact O-CG2 3.38Å; M253-T257 PolarHBondContact O-N 3.27Å; M253-T257 PolarHBondContact O-OG1 2.92Å; D254-T257 PolarHBondContact O-OG1 3.25Å; T257-I259 VanDerWaalsContact C-N 3.35Å; T257-I259 PolarHBondContact O-N 3.47Å; T257-F260 PolarHBondContact O-N 3.04Å; T257-F261 WeakPolarHBondContact O-CD2 3.4Å; T257-F261 PolarHBondContact O-N 3.29Å
258	Q	91.7	Very high	89.8	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-59.6	-42.4	175.7	179.7	58.8	28.7	0	0	112.5	R29 F30 L33 Y46 D254 A255 G256 S262	R29-Q258 VanDerWaalsContact CD-OE1 3.24Å; R29-Q258 VanDerWaalsContact CG-OE1 3.31Å; F30-Q258 HydrophobicContact CD2-CG 4.12Å; L33-Q258 HydrophobicContact CD1-CB 3.79Å; L33-Q258 HydrophobicContact CD1-CG 4.1Å; Y46-Q258 HydrophobicContact CD2-CG 4.48Å; Y46-Q258 HydrophobicContact CE2-CG 4.07Å; D254-Q258 WeakPolarHBondContact O-CB 3.34Å; D254-Q258 PolarHBondContact O-N 3.17Å; A255-Q258 PolarHBondContact O-N 3.48Å; G256-Q258 VanDerWaalsContact C-N 3.32Å; G256-Q258 PolarHBondContact O-N 2.97Å; Q258-S262 WeakPolarHBondContact O-CB 3.47Å; Q258-S262 PolarHBondContact O-N 3.1Å
259	I	92.9	Very high	90	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.3	-47.3	175.8	-71.8	-69.2	0	0	0	110.3	Y46 F49 L50 A255 G256 T257 S262 Y263	Y46-I259 HydrophobicContact CD1-CD1 4.35Å; Y46-I259 HydrophobicContact CD2-CD1 3.76Å; Y46-I259 HydrophobicContact CD2-CG1 3.97Å; Y46-I259 HydrophobicContact CE1-CD1 3.96Å; Y46-I259 HydrophobicContact CE2-CD1 3.31Å; Y46-I259 HydrophobicContact CE2-CG1 3.89Å; Y46-I259 HydrophobicContact CG-CD1 4.26Å; Y46-I259 VanDerWaalsContact CZ-CD1 3.42Å; F49-I259 HydrophobicContact CB-CB 4.35Å; F49-I259 HydrophobicContact CB-CG1 3.89Å; L50-I259 HydrophobicContact CB-CD1 3.94Å; L50-I259 HydrophobicContact CD1-CD1 4.27Å; A255-I259 PolarHBondContact O-N 3.09Å; A255-I259 VanDerWaalsContact O-N 3.08Å; G256-I259 PolarHBondContact O-N 3.11Å; T257-I259 VanDerWaalsContact C-N 3.35Å; T257-I259 PolarHBondContact O-N 3.47Å; I259-S262 PolarHBondContact O-N 2.91Å; I259-Y263 HydrophobicContact CD1-CE2 4.03Å; I259-Y263 HydrophobicContact CG2-CD2 4.36Å; I259-Y263 VanDerWaalsContact O-CB 3.27Å; I259-Y263 WeakPolarHBondContact O-CB 3.32Å; I259-Y263 WeakPolarHBondContact O-CD2 3.21Å; I259-Y263 PolarHBondContact O-N 3.33Å
260	F	91.1	Very high	90.5	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.9	-48	-177.5	-82.9	-120.3	0	0	0	112.4	C53 G256 T257 A264 I265 L429 L430 S433 C477	C53-F260 HydrophobicContact CB-CE2 3.7Å; C53-F260 HydrophobicContact CB-CZ 4.14Å; G256-F260 WeakPolarHBondContact O-CD2 3.31Å; G256-F260 PolarHBondContact O-N 3.19Å; G256-F260 VanDerWaalsContact O-N 3.08Å; T257-F260 PolarHBondContact O-N 3.04Å; F260-A264 PolarHBondContact O-N 3.35Å; F260-I265 HydrophobicContact CB-CD1 4.32Å; F260-I265 HydrophobicContact CB-CG1 4.19Å; F260-I265 HydrophobicContact CD1-CD1 3.76Å; F260-I265 HydrophobicContact CD1-CG1 4.05Å; F260-I265 HydrophobicContact CD2-CD1 3.89Å; F260-I265 HydrophobicContact CE1-CD1 3.98Å; F260-I265 HydrophobicContact CE2-CD1 4.08Å; F260-I265 HydrophobicContact CG-CD1 3.73Å; F260-I265 HydrophobicContact CG-CG1 4.07Å; F260-I265 HydrophobicContact CZ-CD1 4.1Å; F260-I265 PolarHBondContact O-N 3.33Å; F260-L429 HydrophobicContact CB-CB 4.37Å; F260-L429 HydrophobicContact CB-CD1 4.21Å; F260-L429 HydrophobicContact CD1-CB 3.95Å; F260-L430 HydrophobicContact CD1-CD2 4.47Å; F260-L430 HydrophobicContact CE1-CD2 4.07Å; F260-L430 HydrophobicContact CE2-CD2 4.16Å; F260-L430 HydrophobicContact CZ-CD2 3.95Å; F260-S433 VanDerWaalsContact CE1-CB 3.42Å; F260-C477 WeakPolarHBondContact CZ-SG 3.39Å
261	F	86.7	Confident	90.9	Very high	43 Å²	43	10 Å²	10	19%	0.189	5%	0.047	C	C	.	.	H	α-helix	trans	-64.6	-48.4	176.4	-80.5	-65.3	0	0	0	112.7	T257 Y263 A264 A424 S425 L429	T257-F261 WeakPolarHBondContact O-CD2 3.4Å; T257-F261 PolarHBondContact O-N 3.29Å; F261-Y263 PolarHBondContact O-N 2.98Å; F261-A264 PolarHBondContact O-N 3Å; F261-A424 HydrophobicContact CE1-CB 4.32Å; F261-A424 WeakPolarHBondContact CE1-O 3.4Å; F261-A424 WeakPolarHBondContact CZ-O 3.36Å; F261-S425 VanDerWaalsContact CZ-C 3.46Å; F261-L429 HydrophobicContact CD1-CD1 3.74Å; F261-L429 HydrophobicContact CD2-CD1 4.41Å; F261-L429 HydrophobicContact CE1-CD1 3.49Å; F261-L429 VanDerWaalsContact CE1-CD1 3.49Å; F261-L429 HydrophobicContact CE2-CD1 4.2Å; F261-L429 HydrophobicContact CG-CD1 4.16Å; F261-L429 HydrophobicContact CZ-CD1 3.71Å
262	S	91.6	Very high	91.1	Very high	7 Å²	7	10 Å²	10	5%	0.049	5%	0.048	C	C	.	.	H	α-helix	trans	-67.2	-26.8	-175.7	-177.1	0	0	0	0	112.4	I21 N26 Q258 I259 N294	I21-S262 CarbonylContact C-O 3.59Å; N26-S262 PolarHBondContact ND2-OG 2.98Å; N26-S262 VanDerWaalsContact ND2-OG 3.17Å; Q258-S262 WeakPolarHBondContact O-CB 3.47Å; Q258-S262 PolarHBondContact O-N 3.1Å; I259-S262 PolarHBondContact O-N 2.91Å; S262-N294 PolarHBondContact O-ND2 3.46Å; S262-N294 PolarHBondContact OG-ND2 3.36Å; S262-N294 PolarHBondContact OG-OD1 2.91Å
263	Y	92.1	Very high	91.4	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-4	179.4	-77.5	-123.1	0	0	0	112.2	L50 F58 I259 F261 I265 C291 N294 S295	L50-Y263 HydrophobicContact CD1-CE1 3.86Å; L50-Y263 HydrophobicContact CD1-CE2 4.28Å; L50-Y263 VanDerWaalsContact CD1-CZ 3.45Å; L50-Y263 WeakPolarHBondContact CD1-OH 3.37Å; F58-Y263 HydrophobicContact CB-CD1 4.47Å; F58-Y263 AromaticContact CD2-CD1 3.85Å; F58-Y263 HydrophobicContact CD2-CD1 3.85Å; F58-Y263 HydrophobicContact CD2-CG 4.49Å; F58-Y263 HydrophobicContact CE2-CD1 4.49Å; F58-Y263 HydrophobicContact CG-CD1 4.41Å; I259-Y263 HydrophobicContact CD1-CE2 4.03Å; I259-Y263 HydrophobicContact CG2-CD2 4.36Å; I259-Y263 VanDerWaalsContact O-CB 3.27Å; I259-Y263 WeakPolarHBondContact O-CB 3.32Å; I259-Y263 WeakPolarHBondContact O-CD2 3.21Å; I259-Y263 PolarHBondContact O-N 3.33Å; F261-Y263 PolarHBondContact O-N 2.98Å; Y263-I265 PolarHBondContact O-N 3.18Å; Y263-C291 HydrophobicContact CE1-CB 3.57Å; Y263-C291 WeakPolarHBondContact CE1-SG 3.48Å; Y263-C291 PolarHBondContact OH-O 3.12Å; Y263-N294 WeakPolarHBondContact CD2-ND2 3.27Å; Y263-N294 HydrophobicContact CE2-CB 4.29Å; Y263-N294 WeakPolarHBondContact CE2-ND2 3.34Å; Y263-S295 PolarHBondContact OH-OG 2.91Å
264	A	90.7	Very high	91.9	Very high	9 Å²	9	5.2 Å²	5.2	7%	0.074	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	31.4	-175	0	0	0	0	0	113.3	F260 F261 L267	F260-A264 PolarHBondContact O-N 3.35Å; F261-A264 PolarHBondContact O-N 3Å; A264-L267 HydrophobicContact CB-CD1 3.98Å
265	I	93.7	Very high	92.2	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	150.5	-179.8	53.8	167.1	0	0	0	111.4	V57 F58 E61 F260 Y263 L267 L270	V57-I265 HydrophobicContact CB-CD1 3.97Å; V57-I265 HydrophobicContact CG1-CB 3.94Å; V57-I265 HydrophobicContact CG1-CD1 3.99Å; V57-I265 HydrophobicContact CG1-CG2 4.27Å; F58-I265 HydrophobicContact CB-CG2 3.95Å; F58-I265 HydrophobicContact CD2-CG2 3.93Å; F58-I265 HydrophobicContact CG-CG2 4.42Å; E61-I265 WeakPolarHBondContact OE2-CA 3.26Å; F260-I265 HydrophobicContact CB-CD1 4.32Å; F260-I265 HydrophobicContact CB-CG1 4.19Å; F260-I265 HydrophobicContact CD1-CD1 3.76Å; F260-I265 HydrophobicContact CD1-CG1 4.05Å; F260-I265 HydrophobicContact CD2-CD1 3.89Å; F260-I265 HydrophobicContact CE1-CD1 3.98Å; F260-I265 HydrophobicContact CE2-CD1 4.08Å; F260-I265 HydrophobicContact CG-CD1 3.73Å; F260-I265 HydrophobicContact CG-CG1 4.07Å; F260-I265 HydrophobicContact CZ-CD1 4.1Å; F260-I265 PolarHBondContact O-N 3.33Å; Y263-I265 PolarHBondContact O-N 3.18Å; I265-L267 PolarHBondContact O-N 3.25Å; I265-L270 HydrophobicContact CG2-CD1 3.78Å
266	C	93.1	Very high	92.3	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	27.8	-177.8	-53	0	0	0	0	113.1	E61 T90 L429 M432 S433 E436	E61-C266 VanDerWaalsContact CD-N 3.29Å; E61-C266 VanDerWaalsContact OE1-CA 3.22Å; E61-C266 WeakPolarHBondContact OE1-CA 3.41Å; E61-C266 PolarHBondContact OE1-N 3.26Å; E61-C266 PolarHBondContact OE2-N 2.95Å; E61-C266 VanDerWaalsContact OE2-N 3.14Å; T90-C266 WeakPolarHBondContact CG2-O 3.37Å; C266-L429 HydrophobicContact CB-CD2 4.47Å; C266-M432 HydrophobicContact CB-CB 3.78Å; C266-S433 VanDerWaalsContact SG-CA 3.57Å; C266-S433 WeakPolarHBondContact SG-CB 3.42Å; C266-E436 PolarHBondContact SG-OE2 3.31Å
267	L	90.5	Very high	92.6	Very high	8 Å²	8	5.9 Å²	5.9	4%	0.042	3%	0.031	C	C	.	.	S	Bend	trans	-106.8	-8.5	170.4	-65.1	177.9	0	0	0	111.3	I93 V94 L97 A264 I265 S269 L429	I93-L267 HydrophobicContact CB-CD2 4.27Å; I93-L267 HydrophobicContact CG2-CD2 3.41Å; I93-L267 VanDerWaalsContact CG2-CD2 3.41Å; V94-L267 HydrophobicContact CG2-CB 3.99Å; V94-L267 HydrophobicContact CG2-CD2 4.47Å; V94-L267 WeakPolarHBondContact CG2-O 3.27Å; L97-L267 HydrophobicContact CD1-CD1 4.32Å; A264-L267 HydrophobicContact CB-CD1 3.98Å; I265-L267 PolarHBondContact O-N 3.25Å; L267-S269 PolarHBondContact O-N 3.48Å; L267-S269 VanDerWaalsContact O-N 3.13Å; L267-L429 HydrophobicContact CD2-CD2 3.64Å; L267-L429 HydrophobicContact CG-CD2 4.25Å
268	G	89.8	Confident	93	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.01	5%	0.051	C	C	.	.	S	Bend	trans	71.8	-4.4	-173.9	0	0	0	0	0	114.7	E61 T271 A272 S370	E61-G268 PolarHBondContact OE1-N 3.03Å; G268-T271 WeakPolarHBondContact O-CB 3.44Å; G268-T271 PolarHBondContact O-N 3.31Å; G268-A272 PolarHBondContact O-N 3.11Å; G268-S370 PolarHBondContact O-OG 2.83Å
269	S	92.8	Very high	93	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.007	6%	0.063	C	C	.	.	H	α-helix	trans	-66.1	-42.7	177.2	-56.1	0	0	0	0	112.2	L267 T271 A272 L273 S370	L267-S269 PolarHBondContact O-N 3.48Å; L267-S269 VanDerWaalsContact O-N 3.13Å; S269-T271 VanDerWaalsContact C-N 3.35Å; S269-A272 WeakPolarHBondContact O-CB 3.33Å; S269-A272 PolarHBondContact O-N 2.83Å; S269-L273 WeakPolarHBondContact O-CG 3.15Å; S269-L273 PolarHBondContact O-N 3.27Å; S269-S370 WeakPolarHBondContact CA-OG 3.19Å; S269-S370 PolarHBondContact N-OG 3.38Å
270	L	95.6	Very high	93	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-65.7	-38.7	175.5	-64.8	178.9	0	0	0	111.9	V17 I21 F58 E61 V62 I265 A272 L273 G274	V17-L270 HydrophobicContact CG1-CD2 3.95Å; I21-L270 HydrophobicContact CG2-CD2 4.39Å; F58-L270 HydrophobicContact CD1-CD1 4.5Å; F58-L270 HydrophobicContact CD2-CD1 3.27Å; F58-L270 HydrophobicContact CD2-CD2 4.45Å; F58-L270 HydrophobicContact CD2-CG 4.5Å; F58-L270 HydrophobicContact CE2-CD1 3.34Å; F58-L270 HydrophobicContact CE2-CD2 3.67Å; F58-L270 HydrophobicContact CE2-CG 4.17Å; F58-L270 HydrophobicContact CG-CD1 3.9Å; F58-L270 HydrophobicContact CZ-CD1 4.04Å; F58-L270 HydrophobicContact CZ-CD2 3.79Å; E61-L270 HydrophobicContact CB-CB 3.92Å; E61-L270 WeakPolarHBondContact OE2-CD1 3.36Å; V62-L270 HydrophobicContact CG2-CB 4.01Å; I265-L270 HydrophobicContact CG2-CD1 3.78Å; L270-A272 VanDerWaalsContact C-N 3.34Å; L270-A272 PolarHBondContact O-N 3.35Å; L270-L273 PolarHBondContact O-N 3.18Å; L270-G274 PolarHBondContact O-N 3.19Å
271	T	95.7	Very high	93.2	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-60.1	-44.5	172.1	-50.5	0	0	0	0	110.9	E61 G65 C75 G268 S269 S275	E61-T271 WeakPolarHBondContact O-CA 3.41Å; G65-T271 VanDerWaalsContact CA-O 3.3Å; G65-T271 WeakPolarHBondContact CA-O 3.32Å; C75-T271 HydrophobicContact CB-CG2 4.22Å; G268-T271 WeakPolarHBondContact O-CB 3.44Å; G268-T271 PolarHBondContact O-N 3.31Å; S269-T271 VanDerWaalsContact C-N 3.35Å; T271-S275 WeakPolarHBondContact O-CB 3.27Å; T271-S275 PolarHBondContact O-N 2.88Å
272	A	94.6	Very high	93.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.008	10%	0.101	C	C	.	.	H	α-helix	trans	-63.4	-48.6	176	0	0	0	0	0	112	G268 S269 L270 G274 S275 Y276 T373	G268-A272 PolarHBondContact O-N 3.11Å; S269-A272 WeakPolarHBondContact O-CB 3.33Å; S269-A272 PolarHBondContact O-N 2.83Å; L270-A272 VanDerWaalsContact C-N 3.34Å; L270-A272 PolarHBondContact O-N 3.35Å; A272-G274 PolarHBondContact O-N 2.93Å; A272-S275 WeakPolarHBondContact O-CB 3.44Å; A272-S275 PolarHBondContact O-N 3.26Å; A272-S275 PolarHBondContact O-OG 3.14Å; A272-Y276 WeakPolarHBondContact O-CD2 3.39Å; A272-T373 HydrophobicContact CB-CG2 4.26Å
273	L	95	Very high	93.8	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.016	10%	0.099	C	C	.	.	H	α-helix	trans	-63.6	-40.7	178.4	-65.6	179.3	0	0	0	112.3	W7 F13 V17 S269 L270 S275 Y276 V366	W7-L273 HydrophobicContact CH2-CD2 3.89Å; W7-L273 HydrophobicContact CZ2-CB 4.34Å; W7-L273 HydrophobicContact CZ2-CD2 3.64Å; W7-L273 PolarHBondContact NE1-O 3.37Å; F13-L273 HydrophobicContact CE2-CB 4.38Å; V17-L273 HydrophobicContact CB-CD1 4.5Å; V17-L273 HydrophobicContact CG2-CB 4.28Å; V17-L273 HydrophobicContact CG2-CD1 3.76Å; S269-L273 WeakPolarHBondContact O-CG 3.15Å; S269-L273 PolarHBondContact O-N 3.27Å; L270-L273 PolarHBondContact O-N 3.18Å; L273-S275 VanDerWaalsContact C-N 3.29Å; L273-S275 PolarHBondContact O-N 3.08Å; L273-Y276 PolarHBondContact O-N 2.84Å; L273-V366 HydrophobicContact CD1-CG1 3.76Å; L273-V366 HydrophobicContact CD1-CG2 4.37Å; L273-V366 HydrophobicContact CD2-CG1 4.31Å; L273-V366 HydrophobicContact CG-CG1 4.14Å
274	G	95.5	Very high	94	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.4	-33.4	175.8	0	0	0	0	0	112.8	Q66 L270 A272 Y276 N277	Q66-G274 VanDerWaalsContact CA-O 3.28Å; Q66-G274 WeakPolarHBondContact CA-O 3.23Å; Q66-G274 PolarHBondContact N-O 3.48Å; L270-G274 PolarHBondContact O-N 3.19Å; A272-G274 PolarHBondContact O-N 2.93Å; G274-Y276 PolarHBondContact O-N 3.09Å; G274-Y276 VanDerWaalsContact O-N 3.12Å; G274-N277 VanDerWaalsContact O-CB 3.26Å; G274-N277 WeakPolarHBondContact O-CB 3.24Å; G274-N277 PolarHBondContact O-N 3.43Å
275	S	95.9	Very high	94.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.014	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.4	179.1	79.1	0	0	0	0	115.6	R4 G65 Q70 T271 A272 L273	R4-S275 PolarHBondContact NE-O 2.87Å; R4-S275 PolarHBondContact NH2-OG 2.85Å; G65-S275 VanDerWaalsContact O-CA 3.23Å; G65-S275 WeakPolarHBondContact O-CA 3.33Å; Q70-S275 VanDerWaalsContact O-CB 3.31Å; Q70-S275 WeakPolarHBondContact O-CB 3.27Å; T271-S275 WeakPolarHBondContact O-CB 3.27Å; T271-S275 PolarHBondContact O-N 2.88Å; A272-S275 WeakPolarHBondContact O-CB 3.44Å; A272-S275 PolarHBondContact O-N 3.26Å; A272-S275 PolarHBondContact O-OG 3.14Å; L273-S275 VanDerWaalsContact C-N 3.29Å; L273-S275 PolarHBondContact O-N 3.08Å
276	Y	94.6	Very high	94.3	Very high	18 Å²	18	31.4 Å²	31.4	7%	0.071	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.4	176	-66.5	-68.3	0	0	0	112.6	R4 G5 Q6 W7 V200 A272 L273 G274 T373	R4-Y276 HydrophobicContact CG-CD1 4.46Å; R4-Y276 HydrophobicContact CG-CE1 4.15Å; G5-Y276 VanDerWaalsContact O-CD1 3.28Å; G5-Y276 WeakPolarHBondContact O-CD1 3.25Å; Q6-Y276 WeakPolarHBondContact CA-O 3.31Å; W7-Y276 VanDerWaalsContact CD1-C 3.42Å; W7-Y276 VanDerWaalsContact CD1-O 3.26Å; W7-Y276 PolarHBondContact N-O 2.87Å; V200-Y276 HydrophobicContact CG1-CD1 4.1Å; V200-Y276 HydrophobicContact CG1-CD2 3.4Å; V200-Y276 VanDerWaalsContact CG1-CD2 3.4Å; V200-Y276 HydrophobicContact CG1-CE1 4.25Å; V200-Y276 HydrophobicContact CG1-CE2 3.58Å; V200-Y276 HydrophobicContact CG1-CG 3.67Å; V200-Y276 HydrophobicContact CG2-CD1 3.99Å; V200-Y276 HydrophobicContact CG2-CE1 4.29Å; V200-Y276 HydrophobicContact CG2-CG 4.21Å; A272-Y276 WeakPolarHBondContact O-CD2 3.39Å; L273-Y276 PolarHBondContact O-N 2.84Å; G274-Y276 PolarHBondContact O-N 3.09Å; G274-Y276 VanDerWaalsContact O-N 3.12Å; Y276-T373 HydrophobicContact CE2-CG2 4.02Å; Y276-T373 WeakPolarHBondContact OH-CG2 3.38Å; Y276-T373 PolarHBondContact OH-OG1 3.22Å
277	N	95.6	Very high	94.4	Very high	9 Å²	9	31.5 Å²	31.5	5%	0.048	14%	0.141	C	C	.	.	S	Bend	trans	-71.9	156.3	174.2	-73.7	-18	0	0	0	111.5	W7 F13 Q66 G274 N281	W7-N277 PolarHBondContact NE1-OD1 3.25Å; F13-N277 WeakPolarHBondContact CD2-OD1 3.39Å; F13-N277 WeakPolarHBondContact CE2-ND2 3.45Å; F13-N277 VanDerWaalsContact CG-OD1 3.22Å; F13-N277 WeakPolarHBondContact CG-OD1 3.44Å; F13-N277 WeakPolarHBondContact CZ-ND2 3.23Å; Q66-N277 HydrophobicContact CB-CB 4.42Å; Q66-N277 HydrophobicContact CG-CB 3.92Å; Q66-N277 PolarHBondContact OE1-ND2 3.06Å; G274-N277 VanDerWaalsContact O-CB 3.26Å; G274-N277 WeakPolarHBondContact O-CB 3.24Å; G274-N277 PolarHBondContact O-N 3.43Å; N277-N281 HydrophobicContact CB-CB 4.4Å
278	K	93.3	Very high	94.7	Very high	123 Å²	123	33.3 Å²	33.3	54%	0.535	15%	0.15	S	C	.	.			trans	-67.3	143.8	165.3	-61.8	-177	-178.7	-178.3	0	109	Q66 N280 N281	Q66-K278 PolarHBondContact NE2-O 3.35Å; K278-N280 PolarHBondContact O-N 3Å; K278-N280 VanDerWaalsContact O-N 3.14Å; K278-N281 WeakPolarHBondContact O-CB 3.32Å; K278-N281 PolarHBondContact O-N 3.17Å
279	Y	91.9	Very high	95	Very high	65 Å²	65	36.2 Å²	36.2	26%	0.255	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-39.2	-179.5	-171.1	-96	0	0	0	112.7	Q66 Y67 N281 D455 M456 P548	Q66-Y279 PolarHBondContact NE2-O 3Å; Y67-Y279 HydrophobicContact CD2-CE2 4.12Å; Y279-N281 PolarHBondContact O-N 3.21Å; Y279-D455 WeakPolarHBondContact CE1-OD2 3.32Å; Y279-D455 PolarHBondContact OH-OD2 3.23Å; Y279-D455 VanDerWaalsContact OH-OD2 3.09Å; Y279-M456 HydrophobicContact CD1-CG 4.17Å; Y279-M456 HydrophobicContact CD2-CG 4.2Å; Y279-M456 HydrophobicContact CE1-CB 4.37Å; Y279-M456 HydrophobicContact CE1-CG 3.73Å; Y279-M456 HydrophobicContact CE2-CG 3.78Å; Y279-M456 HydrophobicContact CE2-SD 4.4Å; Y279-M456 HydrophobicContact CG-CG 4.39Å; Y279-M456 WeakPolarHBondContact O-CB 3.14Å; Y279-P548 HydrophobicContact CE2-CB 3.89Å; Y279-P548 HydrophobicContact CE2-CG 4Å
280	N	93.4	Very high	95.2	Very high	121 Å²	121	36.3 Å²	36.3	65%	0.647	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	11.5	-178.3	69.2	-16.2	0	0	0	115.3	K278 M456	K278-N280 PolarHBondContact O-N 3Å; K278-N280 VanDerWaalsContact O-N 3.14Å; N280-M456 VanDerWaalsContact CA-O 3.26Å; N280-M456 WeakPolarHBondContact CA-O 3.32Å
281	N	94.7	Very high	95.2	Very high	25 Å²	25	36.4 Å²	36.4	13%	0.134	18%	0.175	C	C	.	.	S	Bend	trans	-69.9	137.3	175.9	-179.6	58	0	0	0	110.2	K10 Q66 N277 K278 Y279 C283 D286	K10-N281 PolarHBondContact NZ-OD1 3.11Å; Q66-N281 PolarHBondContact NE2-O 3.5Å; N277-N281 HydrophobicContact CB-CB 4.4Å; K278-N281 WeakPolarHBondContact O-CB 3.32Å; K278-N281 PolarHBondContact O-N 3.17Å; Y279-N281 PolarHBondContact O-N 3.21Å; N281-C283 PolarHBondContact O-N 3.26Å; N281-D286 PolarHBondContact ND2-OD2 2.96Å
282	N	95.9	Very high	95.2	Very high	40 Å²	40	41.1 Å²	41.1	21%	0.214	20%	0.195	C	C	.	.			trans	-75.1	79.4	175.3	-172.2	-21.1	0	0	0	110.9	Y284 R285 D286 Y459	N282-Y284 VanDerWaalsContact C-N 3.27Å; N282-Y284 PolarHBondContact O-N 3.16Å; N282-Y284 PolarHBondContact OD1-N 3.44Å; N282-R285 PolarHBondContact OD1-N 3.23Å; N282-D286 PolarHBondContact O-N 2.65Å; N282-Y459 WeakPolarHBondContact ND2-CE1 3.15Å; N282-Y459 PolarHBondContact ND2-OH 3.22Å; N282-Y459 PolarHBondContact OD1-OH 3.29Å
283	C	95.6	Very high	95.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-28.3	178.9	56.3	0	0	0	0	112.7	V62 N281 D286 C287	V62-C283 HydrophobicContact CG1-CB 4.01Å; N281-C283 PolarHBondContact O-N 3.26Å; C283-D286 PolarHBondContact O-N 3.48Å; C283-C287 WeakPolarHBondContact O-CB 3.24Å; C283-C287 PolarHBondContact O-N 3.38Å; C283-C287 PolarHBondContact O-SG 3.22Å
284	Y	95.9	Very high	95.3	Very high	49 Å²	49	44 Å²	44	19%	0.192	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-51.2	179.6	178.9	-106.4	0	0	0	112.1	F59 N282 D286 C287 L288 Y459 P461 I465	F59-Y284 HydrophobicContact CD1-CD2 4.13Å; F59-Y284 HydrophobicContact CD2-CD2 4.16Å; F59-Y284 AromaticContact CE1-CD2 3.83Å; F59-Y284 HydrophobicContact CE1-CD2 3.83Å; F59-Y284 VanDerWaalsContact CE2-CA 3.4Å; F59-Y284 AromaticContact CE2-CD2 3.89Å; F59-Y284 HydrophobicContact CE2-CD2 3.89Å; F59-Y284 HydrophobicContact CE2-CG 4.28Å; F59-Y284 HydrophobicContact CG-CD2 4.28Å; F59-Y284 AromaticContact CZ-CD2 3.71Å; F59-Y284 HydrophobicContact CZ-CD2 3.71Å; F59-Y284 HydrophobicContact CZ-CG 4.26Å; N282-Y284 VanDerWaalsContact C-N 3.27Å; N282-Y284 PolarHBondContact O-N 3.16Å; N282-Y284 PolarHBondContact OD1-N 3.44Å; Y284-D286 VanDerWaalsContact C-N 3.3Å; Y284-D286 PolarHBondContact O-N 2.61Å; Y284-C287 PolarHBondContact O-N 3.35Å; Y284-L288 HydrophobicContact CD1-CD1 4.13Å; Y284-L288 HydrophobicContact CE1-CD1 3.56Å; Y284-L288 HydrophobicContact CE1-CG 4.5Å; Y284-L288 HydrophobicContact CE2-CD1 4.21Å; Y284-L288 HydrophobicContact CE2-CG 4.44Å; Y284-L288 WeakPolarHBondContact O-CG 3.19Å; Y284-L288 PolarHBondContact O-N 3.33Å; Y284-L288 VanDerWaalsContact O-N 3.08Å; Y284-Y459 HydrophobicContact CD1-CE2 4.24Å; Y284-Y459 WeakPolarHBondContact CD1-OH 3.33Å; Y284-P461 HydrophobicContact CD2-CB 4.08Å; Y284-P461 HydrophobicContact CD2-CG 4.27Å; Y284-P461 HydrophobicContact CE2-CB 3.95Å; Y284-I465 HydrophobicContact CE2-CG1 4.41Å
285	R	94.8	Very high	95.3	Very high	181 Å²	181	44.7 Å²	44.7	68%	0.683	22%	0.215	S	C	*	.	H	α-helix	trans	-63.8	-39.1	178	-174.9	176.4	177.1	-179.8	-0.7	111.6	N282 A289	N282-R285 PolarHBondContact OD1-N 3.23Å; R285-A289 WeakPolarHBondContact O-CB 3.45Å; R285-A289 PolarHBondContact O-N 3.17Å; R285-A289 VanDerWaalsContact O-N 3.09Å
286	D	95.7	Very high	95.3	Very high	12 Å²	12	47.6 Å²	47.6	6%	0.064	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-47.2	179.4	-63.3	-14	0	0	0	110.7	K10 F13 N281 N282 C283 Y284 L288 A289 L290	K10-D286 WeakPolarHBondContact CE-OD1 3.08Å; K10-D286 WeakPolarHBondContact CE-OD2 3.48Å; K10-D286 IonicContact NZ-OD1 3.87Å; K10-D286 PolarHBondContact NZ-OD1 3.28Å; K10-D286 IonicContact NZ-OD2 3.14Å; K10-D286 PolarHBondContact NZ-OD2 2.98Å; F13-D286 HydrophobicContact CE1-CB 4.17Å; N281-D286 PolarHBondContact ND2-OD2 2.96Å; N282-D286 PolarHBondContact O-N 2.65Å; C283-D286 PolarHBondContact O-N 3.48Å; Y284-D286 VanDerWaalsContact C-N 3.3Å; Y284-D286 PolarHBondContact O-N 2.61Å; D286-L288 PolarHBondContact O-N 2.91Å; D286-A289 PolarHBondContact O-N 3.47Å; D286-L290 WeakPolarHBondContact O-CB 3.27Å; D286-L290 WeakPolarHBondContact O-CD1 2.76Å; D286-L290 VanDerWaalsContact O-CG 3.25Å; D286-L290 WeakPolarHBondContact O-CG 3.39Å; D286-L290 PolarHBondContact O-N 3.49Å
287	C	96.3	Very high	95.3	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-59.7	-48	177.6	-69.4	0	0	0	0	111.7	F58 F59 C283 Y284 A289 L290 C291	F58-C287 HydrophobicContact CD1-CB 3.78Å; F58-C287 HydrophobicContact CE1-CB 4.07Å; F59-C287 HydrophobicContact CB-CB 4.24Å; F59-C287 HydrophobicContact CD2-CB 4.15Å; C283-C287 WeakPolarHBondContact O-CB 3.24Å; C283-C287 PolarHBondContact O-N 3.38Å; C283-C287 PolarHBondContact O-SG 3.22Å; Y284-C287 PolarHBondContact O-N 3.35Å; C287-A289 VanDerWaalsContact C-N 3.35Å; C287-A289 PolarHBondContact O-N 2.91Å; C287-L290 PolarHBondContact O-N 3.09Å; C287-C291 WeakPolarHBondContact O-CB 3.35Å; C287-C291 PolarHBondContact O-N 2.91Å; C287-C291 PolarHBondContact O-SG 3.16Å
288	L	95.9	Very high	95.2	Very high	47 Å²	47	47 Å²	47	25%	0.246	23%	0.234	C	C	.	.	H	α-helix	trans	-57.9	-47.8	177.8	-70.9	179.2	0	0	0	111.8	V55 Y284 D286 L290 C291 F292	V55-L288 HydrophobicContact CG1-CD2 3.59Å; Y284-L288 HydrophobicContact CD1-CD1 4.13Å; Y284-L288 HydrophobicContact CE1-CD1 3.56Å; Y284-L288 HydrophobicContact CE1-CG 4.5Å; Y284-L288 HydrophobicContact CE2-CD1 4.21Å; Y284-L288 HydrophobicContact CE2-CG 4.44Å; Y284-L288 WeakPolarHBondContact O-CG 3.19Å; Y284-L288 PolarHBondContact O-N 3.33Å; Y284-L288 VanDerWaalsContact O-N 3.08Å; D286-L288 PolarHBondContact O-N 2.91Å; L288-L290 PolarHBondContact O-N 2.98Å; L288-C291 PolarHBondContact O-N 3.38Å; L288-F292 WeakPolarHBondContact O-CD2 3.41Å; L288-F292 PolarHBondContact O-N 3.36Å; L288-F292 VanDerWaalsContact O-N 3.08Å
289	A	96.8	Very high	95.3	Very high	61 Å²	61	44.4 Å²	44.4	50%	0.504	22%	0.223	S	C	.	.	H	α-helix	trans	-61.8	-43.3	179.6	0	0	0	0	0	112.1	R285 D286 C287 F292 L293	R285-A289 WeakPolarHBondContact O-CB 3.45Å; R285-A289 PolarHBondContact O-N 3.17Å; R285-A289 VanDerWaalsContact O-N 3.09Å; D286-A289 PolarHBondContact O-N 3.47Å; C287-A289 VanDerWaalsContact C-N 3.35Å; C287-A289 PolarHBondContact O-N 2.91Å; A289-F292 PolarHBondContact O-N 3.41Å; A289-L293 VanDerWaalsContact O-CB 3.27Å; A289-L293 WeakPolarHBondContact O-CB 3.32Å; A289-L293 PolarHBondContact O-N 3.32Å
290	L	96.9	Very high	95.4	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-66.5	-41.6	179.6	-74.6	163.7	0	0	0	112.5	V14 V17 A18 I21 F58 D286 C287 L288 L293 N294	V14-L290 HydrophobicContact CG1-CD2 4.04Å; V17-L290 HydrophobicContact CB-CD1 3.86Å; V17-L290 HydrophobicContact CB-CD2 4.36Å; V17-L290 HydrophobicContact CG1-CD1 3.65Å; V17-L290 HydrophobicContact CG1-CD2 4.34Å; V17-L290 HydrophobicContact CG1-CG 4.46Å; A18-L290 HydrophobicContact CB-CD2 3.96Å; I21-L290 HydrophobicContact CD1-CB 4.05Å; I21-L290 HydrophobicContact CD1-CD2 4.41Å; F58-L290 HydrophobicContact CE1-CB 4.39Å; F58-L290 HydrophobicContact CZ-CB 4.34Å; D286-L290 WeakPolarHBondContact O-CB 3.27Å; D286-L290 WeakPolarHBondContact O-CD1 2.76Å; D286-L290 VanDerWaalsContact O-CG 3.25Å; D286-L290 WeakPolarHBondContact O-CG 3.39Å; D286-L290 PolarHBondContact O-N 3.49Å; C287-L290 PolarHBondContact O-N 3.09Å; L288-L290 PolarHBondContact O-N 2.98Å; L290-L293 WeakPolarHBondContact O-CB 3.38Å; L290-L293 PolarHBondContact O-N 3.42Å; L290-N294 WeakPolarHBondContact O-CB 3.47Å; L290-N294 PolarHBondContact O-N 3.42Å
291	C	96.3	Very high	95.4	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-52.2	173.8	-68.1	0	0	0	0	111.2	V55 Y263 C287 L288 L293 N294 S295	V55-C291 HydrophobicContact CG2-CB 3.75Å; Y263-C291 HydrophobicContact CE1-CB 3.57Å; Y263-C291 WeakPolarHBondContact CE1-SG 3.48Å; Y263-C291 PolarHBondContact OH-O 3.12Å; C287-C291 WeakPolarHBondContact O-CB 3.35Å; C287-C291 PolarHBondContact O-N 2.91Å; C287-C291 PolarHBondContact O-SG 3.16Å; L288-C291 PolarHBondContact O-N 3.38Å; C291-L293 VanDerWaalsContact C-N 3.3Å; C291-L293 PolarHBondContact O-N 3.23Å; C291-N294 WeakPolarHBondContact O-CB 3.22Å; C291-N294 PolarHBondContact O-N 3.47Å; C291-S295 PolarHBondContact O-N 3.33Å; C291-S295 VanDerWaalsContact O-N 3.12Å
292	F	95.6	Very high	95.3	Very high	100 Å²	100	37 Å²	37	44%	0.439	19%	0.189	S	C	.	.	H	α-helix	trans	-61.2	-39.9	177.5	-80.3	-65.9	0	0	0	112.4	F51 L288 A289 N294 S296	F51-F292 HydrophobicContact CE1-CE1 4.3Å; F51-F292 AromaticContact CE1-CZ 3.92Å; F51-F292 HydrophobicContact CE1-CZ 3.92Å; F51-F292 HydrophobicContact CZ-CE1 4.12Å; F51-F292 HydrophobicContact CZ-CZ 4.14Å; L288-F292 WeakPolarHBondContact O-CD2 3.41Å; L288-F292 PolarHBondContact O-N 3.36Å; L288-F292 VanDerWaalsContact O-N 3.08Å; A289-F292 PolarHBondContact O-N 3.41Å; F292-N294 VanDerWaalsContact C-N 3.34Å; F292-N294 PolarHBondContact O-N 2.91Å; F292-S296 WeakPolarHBondContact O-CB 3.29Å; F292-S296 PolarHBondContact O-N 3.47Å; F292-S296 PolarHBondContact O-OG 3.07Å
293	L	95.7	Very high	95.3	Very high	65 Å²	65	37.3 Å²	37.3	34%	0.34	19%	0.189	S	C	.	.	H	α-helix	trans	-59.1	-45.6	175.6	-177.8	65.1	0	0	0	111.4	A18 I22 Y215 A289 L290 C291 S296 T297	A18-L293 HydrophobicContact CB-CD2 4.18Å; I22-L293 HydrophobicContact CD1-CD2 4.31Å; I22-L293 HydrophobicContact CD1-CG 4.06Å; Y215-L293 HydrophobicContact CE1-CD1 4.33Å; Y215-L293 WeakPolarHBondContact OH-CD1 3.38Å; Y215-L293 VanDerWaalsContact OH-CD2 3.32Å; Y215-L293 WeakPolarHBondContact OH-CD2 3.34Å; Y215-L293 WeakPolarHBondContact OH-CG 3.49Å; A289-L293 VanDerWaalsContact O-CB 3.27Å; A289-L293 WeakPolarHBondContact O-CB 3.32Å; A289-L293 PolarHBondContact O-N 3.32Å; L290-L293 WeakPolarHBondContact O-CB 3.38Å; L290-L293 PolarHBondContact O-N 3.42Å; C291-L293 VanDerWaalsContact C-N 3.3Å; C291-L293 PolarHBondContact O-N 3.23Å; L293-S296 PolarHBondContact O-N 3.3Å; L293-T297 VanDerWaalsContact O-CB 3.31Å; L293-T297 WeakPolarHBondContact O-CB 3.19Å; L293-T297 PolarHBondContact O-N 3.06Å; L293-T297 PolarHBondContact O-OG1 3.31Å
294	N	95.7	Very high	95.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-52.4	-179.9	-170.9	27.7	0	0	0	112.7	I21 N26 S262 Y263 L290 C291 F292 S296 T297 S298	I21-N294 HydrophobicContact CD1-CB 3.84Å; I21-N294 HydrophobicContact CG1-CB 4.03Å; I21-N294 PolarHBondContact O-OD1 3.37Å; N26-N294 PolarHBondContact ND2-OD1 3.25Å; S262-N294 PolarHBondContact O-ND2 3.46Å; S262-N294 PolarHBondContact OG-ND2 3.36Å; S262-N294 PolarHBondContact OG-OD1 2.91Å; Y263-N294 WeakPolarHBondContact CD2-ND2 3.27Å; Y263-N294 HydrophobicContact CE2-CB 4.29Å; Y263-N294 WeakPolarHBondContact CE2-ND2 3.34Å; L290-N294 WeakPolarHBondContact O-CB 3.47Å; L290-N294 PolarHBondContact O-N 3.42Å; C291-N294 WeakPolarHBondContact O-CB 3.22Å; C291-N294 PolarHBondContact O-N 3.47Å; F292-N294 VanDerWaalsContact C-N 3.34Å; F292-N294 PolarHBondContact O-N 2.91Å; N294-S296 PolarHBondContact O-N 3.08Å; N294-T297 PolarHBondContact O-N 3.47Å; N294-S298 PolarHBondContact O-N 3.44Å; N294-S298 PolarHBondContact O-OG 3.32Å
295	S	95.2	Very high	94.9	Very high	14 Å²	14	35.6 Å²	35.6	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-39.1	179.5	-71.7	0	0	0	0	112.4	Y46 Y263 C291 T297 S298 F299	Y46-S295 PolarHBondContact OH-OG 3.45Å; Y263-S295 PolarHBondContact OH-OG 2.91Å; C291-S295 PolarHBondContact O-N 3.33Å; C291-S295 VanDerWaalsContact O-N 3.12Å; S295-T297 VanDerWaalsContact C-N 3.34Å; S295-T297 PolarHBondContact O-N 3.24Å; S295-S298 WeakPolarHBondContact O-CB 3.43Å; S295-S298 PolarHBondContact O-N 3.44Å; S295-F299 PolarHBondContact O-N 3.06Å
296	S	94.8	Very high	94.7	Very high	64 Å²	64	27 Å²	27	45%	0.448	15%	0.151	S	C	.	.	H	α-helix	trans	-64.1	-41	176.1	-56.2	0	0	0	0	111.4	F292 L293 N294 S298 F299 V300	F292-S296 WeakPolarHBondContact O-CB 3.29Å; F292-S296 PolarHBondContact O-N 3.47Å; F292-S296 PolarHBondContact O-OG 3.07Å; L293-S296 PolarHBondContact O-N 3.3Å; N294-S296 PolarHBondContact O-N 3.08Å; S296-S298 VanDerWaalsContact C-N 3.35Å; S296-S298 PolarHBondContact O-N 3.36Å; S296-F299 PolarHBondContact O-N 2.76Å; S296-V300 WeakPolarHBondContact O-CG2 3.42Å; S296-V300 PolarHBondContact O-N 2.97Å
297	T	94.5	Very high	94.7	Very high	13 Å²	13	26.5 Å²	26.5	8%	0.08	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-42.6	177.4	-54.9	0	0	0	0	111	I22 Y215 L218 L293 N294 S295 F299 V300 A301	I22-T297 HydrophobicContact CD1-CG2 4.41Å; I22-T297 HydrophobicContact CG2-CG2 3.77Å; Y215-T297 HydrophobicContact CE1-CG2 3.9Å; Y215-T297 WeakPolarHBondContact CE1-OG1 3.49Å; Y215-T297 PolarHBondContact OH-OG1 2.95Å; L218-T297 HydrophobicContact CD2-CG2 3.93Å; L293-T297 VanDerWaalsContact O-CB 3.31Å; L293-T297 WeakPolarHBondContact O-CB 3.19Å; L293-T297 PolarHBondContact O-N 3.06Å; L293-T297 PolarHBondContact O-OG1 3.31Å; N294-T297 PolarHBondContact O-N 3.47Å; S295-T297 VanDerWaalsContact C-N 3.34Å; S295-T297 PolarHBondContact O-N 3.24Å; T297-F299 VanDerWaalsContact C-N 3.34Å; T297-F299 PolarHBondContact O-N 3.48Å; T297-V300 PolarHBondContact O-N 3.38Å; T297-A301 VanDerWaalsContact O-CB 3.26Å; T297-A301 WeakPolarHBondContact O-CB 3.3Å; T297-A301 PolarHBondContact O-N 3.34Å
298	S	94.6	Very high	94.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.5	-45	175.1	-48.9	0	0	0	0	112	N26 F30 N294 S295 S296 A301 G302	N26-S298 PolarHBondContact ND2-OG 3Å; F30-S298 WeakPolarHBondContact CD1-O 3.37Å; N294-S298 PolarHBondContact O-N 3.44Å; N294-S298 PolarHBondContact O-OG 3.32Å; S295-S298 WeakPolarHBondContact O-CB 3.43Å; S295-S298 PolarHBondContact O-N 3.44Å; S296-S298 VanDerWaalsContact C-N 3.35Å; S296-S298 PolarHBondContact O-N 3.36Å; S298-A301 PolarHBondContact O-N 2.93Å; S298-G302 PolarHBondContact O-N 2.89Å
299	F	94.9	Very high	94.1	Very high	70 Å²	70	24.5 Å²	24.5	31%	0.307	14%	0.138	S	C	.	.	H	α-helix	trans	-63	-46.3	179.6	-175.7	-113.2	0	0	0	111.9	L43 Y238 L239 S295 S296 T297 G302 F303	L43-F299 HydrophobicContact CD1-CE2 3.99Å; L43-F299 HydrophobicContact CD2-CD2 4.48Å; Y238-F299 WeakPolarHBondContact OH-CD2 3.49Å; Y238-F299 PolarHBondContact OH-O 3.36Å; Y238-F299 VanDerWaalsContact OH-O 3.06Å; L239-F299 HydrophobicContact CD1-CZ 4.49Å; L239-F299 HydrophobicContact CD2-CE2 3.83Å; L239-F299 HydrophobicContact CD2-CZ 4.42Å; S295-F299 PolarHBondContact O-N 3.06Å; S296-F299 PolarHBondContact O-N 2.76Å; T297-F299 VanDerWaalsContact C-N 3.34Å; T297-F299 PolarHBondContact O-N 3.48Å; F299-G302 PolarHBondContact O-N 3.11Å; F299-F303 HydrophobicContact CD1-CE2 4.01Å; F299-F303 HydrophobicContact CE1-CD2 4.48Å; F299-F303 AromaticContact CE1-CE2 3.51Å; F299-F303 HydrophobicContact CE1-CE2 3.51Å; F299-F303 HydrophobicContact CE1-CZ 4.25Å; F299-F303 HydrophobicContact CE2-CE2 4.15Å; F299-F303 AromaticContact CZ-CE2 3.58Å; F299-F303 HydrophobicContact CZ-CE2 3.58Å; F299-F303 HydrophobicContact CZ-CZ 4.09Å; F299-F303 WeakPolarHBondContact O-CD2 3.35Å; F299-F303 PolarHBondContact O-N 2.8Å
300	V	95	Very high	93.9	Very high	53 Å²	53	21.6 Å²	21.6	32%	0.321	11%	0.114	S	C	.	.	H	α-helix	trans	-66	-40.7	177.1	173.5	0	0	0	0	111.7	L218 L222 S296 T297 G302 F303 A304	L218-V300 HydrophobicContact CD2-CG1 4.11Å; L218-V300 HydrophobicContact CG-CG1 4.44Å; L222-V300 HydrophobicContact CD2-CG1 3.9Å; S296-V300 WeakPolarHBondContact O-CG2 3.42Å; S296-V300 PolarHBondContact O-N 2.97Å; T297-V300 PolarHBondContact O-N 3.38Å; V300-G302 PolarHBondContact O-N 2.99Å; V300-F303 WeakPolarHBondContact O-CB 3.09Å; V300-F303 PolarHBondContact O-N 3.29Å; V300-F303 VanDerWaalsContact O-N 3.07Å; V300-A304 PolarHBondContact O-N 2.92Å; V300-A304 VanDerWaalsContact O-N 3.16Å
301	A	92.8	Very high	93.6	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-60.6	-34.3	174.9	0	0	0	0	0	112.1	M27 L218 T297 S298 F303 A304 I305	M27-A301 HydrophobicContact CG-CB 4.5Å; L218-A301 HydrophobicContact CD1-CB 3.9Å; L218-A301 HydrophobicContact CD2-CB 4.36Å; T297-A301 VanDerWaalsContact O-CB 3.26Å; T297-A301 WeakPolarHBondContact O-CB 3.3Å; T297-A301 PolarHBondContact O-N 3.34Å; S298-A301 PolarHBondContact O-N 2.93Å; A301-F303 PolarHBondContact O-N 2.94Å; A301-A304 PolarHBondContact O-N 2.95Å; A301-I305 WeakPolarHBondContact O-CG1 3.21Å; A301-I305 PolarHBondContact O-N 3.47Å
302	G	93.4	Very high	93.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.9	-43.3	171.3	0	0	0	0	0	113.5	P31 S298 F299 V300 I305 F306	P31-G302 VanDerWaalsContact CG-CA 3.45Å; S298-G302 PolarHBondContact O-N 2.89Å; F299-G302 PolarHBondContact O-N 3.11Å; V300-G302 PolarHBondContact O-N 2.99Å; G302-I305 PolarHBondContact O-N 2.93Å; G302-F306 WeakPolarHBondContact O-CB 3.4Å; G302-F306 WeakPolarHBondContact O-CD2 3.3Å; G302-F306 PolarHBondContact O-N 2.91Å
303	F	94.7	Very high	92.8	Very high	47 Å²	47	17.6 Å²	17.6	21%	0.206	10%	0.097	C	C	.	.	H	α-helix	trans	-62.5	-44.1	173.6	-76.1	-90.3	0	0	0	112.4	L222 I235 Y238 L239 F299 V300 A301 I305 S307	L222-F303 HydrophobicContact CD1-CB 3.52Å; I235-F303 HydrophobicContact CD1-CD1 4.27Å; I235-F303 HydrophobicContact CG1-CD1 4.2Å; I235-F303 HydrophobicContact CG2-CD1 4.19Å; I235-F303 HydrophobicContact CG2-CE1 3.84Å; Y238-F303 HydrophobicContact CE1-CD2 4.02Å; Y238-F303 HydrophobicContact CE1-CE2 4.16Å; Y238-F303 HydrophobicContact CE1-CG 4.43Å; L239-F303 HydrophobicContact CD1-CE1 3.93Å; L239-F303 HydrophobicContact CD1-CE2 4.21Å; L239-F303 HydrophobicContact CD1-CZ 3.47Å; L239-F303 VanDerWaalsContact CD1-CZ 3.47Å; F299-F303 HydrophobicContact CD1-CE2 4.01Å; F299-F303 HydrophobicContact CE1-CD2 4.48Å; F299-F303 AromaticContact CE1-CE2 3.51Å; F299-F303 HydrophobicContact CE1-CE2 3.51Å; F299-F303 HydrophobicContact CE1-CZ 4.25Å; F299-F303 HydrophobicContact CE2-CE2 4.15Å; F299-F303 AromaticContact CZ-CE2 3.58Å; F299-F303 HydrophobicContact CZ-CE2 3.58Å; F299-F303 HydrophobicContact CZ-CZ 4.09Å; F299-F303 WeakPolarHBondContact O-CD2 3.35Å; F299-F303 PolarHBondContact O-N 2.8Å; V300-F303 WeakPolarHBondContact O-CB 3.09Å; V300-F303 PolarHBondContact O-N 3.29Å; V300-F303 VanDerWaalsContact O-N 3.07Å; A301-F303 PolarHBondContact O-N 2.94Å; F303-I305 PolarHBondContact O-N 3.46Å; F303-S307 WeakPolarHBondContact O-CB 3.27Å; F303-S307 PolarHBondContact O-N 3.07Å; F303-S307 PolarHBondContact O-OG 2.74Å
304	A	92.5	Very high	92.5	Very high	2 Å²	2	20.7 Å²	20.7	2%	0.017	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-43.7	-180	0	0	0	0	0	111.7	L218 L222 V300 A301 S307 I308	L218-A304 HydrophobicContact CD1-CB 4.14Å; L222-A304 HydrophobicContact CB-CB 4.21Å; L222-A304 HydrophobicContact CD1-CB 4.3Å; V300-A304 PolarHBondContact O-N 2.92Å; V300-A304 VanDerWaalsContact O-N 3.16Å; A301-A304 PolarHBondContact O-N 2.95Å; A304-S307 PolarHBondContact O-OG 3.27Å; A304-S307 VanDerWaalsContact O-OG 3.05Å; A304-I308 WeakPolarHBondContact O-CD1 3.34Å; A304-I308 WeakPolarHBondContact O-CG1 3.23Å
305	I	90.4	Very high	92	Very high	11 Å²	11	25.3 Å²	25.3	6%	0.056	13%	0.127	C	C	.	.	H	α-helix	trans	-72.5	-50.5	-179.6	-65.2	-65.8	0	0	0	111.5	M27 A301 G302 F303 S307 I308 L309 L330 Y335	M27-I305 HydrophobicContact CE-CD1 4.3Å; A301-I305 WeakPolarHBondContact O-CG1 3.21Å; A301-I305 PolarHBondContact O-N 3.47Å; G302-I305 PolarHBondContact O-N 2.93Å; F303-I305 PolarHBondContact O-N 3.46Å; I305-S307 PolarHBondContact O-N 3.3Å; I305-I308 PolarHBondContact O-N 3.35Å; I305-L309 HydrophobicContact CG2-CD1 4.11Å; I305-L309 HydrophobicContact CG2-CG 4.4Å; I305-L309 WeakPolarHBondContact O-CG 3.44Å; I305-L309 PolarHBondContact O-N 2.95Å; I305-L330 HydrophobicContact CG2-CD1 4.35Å; I305-L330 HydrophobicContact CG2-CD2 4.23Å; I305-Y335 HydrophobicContact CD1-CD2 4.09Å; I305-Y335 HydrophobicContact CD1-CE2 4.18Å
306	F	91.9	Very high	91.3	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-70.4	-30.1	-175.5	-87.2	-89.9	0	0	0	113.3	P31 Y35 G234 F237 Y238 G302 I308 L309 G310 I320	P31-F306 HydrophobicContact CB-CD2 3.84Å; P31-F306 HydrophobicContact CB-CE2 3.48Å; P31-F306 VanDerWaalsContact CB-CE2 3.48Å; P31-F306 WeakPolarHBondContact O-CE2 3.5Å; Y35-F306 HydrophobicContact CD1-CE1 4.2Å; Y35-F306 HydrophobicContact CD1-CE2 4.46Å; Y35-F306 AromaticContact CD1-CZ 3.49Å; Y35-F306 HydrophobicContact CD1-CZ 3.49Å; Y35-F306 VanDerWaalsContact CD1-CZ 3.49Å; Y35-F306 HydrophobicContact CE1-CZ 4.34Å; Y35-F306 HydrophobicContact CG-CE1 4.25Å; Y35-F306 AromaticContact CG-CZ 3.91Å; Y35-F306 HydrophobicContact CG-CZ 3.91Å; G234-F306 VanDerWaalsContact CA-O 3.31Å; G234-F306 WeakPolarHBondContact CA-O 3.48Å; F237-F306 HydrophobicContact CD1-CE1 4.04Å; Y238-F306 AromaticContact CD2-CD2 3.97Å; Y238-F306 HydrophobicContact CD2-CD2 3.97Å; Y238-F306 HydrophobicContact CD2-CE2 4.17Å; Y238-F306 HydrophobicContact CD2-CG 4.49Å; Y238-F306 HydrophobicContact CG-CB 4.36Å; Y238-F306 AromaticContact CG-CD2 3.97Å; Y238-F306 HydrophobicContact CG-CD2 3.97Å; Y238-F306 HydrophobicContact CG-CG 4.1Å; G302-F306 WeakPolarHBondContact O-CB 3.4Å; G302-F306 WeakPolarHBondContact O-CD2 3.3Å; G302-F306 PolarHBondContact O-N 2.91Å; F306-I308 VanDerWaalsContact C-N 3.31Å; F306-I308 PolarHBondContact O-N 2.89Å; F306-L309 HydrophobicContact CD1-CD1 4.32Å; F306-L309 HydrophobicContact CE1-CD1 4.22Å; F306-L309 HydrophobicContact CZ-CD1 4.42Å; F306-L309 PolarHBondContact O-N 2.81Å; F306-G310 PolarHBondContact O-N 3.27Å; F306-I320 HydrophobicContact CD1-CD1 4.14Å
307	S	94.3	Very high	90.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-40.3	172.3	57.5	0	0	0	0	112	G225 F303 A304 I305 G310 F311	G225-S307 WeakPolarHBondContact CA-OG 3.18Å; F303-S307 WeakPolarHBondContact O-CB 3.27Å; F303-S307 PolarHBondContact O-N 3.07Å; F303-S307 PolarHBondContact O-OG 2.74Å; A304-S307 PolarHBondContact O-OG 3.27Å; A304-S307 VanDerWaalsContact O-OG 3.05Å; I305-S307 PolarHBondContact O-N 3.3Å; S307-G310 PolarHBondContact O-N 3.11Å; S307-F311 PolarHBondContact O-N 3.17Å; S307-F311 VanDerWaalsContact O-N 3.08Å
308	I	90.6	Very high	90.2	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-69.6	-40.2	175.6	-67.1	170.9	0	0	0	111.6	L228 A304 I305 F306 G310 F311 M312 Y335 A338 M342	L228-I308 HydrophobicContact CD1-CG1 4.35Å; A304-I308 WeakPolarHBondContact O-CD1 3.34Å; A304-I308 WeakPolarHBondContact O-CG1 3.23Å; I305-I308 PolarHBondContact O-N 3.35Å; F306-I308 VanDerWaalsContact C-N 3.31Å; F306-I308 PolarHBondContact O-N 2.89Å; I308-G310 VanDerWaalsContact C-N 3.33Å; I308-F311 WeakPolarHBondContact O-CB 3.39Å; I308-F311 PolarHBondContact O-N 3.26Å; I308-M312 PolarHBondContact O-N 3.46Å; I308-Y335 HydrophobicContact CD1-CE2 3.56Å; I308-Y335 HydrophobicContact CG2-CE2 4.43Å; I308-A338 HydrophobicContact CG2-CB 3.39Å; I308-M342 HydrophobicContact CB-CE 4.48Å; I308-M342 HydrophobicContact CD1-CE 4.32Å; I308-M342 HydrophobicContact CG1-CE 4.09Å; I308-M342 HydrophobicContact CG2-CE 3.7Å
309	L	89.8	Confident	89.7	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-36.6	173.9	-68.4	178.8	0	0	0	112.4	I305 F306 F311 M312 S313 I320 L330 A334	I305-L309 HydrophobicContact CG2-CD1 4.11Å; I305-L309 HydrophobicContact CG2-CG 4.4Å; I305-L309 WeakPolarHBondContact O-CG 3.44Å; I305-L309 PolarHBondContact O-N 2.95Å; F306-L309 HydrophobicContact CD1-CD1 4.32Å; F306-L309 HydrophobicContact CE1-CD1 4.22Å; F306-L309 HydrophobicContact CZ-CD1 4.42Å; F306-L309 PolarHBondContact O-N 2.81Å; L309-F311 VanDerWaalsContact C-N 3.35Å; L309-M312 WeakPolarHBondContact O-CB 3.09Å; L309-M312 PolarHBondContact O-N 3.35Å; L309-S313 WeakPolarHBondContact O-CB 3.46Å; L309-S313 PolarHBondContact O-N 3.01Å; L309-I320 HydrophobicContact CB-CD1 4.03Å; L309-I320 HydrophobicContact CB-CG1 4.3Å; L309-L330 HydrophobicContact CD1-CD1 4.02Å; L309-L330 HydrophobicContact CD2-CD1 4.35Å; L309-A334 HydrophobicContact CD2-CB 3.98Å
310	G	92	Very high	89.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-41.9	174.2	0	0	0	0	0	112.1	G230 F306 S307 I308 S313 Y314	G230-G310 CarbonylContact O-C 3.49Å; F306-G310 PolarHBondContact O-N 3.27Å; S307-G310 PolarHBondContact O-N 3.11Å; I308-G310 VanDerWaalsContact C-N 3.33Å; G310-S313 PolarHBondContact O-N 2.9Å; G310-Y314 WeakPolarHBondContact O-CB 2.95Å; G310-Y314 PolarHBondContact O-N 3.3Å
311	F	90.5	Very high	88.5	Confident	9 Å²	9	33 Å²	33	4%	0.039	17%	0.172	C	C	.	.	H	α-helix	trans	-59.1	-46.7	170.7	164.9	-109.9	0	0	0	112.4	L228 P229 S307 I308 L309 S313 Y314 E315 M341 M342	L228-F311 HydrophobicContact CB-CB 3.79Å; L228-F311 HydrophobicContact CB-CD2 3.87Å; L228-F311 HydrophobicContact CB-CG 3.85Å; L228-F311 HydrophobicContact CD1-CB 3.98Å; L228-F311 HydrophobicContact CD1-CD1 3.78Å; L228-F311 HydrophobicContact CD1-CD2 4.44Å; L228-F311 HydrophobicContact CD1-CE1 4.36Å; L228-F311 HydrophobicContact CD1-CG 3.81Å; L228-F311 HydrophobicContact CD2-CD1 4.45Å; L228-F311 HydrophobicContact CD2-CD2 4.12Å; L228-F311 HydrophobicContact CD2-CE1 4.41Å; L228-F311 HydrophobicContact CD2-CE2 4.1Å; L228-F311 HydrophobicContact CD2-CG 4.29Å; L228-F311 HydrophobicContact CD2-CZ 4.25Å; L228-F311 HydrophobicContact CG-CB 4.45Å; L228-F311 HydrophobicContact CG-CD2 4.36Å; L228-F311 HydrophobicContact CG-CG 4.2Å; P229-F311 HydrophobicContact CG-CD2 3.79Å; P229-F311 HydrophobicContact CG-CE2 3.89Å; P229-F311 VanDerWaalsContact O-CA 3.26Å; P229-F311 WeakPolarHBondContact O-CA 3.49Å; P229-F311 WeakPolarHBondContact O-CB 3.35Å; P229-F311 WeakPolarHBondContact O-CD2 3.48Å; S307-F311 PolarHBondContact O-N 3.17Å; S307-F311 VanDerWaalsContact O-N 3.08Å; I308-F311 WeakPolarHBondContact O-CB 3.39Å; I308-F311 PolarHBondContact O-N 3.26Å; L309-F311 VanDerWaalsContact C-N 3.35Å; F311-S313 VanDerWaalsContact C-N 3.34Å; F311-S313 PolarHBondContact O-N 3.18Å; F311-Y314 PolarHBondContact O-N 3.32Å; F311-E315 HydrophobicContact CD2-CG 3.71Å; F311-E315 HydrophobicContact CE1-CG 4.41Å; F311-E315 HydrophobicContact CE2-CG 3.27Å; F311-E315 HydrophobicContact CG-CG 4.45Å; F311-E315 HydrophobicContact CZ-CG 3.67Å; F311-E315 WeakPolarHBondContact O-CG 3.36Å; F311-E315 PolarHBondContact O-N 2.98Å; F311-M341 HydrophobicContact CE1-CB 3.89Å; F311-M341 HydrophobicContact CZ-CB 4.12Å; F311-M342 HydrophobicContact CD1-CE 4.4Å; F311-M342 HydrophobicContact CE1-CE 4.49Å; F311-M342 HydrophobicContact CE1-CG 4.12Å
312	M	87.6	Confident	87.8	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-42.8	177.8	-179.1	179.3	160.1	0	0	112.3	I308 L309 Q316 V323 R337 A338 M341	I308-M312 PolarHBondContact O-N 3.46Å; L309-M312 WeakPolarHBondContact O-CB 3.09Å; L309-M312 PolarHBondContact O-N 3.35Å; M312-Q316 WeakPolarHBondContact O-CB 3.47Å; M312-Q316 WeakPolarHBondContact O-CG 3.19Å; M312-Q316 PolarHBondContact O-N 2.91Å; M312-V323 HydrophobicContact CE-CB 3.69Å; M312-V323 HydrophobicContact CE-CG1 3.61Å; M312-V323 HydrophobicContact SD-CB 4.15Å; M312-V323 HydrophobicContact SD-CG1 4.46Å; M312-R337 HydrophobicContact CE-CB 4.31Å; M312-R337 HydrophobicContact CE-CG 3.72Å; M312-R337 VanDerWaalsContact CE-NE 3.35Å; M312-R337 HydrophobicContact SD-CB 4.34Å; M312-R337 HydrophobicContact SD-CG 4.16Å; M312-A338 HydrophobicContact CB-CB 4.21Å; M312-A338 HydrophobicContact SD-CB 4.3Å; M312-M341 HydrophobicContact CG-SD 4.26Å
313	S	88.4	Confident	86.9	Confident	11 Å²	11	39.4 Å²	39.4	8%	0.077	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-42.6	175.3	172.4	0	0	0	0	111.9	L309 G310 F311 N317 V318 I320	L309-S313 WeakPolarHBondContact O-CB 3.46Å; L309-S313 PolarHBondContact O-N 3.01Å; G310-S313 PolarHBondContact O-N 2.9Å; F311-S313 VanDerWaalsContact C-N 3.34Å; F311-S313 PolarHBondContact O-N 3.18Å; S313-N317 WeakPolarHBondContact O-CA 3.32Å; S313-N317 PolarHBondContact O-N 2.67Å; S313-V318 WeakPolarHBondContact CB-O 2.85Å; S313-V318 PolarHBondContact O-N 3.41Å; S313-V318 PolarHBondContact OG-O 3.3Å; S313-I320 PolarHBondContact OG-N 3.49Å
314	Y	88.6	Confident	85.9	Confident	131 Å²	131	37.7 Å²	37.7	51%	0.514	20%	0.197	S	C	.	.	H	α-helix	trans	-64.5	-49.2	177.9	177.4	-98.3	0	0	0	112.7	P229 I233 G310 F311 N317	P229-Y314 HydrophobicContact CB-CD1 3.98Å; P229-Y314 HydrophobicContact CB-CE1 3.79Å; P229-Y314 HydrophobicContact CG-CD1 4.3Å; P229-Y314 HydrophobicContact CG-CE1 4.29Å; I233-Y314 HydrophobicContact CD1-CD2 4.34Å; G310-Y314 WeakPolarHBondContact O-CB 2.95Å; G310-Y314 PolarHBondContact O-N 3.3Å; F311-Y314 PolarHBondContact O-N 3.32Å; Y314-N317 PolarHBondContact O-N 3.23Å
315	E	84.9	Confident	85	Confident	97 Å²	97	41 Å²	41	45%	0.453	21%	0.212	S	C	.	.	H	α-helix	trans	-68.5	-35.4	-178	-70.8	-68.5	143.2	0	0	113	F311 M341	F311-E315 HydrophobicContact CD2-CG 3.71Å; F311-E315 HydrophobicContact CE1-CG 4.41Å; F311-E315 HydrophobicContact CE2-CG 3.27Å; F311-E315 HydrophobicContact CG-CG 4.45Å; F311-E315 HydrophobicContact CZ-CG 3.67Å; F311-E315 WeakPolarHBondContact O-CG 3.36Å; F311-E315 PolarHBondContact O-N 2.98Å; E315-M341 HydrophobicContact CB-CE 3.26Å; E315-M341 HydrophobicContact CG-CE 3.97Å
316	Q	81.6	Confident	84.1	Confident	35 Å²	35	43.5 Å²	43.5	16%	0.164	23%	0.23	C	C	.	.	H	α-helix	trans	-89.7	-8.7	180	-66.2	177.2	9.5	0	0	113	M312 V318 R337 M341	M312-Q316 WeakPolarHBondContact O-CB 3.47Å; M312-Q316 WeakPolarHBondContact O-CG 3.19Å; M312-Q316 PolarHBondContact O-N 2.91Å; Q316-V318 HydrophobicContact CB-CG1 4.44Å; Q316-V318 HydrophobicContact CB-CG2 3.82Å; Q316-V318 PolarHBondContact O-N 2.86Å; Q316-R337 VanDerWaalsContact NE2-NE 3.16Å; Q316-R337 VanDerWaalsContact OE1-CZ 3.28Å; Q316-M341 HydrophobicContact CG-CE 3.98Å; Q316-M341 HydrophobicContact CG-SD 4.38Å; Q316-M341 PolarHBondContact NE2-SD 2.86Å
317	N	82.6	Confident	83.4	Confident	151 Å²	151	44.5 Å²	44.5	81%	0.807	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	40.3	-175.8	-154.7	19.4	0	0	0	113	S313 Y314	S313-N317 WeakPolarHBondContact O-CA 3.32Å; S313-N317 PolarHBondContact O-N 2.67Å; Y314-N317 PolarHBondContact O-N 3.23Å
318	V	82.3	Confident	82.9	Confident	42 Å²	42	45.3 Å²	45.3	26%	0.255	25%	0.247	S	C	.	.			trans	-118	148.2	177.7	-65	0	0	0	0	110.5	S313 Q316 I320 V323	S313-V318 WeakPolarHBondContact CB-O 2.85Å; S313-V318 PolarHBondContact O-N 3.41Å; S313-V318 PolarHBondContact OG-O 3.3Å; Q316-V318 HydrophobicContact CB-CG1 4.44Å; Q316-V318 HydrophobicContact CB-CG2 3.82Å; Q316-V318 PolarHBondContact O-N 2.86Å; V318-I320 PolarHBondContact O-N 3Å; V318-V323 HydrophobicContact CG2-CG1 3.52Å
319	P	85	Confident	82.6	Confident	70 Å²	70	45.6 Å²	45.6	46%	0.455	25%	0.25	S	S	.	.			trans	-57.5	138.3	176.2	-22.7	33.3	0	0	0	111.9	S321 E322	P319-S321 PolarHBondContact O-N 2.97Å; P319-S321 VanDerWaalsContact O-N 3.11Å; P319-E322 PolarHBondContact O-N 2.72Å
320	I	83.4	Confident	82.4	Confident	8 Å²	8	45.8 Å²	45.8	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-25.5	-178.6	-168.3	171	0	0	0	113.2	F237 F306 L309 S313 V318 E322 V323 A324	F237-I320 HydrophobicContact CB-CD1 4.12Å; F237-I320 HydrophobicContact CB-CG2 3.83Å; F237-I320 HydrophobicContact CD1-CD1 4.41Å; F237-I320 HydrophobicContact CD1-CG2 3.57Å; F237-I320 HydrophobicContact CD2-CG2 3.24Å; F237-I320 HydrophobicContact CE1-CG2 3.8Å; F237-I320 HydrophobicContact CE2-CG2 3.52Å; F237-I320 HydrophobicContact CG-CD1 4.41Å; F237-I320 HydrophobicContact CG-CG2 3.26Å; F237-I320 HydrophobicContact CZ-CG2 3.79Å; F306-I320 HydrophobicContact CD1-CD1 4.14Å; L309-I320 HydrophobicContact CB-CD1 4.03Å; L309-I320 HydrophobicContact CB-CG1 4.3Å; S313-I320 PolarHBondContact OG-N 3.49Å; V318-I320 PolarHBondContact O-N 3Å; I320-E322 PolarHBondContact O-N 3.13Å; I320-V323 HydrophobicContact CG1-CG2 4Å; I320-V323 VanDerWaalsContact O-CG2 3.27Å; I320-V323 WeakPolarHBondContact O-CG2 3.14Å; I320-V323 PolarHBondContact O-N 2.97Å; I320-A324 WeakPolarHBondContact O-CB 3.3Å; I320-A324 PolarHBondContact O-N 3.05Å; I320-A324 VanDerWaalsContact O-N 3.08Å
321	S	81.9	Confident	82.2	Confident	68 Å²	68	46 Å²	46	48%	0.476	25%	0.253	S	S	.	.	H	α-helix	trans	-62.8	-25.2	175	52	0	0	0	0	113.8	P319	P319-S321 PolarHBondContact O-N 2.97Å; P319-S321 VanDerWaalsContact O-N 3.11Å
322	E	77.3	Confident	82.3	Confident	131 Å²	131	45.6 Å²	45.6	61%	0.612	25%	0.252	S	S	*	.	H	α-helix	trans	-86.7	-15.5	179.3	-64.9	-178.9	-168.6	0	0	112.7	P319 I320	P319-E322 PolarHBondContact O-N 2.72Å; I320-E322 PolarHBondContact O-N 3.13Å
323	V	75.3	Confident	82.5	Confident	6 Å²	6	46.2 Å²	46.2	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-104.7	-13.1	178.8	-52.2	0	0	0	0	112.7	M312 V318 I320 E325	M312-V323 HydrophobicContact CE-CB 3.69Å; M312-V323 HydrophobicContact CE-CG1 3.61Å; M312-V323 HydrophobicContact SD-CB 4.15Å; M312-V323 HydrophobicContact SD-CG1 4.46Å; V318-V323 HydrophobicContact CG2-CG1 3.52Å; I320-V323 HydrophobicContact CG1-CG2 4Å; I320-V323 VanDerWaalsContact O-CG2 3.27Å; I320-V323 WeakPolarHBondContact O-CG2 3.14Å; I320-V323 PolarHBondContact O-N 2.97Å; V323-E325 PolarHBondContact O-N 3.49Å; V323-E325 VanDerWaalsContact O-N 3.16Å
324	A	73.3	Confident	82.5	Confident	11 Å²	11	45.8 Å²	45.8	9%	0.091	25%	0.252	C	S	.	.			trans	-81.6	88.7	178.4	0	0	0	0	0	110.9	Y35 I320	Y35-A324 HydrophobicContact CE1-CB 4.13Å; Y35-A324 PolarHBondContact OH-O 3.5Å; I320-A324 WeakPolarHBondContact O-CB 3.3Å; I320-A324 PolarHBondContact O-N 3.05Å; I320-A324 VanDerWaalsContact O-N 3.08Å
325	E	72.8	Confident	82.5	Confident	72 Å²	72	40 Å²	40	34%	0.336	23%	0.229	S	C	.	.			trans	-77.4	157.7	173.9	-71.4	-66.6	174.6	0	0	112.7	Y32 V323	Y32-E325 WeakPolarHBondContact CD2-O 3.31Å; V323-E325 PolarHBondContact O-N 3.49Å; V323-E325 VanDerWaalsContact O-N 3.16Å
326	S	72	Confident	82.8	Confident	62 Å²	62	35.4 Å²	35.4	43%	0.434	21%	0.208	S	C	.	.			trans	-100.8	150.5	177.5	79.6	0	0	0	0	112.8	G329	S326-G329 PolarHBondContact O-N 2.87Å
327	G	76.9	Confident	83.1	Confident	24 Å²	24	36.3 Å²	36.3	25%	0.247	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	-135.8	172.5	0	0	0	0	0	113.2	G329 L330	G327-G329 PolarHBondContact O-N 3.45Å; G327-L330 WeakPolarHBondContact O-CB 3.34Å; G327-L330 PolarHBondContact O-N 2.91Å; G327-L330 VanDerWaalsContact O-N 3.14Å
328	P	83.2	Confident	83.4	Confident	16 Å²	16	29.1 Å²	29.1	10%	0.104	17%	0.171	C	C	.	.	H	α-helix	trans	-56.6	-30.4	179	-26.7	35.7	0	0	0	114.4	W28 W107 W160 L330 A331 F332 M413 F416	W28-P328 HydrophobicContact CH2-CB 4.41Å; W28-P328 HydrophobicContact CH2-CG 4.34Å; W28-P328 HydrophobicContact CZ3-CB 4.36Å; W107-P328 HydrophobicContact CZ3-CB 3.99Å; W107-P328 HydrophobicContact CZ3-CG 4.01Å; W160-P328 HydrophobicContact CZ2-CB 4.27Å; P328-L330 PolarHBondContact O-N 3.05Å; P328-A331 PolarHBondContact O-N 3.1Å; P328-F332 HydrophobicContact CB-CD2 4.08Å; P328-F332 VanDerWaalsContact O-CD2 3.3Å; P328-F332 WeakPolarHBondContact O-CD2 3.5Å; P328-F332 PolarHBondContact O-N 3.02Å; P328-M413 HydrophobicContact CG-CE 4.41Å; P328-F416 HydrophobicContact CG-CE1 4.14Å
329	G	85.8	Confident	83.7	Confident	9 Å²	9	27.1 Å²	27.1	9%	0.093	16%	0.159	C	C	.	.	H	α-helix	trans	-58.7	-33.6	178.5	0	0	0	0	0	112.6	S326 G327 A331 I333 A334	S326-G329 PolarHBondContact O-N 2.87Å; G327-G329 PolarHBondContact O-N 3.45Å; G329-A331 PolarHBondContact O-N 3.26Å; G329-I333 WeakPolarHBondContact O-CA 3.2Å; G329-I333 WeakPolarHBondContact O-CB 3.39Å; G329-I333 PolarHBondContact O-N 3.45Å; G329-A334 PolarHBondContact O-N 2.97Å
330	L	84.6	Confident	84	Confident	8 Å²	8	24.6 Å²	24.6	4%	0.042	14%	0.143	C	C	.	.	I	π-helix	trans	-63.4	-43.5	179	-172.2	58	0	0	0	112.4	W28 I305 L309 G327 P328 A334 Y335	W28-L330 HydrophobicContact CB-CB 4.33Å; W28-L330 HydrophobicContact CB-CD2 3.91Å; W28-L330 HydrophobicContact CB-CG 4.42Å; W28-L330 VanDerWaalsContact O-CD2 3.23Å; W28-L330 WeakPolarHBondContact O-CD2 3.45Å; I305-L330 HydrophobicContact CG2-CD1 4.35Å; I305-L330 HydrophobicContact CG2-CD2 4.23Å; L309-L330 HydrophobicContact CD1-CD1 4.02Å; L309-L330 HydrophobicContact CD2-CD1 4.35Å; G327-L330 WeakPolarHBondContact O-CB 3.34Å; G327-L330 PolarHBondContact O-N 2.91Å; G327-L330 VanDerWaalsContact O-N 3.14Å; P328-L330 PolarHBondContact O-N 3.05Å; L330-A334 HydrophobicContact CD1-CB 4.07Å; L330-Y335 WeakPolarHBondContact O-CB 3.16Å; L330-Y335 PolarHBondContact O-N 3.35Å
331	A	88.7	Confident	84	Confident	5 Å²	5	25.7 Å²	25.7	4%	0.041	15%	0.149	C	C	.	.	I	π-helix	trans	-87.1	-30.4	-178.8	0	0	0	0	0	114.5	W28 P328 G329 P336 F352 I356	W28-A331 HydrophobicContact CE3-CB 3.37Å; W28-A331 HydrophobicContact CZ3-CB 3.65Å; P328-A331 PolarHBondContact O-N 3.1Å; G329-A331 PolarHBondContact O-N 3.26Å; A331-P336 WeakPolarHBondContact O-CD 3.4Å; A331-P336 WeakPolarHBondContact O-CG 3.5Å; A331-F352 HydrophobicContact CB-CE1 4.32Å; A331-F352 HydrophobicContact CB-CZ 4Å; A331-F352 WeakPolarHBondContact O-CE1 3.21Å; A331-I356 HydrophobicContact CB-CD1 3.68Å
332	F	92.4	Very high	84.3	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-102.4	-7.7	-174.5	-63.2	-71.4	0	0	0	113.8	W28 V104 W107 Y111 W160 P328 F353 I356	W28-F332 HydrophobicContact CH2-CE2 4.16Å; W28-F332 HydrophobicContact CZ3-CD2 4.16Å; W28-F332 AromaticContact CZ3-CE2 3.72Å; W28-F332 HydrophobicContact CZ3-CE2 3.72Å; V104-F332 HydrophobicContact CG1-CE2 3.94Å; V104-F332 HydrophobicContact CG1-CZ 4.02Å; W107-F332 HydrophobicContact CB-CD1 4.33Å; W107-F332 HydrophobicContact CB-CE1 3.66Å; W107-F332 HydrophobicContact CB-CE2 4.15Å; W107-F332 HydrophobicContact CB-CZ 3.56Å; W107-F332 HydrophobicContact CE3-CD2 4.23Å; W107-F332 AromaticContact CE3-CE2 3.76Å; W107-F332 HydrophobicContact CE3-CE2 3.76Å; W107-F332 HydrophobicContact CE3-CZ 4.3Å; Y111-F332 AromaticContact CD2-CD1 3.69Å; Y111-F332 HydrophobicContact CD2-CD1 3.69Å; Y111-F332 HydrophobicContact CD2-CE1 4.11Å; Y111-F332 HydrophobicContact CE1-CD1 4.48Å; Y111-F332 HydrophobicContact CE2-CB 4.3Å; Y111-F332 AromaticContact CE2-CD1 3.65Å; Y111-F332 HydrophobicContact CE2-CD1 3.65Å; Y111-F332 HydrophobicContact CE2-CE1 4.45Å; Y111-F332 HydrophobicContact CE2-CG 4.34Å; Y111-F332 HydrophobicContact CG-CD1 4.14Å; Y111-F332 PolarHBondContact OH-O 3.32Å; W160-F332 HydrophobicContact CD2-CB 4.15Å; W160-F332 HydrophobicContact CE3-CB 3.63Å; W160-F332 HydrophobicContact CE3-CG 4.23Å; W160-F332 HydrophobicContact CH2-CB 3.96Å; W160-F332 AromaticContact CH2-CD2 3.84Å; W160-F332 HydrophobicContact CH2-CD2 3.84Å; W160-F332 AromaticContact CH2-CG 3.94Å; W160-F332 HydrophobicContact CH2-CG 3.94Å; W160-F332 HydrophobicContact CZ2-CB 4.47Å; W160-F332 HydrophobicContact CZ3-CB 3.51Å; W160-F332 HydrophobicContact CZ3-CD1 4.11Å; W160-F332 AromaticContact CZ3-CD2 3.99Å; W160-F332 HydrophobicContact CZ3-CD2 3.99Å; W160-F332 AromaticContact CZ3-CG 3.61Å; W160-F332 HydrophobicContact CZ3-CG 3.61Å; P328-F332 HydrophobicContact CB-CD2 4.08Å; P328-F332 VanDerWaalsContact O-CD2 3.3Å; P328-F332 WeakPolarHBondContact O-CD2 3.5Å; P328-F332 PolarHBondContact O-N 3.02Å; F332-F353 AromaticContact CD1-CE1 3.87Å; F332-F353 HydrophobicContact CD1-CE1 3.87Å; F332-F353 HydrophobicContact CE1-CD1 4.38Å; F332-F353 AromaticContact CE1-CE1 3.86Å; F332-F353 HydrophobicContact CE1-CE1 3.86Å; F332-I356 HydrophobicContact CZ-CG2 4.47Å
333	I	90.4	Very high	84.7	Confident	13 Å²	13	20.5 Å²	20.5	7%	0.067	12%	0.124	C	C	.	.	I	π-helix	trans	-125.6	-62.7	179.1	-50.6	172.5	0	0	0	111.1	V156 M157 W160 G329 P336 R337	V156-I333 HydrophobicContact CG1-CG2 4.31Å; V156-I333 WeakPolarHBondContact CG1-O 3.4Å; M157-I333 HydrophobicContact CE-CD1 4.35Å; M157-I333 HydrophobicContact CG-CG2 4.1Å; M157-I333 HydrophobicContact SD-CB 4.39Å; M157-I333 HydrophobicContact SD-CD1 3.61Å; M157-I333 HydrophobicContact SD-CG1 4.27Å; M157-I333 HydrophobicContact SD-CG2 3.36Å; M157-I333 WeakPolarHBondContact SD-CG2 3.18Å; W160-I333 HydrophobicContact CB-CD1 4.48Å; W160-I333 HydrophobicContact CB-CG1 4.1Å; W160-I333 HydrophobicContact CG-CD1 4.04Å; W160-I333 HydrophobicContact CG-CG1 3.93Å; G329-I333 WeakPolarHBondContact O-CA 3.2Å; G329-I333 WeakPolarHBondContact O-CB 3.39Å; G329-I333 PolarHBondContact O-N 3.45Å; I333-P336 WeakPolarHBondContact O-CD 3.24Å; I333-R337 WeakPolarHBondContact O-CB 3.43Å; I333-R337 PolarHBondContact O-N 3.34Å; I333-R337 VanDerWaalsContact O-N 3.16Å
334	A	88.7	Confident	85.4	Confident	3 Å²	3	27.9 Å²	27.9	3%	0.025	16%	0.156	C	C	.	.	I	π-helix	trans	-66.9	-44.8	-174.1	0	0	0	0	0	111.9	L309 G329 L330 R337 A338	L309-A334 HydrophobicContact CD2-CB 3.98Å; G329-A334 PolarHBondContact O-N 2.97Å; L330-A334 HydrophobicContact CD1-CB 4.07Å; A334-R337 WeakPolarHBondContact O-CB 3.31Å; A334-R337 PolarHBondContact O-N 3.3Å; A334-A338 PolarHBondContact O-N 3.13Å
335	Y	88.5	Confident	86.2	Confident	9 Å²	9	28.3 Å²	28.3	4%	0.035	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-48.9	-179.6	-162.3	-85.7	0	0	0	113.8	L221 I305 I308 L330 R337 A338 V339 F352	L221-Y335 WeakPolarHBondContact CD1-OH 3.36Å; L221-Y335 WeakPolarHBondContact CD2-OH 3.47Å; I305-Y335 HydrophobicContact CD1-CD2 4.09Å; I305-Y335 HydrophobicContact CD1-CE2 4.18Å; I308-Y335 HydrophobicContact CD1-CE2 3.56Å; I308-Y335 HydrophobicContact CG2-CE2 4.43Å; L330-Y335 WeakPolarHBondContact O-CB 3.16Å; L330-Y335 PolarHBondContact O-N 3.35Å; Y335-R337 PolarHBondContact O-N 3.44Å; Y335-A338 PolarHBondContact O-N 2.97Å; Y335-A338 VanDerWaalsContact O-N 3.11Å; Y335-V339 HydrophobicContact CD1-CG2 3.59Å; Y335-V339 HydrophobicContact CE1-CG2 3.21Å; Y335-V339 WeakPolarHBondContact O-CG2 3.41Å; Y335-V339 PolarHBondContact O-N 3.45Å; Y335-F352 HydrophobicContact CD1-CB 4.22Å; Y335-F352 AromaticContact CD1-CD1 3.36Å; Y335-F352 HydrophobicContact CD1-CD1 3.36Å; Y335-F352 AromaticContact CD1-CD2 3.59Å; Y335-F352 HydrophobicContact CD1-CD2 3.59Å; Y335-F352 AromaticContact CD1-CE1 3.36Å; Y335-F352 HydrophobicContact CD1-CE1 3.36Å; Y335-F352 AromaticContact CD1-CE2 3.6Å; Y335-F352 HydrophobicContact CD1-CE2 3.6Å; Y335-F352 AromaticContact CD1-CG 3.45Å; Y335-F352 HydrophobicContact CD1-CG 3.45Å; Y335-F352 VanDerWaalsContact CD1-CG 3.45Å; Y335-F352 AromaticContact CD1-CZ 3.48Å; Y335-F352 HydrophobicContact CD1-CZ 3.48Å; Y335-F352 VanDerWaalsContact CD1-CZ 3.48Å; Y335-F352 HydrophobicContact CD2-CD2 4.22Å; Y335-F352 AromaticContact CD2-CE2 3.71Å; Y335-F352 HydrophobicContact CD2-CE2 3.71Å; Y335-F352 AromaticContact CD2-CZ 3.93Å; Y335-F352 HydrophobicContact CD2-CZ 3.93Å; Y335-F352 HydrophobicContact CE1-CB 3.49Å; Y335-F352 VanDerWaalsContact CE1-CB 3.49Å; Y335-F352 AromaticContact CE1-CD1 3.55Å; Y335-F352 HydrophobicContact CE1-CD1 3.55Å; Y335-F352 AromaticContact CE1-CD2 3.14Å; Y335-F352 HydrophobicContact CE1-CD2 3.14Å; Y335-F352 AromaticContact CE1-CE1 3.96Å; Y335-F352 HydrophobicContact CE1-CE1 3.96Å; Y335-F352 AromaticContact CE1-CE2 3.61Å; Y335-F352 HydrophobicContact CE1-CE2 3.61Å; Y335-F352 AromaticContact CE1-CG 3.09Å; Y335-F352 HydrophobicContact CE1-CG 3.09Å; Y335-F352 AromaticContact CE1-CZ 3.98Å; Y335-F352 HydrophobicContact CE1-CZ 3.98Å; Y335-F352 AromaticContact CE2-CD2 3.84Å; Y335-F352 HydrophobicContact CE2-CD2 3.84Å; Y335-F352 AromaticContact CE2-CE2 3.7Å; Y335-F352 HydrophobicContact CE2-CE2 3.7Å; Y335-F352 HydrophobicContact CE2-CZ 4.36Å; Y335-F352 HydrophobicContact CG-CD1 4.2Å; Y335-F352 HydrophobicContact CG-CD2 4.1Å; Y335-F352 AromaticContact CG-CE1 3.76Å; Y335-F352 HydrophobicContact CG-CE1 3.76Å; Y335-F352 AromaticContact CG-CE2 3.65Å; Y335-F352 HydrophobicContact CG-CE2 3.65Å; Y335-F352 HydrophobicContact CG-CG 4.34Å; Y335-F352 AromaticContact CG-CZ 3.45Å; Y335-F352 HydrophobicContact CG-CZ 3.45Å; Y335-F352 VanDerWaalsContact CG-CZ 3.45Å; Y335-F352 AromaticContact CZ-CD2 3.29Å; Y335-F352 AromaticContact CZ-CE2 3.66Å; Y335-F352 AromaticContact CZ-CG 3.75Å
336	P	91.5	Very high	87.2	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-30.9	178.8	-24.3	39.8	0	0	0	111.6	Y111 W122 V156 A331 I333 S340 F353	Y111-P336 HydrophobicContact CD1-CG 4.49Å; Y111-P336 HydrophobicContact CE1-CB 4.48Å; Y111-P336 HydrophobicContact CE1-CG 4.13Å; W122-P336 HydrophobicContact CD2-CB 4.37Å; W122-P336 HydrophobicContact CG-CB 4.33Å; W122-P336 HydrophobicContact CZ2-CB 4.47Å; W122-P336 PolarHBondContact NE1-O 3.32Å; V156-P336 HydrophobicContact CG1-CB 4.23Å; A331-P336 WeakPolarHBondContact O-CD 3.4Å; A331-P336 WeakPolarHBondContact O-CG 3.5Å; I333-P336 WeakPolarHBondContact O-CD 3.24Å; P336-S340 WeakPolarHBondContact O-CB 3.42Å; P336-S340 PolarHBondContact O-N 3.04Å; P336-S340 PolarHBondContact O-OG 3.49Å; P336-F353 HydrophobicContact CG-CE2 4.39Å; P336-F353 HydrophobicContact CG-CZ 3.71Å
337	R	89	Confident	88.2	Confident	53 Å²	53	27.6 Å²	27.6	20%	0.2	15%	0.152	C	C	.	.	H	α-helix	trans	-60.6	-52.5	170.3	-171.6	162.5	172.1	-165.4	-0.3	111.3	V156 M312 Q316 I333 A334 Y335 V339 S340 M341	V156-R337 HydrophobicContact CB-CB 4.43Å; V156-R337 HydrophobicContact CG2-CB 3.84Å; V156-R337 HydrophobicContact CG2-CG 4.21Å; M312-R337 HydrophobicContact CE-CB 4.31Å; M312-R337 HydrophobicContact CE-CG 3.72Å; M312-R337 VanDerWaalsContact CE-NE 3.35Å; M312-R337 HydrophobicContact SD-CB 4.34Å; M312-R337 HydrophobicContact SD-CG 4.16Å; Q316-R337 VanDerWaalsContact NE2-NE 3.16Å; Q316-R337 VanDerWaalsContact OE1-CZ 3.28Å; I333-R337 WeakPolarHBondContact O-CB 3.43Å; I333-R337 PolarHBondContact O-N 3.34Å; I333-R337 VanDerWaalsContact O-N 3.16Å; A334-R337 WeakPolarHBondContact O-CB 3.31Å; A334-R337 PolarHBondContact O-N 3.3Å; Y335-R337 PolarHBondContact O-N 3.44Å; R337-V339 PolarHBondContact O-N 3.38Å; R337-S340 PolarHBondContact O-N 3.06Å; R337-M341 WeakPolarHBondContact O-CG 3.23Å
338	A	88.3	Confident	88.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-40.7	179.2	0	0	0	0	0	112.8	I308 M312 A334 Y335 S340 M341	I308-A338 HydrophobicContact CG2-CB 3.39Å; M312-A338 HydrophobicContact CB-CB 4.21Å; M312-A338 HydrophobicContact SD-CB 4.3Å; A334-A338 PolarHBondContact O-N 3.13Å; Y335-A338 PolarHBondContact O-N 2.97Å; Y335-A338 VanDerWaalsContact O-N 3.11Å; A338-S340 VanDerWaalsContact C-N 3.31Å; A338-S340 PolarHBondContact O-N 3.32Å; A338-M341 WeakPolarHBondContact O-CB 3.29Å; A338-M341 PolarHBondContact O-N 3.29Å; A338-M341 VanDerWaalsContact O-N 3.11Å
339	V	89.6	Confident	89.4	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-37.1	177.4	164.8	0	0	0	0	112.5	L120 Y335 R337 M341 M342 S345 W348 A349	L120-V339 HydrophobicContact CD1-CG1 4.37Å; Y335-V339 HydrophobicContact CD1-CG2 3.59Å; Y335-V339 HydrophobicContact CE1-CG2 3.21Å; Y335-V339 WeakPolarHBondContact O-CG2 3.41Å; Y335-V339 PolarHBondContact O-N 3.45Å; R337-V339 PolarHBondContact O-N 3.38Å; V339-M341 PolarHBondContact O-N 3.12Å; V339-M341 VanDerWaalsContact O-N 3.1Å; V339-M342 WeakPolarHBondContact O-CB 3.38Å; V339-M342 PolarHBondContact O-N 3.26Å; V339-S345 WeakPolarHBondContact CG1-O 3.37Å; V339-S345 WeakPolarHBondContact O-CB 3.19Å; V339-W348 HydrophobicContact CG1-CB 3.82Å; V339-W348 HydrophobicContact CG2-CB 4.31Å; V339-A349 HydrophobicContact CG1-CB 3.92Å
340	S	89.5	Confident	89.8	Confident	16 Å²	16	28.1 Å²	28.1	11%	0.112	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.8	177.4	-56.9	0	0	0	0	113	W122 P336 R337 A338	W122-S340 PolarHBondContact NE1-OG 2.81Å; P336-S340 WeakPolarHBondContact O-CB 3.42Å; P336-S340 PolarHBondContact O-N 3.04Å; P336-S340 PolarHBondContact O-OG 3.49Å; R337-S340 PolarHBondContact O-N 3.06Å; A338-S340 VanDerWaalsContact C-N 3.31Å; A338-S340 PolarHBondContact O-N 3.32Å
341	M	85.3	Confident	90.1	Very high	32 Å²	32	29.9 Å²	29.9	16%	0.158	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.9	176.7	-44	179.3	64.7	0	0	113	Q138 F311 M312 E315 Q316 R337 A338 V339	Q138-M341 HydrophobicContact CG-CE 4.35Å; Q138-M341 HydrophobicContact CG-CG 4.47Å; Q138-M341 VanDerWaalsContact NE2-CA 3.34Å; Q138-M341 VanDerWaalsContact NE2-CG 3.35Å; F311-M341 HydrophobicContact CE1-CB 3.89Å; F311-M341 HydrophobicContact CZ-CB 4.12Å; M312-M341 HydrophobicContact CG-SD 4.26Å; E315-M341 HydrophobicContact CB-CE 3.26Å; E315-M341 HydrophobicContact CG-CE 3.97Å; Q316-M341 HydrophobicContact CG-CE 3.98Å; Q316-M341 HydrophobicContact CG-SD 4.38Å; Q316-M341 PolarHBondContact NE2-SD 2.86Å; R337-M341 WeakPolarHBondContact O-CG 3.23Å; A338-M341 WeakPolarHBondContact O-CB 3.29Å; A338-M341 PolarHBondContact O-N 3.29Å; A338-M341 VanDerWaalsContact O-N 3.11Å; V339-M341 PolarHBondContact O-N 3.12Å; V339-M341 VanDerWaalsContact O-N 3.1Å
342	M	86.4	Confident	90.3	Very high	10 Å²	10	29.8 Å²	29.8	5%	0.049	15%	0.154	C	C	.	.	S	Bend	trans	-91.1	147.6	-178.9	-58.3	-172.1	-160.5	0	0	111.5	R224 L228 I308 F311 V339 S345	R224-M342 HydrophobicContact CG-SD 4.42Å; L228-M342 HydrophobicContact CD1-CE 3.62Å; L228-M342 HydrophobicContact CD1-SD 4.11Å; I308-M342 HydrophobicContact CB-CE 4.48Å; I308-M342 HydrophobicContact CD1-CE 4.32Å; I308-M342 HydrophobicContact CG1-CE 4.09Å; I308-M342 HydrophobicContact CG2-CE 3.7Å; F311-M342 HydrophobicContact CD1-CE 4.4Å; F311-M342 HydrophobicContact CE1-CE 4.49Å; F311-M342 HydrophobicContact CE1-CG 4.12Å; V339-M342 WeakPolarHBondContact O-CB 3.38Å; V339-M342 PolarHBondContact O-N 3.26Å; M342-S345 PolarHBondContact O-N 3.15Å
343	P	86.6	Confident	90.4	Very high	80 Å²	80	29.9 Å²	29.9	52%	0.519	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	142	169.3	27.4	-35.4	0	0	0	110.5	W348	P343-W348 PolarHBondContact O-NE1 3.41Å
344	F	89.3	Confident	90.6	Very high	161 Å²	161	30.7 Å²	30.7	71%	0.706	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	45.2	-173.8	-55.1	-80.5	0	0	0	112.9	P346 L347 W348	F344-P346 VanDerWaalsContact C-N 3.32Å; F344-L347 WeakPolarHBondContact O-CB 3.39Å; F344-L347 PolarHBondContact O-N 3.12Å; F344-L347 VanDerWaalsContact O-N 3.12Å; F344-W348 VanDerWaalsContact O-CD1 3.25Å
345	S	91.3	Very high	90.7	Very high	20 Å²	20	30.6 Å²	30.6	14%	0.14	16%	0.159	C	C	.	.	H	α-helix	trans	-50.9	-35.9	-177	59.7	0	0	0	0	115.5	V339 M342 L347 W348 A349	V339-S345 WeakPolarHBondContact CG1-O 3.37Å; V339-S345 WeakPolarHBondContact O-CB 3.19Å; M342-S345 PolarHBondContact O-N 3.15Å; S345-L347 VanDerWaalsContact C-N 3.32Å; S345-L347 PolarHBondContact O-N 3.29Å; S345-W348 PolarHBondContact O-N 3.37Å; S345-A349 WeakPolarHBondContact O-CB 3.45Å; S345-A349 PolarHBondContact O-N 3.26Å
346	P	93.4	Very high	90.9	Very high	21 Å²	21	30.3 Å²	30.3	14%	0.136	16%	0.158	C	C	.	.	H	α-helix	trans	-62.7	-35.8	178.7	-24.3	37	0	0	0	113.5	S117 W118 L120 F344 A349 A350	S117-P346 WeakPolarHBondContact O-CB 3.45Å; S117-P346 WeakPolarHBondContact O-CG 3.38Å; W118-P346 VanDerWaalsContact O-CG 3.25Å; W118-P346 WeakPolarHBondContact O-CG 3.27Å; L120-P346 HydrophobicContact CD2-CB 4.43Å; L120-P346 HydrophobicContact CD2-CG 4.48Å; F344-P346 VanDerWaalsContact C-N 3.32Å; P346-A349 PolarHBondContact O-N 3.12Å; P346-A350 WeakPolarHBondContact O-CB 3.33Å; P346-A350 PolarHBondContact O-N 3.48Å
347	L	92.1	Very high	91.1	Very high	98 Å²	98	30.6 Å²	30.6	51%	0.513	16%	0.159	S	C	.	.	H	α-helix	trans	-63.6	-49.3	177.8	176.3	64.5	0	0	0	110.8	F344 S345 A349 A350 L351	F344-L347 WeakPolarHBondContact O-CB 3.39Å; F344-L347 PolarHBondContact O-N 3.12Å; F344-L347 VanDerWaalsContact O-N 3.12Å; S345-L347 VanDerWaalsContact C-N 3.32Å; S345-L347 PolarHBondContact O-N 3.29Å; L347-A349 VanDerWaalsContact C-N 3.34Å; L347-A349 PolarHBondContact O-N 3.38Å; L347-A350 PolarHBondContact O-N 3.01Å; L347-L351 HydrophobicContact CD1-CD1 3.95Å; L347-L351 HydrophobicContact CD1-CG 4.15Å; L347-L351 HydrophobicContact CG-CD1 4Å; L347-L351 WeakPolarHBondContact O-CB 3.47Å; L347-L351 VanDerWaalsContact O-CG 3.24Å; L347-L351 WeakPolarHBondContact O-CG 3.25Å; L347-L351 PolarHBondContact O-N 3.25Å
348	W	91.7	Very high	91.4	Very high	42 Å²	42	29.5 Å²	29.5	16%	0.159	16%	0.156	C	C	.	.	H	α-helix	trans	-64.8	-39.1	-179.7	-59.3	109.8	0	0	0	111.9	V220 L221 R224 V339 P343 F344 S345 F352	V220-W348 HydrophobicContact CG1-CZ3 3.9Å; L221-W348 HydrophobicContact CD2-CE3 4.21Å; R224-W348 HydrophobicContact CB-CH2 3.92Å; R224-W348 HydrophobicContact CB-CZ3 3.91Å; R224-W348 HydrophobicContact CG-CE3 4.32Å; R224-W348 HydrophobicContact CG-CH2 3.67Å; R224-W348 HydrophobicContact CG-CZ2 4Å; R224-W348 HydrophobicContact CG-CZ3 3.83Å; V339-W348 HydrophobicContact CG1-CB 3.82Å; V339-W348 HydrophobicContact CG2-CB 4.31Å; P343-W348 PolarHBondContact O-NE1 3.41Å; F344-W348 VanDerWaalsContact O-CD1 3.25Å; S345-W348 PolarHBondContact O-N 3.37Å; W348-F352 VanDerWaalsContact O-CB 3.3Å; W348-F352 WeakPolarHBondContact O-CB 3.43Å; W348-F352 PolarHBondContact O-N 2.96Å
349	A	93.7	Very high	91.6	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-51.1	175.4	0	0	0	0	0	111.2	L120 W122 V339 S345 P346 L347 L351 F352 F353	L120-A349 HydrophobicContact CD1-CB 4.11Å; L120-A349 HydrophobicContact CD2-CB 4.16Å; W122-A349 HydrophobicContact CZ2-CB 4.01Å; V339-A349 HydrophobicContact CG1-CB 3.92Å; S345-A349 WeakPolarHBondContact O-CB 3.45Å; S345-A349 PolarHBondContact O-N 3.26Å; P346-A349 PolarHBondContact O-N 3.12Å; L347-A349 VanDerWaalsContact C-N 3.34Å; L347-A349 PolarHBondContact O-N 3.38Å; A349-L351 PolarHBondContact O-N 3.35Å; A349-F352 PolarHBondContact O-N 3.02Å; A349-F353 HydrophobicContact CB-CD2 4.5Å; A349-F353 WeakPolarHBondContact O-CD2 3.41Å; A349-F353 PolarHBondContact O-N 3.2Å
350	A	93.9	Very high	91.8	Very high	16 Å²	16	29.8 Å²	29.8	13%	0.132	16%	0.158	C	C	.	.	H	α-helix	trans	-59.2	-47.3	179.8	0	0	0	0	0	111.6	L112 P346 L347 F352 F353 V354	L112-A350 HydrophobicContact CD1-CB 4.29Å; P346-A350 WeakPolarHBondContact O-CB 3.33Å; P346-A350 PolarHBondContact O-N 3.48Å; L347-A350 PolarHBondContact O-N 3.01Å; A350-F352 VanDerWaalsContact C-N 3.34Å; A350-F352 PolarHBondContact O-N 3.31Å; A350-F353 PolarHBondContact O-N 3.21Å; A350-V354 WeakPolarHBondContact O-CB 3.32Å; A350-V354 VanDerWaalsContact O-CG2 3.24Å; A350-V354 WeakPolarHBondContact O-CG2 3.2Å; A350-V354 PolarHBondContact O-N 2.94Å
351	L	92	Very high	92.1	Very high	45 Å²	45	29.3 Å²	29.3	24%	0.236	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-40.1	179	-70.2	176.4	0	0	0	112.6	M217 L347 A349 M355	M217-L351 HydrophobicContact CE-CB 3.5Å; M217-L351 VanDerWaalsContact CE-CB 3.5Å; M217-L351 HydrophobicContact CE-CD1 3.97Å; M217-L351 HydrophobicContact CE-CD2 4.39Å; M217-L351 HydrophobicContact CE-CG 4.15Å; M217-L351 HydrophobicContact SD-CB 3.94Å; M217-L351 HydrophobicContact SD-CD1 4.31Å; M217-L351 HydrophobicContact SD-CD2 3.8Å; M217-L351 HydrophobicContact SD-CG 4.23Å; L347-L351 HydrophobicContact CD1-CD1 3.95Å; L347-L351 HydrophobicContact CD1-CG 4.15Å; L347-L351 HydrophobicContact CG-CD1 4Å; L347-L351 WeakPolarHBondContact O-CB 3.47Å; L347-L351 VanDerWaalsContact O-CG 3.24Å; L347-L351 WeakPolarHBondContact O-CG 3.25Å; L347-L351 PolarHBondContact O-N 3.25Å; A349-L351 PolarHBondContact O-N 3.35Å; L351-M355 WeakPolarHBondContact O-CB 3.16Å; L351-M355 PolarHBondContact O-N 3.37Å; L351-M355 VanDerWaalsContact O-N 3.12Å
352	F	92	Very high	92.5	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-66.4	-46.2	176.8	175.6	-104.6	0	0	0	112.5	M27 L221 A331 Y335 W348 A349 A350 M355 I356	M27-F352 HydrophobicContact CE-CE2 4.16Å; L221-F352 HydrophobicContact CD1-CD2 4.14Å; A331-F352 HydrophobicContact CB-CE1 4.32Å; A331-F352 HydrophobicContact CB-CZ 4Å; A331-F352 WeakPolarHBondContact O-CE1 3.21Å; Y335-F352 HydrophobicContact CD1-CB 4.22Å; Y335-F352 AromaticContact CD1-CD1 3.36Å; Y335-F352 HydrophobicContact CD1-CD1 3.36Å; Y335-F352 AromaticContact CD1-CD2 3.59Å; Y335-F352 HydrophobicContact CD1-CD2 3.59Å; Y335-F352 AromaticContact CD1-CE1 3.36Å; Y335-F352 HydrophobicContact CD1-CE1 3.36Å; Y335-F352 AromaticContact CD1-CE2 3.6Å; Y335-F352 HydrophobicContact CD1-CE2 3.6Å; Y335-F352 AromaticContact CD1-CG 3.45Å; Y335-F352 HydrophobicContact CD1-CG 3.45Å; Y335-F352 VanDerWaalsContact CD1-CG 3.45Å; Y335-F352 AromaticContact CD1-CZ 3.48Å; Y335-F352 HydrophobicContact CD1-CZ 3.48Å; Y335-F352 VanDerWaalsContact CD1-CZ 3.48Å; Y335-F352 HydrophobicContact CD2-CD2 4.22Å; Y335-F352 AromaticContact CD2-CE2 3.71Å; Y335-F352 HydrophobicContact CD2-CE2 3.71Å; Y335-F352 AromaticContact CD2-CZ 3.93Å; Y335-F352 HydrophobicContact CD2-CZ 3.93Å; Y335-F352 HydrophobicContact CE1-CB 3.49Å; Y335-F352 VanDerWaalsContact CE1-CB 3.49Å; Y335-F352 AromaticContact CE1-CD1 3.55Å; Y335-F352 HydrophobicContact CE1-CD1 3.55Å; Y335-F352 AromaticContact CE1-CD2 3.14Å; Y335-F352 HydrophobicContact CE1-CD2 3.14Å; Y335-F352 AromaticContact CE1-CE1 3.96Å; Y335-F352 HydrophobicContact CE1-CE1 3.96Å; Y335-F352 AromaticContact CE1-CE2 3.61Å; Y335-F352 HydrophobicContact CE1-CE2 3.61Å; Y335-F352 AromaticContact CE1-CG 3.09Å; Y335-F352 HydrophobicContact CE1-CG 3.09Å; Y335-F352 AromaticContact CE1-CZ 3.98Å; Y335-F352 HydrophobicContact CE1-CZ 3.98Å; Y335-F352 AromaticContact CE2-CD2 3.84Å; Y335-F352 HydrophobicContact CE2-CD2 3.84Å; Y335-F352 AromaticContact CE2-CE2 3.7Å; Y335-F352 HydrophobicContact CE2-CE2 3.7Å; Y335-F352 HydrophobicContact CE2-CZ 4.36Å; Y335-F352 HydrophobicContact CG-CD1 4.2Å; Y335-F352 HydrophobicContact CG-CD2 4.1Å; Y335-F352 AromaticContact CG-CE1 3.76Å; Y335-F352 HydrophobicContact CG-CE1 3.76Å; Y335-F352 AromaticContact CG-CE2 3.65Å; Y335-F352 HydrophobicContact CG-CE2 3.65Å; Y335-F352 HydrophobicContact CG-CG 4.34Å; Y335-F352 AromaticContact CG-CZ 3.45Å; Y335-F352 HydrophobicContact CG-CZ 3.45Å; Y335-F352 VanDerWaalsContact CG-CZ 3.45Å; Y335-F352 AromaticContact CZ-CD2 3.29Å; Y335-F352 AromaticContact CZ-CE2 3.66Å; Y335-F352 AromaticContact CZ-CG 3.75Å; W348-F352 VanDerWaalsContact O-CB 3.3Å; W348-F352 WeakPolarHBondContact O-CB 3.43Å; W348-F352 PolarHBondContact O-N 2.96Å; A349-F352 PolarHBondContact O-N 3.02Å; A350-F352 VanDerWaalsContact C-N 3.34Å; A350-F352 PolarHBondContact O-N 3.31Å; F352-M355 HydrophobicContact CD2-CE 3.47Å; F352-M355 VanDerWaalsContact CD2-CE 3.47Å; F352-M355 HydrophobicContact CE2-CE 3.92Å; F352-M355 HydrophobicContact CG-CE 4.4Å; F352-M355 WeakPolarHBondContact O-CB 3.34Å; F352-M355 PolarHBondContact O-N 3.04Å; F352-I356 HydrophobicContact CD1-CD1 4.07Å; F352-I356 HydrophobicContact CE1-CD1 3.34Å; F352-I356 HydrophobicContact CE1-CG1 4.19Å; F352-I356 HydrophobicContact CE2-CD1 4.25Å; F352-I356 HydrophobicContact CZ-CD1 3.46Å; F352-I356 VanDerWaalsContact CZ-CD1 3.46Å; F352-I356 HydrophobicContact CZ-CG1 4.17Å; F352-I356 PolarHBondContact O-N 2.69Å
353	F	94.7	Very high	92.8	Very high	1 Å²	1	27.9 Å²	27.9	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-72.6	-31.1	-179.4	-71.3	-63	0	0	0	112.9	Y111 L112 W122 F332 P336 A349 A350 M355 I356 V357	Y111-F353 VanDerWaalsContact CB-CE1 3.46Å; Y111-F353 VanDerWaalsContact CB-CZ 3.46Å; Y111-F353 AromaticContact CD1-CE1 3.84Å; Y111-F353 HydrophobicContact CD1-CE1 3.84Å; Y111-F353 AromaticContact CD1-CE2 3.66Å; Y111-F353 HydrophobicContact CD1-CE2 3.66Å; Y111-F353 AromaticContact CD1-CZ 3.17Å; Y111-F353 HydrophobicContact CD1-CZ 3.17Å; Y111-F353 HydrophobicContact CE1-CZ 4Å; Y111-F353 HydrophobicContact CG-CD1 4.38Å; Y111-F353 AromaticContact CG-CE1 3.73Å; Y111-F353 HydrophobicContact CG-CE1 3.73Å; Y111-F353 HydrophobicContact CG-CE2 4.07Å; Y111-F353 AromaticContact CG-CZ 3.55Å; Y111-F353 HydrophobicContact CG-CZ 3.55Å; L112-F353 HydrophobicContact CB-CB 3.96Å; L112-F353 HydrophobicContact CD1-CB 4.4Å; W122-F353 HydrophobicContact CH2-CE2 4.03Å; W122-F353 HydrophobicContact CZ2-CE2 4.1Å; F332-F353 AromaticContact CD1-CE1 3.87Å; F332-F353 HydrophobicContact CD1-CE1 3.87Å; F332-F353 HydrophobicContact CE1-CD1 4.38Å; F332-F353 AromaticContact CE1-CE1 3.86Å; F332-F353 HydrophobicContact CE1-CE1 3.86Å; P336-F353 HydrophobicContact CG-CE2 4.39Å; P336-F353 HydrophobicContact CG-CZ 3.71Å; A349-F353 HydrophobicContact CB-CD2 4.5Å; A349-F353 WeakPolarHBondContact O-CD2 3.41Å; A349-F353 PolarHBondContact O-N 3.2Å; A350-F353 PolarHBondContact O-N 3.21Å; F353-M355 VanDerWaalsContact C-N 3.33Å; F353-I356 HydrophobicContact CD1-CD1 4.31Å; F353-I356 HydrophobicContact CE1-CD1 4.46Å; F353-I356 PolarHBondContact O-N 2.89Å; F353-V357 VanDerWaalsContact O-CG2 3.28Å; F353-V357 WeakPolarHBondContact O-CG2 3.42Å; F353-V357 PolarHBondContact O-N 3.44Å
354	V	94.3	Very high	93.2	Very high	31 Å²	31	24 Å²	24	19%	0.188	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-44.5	167.9	171.1	0	0	0	0	110.7	L112 F213 A350 V357 F358	L112-V354 HydrophobicContact CD1-CG2 3.71Å; L112-V354 HydrophobicContact CD2-CG2 3.88Å; L112-V354 HydrophobicContact CG-CG2 4.47Å; F213-V354 HydrophobicContact CD1-CG1 4.12Å; F213-V354 HydrophobicContact CE1-CB 4.31Å; F213-V354 HydrophobicContact CE1-CG1 3.48Å; F213-V354 VanDerWaalsContact CE1-CG1 3.48Å; F213-V354 HydrophobicContact CZ-CG1 4.08Å; A350-V354 WeakPolarHBondContact O-CB 3.32Å; A350-V354 VanDerWaalsContact O-CG2 3.24Å; A350-V354 WeakPolarHBondContact O-CG2 3.2Å; A350-V354 PolarHBondContact O-N 2.94Å; V354-V357 PolarHBondContact O-N 2.91Å; V354-F358 HydrophobicContact CG1-CD2 3.81Å; V354-F358 HydrophobicContact CG1-CE2 3.36Å; V354-F358 HydrophobicContact CG1-CZ 3.92Å; V354-F358 PolarHBondContact O-N 2.93Å
355	M	92.6	Very high	93.4	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-61.3	-44.3	176	174.3	-175.4	63.1	0	0	111.8	M27 P214 M217 L221 L351 F352 F353 V357 F358 L359	M27-M355 HydrophobicContact CE-CE 3.12Å; M27-M355 HydrophobicContact CE-SD 3.86Å; M27-M355 HydrophobicContact SD-CE 3.62Å; M27-M355 HydrophobicContact SD-CG 4.31Å; M27-M355 HydrophobicContact SD-SD 3.89Å; P214-M355 HydrophobicContact CB-CG 4.02Å; M217-M355 HydrophobicContact CB-CB 4.09Å; M217-M355 HydrophobicContact CB-CG 4.15Å; M217-M355 HydrophobicContact CB-SD 3.7Å; M217-M355 HydrophobicContact CG-CB 4.27Å; L221-M355 HydrophobicContact CD1-CE 3.52Å; L221-M355 HydrophobicContact CD1-SD 4.17Å; L351-M355 WeakPolarHBondContact O-CB 3.16Å; L351-M355 PolarHBondContact O-N 3.37Å; L351-M355 VanDerWaalsContact O-N 3.12Å; F352-M355 HydrophobicContact CD2-CE 3.47Å; F352-M355 VanDerWaalsContact CD2-CE 3.47Å; F352-M355 HydrophobicContact CE2-CE 3.92Å; F352-M355 HydrophobicContact CG-CE 4.4Å; F352-M355 WeakPolarHBondContact O-CB 3.34Å; F352-M355 PolarHBondContact O-N 3.04Å; F353-M355 VanDerWaalsContact C-N 3.33Å; M355-V357 VanDerWaalsContact C-N 3.34Å; M355-V357 PolarHBondContact O-N 3.42Å; M355-F358 PolarHBondContact O-N 3.15Å; M355-L359 HydrophobicContact CG-CD1 3.77Å; M355-L359 HydrophobicContact CG-CG 4.39Å; M355-L359 WeakPolarHBondContact O-CB 3.45Å; M355-L359 WeakPolarHBondContact O-CG 3.3Å; M355-L359 PolarHBondContact O-N 2.91Å
356	I	92.6	Very high	93.5	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.015	8%	0.083	C	C	.	.	H	α-helix	trans	-59	-44.9	174.7	-77.5	-170.4	0	0	0	111.4	L24 A331 F332 F352 F353 F358 G360	L24-I356 HydrophobicContact CD2-CB 4.21Å; L24-I356 HydrophobicContact CD2-CG1 4.07Å; L24-I356 HydrophobicContact CD2-CG2 3.87Å; A331-I356 HydrophobicContact CB-CD1 3.68Å; F332-I356 HydrophobicContact CZ-CG2 4.47Å; F352-I356 HydrophobicContact CD1-CD1 4.07Å; F352-I356 HydrophobicContact CE1-CD1 3.34Å; F352-I356 HydrophobicContact CE1-CG1 4.19Å; F352-I356 HydrophobicContact CE2-CD1 4.25Å; F352-I356 HydrophobicContact CZ-CD1 3.46Å; F352-I356 VanDerWaalsContact CZ-CD1 3.46Å; F352-I356 HydrophobicContact CZ-CG1 4.17Å; F352-I356 PolarHBondContact O-N 2.69Å; F353-I356 HydrophobicContact CD1-CD1 4.31Å; F353-I356 HydrophobicContact CE1-CD1 4.46Å; F353-I356 PolarHBondContact O-N 2.89Å; I356-F358 PolarHBondContact O-N 2.86Å; I356-G360 PolarHBondContact O-N 3.31Å
357	V	95.1	Very high	93.5	Very high	7 Å²	7	14.9 Å²	14.9	4%	0.042	8%	0.079	C	C	.	.	H	α-helix	trans	-61.9	-44.5	179.7	169.2	0	0	0	0	110.8	I109 M191 F353 V354 M355 L361	I109-V357 HydrophobicContact CG1-CG1 4.35Å; I109-V357 HydrophobicContact CG1-CG2 3.83Å; M191-V357 HydrophobicContact CE-CG1 4.05Å; F353-V357 VanDerWaalsContact O-CG2 3.28Å; F353-V357 WeakPolarHBondContact O-CG2 3.42Å; F353-V357 PolarHBondContact O-N 3.44Å; V354-V357 PolarHBondContact O-N 2.91Å; M355-V357 VanDerWaalsContact C-N 3.34Å; M355-V357 PolarHBondContact O-N 3.42Å; V357-L361 WeakPolarHBondContact O-CB 3.14Å; V357-L361 PolarHBondContact O-N 3.25Å
358	F	94.7	Very high	93.7	Very high	30 Å²	30	10.2 Å²	10.2	13%	0.132	6%	0.055	C	C	.	.	H	α-helix	trans	-71.1	-42	179.3	-66.4	-28.5	0	0	0	113.9	F209 T210 F213 P214 V354 M355 I356 G360 L361 D362	F209-F358 HydrophobicContact CD1-CE2 4.21Å; F209-F358 HydrophobicContact CD1-CZ 4.21Å; F209-F358 HydrophobicContact CE1-CD2 4.37Å; F209-F358 HydrophobicContact CE1-CE1 4.39Å; F209-F358 AromaticContact CE1-CE2 3.42Å; F209-F358 HydrophobicContact CE1-CE2 3.42Å; F209-F358 VanDerWaalsContact CE1-CE2 3.42Å; F209-F358 AromaticContact CE1-CZ 3.46Å; F209-F358 HydrophobicContact CE1-CZ 3.46Å; F209-F358 VanDerWaalsContact CE1-CZ 3.46Å; F209-F358 AromaticContact CZ-CE2 3.98Å; F209-F358 HydrophobicContact CZ-CE2 3.98Å; F209-F358 HydrophobicContact CZ-CZ 4.32Å; T210-F358 HydrophobicContact CG2-CD1 4.04Å; T210-F358 HydrophobicContact CG2-CE1 4.43Å; T210-F358 HydrophobicContact CG2-CG 4.45Å; F213-F358 HydrophobicContact CB-CD2 4.18Å; F213-F358 HydrophobicContact CB-CE2 4.48Å; F213-F358 AromaticContact CD1-CD2 3.65Å; F213-F358 HydrophobicContact CD1-CD2 3.65Å; F213-F358 AromaticContact CD1-CE2 3.88Å; F213-F358 HydrophobicContact CD1-CE2 3.88Å; F213-F358 HydrophobicContact CE1-CD2 4.38Å; F213-F358 HydrophobicContact CE1-CE2 4.34Å; F213-F358 HydrophobicContact CG-CD2 4.13Å; F213-F358 HydrophobicContact CG-CE2 4.18Å; P214-F358 HydrophobicContact CG-CB 4.09Å; V354-F358 HydrophobicContact CG1-CD2 3.81Å; V354-F358 HydrophobicContact CG1-CE2 3.36Å; V354-F358 HydrophobicContact CG1-CZ 3.92Å; V354-F358 PolarHBondContact O-N 2.93Å; M355-F358 PolarHBondContact O-N 3.15Å; I356-F358 PolarHBondContact O-N 2.86Å; F358-G360 VanDerWaalsContact C-N 3.27Å; F358-G360 PolarHBondContact O-N 2.92Å; F358-L361 HydrophobicContact CD1-CD2 4.46Å; F358-L361 PolarHBondContact O-N 3.35Å; F358-D362 PolarHBondContact O-N 3.21Å
359	L	92.8	Very high	93.8	Very high	7 Å²	7	8.4 Å²	8.4	4%	0.037	5%	0.048	C	C	.	.	H	α-helix	trans	-59.9	-40.5	174.6	-74.3	169.5	0	0	0	111.8	I22 L24 M27 P214 M355 S363	I22-L359 HydrophobicContact CG2-CD2 4.08Å; I22-L359 VanDerWaalsContact O-CD2 3.29Å; I22-L359 WeakPolarHBondContact O-CD2 3.31Å; L24-L359 HydrophobicContact CD2-CB 4.38Å; M27-L359 HydrophobicContact CG-CD1 3.94Å; M27-L359 HydrophobicContact SD-CD1 3.19Å; M27-L359 WeakPolarHBondContact SD-CD1 3.32Å; P214-L359 HydrophobicContact CB-CD1 4.22Å; P214-L359 HydrophobicContact CB-CD2 3.59Å; P214-L359 HydrophobicContact CB-CG 3.72Å; P214-L359 HydrophobicContact CG-CD2 3.87Å; P214-L359 HydrophobicContact CG-CG 3.83Å; M355-L359 HydrophobicContact CG-CD1 3.77Å; M355-L359 HydrophobicContact CG-CG 4.39Å; M355-L359 WeakPolarHBondContact O-CB 3.45Å; M355-L359 WeakPolarHBondContact O-CG 3.3Å; M355-L359 PolarHBondContact O-N 2.91Å; L359-S363 PolarHBondContact O-OG 3.33Å
360	G	93.8	Very high	93.9	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-68.4	-42.8	174.3	0	0	0	0	0	112.6	Y101 L105 I356 F358 D362 S363 Q364	Y101-G360 WeakPolarHBondContact CE1-O 3.46Å; L105-G360 VanDerWaalsContact CD1-CA 3.47Å; I356-G360 PolarHBondContact O-N 3.31Å; F358-G360 VanDerWaalsContact C-N 3.27Å; F358-G360 PolarHBondContact O-N 2.92Å; G360-D362 PolarHBondContact O-N 3.06Å; G360-S363 PolarHBondContact O-N 3.01Å; G360-Q364 VanDerWaalsContact O-CB 3.26Å; G360-Q364 WeakPolarHBondContact O-CB 3.03Å; G360-Q364 PolarHBondContact O-N 2.85Å
361	L	95.2	Very high	93.9	Very high	5 Å²	5	8.3 Å²	8.3	3%	0.026	5%	0.045	C	C	.	.	H	α-helix	trans	-61.2	-43.9	-178.2	-175.4	67.2	0	0	0	112	L105 M191 C192 T210 V357 F358 Q364 F365	L105-L361 HydrophobicContact CD2-CB 4.32Å; L105-L361 HydrophobicContact CD2-CD1 4.46Å; M191-L361 HydrophobicContact CB-CD1 4.14Å; M191-L361 HydrophobicContact CE-CD2 3.9Å; C192-L361 HydrophobicContact CB-CD1 4.35Å; T210-L361 HydrophobicContact CG2-CD2 4.21Å; V357-L361 WeakPolarHBondContact O-CB 3.14Å; V357-L361 PolarHBondContact O-N 3.25Å; F358-L361 HydrophobicContact CD1-CD2 4.46Å; F358-L361 PolarHBondContact O-N 3.35Å; L361-Q364 PolarHBondContact O-N 3.34Å; L361-F365 HydrophobicContact CG-CD1 4.27Å; L361-F365 WeakPolarHBondContact O-CD1 2.93Å; L361-F365 PolarHBondContact O-N 2.99Å
362	D	94.2	Very high	94	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.4	-47	-179.2	-74.8	-16.3	0	0	0	112.4	G19 T210 A211 F358 G360 F365 V366	G19-D362 VanDerWaalsContact O-CB 3.27Å; G19-D362 WeakPolarHBondContact O-CB 3.47Å; T210-D362 WeakPolarHBondContact CB-OD1 3.4Å; T210-D362 PolarHBondContact OG1-OD1 2.97Å; A211-D362 WeakPolarHBondContact CA-OD2 3.48Å; A211-D362 PolarHBondContact N-OD2 3.36Å; A211-D362 VanDerWaalsContact N-OD2 3.12Å; F358-D362 PolarHBondContact O-N 3.21Å; G360-D362 PolarHBondContact O-N 3.06Å; D362-F365 VanDerWaalsContact CA-CE1 3.42Å; D362-F365 HydrophobicContact CB-CE1 4.21Å; D362-F365 HydrophobicContact CB-CZ 4.21Å; D362-F365 WeakPolarHBondContact OD1-CE1 3.39Å; D362-V366 WeakPolarHBondContact O-CG2 3.3Å; D362-V366 PolarHBondContact O-N 3.38Å
363	S	93.5	Very high	94.1	Very high	12 Å²	12	6 Å²	6	8%	0.084	3%	0.034	C	C	.	.	H	α-helix	trans	-62.9	-45.2	175.5	-64.8	0	0	0	0	111.3	S20 Y101 L359 G360 V366 C367	S20-S363 PolarHBondContact O-OG 3.49Å; Y101-S363 WeakPolarHBondContact OH-CB 3.03Å; Y101-S363 PolarHBondContact OH-OG 3.23Å; L359-S363 PolarHBondContact O-OG 3.33Å; G360-S363 PolarHBondContact O-N 3.01Å; S363-V366 PolarHBondContact O-N 3.4Å; S363-C367 PolarHBondContact O-N 3.02Å; S363-C367 VanDerWaalsContact O-N 3.15Å; S363-C367 PolarHBondContact O-SG 2.79Å; S363-C367 VanDerWaalsContact O-SG 3.33Å
364	Q	95.4	Very high	94.1	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-63.8	-47.7	-175.6	-176.4	65.8	19.7	0	0	112.5	N98 Y101 I102 L105 G360 L361 V366 C367 V368	N98-Q364 PolarHBondContact O-NE2 3.48Å; N98-Q364 VanDerWaalsContact O-NE2 3.16Å; Y101-Q364 HydrophobicContact CD1-CB 4.31Å; I102-Q364 HydrophobicContact CB-CG 4.31Å; I102-Q364 HydrophobicContact CD1-CG 3.85Å; I102-Q364 HydrophobicContact CG1-CG 4.39Å; L105-Q364 HydrophobicContact CD2-CB 4.23Å; G360-Q364 VanDerWaalsContact O-CB 3.26Å; G360-Q364 WeakPolarHBondContact O-CB 3.03Å; G360-Q364 PolarHBondContact O-N 2.85Å; L361-Q364 PolarHBondContact O-N 3.34Å; Q364-V366 VanDerWaalsContact C-N 3.26Å; Q364-V366 PolarHBondContact O-N 3.34Å; Q364-C367 PolarHBondContact O-N 3.12Å; Q364-V368 WeakPolarHBondContact O-CG2 3.2Å; Q364-V368 PolarHBondContact O-N 2.92Å; Q364-V368 VanDerWaalsContact O-N 3.07Å
365	F	92.8	Very high	94.1	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-69.5	-28.3	-176.8	75	-123.8	0	0	0	111.7	C195 I196 T203 V207 L361 D362 V368 E369	C195-F365 HydrophobicContact CB-CB 4.48Å; C195-F365 HydrophobicContact CB-CD1 3.99Å; C195-F365 HydrophobicContact CB-CG 4.39Å; I196-F365 HydrophobicContact CG2-CB 3.64Å; I196-F365 HydrophobicContact CG2-CD2 3.88Å; I196-F365 HydrophobicContact CG2-CG 3.96Å; T203-F365 HydrophobicContact CG2-CD2 3.62Å; T203-F365 HydrophobicContact CG2-CE2 3.16Å; T203-F365 HydrophobicContact CG2-CZ 3.85Å; V207-F365 HydrophobicContact CG1-CE1 4.31Å; V207-F365 HydrophobicContact CG1-CE2 4.24Å; V207-F365 HydrophobicContact CG1-CZ 3.48Å; V207-F365 VanDerWaalsContact CG1-CZ 3.48Å; L361-F365 HydrophobicContact CG-CD1 4.27Å; L361-F365 WeakPolarHBondContact O-CD1 2.93Å; L361-F365 PolarHBondContact O-N 2.99Å; D362-F365 VanDerWaalsContact CA-CE1 3.42Å; D362-F365 HydrophobicContact CB-CE1 4.21Å; D362-F365 HydrophobicContact CB-CZ 4.21Å; D362-F365 WeakPolarHBondContact OD1-CE1 3.39Å; F365-V368 PolarHBondContact O-N 3.31Å; F365-E369 VanDerWaalsContact O-CB 3.25Å; F365-E369 WeakPolarHBondContact O-CB 3Å; F365-E369 PolarHBondContact O-N 3.49Å
366	V	93.5	Very high	94	Very high	1 Å²	1	7.2 Å²	7.2	1%	0.006	4%	0.039	C	C	.	.	H	α-helix	trans	-68.3	-41.2	175.1	170.3	0	0	0	0	110.7	S20 L273 D362 S363 Q364 V368 E369 S370	S20-V366 WeakPolarHBondContact OG-CG1 3.49Å; L273-V366 HydrophobicContact CD1-CG1 3.76Å; L273-V366 HydrophobicContact CD1-CG2 4.37Å; L273-V366 HydrophobicContact CD2-CG1 4.31Å; L273-V366 HydrophobicContact CG-CG1 4.14Å; D362-V366 WeakPolarHBondContact O-CG2 3.3Å; D362-V366 PolarHBondContact O-N 3.38Å; S363-V366 PolarHBondContact O-N 3.4Å; Q364-V366 VanDerWaalsContact C-N 3.26Å; Q364-V366 PolarHBondContact O-N 3.34Å; V366-V368 VanDerWaalsContact C-N 3.35Å; V366-V368 PolarHBondContact O-N 3.48Å; V366-E369 PolarHBondContact O-N 3.34Å; V366-S370 WeakPolarHBondContact O-CB 3.28Å; V366-S370 PolarHBondContact O-N 3.33Å
367	C	94	Very high	94	Very high	9 Å²	9	7.4 Å²	7.4	6%	0.061	4%	0.04	C	C	.	.	H	α-helix	trans	-61	-43.2	174.2	-67.3	0	0	0	0	111.8	V94 L97 N98 S363 Q364 S370 L371	V94-C367 HydrophobicContact CG1-CB 4.17Å; V94-C367 WeakPolarHBondContact CG1-O 3.2Å; L97-C367 HydrophobicContact CD2-CB 4.32Å; N98-C367 WeakPolarHBondContact OD1-CB 3.18Å; S363-C367 PolarHBondContact O-N 3.02Å; S363-C367 VanDerWaalsContact O-N 3.15Å; S363-C367 PolarHBondContact O-SG 2.79Å; S363-C367 VanDerWaalsContact O-SG 3.33Å; Q364-C367 PolarHBondContact O-N 3.12Å; C367-S370 WeakPolarHBondContact O-CB 3.39Å; C367-S370 PolarHBondContact O-N 2.89Å; C367-L371 PolarHBondContact O-N 3.49Å
368	V	95.6	Very high	93.8	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-67.3	-41.2	175.7	-178.1	0	0	0	0	111.4	N98 W189 I196 Q364 F365 V366 S370 L371 V372 L393 V396	N98-V368 WeakPolarHBondContact OD1-CG2 3.32Å; W189-V368 HydrophobicContact CH2-CG2 4.23Å; W189-V368 HydrophobicContact CZ3-CG2 3.93Å; I196-V368 HydrophobicContact CD1-CB 3.73Å; I196-V368 HydrophobicContact CD1-CG1 3.39Å; Q364-V368 WeakPolarHBondContact O-CG2 3.2Å; Q364-V368 PolarHBondContact O-N 2.92Å; Q364-V368 VanDerWaalsContact O-N 3.07Å; F365-V368 PolarHBondContact O-N 3.31Å; V366-V368 VanDerWaalsContact C-N 3.35Å; V366-V368 PolarHBondContact O-N 3.48Å; V368-S370 VanDerWaalsContact C-N 3.31Å; V368-S370 PolarHBondContact O-N 3.49Å; V368-L371 PolarHBondContact O-N 3.25Å; V368-V372 HydrophobicContact CG1-CG2 4.3Å; V368-V372 WeakPolarHBondContact O-CG2 3.32Å; V368-V372 PolarHBondContact O-N 2.94Å; V368-L393 HydrophobicContact CG1-CD1 3.66Å; V368-V396 HydrophobicContact CG1-CG1 4.4Å
369	E	94.1	Very high	93.6	Very high	3 Å²	3	13 Å²	13	1%	0.014	6%	0.062	C	C	.	.	H	α-helix	trans	-62.7	-38	177.3	-174	63.2	-149.4	0	0	111.9	I196 F365 V366 V372 T373 R389	I196-E369 HydrophobicContact CG2-CB 4.39Å; F365-E369 VanDerWaalsContact O-CB 3.25Å; F365-E369 WeakPolarHBondContact O-CB 3Å; F365-E369 PolarHBondContact O-N 3.49Å; V366-E369 PolarHBondContact O-N 3.34Å; E369-V372 PolarHBondContact O-N 3.03Å; E369-T373 WeakPolarHBondContact O-CB 3.39Å; E369-T373 PolarHBondContact O-N 2.65Å; E369-T373 PolarHBondContact O-OG1 2.77Å; E369-T373 PolarHBondContact OE1-OG1 3.49Å; E369-R389 IonicContact OE1-CZ 3.88Å; E369-R389 IonicContact OE1-NH2 2.73Å; E369-R389 PolarHBondContact OE1-NH2 3.22Å; E369-R389 IonicContact OE2-CZ 3.91Å; E369-R389 IonicContact OE2-NH2 2.66Å; E369-R389 PolarHBondContact OE2-NH2 2.88Å
370	S	94.2	Very high	93.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.007	7%	0.071	C	C	.	.	H	α-helix	trans	-58.8	-51.1	174.5	-178.3	0	0	0	0	111.3	G268 S269 V366 C367 V368 V372 T373 A374	G268-S370 PolarHBondContact O-OG 2.83Å; S269-S370 WeakPolarHBondContact CA-OG 3.19Å; S269-S370 PolarHBondContact N-OG 3.38Å; V366-S370 WeakPolarHBondContact O-CB 3.28Å; V366-S370 PolarHBondContact O-N 3.33Å; C367-S370 WeakPolarHBondContact O-CB 3.39Å; C367-S370 PolarHBondContact O-N 2.89Å; V368-S370 VanDerWaalsContact C-N 3.31Å; V368-S370 PolarHBondContact O-N 3.49Å; S370-V372 PolarHBondContact O-N 3.12Å; S370-T373 PolarHBondContact O-N 3.48Å; S370-A374 WeakPolarHBondContact O-CB 3.44Å; S370-A374 PolarHBondContact O-N 2.98Å
371	L	95.3	Very high	93	Very high	15 Å²	15	18.6 Å²	18.6	8%	0.079	10%	0.097	C	C	.	.	H	α-helix	trans	-60.5	-47.3	177.7	-179.2	62.7	0	0	0	112	Q91 V94 C367 V368 T373 A374 I375 V396	Q91-L371 HydrophobicContact CB-CD1 4.37Å; Q91-L371 VanDerWaalsContact OE1-CA 3.28Å; V94-L371 HydrophobicContact CG1-CB 4.17Å; C367-L371 PolarHBondContact O-N 3.49Å; V368-L371 PolarHBondContact O-N 3.25Å; L371-T373 PolarHBondContact O-N 3.18Å; L371-A374 PolarHBondContact O-N 3.2Å; L371-I375 HydrophobicContact CD1-CD1 3.92Å; L371-I375 HydrophobicContact CG-CD1 4.27Å; L371-I375 PolarHBondContact O-N 3.21Å; L371-V396 HydrophobicContact CD2-CG1 4Å
372	V	94.5	Very high	92.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-44.3	178.7	171.4	0	0	0	0	110.9	V368 E369 S370 A374 I375 V376 R389 F392 L393	V368-V372 HydrophobicContact CG1-CG2 4.3Å; V368-V372 WeakPolarHBondContact O-CG2 3.32Å; V368-V372 PolarHBondContact O-N 2.94Å; E369-V372 PolarHBondContact O-N 3.03Å; S370-V372 PolarHBondContact O-N 3.12Å; V372-A374 PolarHBondContact O-N 2.86Å; V372-I375 PolarHBondContact O-N 3.15Å; V372-V376 HydrophobicContact CG1-CG2 3.91Å; V372-V376 VanDerWaalsContact O-CB 3.26Å; V372-V376 WeakPolarHBondContact O-CB 3.32Å; V372-V376 WeakPolarHBondContact O-CG2 3.46Å; V372-V376 PolarHBondContact O-N 2.72Å; V372-R389 HydrophobicContact CG1-CG 4.24Å; V372-F392 HydrophobicContact CB-CE1 4.42Å; V372-F392 HydrophobicContact CG1-CD1 4.22Å; V372-F392 HydrophobicContact CG1-CE1 4.33Å; V372-F392 HydrophobicContact CG2-CD1 4.4Å; V372-F392 HydrophobicContact CG2-CE1 4.11Å; V372-L393 HydrophobicContact CG2-CD1 3.99Å
373	T	93.6	Very high	92.5	Very high	1 Å²	1	24 Å²	24	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-44.4	178.9	-61.7	0	0	0	0	111.4	A272 Y276 E369 S370 L371 I375 D377	A272-T373 HydrophobicContact CB-CG2 4.26Å; Y276-T373 HydrophobicContact CE2-CG2 4.02Å; Y276-T373 WeakPolarHBondContact OH-CG2 3.38Å; Y276-T373 PolarHBondContact OH-OG1 3.22Å; E369-T373 WeakPolarHBondContact O-CB 3.39Å; E369-T373 PolarHBondContact O-N 2.65Å; E369-T373 PolarHBondContact O-OG1 2.77Å; E369-T373 PolarHBondContact OE1-OG1 3.49Å; S370-T373 PolarHBondContact O-N 3.48Å; L371-T373 PolarHBondContact O-N 3.18Å; T373-I375 PolarHBondContact O-N 2.8Å; T373-D377 VanDerWaalsContact O-CB 3.3Å; T373-D377 WeakPolarHBondContact O-CB 3.37Å; T373-D377 VanDerWaalsContact O-CG 3.27Å; T373-D377 PolarHBondContact O-N 3.35Å
374	A	94.1	Very high	92	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.2	-46.6	179	0	0	0	0	0	112.1	I73 Q91 S370 L371 V372 M378	I73-A374 HydrophobicContact CD1-CB 4.27Å; I73-A374 HydrophobicContact CG1-CB 4.31Å; Q91-A374 HydrophobicContact CG-CB 3.9Å; S370-A374 WeakPolarHBondContact O-CB 3.44Å; S370-A374 PolarHBondContact O-N 2.98Å; L371-A374 PolarHBondContact O-N 3.2Å; V372-A374 PolarHBondContact O-N 2.86Å; A374-M378 WeakPolarHBondContact O-CG 3.23Å; A374-M378 PolarHBondContact O-N 3.18Å
375	I	93.7	Very high	91.6	Very high	46 Å²	46	33 Å²	33	24%	0.236	16%	0.159	C	C	.	.	H	α-helix	trans	-74	-40.8	-177.8	-65.2	169.8	0	0	0	111.6	L371 V372 T373 D377 M378 Y379 F383 F392	L371-I375 HydrophobicContact CD1-CD1 3.92Å; L371-I375 HydrophobicContact CG-CD1 4.27Å; L371-I375 PolarHBondContact O-N 3.21Å; V372-I375 PolarHBondContact O-N 3.15Å; T373-I375 PolarHBondContact O-N 2.8Å; I375-D377 PolarHBondContact O-N 3.17Å; I375-M378 PolarHBondContact O-N 2.86Å; I375-Y379 PolarHBondContact O-N 3.3Å; I375-Y379 VanDerWaalsContact O-N 3.16Å; I375-F383 HydrophobicContact CG2-CD2 4.45Å; I375-F383 HydrophobicContact CG2-CE2 3.91Å; I375-F383 HydrophobicContact CG2-CZ 4.44Å; I375-F392 HydrophobicContact CB-CE1 4.09Å; I375-F392 HydrophobicContact CB-CZ 3.96Å; I375-F392 HydrophobicContact CD1-CE1 4.38Å; I375-F392 HydrophobicContact CD1-CZ 3.66Å; I375-F392 HydrophobicContact CG1-CZ 4.4Å; I375-F392 HydrophobicContact CG2-CE1 4.03Å; I375-F392 HydrophobicContact CG2-CE2 4.25Å; I375-F392 HydrophobicContact CG2-CZ 3.65Å
376	V	92.3	Very high	91.1	Very high	12 Å²	12	40.7 Å²	40.7	7%	0.073	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-37.3	176.2	169.9	0	0	0	0	110.9	V372 Y379 P380 F383 R384 R389	V372-V376 HydrophobicContact CG1-CG2 3.91Å; V372-V376 VanDerWaalsContact O-CB 3.26Å; V372-V376 WeakPolarHBondContact O-CB 3.32Å; V372-V376 WeakPolarHBondContact O-CG2 3.46Å; V372-V376 PolarHBondContact O-N 2.72Å; V376-Y379 CarbonylContact O-C 3.45Å; V376-P380 WeakPolarHBondContact O-CA 3.16Å; V376-P380 WeakPolarHBondContact O-CB 3.49Å; V376-F383 HydrophobicContact CB-CB 4.35Å; V376-F383 HydrophobicContact CG1-CB 4.24Å; V376-F383 HydrophobicContact CG2-CB 3.88Å; V376-F383 HydrophobicContact CG2-CG 4.42Å; V376-R384 HydrophobicContact CG1-CG 3.76Å; V376-R389 HydrophobicContact CG2-CG 4.35Å
377	D	90.8	Very high	90.7	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.032	22%	0.216	C	C	.	.	H	α-helix	trans	-76	-25.3	178.3	-75.5	-7.1	0	0	0	113.7	R4 G71 T373 I375 R384	R4-D377 IonicContact CZ-OD1 3.69Å; R4-D377 IonicContact CZ-OD2 3.59Å; R4-D377 VanDerWaalsContact NH1-CG 3.31Å; R4-D377 IonicContact NH1-OD1 2.72Å; R4-D377 PolarHBondContact NH1-OD1 3.22Å; R4-D377 IonicContact NH1-OD2 3.61Å; R4-D377 PolarHBondContact NH1-OD2 2.78Å; R4-D377 IonicContact NH2-OD1 3.53Å; R4-D377 IonicContact NH2-OD2 2.98Å; R4-D377 PolarHBondContact NH2-OD2 2.71Å; G71-D377 PolarHBondContact N-OD2 3.44Å; T373-D377 VanDerWaalsContact O-CB 3.3Å; T373-D377 WeakPolarHBondContact O-CB 3.37Å; T373-D377 VanDerWaalsContact O-CG 3.27Å; T373-D377 PolarHBondContact O-N 3.35Å; I375-D377 PolarHBondContact O-N 3.17Å; D377-R384 IonicContact OD1-CZ 3.7Å; D377-R384 IonicContact OD1-NE 3.94Å; D377-R384 IonicContact OD1-NH2 2.67Å; D377-R384 PolarHBondContact OD1-NH2 3.31Å
378	M	91.3	Very high	90.5	Very high	29 Å²	29	51.6 Å²	51.6	14%	0.143	24%	0.239	C	C	.	.	H	α-helix	trans	-71.5	-39.6	172.1	-76.3	-179	69.4	0	0	112.3	I73 Y88 A374 I375 P380	I73-M378 HydrophobicContact CB-CG 4.29Å; I73-M378 HydrophobicContact CB-SD 4.02Å; I73-M378 HydrophobicContact CD1-SD 3.45Å; I73-M378 WeakPolarHBondContact CD1-SD 3.3Å; I73-M378 HydrophobicContact CG1-SD 4.32Å; I73-M378 HydrophobicContact CG2-CE 4.46Å; I73-M378 HydrophobicContact CG2-CG 4.2Å; I73-M378 HydrophobicContact CG2-SD 3.75Å; Y88-M378 HydrophobicContact CE1-CE 4.05Å; Y88-M378 HydrophobicContact CE1-SD 4.29Å; Y88-M378 VanDerWaalsContact OH-CE 3.25Å; Y88-M378 WeakPolarHBondContact OH-CE 3.11Å; A374-M378 WeakPolarHBondContact O-CG 3.23Å; A374-M378 PolarHBondContact O-N 3.18Å; I375-M378 PolarHBondContact O-N 2.86Å; M378-P380 WeakPolarHBondContact O-CD 3.48Å
379	Y	91	Very high	90.3	Very high	127 Å²	127	53.7 Å²	53.7	50%	0.498	25%	0.247	S	C	.	.	S	Bend	trans	-124.3	61.4	-176.6	-57.2	-76.4	0	0	0	112.3	I375 V376 T381 V382 F383	I375-Y379 PolarHBondContact O-N 3.3Å; I375-Y379 VanDerWaalsContact O-N 3.16Å; V376-Y379 CarbonylContact O-C 3.45Å; Y379-T381 VanDerWaalsContact C-N 3.28Å; Y379-T381 PolarHBondContact O-N 3.31Å; Y379-V382 PolarHBondContact O-N 3.02Å; Y379-V382 VanDerWaalsContact O-N 3.11Å; Y379-F383 HydrophobicContact CD2-CE2 4.41Å; Y379-F383 PolarHBondContact O-N 3.13Å
380	P	87.4	Confident	90.3	Very high	35 Å²	35	56.3 Å²	56.3	23%	0.227	26%	0.259	C	S	.	.	H	α-helix	trans	-73.9	-24	-166.5	37.3	-42.1	0	0	0	111.6	M1 V376 M378 V382 R384	M1-P380 HydrophobicContact CE-CB 3.38Å; M1-P380 HydrophobicContact CE-CG 3.91Å; V376-P380 WeakPolarHBondContact O-CA 3.16Å; V376-P380 WeakPolarHBondContact O-CB 3.49Å; M378-P380 WeakPolarHBondContact O-CD 3.48Å; P380-V382 PolarHBondContact O-N 3.14Å; P380-R384 HydrophobicContact CB-CG 4.23Å; P380-R384 VanDerWaalsContact O-CB 3.25Å; P380-R384 WeakPolarHBondContact O-CB 3.33Å; P380-R384 PolarHBondContact O-N 3.34Å; P380-R384 VanDerWaalsContact O-N 3.09Å
381	T	87.4	Confident	90.3	Very high	89 Å²	89	61.2 Å²	61.2	55%	0.546	29%	0.285	S	S	.	.	H	α-helix	trans	-65.7	-24.5	173.5	54.5	0	0	0	0	113.7	Y379 R385	Y379-T381 VanDerWaalsContact C-N 3.28Å; Y379-T381 PolarHBondContact O-N 3.31Å; T381-R385 PolarHBondContact O-NE 3.14Å; T381-R385 PolarHBondContact O-NH2 3.46Å
382	V	89.2	Confident	90.2	Very high	76 Å²	76	62.7 Å²	62.7	46%	0.461	29%	0.291	S	S	.	.	H	α-helix	trans	-92.6	-52.6	-179.2	-179.2	0	0	0	0	110.4	Y379 P380	Y379-V382 PolarHBondContact O-N 3.02Å; Y379-V382 VanDerWaalsContact O-N 3.11Å; P380-V382 PolarHBondContact O-N 3.14Å
383	F	89.3	Confident	90.3	Very high	41 Å²	41	62.7 Å²	62.7	18%	0.18	29%	0.291	C	S	.	.	H	α-helix	trans	-91.8	-23.6	-168.5	-63.3	-68.3	0	0	0	114.9	I375 V376 Y379 R385 R389 F392	I375-F383 HydrophobicContact CG2-CD2 4.45Å; I375-F383 HydrophobicContact CG2-CE2 3.91Å; I375-F383 HydrophobicContact CG2-CZ 4.44Å; V376-F383 HydrophobicContact CB-CB 4.35Å; V376-F383 HydrophobicContact CG1-CB 4.24Å; V376-F383 HydrophobicContact CG2-CB 3.88Å; V376-F383 HydrophobicContact CG2-CG 4.42Å; Y379-F383 HydrophobicContact CD2-CE2 4.41Å; Y379-F383 PolarHBondContact O-N 3.13Å; F383-R385 PolarHBondContact O-N 2.96Å; F383-R389 PolarHBondContact O-N 3.18Å; F383-F392 HydrophobicContact CD1-CB 3.84Å; F383-F392 HydrophobicContact CD1-CD2 4.46Å; F383-F392 HydrophobicContact CD1-CG 4.03Å; F383-F392 HydrophobicContact CE1-CB 3.81Å; F383-F392 AromaticContact CE1-CD2 3.72Å; F383-F392 HydrophobicContact CE1-CD2 3.72Å; F383-F392 AromaticContact CE1-CG 3.75Å; F383-F392 HydrophobicContact CE1-CG 3.75Å; F383-F392 HydrophobicContact CZ-CD2 4.06Å; F383-F392 HydrophobicContact CZ-CE2 4.41Å; F383-F392 HydrophobicContact CZ-CG 4.38Å
384	R	83.5	Confident	90.4	Very high	44 Å²	44	65.7 Å²	65.7	17%	0.166	31%	0.306	C	S	.	.	S	Bend	trans	-83.4	36	174.6	-56.2	-169.4	-174.5	171.2	-3.2	113	M1 E2 V376 D377 P380	M1-R384 HydrophobicContact CE-CB 4.28Å; M1-R384 HydrophobicContact CE-CG 4.39Å; M1-R384 HydrophobicContact CG-CB 3.95Å; E2-R384 PolarHBondContact N-O 2.94Å; V376-R384 HydrophobicContact CG1-CG 3.76Å; D377-R384 IonicContact OD1-CZ 3.7Å; D377-R384 IonicContact OD1-NE 3.94Å; D377-R384 IonicContact OD1-NH2 2.67Å; D377-R384 PolarHBondContact OD1-NH2 3.31Å; P380-R384 HydrophobicContact CB-CG 4.23Å; P380-R384 VanDerWaalsContact O-CB 3.25Å; P380-R384 WeakPolarHBondContact O-CB 3.33Å; P380-R384 PolarHBondContact O-N 3.34Å; P380-R384 VanDerWaalsContact O-N 3.09Å
385	R	85.9	Confident	90.5	Very high	158 Å²	158	67.6 Å²	67.6	60%	0.596	33%	0.326	S	S	*	.	S	Bend	trans	-107.9	151.9	170.2	-63.2	-174.8	-174.8	-166.5	-1	108.4	T381 F383 N387 R388	T381-R385 PolarHBondContact O-NE 3.14Å; T381-R385 PolarHBondContact O-NH2 3.46Å; F383-R385 PolarHBondContact O-N 2.96Å; R385-N387 PolarHBondContact O-N 3.41Å; R385-R388 HydrophobicContact CB-CB 4.42Å; R385-R388 HydrophobicContact CB-CG 3.91Å; R385-R388 WeakPolarHBondContact O-CB 3.46Å; R385-R388 PolarHBondContact O-N 2.98Å
386	K	83.3	Confident	90.6	Very high	161 Å²	161	66.1 Å²	66.1	70%	0.7	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.1	126.2	-179.4	-172.6	172.9	-177.8	-178.8	0	111.6	R388	K386-R388 PolarHBondContact O-N 2.88Å
387	N	85.2	Confident	90.8	Very high	97 Å²	97	66 Å²	66	52%	0.519	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-1.6	178.5	-52.5	3.8	0	0	0	116.5	R385 L391	R385-N387 PolarHBondContact O-N 3.41Å; N387-L391 PolarHBondContact O-N 3.08Å; N387-L391 VanDerWaalsContact O-N 3.12Å
388	R	89.9	Confident	91.2	Very high	143 Å²	143	70 Å²	70	54%	0.54	34%	0.339	S	S	.	.	H	α-helix	trans	-74	-36.2	-178.7	-67.9	-64	-174.6	169.4	0	112.6	R385 K386 F392	R385-R388 HydrophobicContact CB-CB 4.42Å; R385-R388 HydrophobicContact CB-CG 3.91Å; R385-R388 WeakPolarHBondContact O-CB 3.46Å; R385-R388 PolarHBondContact O-N 2.98Å; K386-R388 PolarHBondContact O-N 2.88Å; R388-F392 WeakPolarHBondContact O-CB 3.41Å; R388-F392 PolarHBondContact O-N 2.84Å
389	R	91.1	Very high	91.4	Very high	44 Å²	44	74.1 Å²	74.1	17%	0.166	36%	0.357	C	S	.	.	H	α-helix	trans	-60	-47.1	171.4	-177.8	-171	178.6	-75	-5.6	111.4	I196 W197 E369 V372 V376 F383 L391 F392 L393	I196-R389 PolarHBondContact O-NH1 3Å; W197-R389 PolarHBondContact O-NH1 3.33Å; E369-R389 IonicContact OE1-CZ 3.88Å; E369-R389 IonicContact OE1-NH2 2.73Å; E369-R389 PolarHBondContact OE1-NH2 3.22Å; E369-R389 IonicContact OE2-CZ 3.91Å; E369-R389 IonicContact OE2-NH2 2.66Å; E369-R389 PolarHBondContact OE2-NH2 2.88Å; V372-R389 HydrophobicContact CG1-CG 4.24Å; V376-R389 HydrophobicContact CG2-CG 4.35Å; F383-R389 PolarHBondContact O-N 3.18Å; R389-L391 PolarHBondContact O-N 2.89Å; R389-F392 PolarHBondContact O-N 3.49Å; R389-L393 WeakPolarHBondContact O-CB 3.11Å; R389-L393 PolarHBondContact O-N 3.08Å
390	E	93.1	Very high	91.7	Very high	57 Å²	57	68.2 Å²	68.2	27%	0.266	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-41.7	-179.1	-67.4	168.2	177.2	0	0	111.7	W197 L394	W197-E390 WeakPolarHBondContact O-CG 3.21Å; E390-L394 WeakPolarHBondContact O-CB 3.36Å; E390-L394 PolarHBondContact O-N 3.03Å
391	L	93.6	Very high	92.2	Very high	105 Å²	105	68.4 Å²	68.4	55%	0.55	33%	0.331	S	S	.	.	H	α-helix	trans	-68	-39.2	175.8	-171.8	67.3	0	0	0	112.1	N387 R389 L394 G395	N387-L391 PolarHBondContact O-N 3.08Å; N387-L391 VanDerWaalsContact O-N 3.12Å; R389-L391 PolarHBondContact O-N 2.89Å; L391-L394 PolarHBondContact O-N 3.07Å; L391-G395 PolarHBondContact O-N 2.67Å
392	F	95.1	Very high	92.7	Very high	45 Å²	45	69.2 Å²	69.2	20%	0.197	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-47	174.9	173	-112	0	0	0	111.5	V372 I375 F383 R388 R389 L394 G395 V396	V372-F392 HydrophobicContact CB-CE1 4.42Å; V372-F392 HydrophobicContact CG1-CD1 4.22Å; V372-F392 HydrophobicContact CG1-CE1 4.33Å; V372-F392 HydrophobicContact CG2-CD1 4.4Å; V372-F392 HydrophobicContact CG2-CE1 4.11Å; I375-F392 HydrophobicContact CB-CE1 4.09Å; I375-F392 HydrophobicContact CB-CZ 3.96Å; I375-F392 HydrophobicContact CD1-CE1 4.38Å; I375-F392 HydrophobicContact CD1-CZ 3.66Å; I375-F392 HydrophobicContact CG1-CZ 4.4Å; I375-F392 HydrophobicContact CG2-CE1 4.03Å; I375-F392 HydrophobicContact CG2-CE2 4.25Å; I375-F392 HydrophobicContact CG2-CZ 3.65Å; F383-F392 HydrophobicContact CD1-CB 3.84Å; F383-F392 HydrophobicContact CD1-CD2 4.46Å; F383-F392 HydrophobicContact CD1-CG 4.03Å; F383-F392 HydrophobicContact CE1-CB 3.81Å; F383-F392 AromaticContact CE1-CD2 3.72Å; F383-F392 HydrophobicContact CE1-CD2 3.72Å; F383-F392 AromaticContact CE1-CG 3.75Å; F383-F392 HydrophobicContact CE1-CG 3.75Å; F383-F392 HydrophobicContact CZ-CD2 4.06Å; F383-F392 HydrophobicContact CZ-CE2 4.41Å; F383-F392 HydrophobicContact CZ-CG 4.38Å; R388-F392 WeakPolarHBondContact O-CB 3.41Å; R388-F392 PolarHBondContact O-N 2.84Å; R389-F392 PolarHBondContact O-N 3.49Å; F392-L394 VanDerWaalsContact C-N 3.3Å; F392-L394 PolarHBondContact O-N 2.85Å; F392-G395 WeakPolarHBondContact O-CA 3.44Å; F392-G395 PolarHBondContact O-N 2.92Å; F392-G395 VanDerWaalsContact O-N 3.07Å; F392-V396 HydrophobicContact CD1-CG2 4.49Å; F392-V396 HydrophobicContact CD2-CG2 4.44Å; F392-V396 HydrophobicContact CE1-CG2 3.97Å; F392-V396 HydrophobicContact CE2-CG2 3.9Å; F392-V396 HydrophobicContact CZ-CG2 3.62Å; F392-V396 WeakPolarHBondContact O-CG2 3.39Å; F392-V396 PolarHBondContact O-N 3.09Å
393	L	95.6	Very high	93	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.5	-44.3	173.8	169	63.3	0	0	0	111.5	Y193 I196 V368 V372 R389 G395 V396 V397	Y193-L393 HydrophobicContact CD2-CD2 3.9Å; Y193-L393 HydrophobicContact CD2-CG 3.87Å; Y193-L393 HydrophobicContact CE2-CD2 3.95Å; Y193-L393 HydrophobicContact CE2-CG 3.98Å; I196-L393 HydrophobicContact CD1-CD1 3.38Å; I196-L393 HydrophobicContact CD1-CD2 4.05Å; I196-L393 HydrophobicContact CD1-CG 4.35Å; I196-L393 HydrophobicContact CG1-CD1 4.12Å; I196-L393 HydrophobicContact CG1-CD2 3.87Å; V368-L393 HydrophobicContact CG1-CD1 3.66Å; V372-L393 HydrophobicContact CG2-CD1 3.99Å; R389-L393 WeakPolarHBondContact O-CB 3.11Å; R389-L393 PolarHBondContact O-N 3.08Å; L393-G395 VanDerWaalsContact C-N 3.29Å; L393-G395 PolarHBondContact O-N 3.18Å; L393-V396 PolarHBondContact O-N 3.34Å; L393-V397 HydrophobicContact CD1-CG2 3.92Å; L393-V397 HydrophobicContact CG-CG2 4.45Å; L393-V397 WeakPolarHBondContact O-CG2 3.24Å; L393-V397 PolarHBondContact O-N 2.97Å
394	L	96.3	Very high	93.3	Very high	64 Å²	64	66.5 Å²	66.5	34%	0.335	32%	0.315	S	S	.	.	H	α-helix	trans	-58.6	-43.4	175.5	-178.1	64	0	0	0	111.1	Y193 E390 L391 F392 V397 L398	Y193-L394 HydrophobicContact CD2-CD1 4.41Å; Y193-L394 HydrophobicContact CE2-CB 3.87Å; Y193-L394 HydrophobicContact CE2-CD1 4.16Å; E390-L394 WeakPolarHBondContact O-CB 3.36Å; E390-L394 PolarHBondContact O-N 3.03Å; L391-L394 PolarHBondContact O-N 3.07Å; F392-L394 VanDerWaalsContact C-N 3.3Å; F392-L394 PolarHBondContact O-N 2.85Å; L394-V397 PolarHBondContact O-N 3.15Å; L394-L398 HydrophobicContact CD1-CD1 4.19Å; L394-L398 HydrophobicContact CD1-CG 4.18Å; L394-L398 HydrophobicContact CG-CD1 3.92Å; L394-L398 HydrophobicContact CG-CG 4.33Å; L394-L398 WeakPolarHBondContact O-CB 3.33Å; L394-L398 WeakPolarHBondContact O-CG 3.39Å; L394-L398 PolarHBondContact O-N 2.88Å
395	G	96.4	Very high	94	Very high	40 Å²	40	66.1 Å²	66.1	41%	0.412	32%	0.316	S	S	.	.	H	α-helix	trans	-59.7	-43.9	174.5	0	0	0	0	0	113.3	L391 F392 L393 F399	L391-G395 PolarHBondContact O-N 2.67Å; F392-G395 WeakPolarHBondContact O-CA 3.44Å; F392-G395 PolarHBondContact O-N 2.92Å; F392-G395 VanDerWaalsContact O-N 3.07Å; L393-G395 VanDerWaalsContact C-N 3.29Å; L393-G395 PolarHBondContact O-N 3.18Å; G395-F399 WeakPolarHBondContact O-CB 3.46Å; G395-F399 PolarHBondContact O-N 3.37Å
396	V	96	Very high	94.5	Very high	16 Å²	16	62 Å²	62	10%	0.097	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-49.5	176	173.3	0	0	0	0	110.8	V368 L371 F392 L393 L398 F399 S400	V368-V396 HydrophobicContact CG1-CG1 4.4Å; L371-V396 HydrophobicContact CD2-CG1 4Å; F392-V396 HydrophobicContact CD1-CG2 4.49Å; F392-V396 HydrophobicContact CD2-CG2 4.44Å; F392-V396 HydrophobicContact CE1-CG2 3.97Å; F392-V396 HydrophobicContact CE2-CG2 3.9Å; F392-V396 HydrophobicContact CZ-CG2 3.62Å; F392-V396 WeakPolarHBondContact O-CG2 3.39Å; F392-V396 PolarHBondContact O-N 3.09Å; L393-V396 PolarHBondContact O-N 3.34Å; V396-L398 PolarHBondContact O-N 2.95Å; V396-F399 PolarHBondContact O-N 3.03Å; V396-S400 WeakPolarHBondContact O-CB 3.12Å; V396-S400 PolarHBondContact O-N 3.44Å; V396-S400 PolarHBondContact O-OG 2.85Å; V396-S400 VanDerWaalsContact O-OG 3.12Å
397	V	96.6	Very high	95.1	Very high	8 Å²	8	54.8 Å²	54.8	5%	0.048	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-44.4	179.3	166.1	0	0	0	0	111.7	W189 Y193 L393 L394 S400 F401	W189-V397 HydrophobicContact CB-CG1 3.81Å; W189-V397 HydrophobicContact CD2-CG1 3.89Å; W189-V397 HydrophobicContact CE3-CB 4Å; W189-V397 HydrophobicContact CE3-CG1 3.52Å; W189-V397 HydrophobicContact CE3-CG2 3.8Å; W189-V397 HydrophobicContact CG-CG1 4.06Å; W189-V397 HydrophobicContact CZ3-CB 4.38Å; W189-V397 HydrophobicContact CZ3-CG1 4.37Å; W189-V397 HydrophobicContact CZ3-CG2 3.94Å; Y193-V397 HydrophobicContact CD2-CG2 4.42Å; L393-V397 HydrophobicContact CD1-CG2 3.92Å; L393-V397 HydrophobicContact CG-CG2 4.45Å; L393-V397 WeakPolarHBondContact O-CG2 3.24Å; L393-V397 PolarHBondContact O-N 2.97Å; L394-V397 PolarHBondContact O-N 3.15Å; V397-S400 PolarHBondContact O-N 3.46Å; V397-F401 WeakPolarHBondContact O-CB 3.34Å; V397-F401 PolarHBondContact O-N 2.93Å
398	L	97.2	Very high	95.6	Very high	91 Å²	91	50.5 Å²	50.5	48%	0.476	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-42.3	177.9	-72.5	173.5	0	0	0	111.9	L394 V396 F401 L402	L394-L398 HydrophobicContact CD1-CD1 4.19Å; L394-L398 HydrophobicContact CD1-CG 4.18Å; L394-L398 HydrophobicContact CG-CD1 3.92Å; L394-L398 HydrophobicContact CG-CG 4.33Å; L394-L398 WeakPolarHBondContact O-CB 3.33Å; L394-L398 WeakPolarHBondContact O-CG 3.39Å; L394-L398 PolarHBondContact O-N 2.88Å; V396-L398 PolarHBondContact O-N 2.95Å; L398-F401 PolarHBondContact O-N 2.89Å; L398-L402 WeakPolarHBondContact O-CG 3.13Å; L398-L402 PolarHBondContact O-N 3.37Å
399	F	97	Very high	95.9	Very high	116 Å²	116	46.2 Å²	46.2	51%	0.509	24%	0.238	S	C	.	.	H	α-helix	trans	-63.5	-45.9	176	176.5	-115.3	0	0	0	111.6	F99 G395 V396 F401 L402 M403	F99-F399 HydrophobicContact CE1-CD1 4.11Å; F99-F399 AromaticContact CE1-CE1 3.97Å; F99-F399 HydrophobicContact CE1-CE1 3.97Å; F99-F399 HydrophobicContact CZ-CD1 4.17Å; F99-F399 AromaticContact CZ-CE1 3.57Å; F99-F399 HydrophobicContact CZ-CE1 3.57Å; F99-F399 HydrophobicContact CZ-CZ 4.26Å; G395-F399 WeakPolarHBondContact O-CB 3.46Å; G395-F399 PolarHBondContact O-N 3.37Å; V396-F399 PolarHBondContact O-N 3.03Å; F399-F401 VanDerWaalsContact C-N 3.33Å; F399-F401 PolarHBondContact O-N 2.85Å; F399-L402 PolarHBondContact O-N 2.86Å; F399-M403 HydrophobicContact CD2-CG 4.46Å; F399-M403 HydrophobicContact CE1-CG 4.31Å; F399-M403 HydrophobicContact CE2-CG 4.05Å; F399-M403 HydrophobicContact CE2-SD 4.22Å; F399-M403 HydrophobicContact CZ-CG 3.97Å; F399-M403 HydrophobicContact CZ-SD 4.26Å; F399-M403 WeakPolarHBondContact O-CG 3.14Å; F399-M403 PolarHBondContact O-N 2.96Å
400	S	96.5	Very high	96.1	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-34.2	177	-62.1	0	0	0	0	112.8	F99 V396 V397 M403 G404	F99-S400 WeakPolarHBondContact CE1-OG 3.31Å; V396-S400 WeakPolarHBondContact O-CB 3.12Å; V396-S400 PolarHBondContact O-N 3.44Å; V396-S400 PolarHBondContact O-OG 2.85Å; V396-S400 VanDerWaalsContact O-OG 3.12Å; V397-S400 PolarHBondContact O-N 3.46Å; S400-M403 PolarHBondContact O-N 3.13Å; S400-G404 PolarHBondContact O-N 3.48Å
401	F	97.5	Very high	96.2	Very high	38 Å²	38	44.2 Å²	44.2	17%	0.167	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-49.6	171	170.4	-99.9	0	0	0	111.4	L185 L186 W189 V397 L398 F399 M403 G404 L405	L185-F401 HydrophobicContact CB-CE2 4.47Å; L185-F401 HydrophobicContact CD2-CD2 4.02Å; L185-F401 HydrophobicContact CD2-CE2 4.21Å; L185-F401 HydrophobicContact CG-CD2 3.93Å; L185-F401 HydrophobicContact CG-CE2 4.15Å; L186-F401 HydrophobicContact CB-CE2 3.87Å; L186-F401 HydrophobicContact CB-CZ 4.41Å; L186-F401 HydrophobicContact CD1-CE2 4.23Å; L186-F401 HydrophobicContact CD1-CZ 4.42Å; W189-F401 AromaticContact CD1-CD2 3.82Å; W189-F401 HydrophobicContact CG-CB 4.27Å; V397-F401 WeakPolarHBondContact O-CB 3.34Å; V397-F401 PolarHBondContact O-N 2.93Å; L398-F401 PolarHBondContact O-N 2.89Å; F399-F401 VanDerWaalsContact C-N 3.33Å; F399-F401 PolarHBondContact O-N 2.85Å; F401-M403 VanDerWaalsContact C-N 3.35Å; F401-M403 PolarHBondContact O-N 2.9Å; F401-G404 PolarHBondContact O-N 2.83Å; F401-G404 VanDerWaalsContact O-N 3.14Å; F401-L405 HydrophobicContact CE1-CD1 4.08Å; F401-L405 HydrophobicContact CE1-CD2 4.36Å; F401-L405 HydrophobicContact CE1-CG 4.39Å; F401-L405 HydrophobicContact CE2-CD2 4.18Å; F401-L405 HydrophobicContact CZ-CD1 4.41Å; F401-L405 HydrophobicContact CZ-CD2 3.9Å; F401-L405 HydrophobicContact CZ-CG 4.41Å; F401-L405 PolarHBondContact O-N 3.41Å
402	L	97.4	Very high	96.3	Very high	106 Å²	106	39.2 Å²	39.2	56%	0.555	20%	0.204	S	C	*	.	H	α-helix	trans	-61.5	-41.8	179.4	-68.3	172.9	0	0	0	112.2	L398 F399 G404 L405	L398-L402 WeakPolarHBondContact O-CG 3.13Å; L398-L402 PolarHBondContact O-N 3.37Å; F399-L402 PolarHBondContact O-N 2.86Å; L402-G404 VanDerWaalsContact C-N 3.33Å; L402-L405 HydrophobicContact CD2-CD1 4.28Å; L402-L405 PolarHBondContact O-N 2.97Å
403	M	96.6	Very high	96.2	Very high	60 Å²	60	37.4 Å²	37.4	30%	0.296	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-39.2	174.8	-68.9	-57.6	-62	0	0	112	F99 F399 S400 F401 L405 I406	F99-M403 HydrophobicContact CD1-CB 3.83Å; F99-M403 HydrophobicContact CD1-CG 4.24Å; F99-M403 HydrophobicContact CD2-CB 4.3Å; F99-M403 HydrophobicContact CE1-CB 4.06Å; F99-M403 HydrophobicContact CE1-CG 3.95Å; F99-M403 HydrophobicContact CE2-CE 4.4Å; F99-M403 HydrophobicContact CE2-CG 4.24Å; F99-M403 HydrophobicContact CG-CB 3.98Å; F99-M403 HydrophobicContact CZ-CB 4.4Å; F99-M403 HydrophobicContact CZ-CG 3.96Å; F399-M403 HydrophobicContact CD2-CG 4.46Å; F399-M403 HydrophobicContact CE1-CG 4.31Å; F399-M403 HydrophobicContact CE2-CG 4.05Å; F399-M403 HydrophobicContact CE2-SD 4.22Å; F399-M403 HydrophobicContact CZ-CG 3.97Å; F399-M403 HydrophobicContact CZ-SD 4.26Å; F399-M403 WeakPolarHBondContact O-CG 3.14Å; F399-M403 PolarHBondContact O-N 2.96Å; S400-M403 PolarHBondContact O-N 3.13Å; F401-M403 VanDerWaalsContact C-N 3.35Å; F401-M403 PolarHBondContact O-N 2.9Å; M403-L405 VanDerWaalsContact C-N 3.28Å; M403-L405 PolarHBondContact O-N 3.42Å; M403-I406 HydrophobicContact CE-CD1 4.44Å; M403-I406 PolarHBondContact O-N 3.49Å
404	G	95.9	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-28.7	178.2	0	0	0	0	0	114.1	I103 S400 F401 L402 I406 M407	I103-G404 WeakPolarHBondContact CD1-O 3.4Å; S400-G404 PolarHBondContact O-N 3.48Å; F401-G404 PolarHBondContact O-N 2.83Å; F401-G404 VanDerWaalsContact O-N 3.14Å; L402-G404 VanDerWaalsContact C-N 3.33Å; G404-I406 PolarHBondContact O-N 3.24Å; G404-M407 PolarHBondContact O-N 3.05Å
405	L	97.4	Very high	96.1	Very high	37 Å²	37	36 Å²	36	19%	0.194	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-58.6	-30.4	178.5	-65.8	178.6	0	0	0	113	L177 A182 L185 F401 L402 M403 M407 L408	L177-L405 HydrophobicContact CD1-CB 4.32Å; L177-L405 HydrophobicContact CD1-CD2 4.39Å; L177-L405 WeakPolarHBondContact CD1-O 3.12Å; L177-L405 HydrophobicContact CD2-CD2 4.45Å; A182-L405 HydrophobicContact CB-CD2 3.92Å; L185-L405 HydrophobicContact CD2-CD2 4.32Å; F401-L405 HydrophobicContact CE1-CD1 4.08Å; F401-L405 HydrophobicContact CE1-CD2 4.36Å; F401-L405 HydrophobicContact CE1-CG 4.39Å; F401-L405 HydrophobicContact CE2-CD2 4.18Å; F401-L405 HydrophobicContact CZ-CD1 4.41Å; F401-L405 HydrophobicContact CZ-CD2 3.9Å; F401-L405 HydrophobicContact CZ-CG 4.41Å; F401-L405 PolarHBondContact O-N 3.41Å; L402-L405 HydrophobicContact CD2-CD1 4.28Å; L402-L405 PolarHBondContact O-N 2.97Å; M403-L405 VanDerWaalsContact C-N 3.28Å; M403-L405 PolarHBondContact O-N 3.42Å; L405-M407 PolarHBondContact O-N 3.42Å; L405-L408 HydrophobicContact CD2-CD1 4.38Å; L405-L408 PolarHBondContact O-N 3.04Å
406	I	96.3	Very high	96.1	Very high	71 Å²	71	34.3 Å²	34.3	36%	0.364	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-61.5	-35.9	177.1	-58.7	173.5	0	0	0	110.7	M174 M403 G404 L408 V415	M174-I406 HydrophobicContact CE-CG2 3.57Å; M174-I406 WeakPolarHBondContact CE-O 3.2Å; M403-I406 HydrophobicContact CE-CD1 4.44Å; M403-I406 PolarHBondContact O-N 3.49Å; G404-I406 PolarHBondContact O-N 3.24Å; I406-L408 VanDerWaalsContact C-N 3.25Å; I406-L408 PolarHBondContact O-N 3.12Å; I406-V415 HydrophobicContact CG2-CG1 4.44Å
407	M	95.9	Very high	95.9	Very high	10 Å²	10	35.1 Å²	35.1	5%	0.049	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-80.4	-5.6	178.9	-60.3	179.3	-164.7	0	0	113.1	F99 Y100 I103 G404 L405 G412 V415 F416 F419	F99-M407 HydrophobicContact CB-CE 4.39Å; Y100-M407 VanDerWaalsContact CB-SD 3.57Å; I103-M407 HydrophobicContact CD1-CB 4.12Å; I103-M407 HydrophobicContact CG1-CB 4.01Å; I103-M407 HydrophobicContact CG1-SD 3.91Å; G404-M407 PolarHBondContact O-N 3.05Å; L405-M407 PolarHBondContact O-N 3.42Å; M407-G412 CarbonylContact O-C 3.5Å; M407-G412 WeakPolarHBondContact O-CA 3.47Å; M407-V415 HydrophobicContact CE-CG1 4.38Å; M407-V415 HydrophobicContact CG-CB 4.38Å; M407-V415 HydrophobicContact CG-CG1 4.07Å; M407-F416 HydrophobicContact SD-CB 4.32Å; M407-F416 HydrophobicContact SD-CD2 4.37Å; M407-F419 HydrophobicContact CE-CB 4.19Å; M407-F419 HydrophobicContact CE-CD1 3.8Å; M407-F419 HydrophobicContact CE-CD2 3.49Å; M407-F419 VanDerWaalsContact CE-CD2 3.49Å; M407-F419 HydrophobicContact CE-CE1 3.99Å; M407-F419 HydrophobicContact CE-CE2 3.68Å; M407-F419 HydrophobicContact CE-CG 3.54Å; M407-F419 HydrophobicContact CE-CZ 3.93Å
408	L	96.6	Very high	95.7	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.031	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-101.8	3	176.5	-57	-169.3	0	0	0	113.5	I103 L177 N178 M181 A182 L185 L405 I406	I103-L408 HydrophobicContact CD1-CD2 3.93Å; I103-L408 HydrophobicContact CD1-CG 4.3Å; I103-L408 HydrophobicContact CG2-CD2 3.83Å; L177-L408 HydrophobicContact CD1-CB 3.91Å; N178-L408 WeakPolarHBondContact CB-O 3.47Å; N178-L408 PolarHBondContact N-O 3.26Å; N178-L408 VanDerWaalsContact N-O 3.09Å; M181-L408 HydrophobicContact CB-CD1 4.28Å; M181-L408 HydrophobicContact CB-CD2 4.38Å; M181-L408 HydrophobicContact CG-CD1 4.12Å; M181-L408 HydrophobicContact CG-CD2 3.56Å; M181-L408 HydrophobicContact CG-CG 4.35Å; A182-L408 HydrophobicContact CB-CD1 4.2Å; L185-L408 HydrophobicContact CB-CD1 3.8Å; L185-L408 HydrophobicContact CD2-CD1 3.59Å; L185-L408 HydrophobicContact CD2-CG 4.26Å; L185-L408 HydrophobicContact CG-CD1 4.29Å; L405-L408 HydrophobicContact CD2-CD1 4.38Å; L405-L408 PolarHBondContact O-N 3.04Å; I406-L408 VanDerWaalsContact C-N 3.25Å; I406-L408 PolarHBondContact O-N 3.12Å
409	M	96.4	Very high	95.5	Very high	54 Å²	54	31.7 Å²	31.7	27%	0.266	15%	0.154	S	C	.	.	B	Isolated β-bridge	trans	-74.8	166.4	168.7	-51.5	-174.9	69.6	0	0	110	M174 G175 S176 L177 G411 G412	M174-M409 HydrophobicContact CB-CE 3.94Å; M174-M409 HydrophobicContact CB-SD 4.19Å; M174-M409 HydrophobicContact CE-CB 4.36Å; M174-M409 HydrophobicContact CE-SD 3.94Å; M174-M409 VanDerWaalsContact O-CB 3.23Å; M174-M409 WeakPolarHBondContact O-CB 3.46Å; G175-M409 WeakPolarHBondContact O-CE 3.37Å; S176-M409 WeakPolarHBondContact O-CA 3.09Å; L177-M409 HydrophobicContact CD1-CG 4.35Å; M409-G411 VanDerWaalsContact C-N 3.27Å; M409-G411 PolarHBondContact O-N 2.88Å; M409-G412 WeakPolarHBondContact O-CA 3.1Å; M409-G412 PolarHBondContact O-N 3.31Å
410	E	95.8	Very high	95.2	Very high	58 Å²	58	29.2 Å²	29.2	27%	0.271	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-37.6	179.2	-64.5	170.1	-165.7	0	0	112.6	R166 I167 S168 M174 G175 S176 G412	R166-E410 HydrophobicContact CB-CG 4.06Å; R166-E410 VanDerWaalsContact O-CA 3.31Å; R166-E410 WeakPolarHBondContact O-CA 3.39Å; R166-E410 WeakPolarHBondContact O-CB 3.08Å; R166-E410 WeakPolarHBondContact O-CG 3.39Å; I167-E410 WeakPolarHBondContact CA-O 3.19Å; S168-E410 PolarHBondContact N-O 3.02Å; M174-E410 PolarHBondContact O-N 2.84Å; G175-E410 WeakPolarHBondContact CA-OE2 3.15Å; S176-E410 WeakPolarHBondContact CB-OE1 3.29Å; S176-E410 VanDerWaalsContact N-CD 3.34Å; S176-E410 PolarHBondContact N-OE1 3.17Å; S176-E410 PolarHBondContact O-N 2.85Å; S176-E410 PolarHBondContact OG-OE1 3.48Å; E410-G412 VanDerWaalsContact C-N 3.28Å; E410-G412 PolarHBondContact O-N 3.11Å
411	G	94.6	Very high	94.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	1.8	171.7	0	0	0	0	0	114.7	S168 M174 M409 M413 Y414	S168-G411 VanDerWaalsContact OG-CA 3.31Å; S168-G411 WeakPolarHBondContact OG-CA 3.09Å; M174-G411 PolarHBondContact O-N 2.97Å; M409-G411 VanDerWaalsContact C-N 3.27Å; M409-G411 PolarHBondContact O-N 2.88Å; G411-M413 VanDerWaalsContact C-N 3.33Å; G411-M413 PolarHBondContact O-N 3.25Å; G411-Y414 WeakPolarHBondContact O-CD2 3.07Å; G411-Y414 PolarHBondContact O-N 2.62Å
412	G	95.3	Very high	94.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.6	-27.6	-169.4	0	0	0	0	0	114.6	M407 M409 E410 Y414 V415 F416	M407-G412 CarbonylContact O-C 3.5Å; M407-G412 WeakPolarHBondContact O-CA 3.47Å; M409-G412 WeakPolarHBondContact O-CA 3.1Å; M409-G412 PolarHBondContact O-N 3.31Å; E410-G412 VanDerWaalsContact C-N 3.28Å; E410-G412 PolarHBondContact O-N 3.11Å; G412-Y414 VanDerWaalsContact C-N 3.29Å; G412-Y414 PolarHBondContact O-N 3.02Å; G412-V415 WeakPolarHBondContact O-CB 3.36Å; G412-V415 PolarHBondContact O-N 3.03Å; G412-V415 VanDerWaalsContact O-N 3.15Å; G412-F416 PolarHBondContact O-N 3.48Å
413	M	93.6	Very high	93.9	Very high	8 Å²	8	26.7 Å²	26.7	4%	0.039	13%	0.128	C	C	.	.	H	α-helix	trans	-61.9	-36.3	176.4	-173.2	61.7	-167.4	0	0	112	W107 L165 I167 P328 G411 F416 Q417 Y493	W107-M413 HydrophobicContact CH2-CE 4.25Å; W107-M413 HydrophobicContact CH2-SD 3.67Å; W107-M413 HydrophobicContact CZ2-SD 3.87Å; L165-M413 HydrophobicContact CD1-CB 4.2Å; L165-M413 HydrophobicContact CD1-CG 3.97Å; L165-M413 HydrophobicContact CD1-SD 4.1Å; L165-M413 HydrophobicContact CD2-SD 4.43Å; I167-M413 HydrophobicContact CD1-CB 3.96Å; I167-M413 HydrophobicContact CD1-CG 4.16Å; I167-M413 HydrophobicContact CG1-CB 4.45Å; P328-M413 HydrophobicContact CG-CE 4.41Å; G411-M413 VanDerWaalsContact C-N 3.33Å; G411-M413 PolarHBondContact O-N 3.25Å; M413-F416 HydrophobicContact CE-CD1 4.11Å; M413-F416 HydrophobicContact CE-CE1 4.47Å; M413-F416 WeakPolarHBondContact O-CB 3.44Å; M413-F416 PolarHBondContact O-N 2.89Å; M413-F416 HydrophobicContact SD-CD1 4.15Å; M413-Q417 HydrophobicContact CE-CG 4.15Å; M413-Q417 WeakPolarHBondContact O-CG 3.36Å; M413-Q417 PolarHBondContact O-N 3.47Å; M413-Y493 HydrophobicContact CE-CE2 4.18Å; M413-Y493 HydrophobicContact CG-CE2 4.12Å
414	Y	94.7	Very high	93	Very high	12 Å²	12	23.8 Å²	23.8	5%	0.047	11%	0.114	C	C	.	.	H	α-helix	trans	-67	-38.5	175.7	-59.4	-69.6	0	0	0	111.8	I167 S168 I171 G411 G412 Q417 L418 Y493 Y497 Y499	I167-Y414 HydrophobicContact CD1-CE2 4.49Å; I167-Y414 HydrophobicContact CG1-CE2 4.23Å; S168-Y414 PolarHBondContact O-OH 3Å; I171-Y414 HydrophobicContact CB-CD2 4.36Å; I171-Y414 HydrophobicContact CB-CG 4.21Å; G411-Y414 WeakPolarHBondContact O-CD2 3.07Å; G411-Y414 PolarHBondContact O-N 2.62Å; G412-Y414 VanDerWaalsContact C-N 3.29Å; G412-Y414 PolarHBondContact O-N 3.02Å; Y414-Q417 PolarHBondContact O-N 3.14Å; Y414-L418 PolarHBondContact O-N 3.38Å; Y414-L418 VanDerWaalsContact O-N 3.12Å; Y414-Y493 HydrophobicContact CD1-CD1 4.27Å; Y414-Y493 HydrophobicContact CD1-CG 4.29Å; Y414-Y493 AromaticContact CE1-CD1 3.51Å; Y414-Y493 HydrophobicContact CE1-CD1 3.51Å; Y414-Y493 HydrophobicContact CE1-CE1 4.23Å; Y414-Y493 AromaticContact CE1-CG 3.93Å; Y414-Y493 HydrophobicContact CE1-CG 3.93Å; Y414-Y497 AromaticContact CD1-CD1 3.74Å; Y414-Y497 HydrophobicContact CD1-CD1 3.74Å; Y414-Y497 AromaticContact CD1-CE1 3.66Å; Y414-Y497 HydrophobicContact CD1-CE1 3.66Å; Y414-Y497 HydrophobicContact CD1-CG 4.44Å; Y414-Y497 AromaticContact CE1-CD1 3.45Å; Y414-Y497 HydrophobicContact CE1-CD1 3.45Å; Y414-Y497 VanDerWaalsContact CE1-CD1 3.45Å; Y414-Y497 HydrophobicContact CE1-CD2 4.15Å; Y414-Y497 AromaticContact CE1-CE1 3.69Å; Y414-Y497 HydrophobicContact CE1-CE1 3.69Å; Y414-Y497 HydrophobicContact CE1-CE2 4.37Å; Y414-Y497 AromaticContact CE1-CG 3.7Å; Y414-Y497 HydrophobicContact CE1-CG 3.7Å; Y414-Y497 HydrophobicContact CG-CE1 4.41Å; Y414-Y499 WeakPolarHBondContact CA-OH 3.48Å; Y414-Y499 HydrophobicContact CD1-CE1 4.39Å; Y414-Y499 PolarHBondContact O-OH 3.26Å
415	V	95.5	Very high	92.1	Very high	21 Å²	21	24.2 Å²	24.2	13%	0.127	12%	0.117	C	C	.	.	H	α-helix	trans	-66.5	-45.8	174.9	-178.1	0	0	0	0	110.5	I171 M174 I406 M407 G412 Q417 L418 F419	I171-V415 HydrophobicContact CD1-CG2 4.15Å; I171-V415 HydrophobicContact CG1-CG2 4.15Å; M174-V415 HydrophobicContact CE-CG2 3.83Å; M174-V415 HydrophobicContact SD-CG2 4.02Å; I406-V415 HydrophobicContact CG2-CG1 4.44Å; M407-V415 HydrophobicContact CE-CG1 4.38Å; M407-V415 HydrophobicContact CG-CB 4.38Å; M407-V415 HydrophobicContact CG-CG1 4.07Å; G412-V415 WeakPolarHBondContact O-CB 3.36Å; G412-V415 PolarHBondContact O-N 3.03Å; G412-V415 VanDerWaalsContact O-N 3.15Å; V415-Q417 PolarHBondContact O-N 3.31Å; V415-L418 PolarHBondContact O-N 3.37Å; V415-L418 VanDerWaalsContact O-N 3.12Å; V415-F419 HydrophobicContact CG1-CD2 4.09Å; V415-F419 HydrophobicContact CG1-CE2 4.01Å; V415-F419 WeakPolarHBondContact O-CD2 3.32Å; V415-F419 PolarHBondContact O-N 2.95Å; V415-F419 VanDerWaalsContact O-N 3.12Å
416	F	94.5	Very high	91.2	Very high	5 Å²	5	23 Å²	23	2%	0.022	11%	0.113	C	C	.	.	H	α-helix	trans	-52.1	-45.3	174.8	172.5	-85.9	0	0	0	111.3	Y100 I103 V104 W107 P328 M407 G412 M413 F419 D420	Y100-F416 HydrophobicContact CD2-CD2 4.19Å; Y100-F416 AromaticContact CD2-CE2 3.72Å; Y100-F416 HydrophobicContact CD2-CE2 3.72Å; Y100-F416 HydrophobicContact CD2-CZ 4.05Å; Y100-F416 WeakPolarHBondContact O-CE2 3.46Å; I103-F416 HydrophobicContact CB-CD2 4.06Å; I103-F416 HydrophobicContact CB-CE2 4.18Å; I103-F416 HydrophobicContact CG1-CD2 4.47Å; I103-F416 HydrophobicContact CG2-CD2 4.18Å; V104-F416 HydrophobicContact CG2-CE2 3.82Å; V104-F416 HydrophobicContact CG2-CZ 3.73Å; W107-F416 AromaticContact CH2-CD1 3.86Å; W107-F416 HydrophobicContact CH2-CD1 3.86Å; W107-F416 AromaticContact CH2-CD2 3.85Å; W107-F416 HydrophobicContact CH2-CD2 3.85Å; W107-F416 AromaticContact CH2-CE1 3.78Å; W107-F416 HydrophobicContact CH2-CE1 3.78Å; W107-F416 AromaticContact CH2-CE2 3.74Å; W107-F416 HydrophobicContact CH2-CE2 3.74Å; W107-F416 AromaticContact CH2-CG 3.91Å; W107-F416 HydrophobicContact CH2-CG 3.91Å; W107-F416 AromaticContact CH2-CZ 3.72Å; W107-F416 HydrophobicContact CH2-CZ 3.72Å; W107-F416 HydrophobicContact CZ2-CD2 4.37Å; W107-F416 HydrophobicContact CZ2-CG 4.48Å; W107-F416 HydrophobicContact CZ3-CE1 4.12Å; W107-F416 HydrophobicContact CZ3-CE2 4.04Å; W107-F416 AromaticContact CZ3-CZ 3.8Å; W107-F416 HydrophobicContact CZ3-CZ 3.8Å; P328-F416 HydrophobicContact CG-CE1 4.14Å; M407-F416 HydrophobicContact SD-CB 4.32Å; M407-F416 HydrophobicContact SD-CD2 4.37Å; G412-F416 PolarHBondContact O-N 3.48Å; M413-F416 HydrophobicContact CE-CD1 4.11Å; M413-F416 HydrophobicContact CE-CE1 4.47Å; M413-F416 WeakPolarHBondContact O-CB 3.44Å; M413-F416 PolarHBondContact O-N 2.89Å; M413-F416 HydrophobicContact SD-CD1 4.15Å; F416-F419 WeakPolarHBondContact O-CB 3.49Å; F416-F419 PolarHBondContact O-N 2.94Å; F416-D420 HydrophobicContact CE1-CB 4.37Å; F416-D420 PolarHBondContact O-N 2.95Å
417	Q	92	Very high	90.6	Very high	34 Å²	34	21.1 Å²	21.1	16%	0.159	10%	0.103	C	C	.	.	H	α-helix	trans	-68.5	-34.5	178.8	-72.9	-158.5	-28.1	0	0	114.5	M413 Y414 V415 F419 D420 Y421 L491 Y499	M413-Q417 HydrophobicContact CE-CG 4.15Å; M413-Q417 WeakPolarHBondContact O-CG 3.36Å; M413-Q417 PolarHBondContact O-N 3.47Å; Y414-Q417 PolarHBondContact O-N 3.14Å; V415-Q417 PolarHBondContact O-N 3.31Å; Q417-F419 VanDerWaalsContact C-N 3.28Å; Q417-F419 PolarHBondContact O-N 3.42Å; Q417-D420 PolarHBondContact O-N 3.33Å; Q417-Y421 WeakPolarHBondContact O-CB 3.37Å; Q417-Y421 PolarHBondContact O-N 3.03Å; Q417-L491 HydrophobicContact CB-CD2 4.24Å; Q417-Y499 WeakPolarHBondContact CB-OH 3.35Å; Q417-Y499 PolarHBondContact OE1-OH 3.24Å; Q417-Y499 VanDerWaalsContact OE1-OH 3.05Å
418	L	93.1	Very high	90.3	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-61.5	-41.3	172.8	-74	172.5	0	0	0	111	I171 Y414 V415 Y422 L491 Y499	I171-L418 HydrophobicContact CD1-CD1 3.52Å; Y414-L418 PolarHBondContact O-N 3.38Å; Y414-L418 VanDerWaalsContact O-N 3.12Å; V415-L418 PolarHBondContact O-N 3.37Å; V415-L418 VanDerWaalsContact O-N 3.12Å; L418-Y422 HydrophobicContact CD2-CD2 4.04Å; L418-Y422 HydrophobicContact CD2-CE2 3.91Å; L418-Y422 WeakPolarHBondContact O-CB 3.17Å; L418-Y422 PolarHBondContact O-N 3.06Å; L418-L491 HydrophobicContact CD2-CD2 3.98Å; L418-Y499 HydrophobicContact CD1-CD1 4.31Å; L418-Y499 HydrophobicContact CD1-CE1 4.15Å; L418-Y499 HydrophobicContact CD2-CD1 4.05Å; L418-Y499 HydrophobicContact CD2-CE1 4.02Å; L418-Y499 HydrophobicContact CG-CD1 4.21Å; L418-Y499 HydrophobicContact CG-CE1 3.8Å
419	F	93.3	Very high	90.1	Very high	23 Å²	23	20.4 Å²	20.4	10%	0.101	10%	0.099	C	C	.	.	I	π-helix	trans	-65	-51.2	175.2	-86.8	-106.4	0	0	0	111.7	L96 F99 Y100 M407 V415 F416 Q417 Y421 A423 L510	L96-F419 HydrophobicContact CB-CD1 4.39Å; L96-F419 HydrophobicContact CB-CE1 4.38Å; L96-F419 HydrophobicContact CD2-CE1 3.81Å; F99-F419 HydrophobicContact CB-CE1 4.41Å; F99-F419 HydrophobicContact CD2-CE1 4.07Å; Y100-F419 HydrophobicContact CD1-CB 3.88Å; Y100-F419 HydrophobicContact CD1-CD1 4.37Å; Y100-F419 HydrophobicContact CG-CB 3.87Å; M407-F419 HydrophobicContact CE-CB 4.19Å; M407-F419 HydrophobicContact CE-CD1 3.8Å; M407-F419 HydrophobicContact CE-CD2 3.49Å; M407-F419 VanDerWaalsContact CE-CD2 3.49Å; M407-F419 HydrophobicContact CE-CE1 3.99Å; M407-F419 HydrophobicContact CE-CE2 3.68Å; M407-F419 HydrophobicContact CE-CG 3.54Å; M407-F419 HydrophobicContact CE-CZ 3.93Å; V415-F419 HydrophobicContact CG1-CD2 4.09Å; V415-F419 HydrophobicContact CG1-CE2 4.01Å; V415-F419 WeakPolarHBondContact O-CD2 3.32Å; V415-F419 PolarHBondContact O-N 2.95Å; V415-F419 VanDerWaalsContact O-N 3.12Å; F416-F419 WeakPolarHBondContact O-CB 3.49Å; F416-F419 PolarHBondContact O-N 2.94Å; Q417-F419 VanDerWaalsContact C-N 3.28Å; Q417-F419 PolarHBondContact O-N 3.42Å; F419-Y421 VanDerWaalsContact C-N 3.32Å; F419-Y421 PolarHBondContact O-N 3.48Å; F419-A423 HydrophobicContact CB-CB 4.49Å; F419-A423 HydrophobicContact CD1-CB 4.19Å; F419-A423 WeakPolarHBondContact O-CB 3.47Å; F419-A423 PolarHBondContact O-N 3.49Å; F419-L510 HydrophobicContact CD2-CD1 3.96Å; F419-L510 HydrophobicContact CE1-CD2 4.18Å; F419-L510 HydrophobicContact CE2-CD1 4.04Å; F419-L510 HydrophobicContact CE2-CD2 4.34Å; F419-L510 HydrophobicContact CG-CD1 4.34Å; F419-L510 HydrophobicContact CZ-CD1 4.47Å; F419-L510 HydrophobicContact CZ-CD2 3.99Å
420	D	89.6	Confident	89.8	Confident	64 Å²	64	17.9 Å²	17.9	34%	0.342	9%	0.087	S	C	.	.	I	π-helix	trans	-62.5	-37.7	-178.3	-171	50.9	0	0	0	112.5	Y100 F416 Q417	Y100-D420 HydrophobicContact CD2-CB 4.16Å; Y100-D420 HydrophobicContact CE2-CB 3.72Å; Y100-D420 WeakPolarHBondContact CE2-OD1 3.44Å; Y100-D420 PolarHBondContact OH-OD1 3.29Å; Y100-D420 VanDerWaalsContact OH-OD1 3.05Å; F416-D420 HydrophobicContact CE1-CB 4.37Å; F416-D420 PolarHBondContact O-N 2.95Å; Q417-D420 PolarHBondContact O-N 3.33Å
421	Y	88.4	Confident	89.7	Confident	87 Å²	87	16.3 Å²	16.3	34%	0.341	8%	0.081	S	C	.	.	I	π-helix	trans	-81.3	-38.6	-178.2	-168.8	-97.6	0	0	0	113.8	Q417 F419 S425 T489 L491	Q417-Y421 WeakPolarHBondContact O-CB 3.37Å; Q417-Y421 PolarHBondContact O-N 3.03Å; F419-Y421 VanDerWaalsContact C-N 3.32Å; F419-Y421 PolarHBondContact O-N 3.48Å; Y421-S425 WeakPolarHBondContact O-CB 3.18Å; Y421-T489 PolarHBondContact OH-O 2.84Å; Y421-L491 HydrophobicContact CD1-CB 3.97Å; Y421-L491 HydrophobicContact CD1-CD1 4.35Å; Y421-L491 HydrophobicContact CD2-CD1 3.77Å; Y421-L491 HydrophobicContact CE1-CB 4.12Å; Y421-L491 HydrophobicContact CE2-CD1 4.31Å; Y421-L491 HydrophobicContact CG-CB 4.27Å; Y421-L491 HydrophobicContact CG-CD1 3.77Å; Y421-L491 HydrophobicContact CG-CD2 4.33Å; Y421-L491 HydrophobicContact CG-CG 4.33Å
422	Y	89.9	Confident	89.7	Confident	7 Å²	7	16.3 Å²	16.3	3%	0.027	8%	0.081	C	C	.	.	I	π-helix	trans	-107.9	-41.1	-172.1	-68.9	-82.1	0	0	0	115.2	L418 S425 Y488 L491 G507	L418-Y422 HydrophobicContact CD2-CD2 4.04Å; L418-Y422 HydrophobicContact CD2-CE2 3.91Å; L418-Y422 WeakPolarHBondContact O-CB 3.17Å; L418-Y422 PolarHBondContact O-N 3.06Å; Y422-S425 VanDerWaalsContact O-CB 3.24Å; Y422-S425 WeakPolarHBondContact O-CB 3.08Å; Y422-S425 PolarHBondContact O-N 2.67Å; Y422-S425 PolarHBondContact O-OG 2.77Å; Y422-Y488 HydrophobicContact CE1-CE2 4.13Å; Y422-Y488 PolarHBondContact OH-OH 3.5Å; Y422-L491 HydrophobicContact CE2-CB 4.12Å; Y422-L491 HydrophobicContact CE2-CD2 4.2Å; Y422-G507 WeakPolarHBondContact CB-O 3.49Å; Y422-G507 VanDerWaalsContact CD2-CA 3.46Å
423	A	87	Confident	89.7	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.	I	π-helix	trans	-71.5	-53.8	-164.8	0	0	0	0	0	113	L96 F419 L510	L96-A423 HydrophobicContact CB-CB 3.85Å; L96-A423 HydrophobicContact CD1-CB 3.8Å; L96-A423 HydrophobicContact CG-CB 4.36Å; F419-A423 HydrophobicContact CB-CB 4.49Å; F419-A423 HydrophobicContact CD1-CB 4.19Å; F419-A423 WeakPolarHBondContact O-CB 3.47Å; F419-A423 PolarHBondContact O-N 3.49Å; A423-L510 HydrophobicContact CB-CB 4.06Å; A423-L510 HydrophobicContact CB-CD1 4.48Å
424	A	77.8	Confident	89.7	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	67.8	165.6	0	0	0	0	0	106	I93 L97 Y100 F261	I93-A424 HydrophobicContact CG2-CB 3.76Å; L97-A424 HydrophobicContact CD1-CB 4.22Å; Y100-A424 HydrophobicContact CE1-CB 4.5Å; F261-A424 HydrophobicContact CE1-CB 4.32Å; F261-A424 WeakPolarHBondContact CE1-O 3.4Å; F261-A424 WeakPolarHBondContact CZ-O 3.36Å
425	S	75.8	Confident	89.8	Confident	9 Å²	9	19 Å²	19	6%	0.063	9%	0.093	C	C	.	.			trans	-89.2	157.1	179	60.5	0	0	0	0	111.4	F261 Y421 Y422 M427 C428 L429	F261-S425 VanDerWaalsContact CZ-C 3.46Å; Y421-S425 WeakPolarHBondContact O-CB 3.18Å; Y422-S425 VanDerWaalsContact O-CB 3.24Å; Y422-S425 WeakPolarHBondContact O-CB 3.08Å; Y422-S425 PolarHBondContact O-N 2.67Å; Y422-S425 PolarHBondContact O-OG 2.77Å; S425-M427 PolarHBondContact O-N 3.36Å; S425-M427 VanDerWaalsContact O-N 3.1Å; S425-C428 PolarHBondContact O-N 2.99Å; S425-C428 PolarHBondContact OG-SG 3.2Å; S425-L429 PolarHBondContact O-N 3.1Å
426	G	78.4	Confident	89.8	Confident	10 Å²	10	18 Å²	18	10%	0.103	9%	0.087	C	C	.	.	H	α-helix	trans	-53.7	-33.3	175.1	0	0	0	0	0	111.9	L429 L430	G426-L429 PolarHBondContact O-N 3.44Å; G426-L430 WeakPolarHBondContact O-CB 3.45Å; G426-L430 WeakPolarHBondContact O-CD1 3.47Å; G426-L430 WeakPolarHBondContact O-CG 3.46Å; G426-L430 PolarHBondContact O-N 2.83Å
427	M	84.5	Confident	89.9	Confident	33 Å²	33	17.8 Å²	17.8	16%	0.163	9%	0.086	C	C	.	.	H	α-helix	trans	-57.7	-49.1	174.5	-60.7	-51.2	-76.7	0	0	113.9	S425 L429 L431 F481 S484 L485	S425-M427 PolarHBondContact O-N 3.36Å; S425-M427 VanDerWaalsContact O-N 3.1Å; M427-L429 VanDerWaalsContact C-N 3.35Å; M427-L431 PolarHBondContact O-N 3.16Å; M427-F481 HydrophobicContact CB-CE2 4.35Å; M427-F481 HydrophobicContact CE-CD2 3.45Å; M427-F481 VanDerWaalsContact CE-CD2 3.45Å; M427-F481 HydrophobicContact CE-CE2 3.47Å; M427-F481 VanDerWaalsContact CE-CE2 3.47Å; M427-F481 HydrophobicContact CE-CG 4.09Å; M427-F481 HydrophobicContact CE-CZ 4.12Å; M427-F481 WeakPolarHBondContact CE-O 3.45Å; M427-F481 HydrophobicContact SD-CD2 4.23Å; M427-S484 WeakPolarHBondContact CE-OG 3.49Å; M427-S484 WeakPolarHBondContact SD-CB 3.26Å; M427-S484 PolarHBondContact SD-OG 3.32Å; M427-L485 HydrophobicContact CE-CD2 3.66Å; M427-L485 HydrophobicContact CE-CG 3.65Å
428	C	90	Very high	90.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.4	-45.8	-177.8	-61.3	0	0	0	0	109.5	I93 S425 L431 M432 M515	I93-C428 HydrophobicContact CD1-CB 4.04Å; S425-C428 PolarHBondContact O-N 2.99Å; S425-C428 PolarHBondContact OG-SG 3.2Å; C428-L431 PolarHBondContact O-N 3.25Å; C428-M432 VanDerWaalsContact O-CG 3.27Å; C428-M432 WeakPolarHBondContact O-CG 3.29Å; C428-M432 PolarHBondContact O-N 3.04Å; C428-M515 HydrophobicContact CB-CG 4.47Å
429	L	91.3	Very high	90.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.3	-40.8	-179.5	-59.2	-179.5	0	0	0	112.7	I93 F260 F261 C266 L267 S425 G426 M427 M432 S433	I93-L429 HydrophobicContact CD1-CD2 4.23Å; I93-L429 HydrophobicContact CG2-CD2 4.37Å; F260-L429 HydrophobicContact CB-CB 4.37Å; F260-L429 HydrophobicContact CB-CD1 4.21Å; F260-L429 HydrophobicContact CD1-CB 3.95Å; F261-L429 HydrophobicContact CD1-CD1 3.74Å; F261-L429 HydrophobicContact CD2-CD1 4.41Å; F261-L429 HydrophobicContact CE1-CD1 3.49Å; F261-L429 VanDerWaalsContact CE1-CD1 3.49Å; F261-L429 HydrophobicContact CE2-CD1 4.2Å; F261-L429 HydrophobicContact CG-CD1 4.16Å; F261-L429 HydrophobicContact CZ-CD1 3.71Å; C266-L429 HydrophobicContact CB-CD2 4.47Å; L267-L429 HydrophobicContact CD2-CD2 3.64Å; L267-L429 HydrophobicContact CG-CD2 4.25Å; S425-L429 PolarHBondContact O-N 3.1Å; G426-L429 PolarHBondContact O-N 3.44Å; M427-L429 VanDerWaalsContact C-N 3.35Å; L429-M432 PolarHBondContact O-N 2.93Å; L429-S433 PolarHBondContact O-N 3.42Å
430	L	91.2	Very high	90.4	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-61.5	-44	175	-72	168.8	0	0	0	111	F260 G426 S433 I434 C477 T480 F481	F260-L430 HydrophobicContact CD1-CD2 4.47Å; F260-L430 HydrophobicContact CE1-CD2 4.07Å; F260-L430 HydrophobicContact CE2-CD2 4.16Å; F260-L430 HydrophobicContact CZ-CD2 3.95Å; G426-L430 WeakPolarHBondContact O-CB 3.45Å; G426-L430 WeakPolarHBondContact O-CD1 3.47Å; G426-L430 WeakPolarHBondContact O-CG 3.46Å; G426-L430 PolarHBondContact O-N 2.83Å; L430-S433 PolarHBondContact O-N 2.97Å; L430-I434 VanDerWaalsContact O-CG1 3.32Å; L430-I434 WeakPolarHBondContact O-CG1 3.47Å; L430-I434 PolarHBondContact O-N 3.02Å; L430-I434 VanDerWaalsContact O-N 3.13Å; L430-C477 HydrophobicContact CD2-CB 4.25Å; L430-T480 HydrophobicContact CD1-CG2 3.67Å; L430-T480 HydrophobicContact CD2-CG2 4.49Å; L430-F481 HydrophobicContact CB-CB 4.38Å; L430-F481 HydrophobicContact CB-CD2 4.37Å
431	L	92.5	Very high	90.7	Very high	26 Å²	26	14.3 Å²	14.3	14%	0.136	7%	0.072	C	C	.	.	H	α-helix	trans	-63.3	-44.4	176.9	-172.2	69.7	0	0	0	111.8	M427 C428 S433 I434 F435 F481 M515	M427-L431 PolarHBondContact O-N 3.16Å; C428-L431 PolarHBondContact O-N 3.25Å; L431-S433 VanDerWaalsContact C-N 3.33Å; L431-S433 PolarHBondContact O-N 3.46Å; L431-I434 PolarHBondContact O-N 2.83Å; L431-F435 HydrophobicContact CD1-CD2 4.14Å; L431-F435 HydrophobicContact CD1-CE2 3.68Å; L431-F435 HydrophobicContact CD2-CE2 4.27Å; L431-F435 HydrophobicContact CG-CD2 4Å; L431-F435 HydrophobicContact CG-CE2 3.85Å; L431-F435 WeakPolarHBondContact O-CD2 3.42Å; L431-F435 PolarHBondContact O-N 3.07Å; L431-F481 HydrophobicContact CB-CD2 4.4Å; L431-F481 HydrophobicContact CB-CE2 4.03Å; L431-F481 HydrophobicContact CD1-CE1 4.48Å; L431-F481 HydrophobicContact CD1-CE2 4.44Å; L431-F481 HydrophobicContact CD1-CZ 4.22Å; L431-M515 HydrophobicContact CB-CE 4.5Å; L431-M515 HydrophobicContact CD2-CB 3.72Å; L431-M515 HydrophobicContact CD2-CE 3.55Å; L431-M515 HydrophobicContact CD2-CG 3.81Å
432	M	94.8	Very high	91.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.6	-47.4	176.7	-68.8	-63.6	163.8	0	0	110.7	L86 T90 I93 C266 C428 L429 I434 F435 E436 S514 I518	L86-M432 HydrophobicContact CD2-SD 4.13Å; T90-M432 HydrophobicContact CG2-CG 4.44Å; T90-M432 HydrophobicContact CG2-SD 4.25Å; I93-M432 HydrophobicContact CD1-CE 4.08Å; I93-M432 HydrophobicContact CD1-CG 3.93Å; C266-M432 HydrophobicContact CB-CB 3.78Å; C428-M432 VanDerWaalsContact O-CG 3.27Å; C428-M432 WeakPolarHBondContact O-CG 3.29Å; C428-M432 PolarHBondContact O-N 3.04Å; L429-M432 PolarHBondContact O-N 2.93Å; M432-I434 VanDerWaalsContact C-N 3.34Å; M432-I434 PolarHBondContact O-N 3.21Å; M432-F435 PolarHBondContact O-N 3.4Å; M432-F435 VanDerWaalsContact O-N 3.12Å; M432-E436 WeakPolarHBondContact O-CG 3.34Å; M432-E436 PolarHBondContact O-N 2.69Å; M432-S514 VanDerWaalsContact CE-O 3.32Å; M432-S514 WeakPolarHBondContact CE-O 3.28Å; M432-I518 HydrophobicContact CE-CD1 4.21Å; M432-I518 HydrophobicContact SD-CD1 3.77Å; M432-I518 HydrophobicContact SD-CG1 4.41Å
433	S	95	Very high	91.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62	-36.7	179.6	-174	0	0	0	0	114.1	F260 C266 L429 L430 L431 F435 T437	F260-S433 VanDerWaalsContact CE1-CB 3.42Å; C266-S433 VanDerWaalsContact SG-CA 3.57Å; C266-S433 WeakPolarHBondContact SG-CB 3.42Å; L429-S433 PolarHBondContact O-N 3.42Å; L430-S433 PolarHBondContact O-N 2.97Å; L431-S433 VanDerWaalsContact C-N 3.33Å; L431-S433 PolarHBondContact O-N 3.46Å; S433-F435 PolarHBondContact O-N 3.28Å; S433-T437 WeakPolarHBondContact O-CB 3.41Å; S433-T437 WeakPolarHBondContact O-CG2 3.17Å; S433-T437 PolarHBondContact O-N 3.47Å; S433-T437 PolarHBondContact O-OG1 3.46Å
434	I	95.3	Very high	91.7	Very high	19 Å²	19	19.3 Å²	19.3	10%	0.097	10%	0.095	C	C	.	.	H	α-helix	trans	-58	-51.1	173.5	-65.6	162.9	0	0	0	109.6	L430 L431 M432 T437 V438 C477 I478 F481	L430-I434 VanDerWaalsContact O-CG1 3.32Å; L430-I434 WeakPolarHBondContact O-CG1 3.47Å; L430-I434 PolarHBondContact O-N 3.02Å; L430-I434 VanDerWaalsContact O-N 3.13Å; L431-I434 PolarHBondContact O-N 2.83Å; M432-I434 VanDerWaalsContact C-N 3.34Å; M432-I434 PolarHBondContact O-N 3.21Å; I434-T437 PolarHBondContact O-OG1 3.11Å; I434-T437 VanDerWaalsContact O-OG1 3.13Å; I434-V438 HydrophobicContact CG2-CG2 4.46Å; I434-V438 VanDerWaalsContact O-CB 3.3Å; I434-V438 WeakPolarHBondContact O-CB 3.33Å; I434-V438 WeakPolarHBondContact O-CG2 3.43Å; I434-V438 PolarHBondContact O-N 3.29Å; I434-C477 HydrophobicContact CD1-CB 4.08Å; I434-C477 HydrophobicContact CG1-CB 3.52Å; I434-I478 HydrophobicContact CD1-CB 4.39Å; I434-I478 HydrophobicContact CD1-CG1 3.62Å; I434-I478 HydrophobicContact CG1-CG1 3.94Å; I434-I478 HydrophobicContact CG2-CD1 4.34Å; I434-I478 HydrophobicContact CG2-CG1 4.14Å; I434-F481 HydrophobicContact CD1-CB 4.49Å
435	F	96.4	Very high	92.6	Very high	57 Å²	57	20.3 Å²	20.3	25%	0.25	11%	0.105	C	C	.	.	H	α-helix	trans	-71.5	-36.1	-177.6	-76.8	-69.7	0	0	0	113.3	F83 L86 L431 M432 S433 C439 I518 M522	F83-F435 HydrophobicContact CE1-CD1 4.07Å; L86-F435 HydrophobicContact CD1-CB 4.42Å; L86-F435 HydrophobicContact CD2-CB 3.59Å; L86-F435 HydrophobicContact CG-CB 4.31Å; L431-F435 HydrophobicContact CD1-CD2 4.14Å; L431-F435 HydrophobicContact CD1-CE2 3.68Å; L431-F435 HydrophobicContact CD2-CE2 4.27Å; L431-F435 HydrophobicContact CG-CD2 4Å; L431-F435 HydrophobicContact CG-CE2 3.85Å; L431-F435 WeakPolarHBondContact O-CD2 3.42Å; L431-F435 PolarHBondContact O-N 3.07Å; M432-F435 PolarHBondContact O-N 3.4Å; M432-F435 VanDerWaalsContact O-N 3.12Å; S433-F435 PolarHBondContact O-N 3.28Å; F435-C439 WeakPolarHBondContact O-CB 3.3Å; F435-C439 PolarHBondContact O-N 3.4Å; F435-I518 HydrophobicContact CB-CD1 4.04Å; F435-I518 HydrophobicContact CD1-CG2 4.12Å; F435-I518 HydrophobicContact CD2-CD1 3.36Å; F435-I518 HydrophobicContact CD2-CG2 4.26Å; F435-I518 HydrophobicContact CE1-CG2 4.21Å; F435-I518 HydrophobicContact CE2-CD1 3.95Å; F435-I518 HydrophobicContact CE2-CG2 4.33Å; F435-I518 HydrophobicContact CG-CD1 3.86Å; F435-I518 HydrophobicContact CG-CG2 4.13Å; F435-I518 HydrophobicContact CZ-CG2 4.31Å; F435-M522 HydrophobicContact CD1-CE 4.49Å; F435-M522 HydrophobicContact CE1-CE 4.49Å
436	E	95.8	Very high	93.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.1	-48.2	175.7	-72.1	-173.1	166.7	0	0	111.5	W76 L86 C266 M432 C439 I440	W76-E436 HydrophobicContact CH2-CB 3.87Å; W76-E436 HydrophobicContact CH2-CG 3.81Å; W76-E436 HydrophobicContact CZ2-CB 4.08Å; W76-E436 HydrophobicContact CZ2-CG 3.51Å; L86-E436 HydrophobicContact CD1-CG 4.03Å; L86-E436 HydrophobicContact CD2-CG 3.85Å; L86-E436 HydrophobicContact CG-CG 4.5Å; C266-E436 PolarHBondContact SG-OE2 3.31Å; M432-E436 WeakPolarHBondContact O-CG 3.34Å; M432-E436 PolarHBondContact O-N 2.69Å; E436-C439 PolarHBondContact O-N 3.05Å; E436-I440 PolarHBondContact O-N 3.41Å
437	T	96.1	Very high	94.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.9	-40.3	179	54.5	0	0	0	0	111.8	V57 L60 S433 I434 C439 I440 A441 T473	V57-T437 HydrophobicContact CG2-CG2 4.19Å; L60-T437 HydrophobicContact CD1-CG2 4.39Å; S433-T437 WeakPolarHBondContact O-CB 3.41Å; S433-T437 WeakPolarHBondContact O-CG2 3.17Å; S433-T437 PolarHBondContact O-N 3.47Å; S433-T437 PolarHBondContact O-OG1 3.46Å; I434-T437 PolarHBondContact O-OG1 3.11Å; I434-T437 VanDerWaalsContact O-OG1 3.13Å; T437-C439 PolarHBondContact O-N 2.89Å; T437-I440 PolarHBondContact O-N 2.87Å; T437-A441 WeakPolarHBondContact O-CB 3.2Å; T437-A441 PolarHBondContact O-N 2.94Å; T437-T473 HydrophobicContact CG2-CG2 3.83Å
438	V	96.2	Very high	94.7	Very high	47 Å²	47	26.5 Å²	26.5	29%	0.285	13%	0.129	S	C	.	.	H	α-helix	trans	-61.7	-43.9	173.5	169.3	0	0	0	0	111.2	I434 W442 V443	I434-V438 HydrophobicContact CG2-CG2 4.46Å; I434-V438 VanDerWaalsContact O-CB 3.3Å; I434-V438 WeakPolarHBondContact O-CB 3.33Å; I434-V438 WeakPolarHBondContact O-CG2 3.43Å; I434-V438 PolarHBondContact O-N 3.29Å; V438-W442 WeakPolarHBondContact O-CB 3.49Å; V438-W442 PolarHBondContact O-N 3.08Å; V438-V443 PolarHBondContact O-N 3.35Å
439	C	96.3	Very high	95	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.129	C	C	.	.	I	π-helix	trans	-60.3	-51.2	178.2	-174.7	0	0	0	0	111.4	W76 F83 L86 F435 E436 T437 V443 Y444	W76-C439 HydrophobicContact CZ3-CB 3.99Å; F83-C439 HydrophobicContact CB-CB 4.29Å; F83-C439 VanDerWaalsContact CB-SG 3.58Å; F83-C439 HydrophobicContact CD1-CB 3.77Å; F83-C439 HydrophobicContact CD2-CB 4.3Å; F83-C439 HydrophobicContact CE1-CB 4.1Å; F83-C439 HydrophobicContact CG-CB 3.87Å; F83-C439 VanDerWaalsContact CG-SG 3.56Å; L86-C439 HydrophobicContact CD1-CB 4.25Å; F435-C439 WeakPolarHBondContact O-CB 3.3Å; F435-C439 PolarHBondContact O-N 3.4Å; E436-C439 PolarHBondContact O-N 3.05Å; T437-C439 PolarHBondContact O-N 2.89Å; C439-V443 VanDerWaalsContact O-CB 3.31Å; C439-V443 WeakPolarHBondContact O-CB 3.23Å; C439-V443 PolarHBondContact O-N 3.42Å; C439-Y444 PolarHBondContact O-N 3.05Å
440	I	96.6	Very high	95.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.129	C	C	.	.	I	π-helix	trans	-72.8	-46.3	-177.4	-64.5	-61.7	0	0	0	112.1	L60 L64 W76 I79 E436 T437 G445 F449	L60-I440 HydrophobicContact CD1-CB 4.03Å; L60-I440 HydrophobicContact CD1-CG1 4.11Å; L60-I440 HydrophobicContact CD1-CG2 4.15Å; L60-I440 HydrophobicContact CD2-CG1 4.1Å; L60-I440 HydrophobicContact CG-CG1 4.27Å; L60-I440 HydrophobicContact CG-CG2 4.5Å; L64-I440 HydrophobicContact CD1-CD1 4.18Å; L64-I440 HydrophobicContact CD2-CD1 4.29Å; W76-I440 HydrophobicContact CH2-CD1 4.28Å; W76-I440 HydrophobicContact CH2-CG1 3.99Å; W76-I440 HydrophobicContact CZ3-CD1 3.87Å; W76-I440 HydrophobicContact CZ3-CG1 3.94Å; I79-I440 HydrophobicContact CG2-CD1 3.94Å; E436-I440 PolarHBondContact O-N 3.41Å; T437-I440 PolarHBondContact O-N 2.87Å; I440-G445 CarbonylContact O-C 3.52Å; I440-G445 PolarHBondContact O-N 3.05Å; I440-F449 HydrophobicContact CG2-CB 4.08Å; I440-F449 HydrophobicContact CG2-CD1 3.51Å; I440-F449 HydrophobicContact CG2-CD2 4.4Å; I440-F449 HydrophobicContact CG2-CE1 4Å; I440-F449 HydrophobicContact CG2-CG 3.75Å
441	A	95.6	Very high	95.3	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.041	14%	0.141	C	C	.	.	I	π-helix	trans	-77.4	-38.5	-170.4	0	0	0	0	0	113.1	T437 A446 W469 L470	T437-A441 WeakPolarHBondContact O-CB 3.2Å; T437-A441 PolarHBondContact O-N 2.94Å; A441-A446 HydrophobicContact CB-CB 4.35Å; A441-A446 PolarHBondContact O-N 3.16Å; A441-W469 HydrophobicContact CB-CB 4.02Å; A441-L470 HydrophobicContact CB-CD2 3.86Å; A441-L470 HydrophobicContact CB-CG 4.17Å
442	W	95.6	Very high	95.4	Very high	147 Å²	147	27.6 Å²	27.6	56%	0.557	14%	0.135	S	C	*	.	I	π-helix	trans	-108.8	-35.9	-171.8	-65.7	90.9	0	0	0	113.9	V438 L470 F471	V438-W442 WeakPolarHBondContact O-CB 3.49Å; V438-W442 PolarHBondContact O-N 3.08Å; W442-L470 HydrophobicContact CD2-CD2 4.25Å; W442-L470 HydrophobicContact CZ2-CD2 4.08Å; W442-L470 PolarHBondContact NE1-O 3.4Å; W442-F471 AromaticContact CH2-CE1 3.87Å; W442-F471 HydrophobicContact CH2-CE1 3.87Å; W442-F471 HydrophobicContact CH2-CZ 4.33Å; W442-F471 HydrophobicContact CZ2-CD1 4.13Å; W442-F471 AromaticContact CZ2-CE1 3.56Å; W442-F471 HydrophobicContact CZ2-CE1 3.56Å; W442-F471 HydrophobicContact CZ2-CZ 4.21Å
443	V	95.4	Very high	95.4	Very high	40 Å²	40	27.6 Å²	27.6	24%	0.242	14%	0.135	C	C	.	.	I	π-helix	trans	-89.1	-54.6	-175.7	179.1	0	0	0	0	111	F83 V438 C439 V541	F83-V443 HydrophobicContact CD2-CG1 4.4Å; F83-V443 HydrophobicContact CE2-CB 4.28Å; F83-V443 HydrophobicContact CE2-CG1 4.03Å; F83-V443 HydrophobicContact CE2-CG2 3.74Å; F83-V443 HydrophobicContact CZ-CG2 3.97Å; V438-V443 PolarHBondContact O-N 3.35Å; C439-V443 VanDerWaalsContact O-CB 3.31Å; C439-V443 WeakPolarHBondContact O-CB 3.23Å; C439-V443 PolarHBondContact O-N 3.42Å; V443-V541 HydrophobicContact CG1-CB 4.11Å; V443-V541 HydrophobicContact CG1-CG1 3.46Å; V443-V541 VanDerWaalsContact CG1-CG1 3.46Å; V443-V541 HydrophobicContact CG1-CG2 3.81Å
444	Y	95.4	Very high	95.4	Very high	11 Å²	11	29.8 Å²	29.8	4%	0.043	15%	0.145	C	C	.	.	I	π-helix	trans	-74	-34.9	174.8	-175.1	-107.9	0	0	0	112.1	Y67 I79 C439 R448 F449 N452 P543	Y67-Y444 PolarHBondContact OH-OH 2.91Å; I79-Y444 HydrophobicContact CD1-CD2 4.26Å; I79-Y444 HydrophobicContact CD1-CE1 4.47Å; I79-Y444 HydrophobicContact CD1-CE2 3.95Å; I79-Y444 HydrophobicContact CG2-CD2 3.77Å; I79-Y444 HydrophobicContact CG2-CE2 4.49Å; I79-Y444 HydrophobicContact CG2-CG 3.9Å; C439-Y444 PolarHBondContact O-N 3.05Å; Y444-R448 HydrophobicContact CE1-CB 4.37Å; Y444-R448 HydrophobicContact CE1-CG 3.8Å; Y444-R448 VanDerWaalsContact CZ-CD 3.49Å; Y444-F449 HydrophobicContact CD1-CB 4.06Å; Y444-F449 HydrophobicContact CD1-CD2 4.42Å; Y444-F449 HydrophobicContact CE1-CB 4.08Å; Y444-F449 HydrophobicContact CE1-CD2 4.1Å; Y444-N452 PolarHBondContact OH-ND2 2.81Å; Y444-P543 HydrophobicContact CD2-CB 4.14Å; Y444-P543 HydrophobicContact CD2-CG 4.34Å; Y444-P543 HydrophobicContact CE2-CB 3.69Å; Y444-P543 HydrophobicContact CE2-CG 3.92Å
445	G	95.8	Very high	95.4	Very high	22 Å²	22	31 Å²	31	23%	0.227	15%	0.152	C	C	.	.	I	π-helix	trans	101.8	118.6	176.6	0	0	0	0	0	112.3	I440 D447 R448 F449	I440-G445 CarbonylContact O-C 3.52Å; I440-G445 PolarHBondContact O-N 3.05Å; G445-D447 VanDerWaalsContact C-N 3.28Å; G445-D447 PolarHBondContact O-N 3.46Å; G445-R448 PolarHBondContact O-N 2.93Å; G445-F449 PolarHBondContact O-N 3.44Å
446	A	95.2	Very high	95.3	Very high	4 Å²	4	28.5 Å²	28.5	3%	0.033	14%	0.141	C	C	.	.	H	α-helix	trans	-58.9	-36.7	-179.1	0	0	0	0	0	113.1	A441 F449 Y450 K466 L470	A441-A446 HydrophobicContact CB-CB 4.35Å; A441-A446 PolarHBondContact O-N 3.16Å; A446-F449 PolarHBondContact O-N 2.85Å; A446-Y450 WeakPolarHBondContact O-CB 3.4Å; A446-Y450 VanDerWaalsContact O-CD2 3.3Å; A446-Y450 WeakPolarHBondContact O-CD2 3.23Å; A446-Y450 PolarHBondContact O-N 3.3Å; A446-K466 HydrophobicContact CB-CD 4.47Å; A446-K466 HydrophobicContact CB-CG 3.9Å; A446-L470 HydrophobicContact CB-CD1 4.28Å; A446-L470 HydrophobicContact CB-CD2 4.15Å; A446-L470 HydrophobicContact CB-CG 4.13Å
447	D	94.8	Very high	95.3	Very high	79 Å²	79	29.5 Å²	29.5	42%	0.422	15%	0.146	S	C	.	.	H	α-helix	trans	-67	-44.5	177.3	-77.4	-58.9	0	0	0	112.6	G445 F449 Y450 D451 R460 K466	G445-D447 VanDerWaalsContact C-N 3.28Å; G445-D447 PolarHBondContact O-N 3.46Å; D447-F449 VanDerWaalsContact C-N 3.32Å; D447-F449 PolarHBondContact O-N 3.01Å; D447-Y450 WeakPolarHBondContact O-CB 3.41Å; D447-Y450 PolarHBondContact O-N 3.01Å; D447-D451 VanDerWaalsContact O-CG 3.26Å; D447-D451 PolarHBondContact O-N 2.63Å; D447-R460 IonicContact OD1-NH2 2.64Å; D447-R460 PolarHBondContact OD1-NH2 2.87Å; D447-R460 VanDerWaalsContact OD1-NH2 3.14Å; D447-K466 WeakPolarHBondContact OD1-CE 3.2Å; D447-K466 IonicContact OD1-NZ 3.26Å; D447-K466 PolarHBondContact OD1-NZ 2.92Å; D447-K466 IonicContact OD2-NZ 3.49Å; D447-K466 PolarHBondContact OD2-NZ 2.98Å
448	R	93.6	Very high	95.2	Very high	98 Å²	98	32.6 Å²	32.6	37%	0.37	18%	0.179	S	C	.	.	H	α-helix	trans	-59.6	-44.8	174.9	177.3	-179.3	-87.2	165.2	-8.8	110.8	Y444 G445 Y450 D451 N452	Y444-R448 HydrophobicContact CE1-CB 4.37Å; Y444-R448 HydrophobicContact CE1-CG 3.8Å; Y444-R448 VanDerWaalsContact CZ-CD 3.49Å; G445-R448 PolarHBondContact O-N 2.93Å; R448-Y450 VanDerWaalsContact C-N 3.32Å; R448-Y450 PolarHBondContact O-N 3.21Å; R448-D451 PolarHBondContact O-N 2.95Å; R448-N452 VanDerWaalsContact O-CG 3.22Å; R448-N452 PolarHBondContact O-N 3.17Å; R448-N452 PolarHBondContact O-OD1 3.06Å
449	F	95.3	Very high	95	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-36.6	178.1	-166.5	-123.1	0	0	0	112.5	L60 A63 L64 I440 Y444 G445 A446 D447 N452 I453 W469	L60-F449 HydrophobicContact CG-CE1 4.4Å; A63-F449 HydrophobicContact CB-CZ 4.07Å; L64-F449 HydrophobicContact CB-CE2 4.4Å; L64-F449 HydrophobicContact CB-CZ 4.08Å; L64-F449 HydrophobicContact CD1-CE2 4.29Å; I440-F449 HydrophobicContact CG2-CB 4.08Å; I440-F449 HydrophobicContact CG2-CD1 3.51Å; I440-F449 HydrophobicContact CG2-CD2 4.4Å; I440-F449 HydrophobicContact CG2-CE1 4Å; I440-F449 HydrophobicContact CG2-CG 3.75Å; Y444-F449 HydrophobicContact CD1-CB 4.06Å; Y444-F449 HydrophobicContact CD1-CD2 4.42Å; Y444-F449 HydrophobicContact CE1-CB 4.08Å; Y444-F449 HydrophobicContact CE1-CD2 4.1Å; G445-F449 PolarHBondContact O-N 3.44Å; A446-F449 PolarHBondContact O-N 2.85Å; D447-F449 VanDerWaalsContact C-N 3.32Å; D447-F449 PolarHBondContact O-N 3.01Å; F449-N452 WeakPolarHBondContact O-CB 3.48Å; F449-N452 PolarHBondContact O-N 3.2Å; F449-I453 HydrophobicContact CD1-CD1 3.82Å; F449-I453 HydrophobicContact CE1-CD1 3.73Å; F449-I453 HydrophobicContact CG-CD1 4.44Å; F449-I453 HydrophobicContact CZ-CD1 4.28Å; F449-I453 VanDerWaalsContact O-CG1 3.29Å; F449-I453 WeakPolarHBondContact O-CG1 3.47Å; F449-I453 PolarHBondContact O-N 2.89Å; F449-W469 HydrophobicContact CD1-CE3 4.32Å; F449-W469 AromaticContact CD1-CH2 3.87Å; F449-W469 HydrophobicContact CD1-CH2 3.87Å; F449-W469 AromaticContact CD1-CZ3 3.54Å; F449-W469 HydrophobicContact CD1-CZ3 3.54Å; F449-W469 AromaticContact CE1-CH2 3.72Å; F449-W469 HydrophobicContact CE1-CH2 3.72Å; F449-W469 HydrophobicContact CE1-CZ2 4.44Å; F449-W469 AromaticContact CE1-CZ3 3.9Å; F449-W469 HydrophobicContact CE1-CZ3 3.9Å
450	Y	95.1	Very high	94.8	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-64.7	-39.1	172.1	-98.4	-108.5	0	0	0	113.1	A446 D447 R448 N452 I453 E454 R460 P461 G462 I465 K466 W469	A446-Y450 WeakPolarHBondContact O-CB 3.4Å; A446-Y450 VanDerWaalsContact O-CD2 3.3Å; A446-Y450 WeakPolarHBondContact O-CD2 3.23Å; A446-Y450 PolarHBondContact O-N 3.3Å; D447-Y450 WeakPolarHBondContact O-CB 3.41Å; D447-Y450 PolarHBondContact O-N 3.01Å; R448-Y450 VanDerWaalsContact C-N 3.32Å; R448-Y450 PolarHBondContact O-N 3.21Å; Y450-N452 VanDerWaalsContact C-N 3.32Å; Y450-I453 PolarHBondContact O-N 3.39Å; Y450-E454 WeakPolarHBondContact O-CB 3.31Å; Y450-E454 PolarHBondContact O-N 3.48Å; Y450-R460 HydrophobicContact CD1-CG 3.74Å; Y450-R460 HydrophobicContact CE1-CG 4.48Å; Y450-P461 HydrophobicContact CE1-CB 4.07Å; Y450-P461 HydrophobicContact CE1-CG 4.4Å; Y450-P461 WeakPolarHBondContact CE1-O 3.4Å; Y450-G462 PolarHBondContact OH-O 3.33Å; Y450-I465 VanDerWaalsContact OH-CB 3.3Å; Y450-I465 WeakPolarHBondContact OH-CB 3.41Å; Y450-K466 HydrophobicContact CD2-CB 4.21Å; Y450-K466 HydrophobicContact CD2-CG 4.05Å; Y450-K466 HydrophobicContact CE1-CB 4.32Å; Y450-K466 HydrophobicContact CE2-CB 3.43Å; Y450-K466 VanDerWaalsContact CE2-CB 3.43Å; Y450-K466 HydrophobicContact CE2-CG 3.74Å; Y450-K466 PolarHBondContact OH-N 3.11Å; Y450-W469 HydrophobicContact CD2-CE3 4.39Å; Y450-W469 AromaticContact CD2-CZ3 3.8Å; Y450-W469 HydrophobicContact CD2-CZ3 3.8Å; Y450-W469 AromaticContact CE2-CE3 3.76Å; Y450-W469 HydrophobicContact CE2-CE3 3.76Å; Y450-W469 HydrophobicContact CE2-CH2 4.12Å; Y450-W469 AromaticContact CE2-CZ3 3.27Å; Y450-W469 HydrophobicContact CE2-CZ3 3.27Å
451	D	94.6	Very high	94.7	Very high	48 Å²	48	39.6 Å²	39.6	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-63.9	-39.6	175.4	-66.2	-23.1	0	0	0	110.7	D447 R448 I453 E454 D455 R460 R552	D447-D451 VanDerWaalsContact O-CG 3.26Å; D447-D451 PolarHBondContact O-N 2.63Å; R448-D451 PolarHBondContact O-N 2.95Å; D451-I453 VanDerWaalsContact C-N 3.34Å; D451-I453 PolarHBondContact O-N 3.27Å; D451-E454 PolarHBondContact O-N 3.39Å; D451-D455 PolarHBondContact O-N 3.24Å; D451-R460 IonicContact OD1-CZ 3.27Å; D451-R460 IonicContact OD1-NH1 3.08Å; D451-R460 PolarHBondContact OD1-NH1 2.85Å; D451-R460 IonicContact OD1-NH2 2.82Å; D451-R552 IonicContact OD1-NH1 3.95Å
452	N	94.7	Very high	94.4	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-40.3	173	-60.3	-14.5	0	0	0	112.1	Y67 Y444 R448 F449 Y450 D455 M456 T550	Y67-N452 HydrophobicContact CD2-CB 3.93Å; Y67-N452 HydrophobicContact CE2-CB 3.8Å; Y67-N452 HydrophobicContact CG-CB 4.48Å; Y67-N452 VanDerWaalsContact CZ-ND2 3.27Å; Y67-N452 PolarHBondContact OH-ND2 2.96Å; Y444-N452 PolarHBondContact OH-ND2 2.81Å; R448-N452 VanDerWaalsContact O-CG 3.22Å; R448-N452 PolarHBondContact O-N 3.17Å; R448-N452 PolarHBondContact O-OD1 3.06Å; F449-N452 WeakPolarHBondContact O-CB 3.48Å; F449-N452 PolarHBondContact O-N 3.2Å; Y450-N452 VanDerWaalsContact C-N 3.32Å; N452-D455 PolarHBondContact O-N 3.24Å; N452-M456 WeakPolarHBondContact O-CG 3.32Å; N452-M456 PolarHBondContact O-N 3.14Å; N452-T550 VanDerWaalsContact OD1-CG2 3.3Å; N452-T550 WeakPolarHBondContact OD1-CG2 3.26Å
453	I	95.3	Very high	94.3	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.4	-43.3	176.8	-69.1	163.2	0	0	0	110.5	F59 A63 F449 Y450 D451 D455 M456 I457 P461 W469	F59-I453 HydrophobicContact CE1-CD1 3.87Å; F59-I453 HydrophobicContact CZ-CD1 3.97Å; F59-I453 HydrophobicContact CZ-CG1 4.43Å; F59-I453 HydrophobicContact CZ-CG2 3.88Å; A63-I453 HydrophobicContact CB-CD1 4.38Å; A63-I453 HydrophobicContact CB-CG1 4.29Å; F449-I453 HydrophobicContact CD1-CD1 3.82Å; F449-I453 HydrophobicContact CE1-CD1 3.73Å; F449-I453 HydrophobicContact CG-CD1 4.44Å; F449-I453 HydrophobicContact CZ-CD1 4.28Å; F449-I453 VanDerWaalsContact O-CG1 3.29Å; F449-I453 WeakPolarHBondContact O-CG1 3.47Å; F449-I453 PolarHBondContact O-N 2.89Å; Y450-I453 PolarHBondContact O-N 3.39Å; D451-I453 VanDerWaalsContact C-N 3.34Å; D451-I453 PolarHBondContact O-N 3.27Å; I453-D455 VanDerWaalsContact C-N 3.27Å; I453-D455 PolarHBondContact O-N 3.12Å; I453-M456 HydrophobicContact CB-CE 4.31Å; I453-M456 HydrophobicContact CG1-CE 3.82Å; I453-M456 PolarHBondContact O-N 3.19Å; I453-I457 HydrophobicContact CG2-CD1 3.78Å; I453-I457 HydrophobicContact CG2-CG1 4.25Å; I453-I457 WeakPolarHBondContact O-CG1 3.24Å; I453-I457 PolarHBondContact O-N 3.26Å; I453-P461 HydrophobicContact CG2-CG 3.62Å; I453-W469 HydrophobicContact CD1-CH2 3.9Å; I453-W469 HydrophobicContact CD1-CZ3 4.29Å
454	E	95.2	Very high	94.2	Very high	45 Å²	45	41.3 Å²	41.3	21%	0.21	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-40.9	175.4	-174	-178.8	171.1	0	0	111	Y450 D451 G458 R460 R552	Y450-E454 WeakPolarHBondContact O-CB 3.31Å; Y450-E454 PolarHBondContact O-N 3.48Å; D451-E454 PolarHBondContact O-N 3.39Å; E454-G458 CarbonylContact O-C 3.57Å; E454-G458 WeakPolarHBondContact O-CA 3.3Å; E454-G458 PolarHBondContact O-N 2.98Å; E454-R460 HydrophobicContact CB-CB 4.39Å; E454-R460 HydrophobicContact CG-CB 4.23Å; E454-R460 IonicContact OE2-NH1 2.74Å; E454-R552 IonicContact OE1-CZ 2.61Å; E454-R552 IonicContact OE1-NH1 2.83Å; E454-R552 IonicContact OE1-NH2 3.38Å; E454-R552 PolarHBondContact OE1-NH2 3.19Å; E454-R552 IonicContact OE2-CZ 3.2Å; E454-R552 IonicContact OE2-NH1 3.63Å; E454-R552 PolarHBondContact OE2-NH1 2.99Å; E454-R552 IonicContact OE2-NH2 2.67Å
455	D	94.5	Very high	94.2	Very high	46 Å²	46	41 Å²	41	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-65.5	-41.7	174.6	-165.9	84.8	0	0	0	112.6	Y279 D451 N452 I453 T550 K551	Y279-D455 WeakPolarHBondContact CE1-OD2 3.32Å; Y279-D455 PolarHBondContact OH-OD2 3.23Å; Y279-D455 VanDerWaalsContact OH-OD2 3.09Å; D451-D455 PolarHBondContact O-N 3.24Å; N452-D455 PolarHBondContact O-N 3.24Å; I453-D455 VanDerWaalsContact C-N 3.27Å; I453-D455 PolarHBondContact O-N 3.12Å; D455-T550 HydrophobicContact CB-CG2 3.96Å; D455-K551 PolarHBondContact OD1-N 3.23Å
456	M	94.7	Very high	94.2	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-54.7	176.5	-75.3	-171	-65.5	0	0	112.8	A63 Q66 Y67 Y279 N280 N452 I453	A63-M456 HydrophobicContact CB-CE 4.31Å; Q66-M456 HydrophobicContact CB-SD 4.29Å; Q66-M456 HydrophobicContact CG-SD 4.08Å; Y67-M456 VanDerWaalsContact CA-SD 3.5Å; Y67-M456 HydrophobicContact CD2-SD 4.39Å; Y279-M456 HydrophobicContact CD1-CG 4.17Å; Y279-M456 HydrophobicContact CD2-CG 4.2Å; Y279-M456 HydrophobicContact CE1-CB 4.37Å; Y279-M456 HydrophobicContact CE1-CG 3.73Å; Y279-M456 HydrophobicContact CE2-CG 3.78Å; Y279-M456 HydrophobicContact CE2-SD 4.4Å; Y279-M456 HydrophobicContact CG-CG 4.39Å; Y279-M456 WeakPolarHBondContact O-CB 3.14Å; N280-M456 VanDerWaalsContact CA-O 3.26Å; N280-M456 WeakPolarHBondContact CA-O 3.32Å; N452-M456 WeakPolarHBondContact O-CG 3.32Å; N452-M456 PolarHBondContact O-N 3.14Å; I453-M456 HydrophobicContact CB-CE 4.31Å; I453-M456 HydrophobicContact CG1-CE 3.82Å; I453-M456 PolarHBondContact O-N 3.19Å
457	I	95.3	Very high	94.3	Very high	20 Å²	20	46.9 Å²	46.9	10%	0.103	24%	0.24	C	C	.	.	H	α-helix	trans	-98.3	-8.1	-168.4	76.6	-175.4	0	0	0	113.7	I453 Y459 P461	I453-I457 HydrophobicContact CG2-CD1 3.78Å; I453-I457 HydrophobicContact CG2-CG1 4.25Å; I453-I457 WeakPolarHBondContact O-CG1 3.24Å; I453-I457 PolarHBondContact O-N 3.26Å; I457-Y459 VanDerWaalsContact C-N 3.35Å; I457-Y459 HydrophobicContact CB-CE1 4.26Å; I457-Y459 HydrophobicContact CD1-CD1 4.24Å; I457-Y459 HydrophobicContact CD1-CD2 4.15Å; I457-Y459 HydrophobicContact CD1-CE1 3.85Å; I457-Y459 HydrophobicContact CD1-CE2 3.74Å; I457-Y459 HydrophobicContact CD1-CG 4.38Å; I457-Y459 WeakPolarHBondContact CD1-O 3.33Å; I457-Y459 HydrophobicContact CG1-CD1 3.89Å; I457-Y459 HydrophobicContact CG1-CD2 4.48Å; I457-Y459 HydrophobicContact CG1-CE1 3.82Å; I457-Y459 HydrophobicContact CG1-CE2 4.42Å; I457-Y459 HydrophobicContact CG1-CG 4.23Å; I457-Y459 WeakPolarHBondContact CG1-O 3.43Å; I457-Y459 WeakPolarHBondContact O-CD1 3.32Å; I457-P461 HydrophobicContact CD1-CG 4.09Å
458	G	93.3	Very high	94.4	Very high	66 Å²	66	43.1 Å²	43.1	68%	0.68	22%	0.22	S	C	*	.	S	Bend	trans	83.3	1.8	178.5	0	0	0	0	0	115.3	E454	E454-G458 CarbonylContact O-C 3.57Å; E454-G458 WeakPolarHBondContact O-CA 3.3Å; E454-G458 PolarHBondContact O-N 2.98Å
459	Y	93.5	Very high	94.5	Very high	90 Å²	90	38.5 Å²	38.5	35%	0.353	20%	0.202	S	C	.	.	S	Bend	trans	-151.1	154.7	174.5	66	-87.6	0	0	0	111	N282 Y284 I457	N282-Y459 WeakPolarHBondContact ND2-CE1 3.15Å; N282-Y459 PolarHBondContact ND2-OH 3.22Å; N282-Y459 PolarHBondContact OD1-OH 3.29Å; Y284-Y459 HydrophobicContact CD1-CE2 4.24Å; Y284-Y459 WeakPolarHBondContact CD1-OH 3.33Å; I457-Y459 VanDerWaalsContact C-N 3.35Å; I457-Y459 HydrophobicContact CB-CE1 4.26Å; I457-Y459 HydrophobicContact CD1-CD1 4.24Å; I457-Y459 HydrophobicContact CD1-CD2 4.15Å; I457-Y459 HydrophobicContact CD1-CE1 3.85Å; I457-Y459 HydrophobicContact CD1-CE2 3.74Å; I457-Y459 HydrophobicContact CD1-CG 4.38Å; I457-Y459 WeakPolarHBondContact CD1-O 3.33Å; I457-Y459 HydrophobicContact CG1-CD1 3.89Å; I457-Y459 HydrophobicContact CG1-CD2 4.48Å; I457-Y459 HydrophobicContact CG1-CE1 3.82Å; I457-Y459 HydrophobicContact CG1-CE2 4.42Å; I457-Y459 HydrophobicContact CG1-CG 4.23Å; I457-Y459 WeakPolarHBondContact CG1-O 3.43Å; I457-Y459 WeakPolarHBondContact O-CD1 3.32Å
460	R	92.4	Very high	94.6	Very high	97 Å²	97	39.6 Å²	39.6	37%	0.366	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-85.4	124.9	179.5	-163.1	170.4	-173.8	131.3	-1	110.5	D447 Y450 D451 E454	D447-R460 IonicContact OD1-NH2 2.64Å; D447-R460 PolarHBondContact OD1-NH2 2.87Å; D447-R460 VanDerWaalsContact OD1-NH2 3.14Å; Y450-R460 HydrophobicContact CD1-CG 3.74Å; Y450-R460 HydrophobicContact CE1-CG 4.48Å; D451-R460 IonicContact OD1-CZ 3.27Å; D451-R460 IonicContact OD1-NH1 3.08Å; D451-R460 PolarHBondContact OD1-NH1 2.85Å; D451-R460 IonicContact OD1-NH2 2.82Å; E454-R460 HydrophobicContact CB-CB 4.39Å; E454-R460 HydrophobicContact CG-CB 4.23Å; E454-R460 IonicContact OE2-NH1 2.74Å
461	P	92.6	Very high	94.6	Very high	7 Å²	7	44.3 Å²	44.3	5%	0.045	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-60.8	162.6	174.6	-22.4	32.6	0	0	0	112.7	F59 Y284 Y450 I453 I457	F59-P461 HydrophobicContact CE1-CG 4.22Å; F59-P461 HydrophobicContact CZ-CG 4.18Å; Y284-P461 HydrophobicContact CD2-CB 4.08Å; Y284-P461 HydrophobicContact CD2-CG 4.27Å; Y284-P461 HydrophobicContact CE2-CB 3.95Å; Y450-P461 HydrophobicContact CE1-CB 4.07Å; Y450-P461 HydrophobicContact CE1-CG 4.4Å; Y450-P461 WeakPolarHBondContact CE1-O 3.4Å; I453-P461 HydrophobicContact CG2-CG 3.62Å; I457-P461 HydrophobicContact CD1-CG 4.09Å
462	G	90.2	Very high	94.6	Very high	34 Å²	34	46.9 Å²	46.9	35%	0.351	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-59.8	144	176.9	0	0	0	0	0	112.3	Y450 Y464 I465	Y450-G462 PolarHBondContact OH-O 3.33Å; G462-Y464 PolarHBondContact O-N 2.94Å; G462-I465 PolarHBondContact O-N 3.37Å
463	P	92.9	Very high	94.7	Very high	85 Å²	85	46.9 Å²	46.9	55%	0.552	24%	0.238	S	C	*	.	H	α-helix	trans	-66.7	-14.9	-172.5	28	-36.4	0	0	0	113.7	I465 K466 Y467	P463-I465 VanDerWaalsContact C-N 3.32Å; P463-I465 PolarHBondContact O-N 2.96Å; P463-K466 WeakPolarHBondContact O-CB 3.31Å; P463-K466 PolarHBondContact O-N 2.95Å; P463-Y467 HydrophobicContact CB-CD2 4.35Å; P463-Y467 HydrophobicContact CB-CE2 4.06Å; P463-Y467 WeakPolarHBondContact O-CD2 3.27Å; P463-Y467 PolarHBondContact O-N 3.2Å; P463-Y467 VanDerWaalsContact O-N 3.13Å
464	Y	95.1	Very high	94.7	Very high	109 Å²	109	47.3 Å²	47.3	43%	0.427	24%	0.241	S	C	.	.	H	α-helix	trans	-50.6	-49.8	176.6	173.9	-104.1	0	0	0	112.4	F51 G462 K466 Y467 C468	F51-Y464 VanDerWaalsContact C-OH 3.3Å; F51-Y464 WeakPolarHBondContact CB-OH 3.44Å; F51-Y464 WeakPolarHBondContact O-CE1 3.37Å; F51-Y464 PolarHBondContact O-OH 3.21Å; G462-Y464 PolarHBondContact O-N 2.94Å; Y464-K466 PolarHBondContact O-N 2.87Å; Y464-Y467 PolarHBondContact O-N 3.48Å; Y464-Y467 VanDerWaalsContact O-N 3.14Å; Y464-C468 VanDerWaalsContact CE1-SG 3.55Å; Y464-C468 PolarHBondContact O-N 2.71Å; Y464-C468 PolarHBondContact O-SG 2.95Å
465	I	95.1	Very high	94.6	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-32.8	-178.2	-60.8	-65.6	0	0	0	111.1	V55 P56 F59 Y284 Y450 G462 P463 C468 W469	V55-I465 HydrophobicContact CG1-CD1 4.1Å; P56-I465 HydrophobicContact CB-CD1 4.4Å; P56-I465 HydrophobicContact CB-CG2 4.32Å; P56-I465 HydrophobicContact CG-CD1 3.95Å; F59-I465 HydrophobicContact CD1-CG2 4Å; Y284-I465 HydrophobicContact CE2-CG1 4.41Å; Y450-I465 VanDerWaalsContact OH-CB 3.3Å; Y450-I465 WeakPolarHBondContact OH-CB 3.41Å; G462-I465 PolarHBondContact O-N 3.37Å; P463-I465 VanDerWaalsContact C-N 3.32Å; P463-I465 PolarHBondContact O-N 2.96Å; I465-C468 WeakPolarHBondContact O-CB 3.18Å; I465-C468 PolarHBondContact O-N 2.68Å; I465-W469 HydrophobicContact CG2-CD2 4.11Å; I465-W469 HydrophobicContact CG2-CH2 3.9Å; I465-W469 HydrophobicContact CG2-CZ2 3.41Å; I465-W469 VanDerWaalsContact CG2-CZ2 3.41Å; I465-W469 HydrophobicContact CG2-CZ3 4.42Å; I465-W469 PolarHBondContact O-N 2.96Å; I465-W469 VanDerWaalsContact O-N 3.11Å
466	K	95	Very high	94.5	Very high	32 Å²	32	47.8 Å²	47.8	14%	0.139	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-47.9	176	-167.1	-170.9	168.8	-173.7	0	110.3	A446 D447 Y450 P463 Y464 C468 W469 L470	A446-K466 HydrophobicContact CB-CD 4.47Å; A446-K466 HydrophobicContact CB-CG 3.9Å; D447-K466 WeakPolarHBondContact OD1-CE 3.2Å; D447-K466 IonicContact OD1-NZ 3.26Å; D447-K466 PolarHBondContact OD1-NZ 2.92Å; D447-K466 IonicContact OD2-NZ 3.49Å; D447-K466 PolarHBondContact OD2-NZ 2.98Å; Y450-K466 HydrophobicContact CD2-CB 4.21Å; Y450-K466 HydrophobicContact CD2-CG 4.05Å; Y450-K466 HydrophobicContact CE1-CB 4.32Å; Y450-K466 HydrophobicContact CE2-CB 3.43Å; Y450-K466 VanDerWaalsContact CE2-CB 3.43Å; Y450-K466 HydrophobicContact CE2-CG 3.74Å; Y450-K466 PolarHBondContact OH-N 3.11Å; P463-K466 WeakPolarHBondContact O-CB 3.31Å; P463-K466 PolarHBondContact O-N 2.95Å; Y464-K466 PolarHBondContact O-N 2.87Å; K466-C468 VanDerWaalsContact C-N 3.3Å; K466-C468 PolarHBondContact O-N 2.84Å; K466-W469 PolarHBondContact O-N 3.02Å; K466-L470 HydrophobicContact CD-CD1 4.49Å; K466-L470 HydrophobicContact CG-CD1 4.09Å; K466-L470 WeakPolarHBondContact O-CG 3.38Å; K466-L470 PolarHBondContact O-N 2.88Å
467	Y	96.6	Very high	94.3	Very high	117 Å²	117	47.6 Å²	47.6	46%	0.459	25%	0.254	S	S	.	.	H	α-helix	trans	-69.2	-29.2	178.7	-69.2	-62.2	0	0	0	112.5	P463 Y464 L470 F471 F472	P463-Y467 HydrophobicContact CB-CD2 4.35Å; P463-Y467 HydrophobicContact CB-CE2 4.06Å; P463-Y467 WeakPolarHBondContact O-CD2 3.27Å; P463-Y467 PolarHBondContact O-N 3.2Å; P463-Y467 VanDerWaalsContact O-N 3.13Å; Y464-Y467 PolarHBondContact O-N 3.48Å; Y464-Y467 VanDerWaalsContact O-N 3.14Å; Y467-L470 HydrophobicContact CD1-CD1 4.41Å; Y467-F471 HydrophobicContact CD1-CD2 4.05Å; Y467-F471 AromaticContact CD1-CE2 3.92Å; Y467-F471 HydrophobicContact CD1-CE2 3.92Å; Y467-F471 HydrophobicContact CE1-CE2 4.4Å; Y467-F471 PolarHBondContact O-N 3.43Å; Y467-F472 PolarHBondContact O-N 3.22Å
468	C	96.8	Very high	94.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	I	π-helix	trans	-59.1	-52.1	169.2	-66.4	0	0	0	0	111.2	P56 Y464 I465 K466 L470 F471 F472 T473	P56-C468 HydrophobicContact CB-CB 3.68Å; P56-C468 HydrophobicContact CG-CB 3.44Å; P56-C468 VanDerWaalsContact CG-CB 3.44Å; Y464-C468 VanDerWaalsContact CE1-SG 3.55Å; Y464-C468 PolarHBondContact O-N 2.71Å; Y464-C468 PolarHBondContact O-SG 2.95Å; I465-C468 WeakPolarHBondContact O-CB 3.18Å; I465-C468 PolarHBondContact O-N 2.68Å; K466-C468 VanDerWaalsContact C-N 3.3Å; K466-C468 PolarHBondContact O-N 2.84Å; C468-L470 VanDerWaalsContact C-N 3.34Å; C468-L470 PolarHBondContact O-N 3.35Å; C468-F471 PolarHBondContact O-N 3.49Å; C468-F472 PolarHBondContact O-N 3.06Å; C468-T473 WeakPolarHBondContact O-CB 3.37Å; C468-T473 PolarHBondContact O-N 2.88Å; C468-T473 PolarHBondContact O-OG1 3.48Å; C468-T473 VanDerWaalsContact O-OG1 3.07Å
469	W	96.6	Very high	94	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-63.1	-38.4	178.7	-59.1	-29.1	0	0	0	113.4	P56 F59 L60 A441 F449 Y450 I453 I465 K466 P474	P56-W469 VanDerWaalsContact C-NE1 3.26Å; P56-W469 PolarHBondContact O-NE1 3.4Å; F59-W469 AromaticContact CD1-CH2 3.83Å; F59-W469 HydrophobicContact CD1-CH2 3.83Å; F59-W469 AromaticContact CD1-CZ2 3.65Å; F59-W469 HydrophobicContact CD1-CZ2 3.65Å; F59-W469 AromaticContact CE1-CH2 3.9Å; F59-W469 HydrophobicContact CE1-CH2 3.9Å; F59-W469 HydrophobicContact CE1-CZ2 4.21Å; L60-W469 HydrophobicContact CB-CZ2 3.77Å; L60-W469 HydrophobicContact CD1-CD2 4.25Å; L60-W469 HydrophobicContact CD1-CG 4.21Å; L60-W469 HydrophobicContact CG-CZ2 4.47Å; A441-W469 HydrophobicContact CB-CB 4.02Å; F449-W469 HydrophobicContact CD1-CE3 4.32Å; F449-W469 AromaticContact CD1-CH2 3.87Å; F449-W469 HydrophobicContact CD1-CH2 3.87Å; F449-W469 AromaticContact CD1-CZ3 3.54Å; F449-W469 HydrophobicContact CD1-CZ3 3.54Å; F449-W469 AromaticContact CE1-CH2 3.72Å; F449-W469 HydrophobicContact CE1-CH2 3.72Å; F449-W469 HydrophobicContact CE1-CZ2 4.44Å; F449-W469 AromaticContact CE1-CZ3 3.9Å; F449-W469 HydrophobicContact CE1-CZ3 3.9Å; Y450-W469 HydrophobicContact CD2-CE3 4.39Å; Y450-W469 AromaticContact CD2-CZ3 3.8Å; Y450-W469 HydrophobicContact CD2-CZ3 3.8Å; Y450-W469 AromaticContact CE2-CE3 3.76Å; Y450-W469 HydrophobicContact CE2-CE3 3.76Å; Y450-W469 HydrophobicContact CE2-CH2 4.12Å; Y450-W469 AromaticContact CE2-CZ3 3.27Å; Y450-W469 HydrophobicContact CE2-CZ3 3.27Å; I453-W469 HydrophobicContact CD1-CH2 3.9Å; I453-W469 HydrophobicContact CD1-CZ3 4.29Å; I465-W469 HydrophobicContact CG2-CD2 4.11Å; I465-W469 HydrophobicContact CG2-CH2 3.9Å; I465-W469 HydrophobicContact CG2-CZ2 3.41Å; I465-W469 VanDerWaalsContact CG2-CZ2 3.41Å; I465-W469 HydrophobicContact CG2-CZ3 4.42Å; I465-W469 PolarHBondContact O-N 2.96Å; I465-W469 VanDerWaalsContact O-N 3.11Å; K466-W469 PolarHBondContact O-N 3.02Å; W469-P474 WeakPolarHBondContact O-CD 3.07Å
470	L	96.3	Very high	93.7	Very high	23 Å²	23	46.2 Å²	46.2	12%	0.12	25%	0.247	C	C	.	.	I	π-helix	trans	-70.7	-41.7	-179.2	-77.3	165.2	0	0	0	113	A441 W442 A446 K466 Y467 C468	A441-L470 HydrophobicContact CB-CD2 3.86Å; A441-L470 HydrophobicContact CB-CG 4.17Å; W442-L470 HydrophobicContact CD2-CD2 4.25Å; W442-L470 HydrophobicContact CZ2-CD2 4.08Å; W442-L470 PolarHBondContact NE1-O 3.4Å; A446-L470 HydrophobicContact CB-CD1 4.28Å; A446-L470 HydrophobicContact CB-CD2 4.15Å; A446-L470 HydrophobicContact CB-CG 4.13Å; K466-L470 HydrophobicContact CD-CD1 4.49Å; K466-L470 HydrophobicContact CG-CD1 4.09Å; K466-L470 WeakPolarHBondContact O-CG 3.38Å; K466-L470 PolarHBondContact O-N 2.88Å; Y467-L470 HydrophobicContact CD1-CD1 4.41Å; C468-L470 VanDerWaalsContact C-N 3.34Å; C468-L470 PolarHBondContact O-N 3.35Å
471	F	95.9	Very high	93.5	Very high	101 Å²	101	43.1 Å²	43.1	44%	0.443	24%	0.236	S	C	.	.	I	π-helix	trans	-132.8	-57.1	-165.4	-54.2	-63.9	0	0	0	113.6	W442 Y467 C468 P474 A475	W442-F471 AromaticContact CH2-CE1 3.87Å; W442-F471 HydrophobicContact CH2-CE1 3.87Å; W442-F471 HydrophobicContact CH2-CZ 4.33Å; W442-F471 HydrophobicContact CZ2-CD1 4.13Å; W442-F471 AromaticContact CZ2-CE1 3.56Å; W442-F471 HydrophobicContact CZ2-CE1 3.56Å; W442-F471 HydrophobicContact CZ2-CZ 4.21Å; Y467-F471 HydrophobicContact CD1-CD2 4.05Å; Y467-F471 AromaticContact CD1-CE2 3.92Å; Y467-F471 HydrophobicContact CD1-CE2 3.92Å; Y467-F471 HydrophobicContact CE1-CE2 4.4Å; Y467-F471 PolarHBondContact O-N 3.43Å; C468-F471 PolarHBondContact O-N 3.49Å; F471-P474 WeakPolarHBondContact O-CD 3.49Å; F471-P474 WeakPolarHBondContact O-CG 3.35Å; F471-A475 WeakPolarHBondContact O-CB 3.34Å; F471-A475 PolarHBondContact O-N 3.44Å
472	F	95.5	Very high	93.3	Very high	103 Å²	103	44.7 Å²	44.7	45%	0.452	25%	0.25	S	S	.	.	I	π-helix	trans	-69.2	-47.8	-167.4	-62.7	-73.5	0	0	0	113	T52 Y467 C468 T476	T52-F472 HydrophobicContact CG2-CB 4.49Å; Y467-F472 PolarHBondContact O-N 3.22Å; C468-F472 PolarHBondContact O-N 3.06Å; F472-T476 WeakPolarHBondContact O-CB 3.41Å; F472-T476 VanDerWaalsContact O-CG2 3.31Å; F472-T476 WeakPolarHBondContact O-CG2 3.3Å; F472-T476 PolarHBondContact O-N 3.05Å; F472-T476 PolarHBondContact O-OG1 3.3Å
473	T	95.4	Very high	93.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-54.5	178.6	-48.7	0	0	0	0	111.8	T52 C53 V57 T437 C468 A475 T476 C477	T52-T473 PolarHBondContact O-OG1 3.22Å; C53-T473 HydrophobicContact CB-CG2 4.23Å; V57-T473 HydrophobicContact CG2-CG2 3.56Å; T437-T473 HydrophobicContact CG2-CG2 3.83Å; C468-T473 WeakPolarHBondContact O-CB 3.37Å; C468-T473 PolarHBondContact O-N 2.88Å; C468-T473 PolarHBondContact O-OG1 3.48Å; C468-T473 VanDerWaalsContact O-OG1 3.07Å; T473-A475 VanDerWaalsContact C-N 3.34Å; T473-A475 PolarHBondContact O-N 3.46Å; T473-T476 PolarHBondContact O-N 3.21Å; T473-T476 PolarHBondContact O-OG1 2.68Å; T473-C477 WeakPolarHBondContact O-CB 3.25Å; T473-C477 PolarHBondContact O-N 2.71Å; T473-C477 PolarHBondContact O-SG 3.33Å
474	P	94.9	Very high	92.6	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.058	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-39.4	179.4	22.4	-32.3	0	0	0	112.3	W469 F471 C477 I478	W469-P474 WeakPolarHBondContact O-CD 3.07Å; F471-P474 WeakPolarHBondContact O-CD 3.49Å; F471-P474 WeakPolarHBondContact O-CG 3.35Å; P474-C477 PolarHBondContact O-N 3.32Å; P474-I478 VanDerWaalsContact O-CB 3.31Å; P474-I478 WeakPolarHBondContact O-CB 3.46Å; P474-I478 WeakPolarHBondContact O-CD1 3.4Å; P474-I478 WeakPolarHBondContact O-CG1 3.47Å; P474-I478 PolarHBondContact O-N 3.35Å
475	A	94.1	Very high	92.2	Very high	64 Å²	64	40.7 Å²	40.7	53%	0.529	22%	0.222	S	C	.	.	H	α-helix	trans	-64.8	-46.4	179.4	0	0	0	0	0	112.9	F471 T473 I478 G479	F471-A475 WeakPolarHBondContact O-CB 3.34Å; F471-A475 PolarHBondContact O-N 3.44Å; T473-A475 VanDerWaalsContact C-N 3.34Å; T473-A475 PolarHBondContact O-N 3.46Å; A475-I478 PolarHBondContact O-N 3.38Å; A475-G479 PolarHBondContact O-N 2.93Å
476	T	91.7	Very high	91.8	Very high	38 Å²	38	46.6 Å²	46.6	23%	0.233	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-39.6	177.5	49.3	0	0	0	0	111.6	C53 F472 T473 T480	C53-T476 PolarHBondContact SG-OG1 3.2Å; F472-T476 WeakPolarHBondContact O-CB 3.41Å; F472-T476 VanDerWaalsContact O-CG2 3.31Å; F472-T476 WeakPolarHBondContact O-CG2 3.3Å; F472-T476 PolarHBondContact O-N 3.05Å; F472-T476 PolarHBondContact O-OG1 3.3Å; T473-T476 PolarHBondContact O-N 3.21Å; T473-T476 PolarHBondContact O-OG1 2.68Å; T476-T480 WeakPolarHBondContact O-CB 3.44Å; T476-T480 PolarHBondContact O-N 3.33Å; T476-T480 PolarHBondContact O-OG1 3.48Å
477	C	91.6	Very high	91.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-44.7	176.3	-64.7	0	0	0	0	112.1	F260 L430 I434 T473 P474 T480 F481	F260-C477 WeakPolarHBondContact CZ-SG 3.39Å; L430-C477 HydrophobicContact CD2-CB 4.25Å; I434-C477 HydrophobicContact CD1-CB 4.08Å; I434-C477 HydrophobicContact CG1-CB 3.52Å; T473-C477 WeakPolarHBondContact O-CB 3.25Å; T473-C477 PolarHBondContact O-N 2.71Å; T473-C477 PolarHBondContact O-SG 3.33Å; P474-C477 PolarHBondContact O-N 3.32Å; C477-T480 PolarHBondContact O-N 3.2Å; C477-F481 WeakPolarHBondContact O-CB 3.23Å; C477-F481 PolarHBondContact O-N 3.12Å
478	I	92	Very high	90.6	Very high	90 Å²	90	49.1 Å²	49.1	46%	0.462	26%	0.264	S	S	.	.	H	α-helix	trans	-60.5	-47.4	176	-71.7	164.4	0	0	0	110.4	I434 P474 A475 T480 F481 A482	I434-I478 HydrophobicContact CD1-CB 4.39Å; I434-I478 HydrophobicContact CD1-CG1 3.62Å; I434-I478 HydrophobicContact CG1-CG1 3.94Å; I434-I478 HydrophobicContact CG2-CD1 4.34Å; I434-I478 HydrophobicContact CG2-CG1 4.14Å; P474-I478 VanDerWaalsContact O-CB 3.31Å; P474-I478 WeakPolarHBondContact O-CB 3.46Å; P474-I478 WeakPolarHBondContact O-CD1 3.4Å; P474-I478 WeakPolarHBondContact O-CG1 3.47Å; P474-I478 PolarHBondContact O-N 3.35Å; A475-I478 PolarHBondContact O-N 3.38Å; I478-T480 PolarHBondContact O-N 3.47Å; I478-F481 PolarHBondContact O-N 2.99Å; I478-A482 VanDerWaalsContact O-CB 3.3Å; I478-A482 WeakPolarHBondContact O-CB 3.27Å; I478-A482 PolarHBondContact O-N 3.41Å
479	G	89.6	Confident	89.9	Confident	43 Å²	43	53 Å²	53	44%	0.443	29%	0.288	S	S	.	.	H	α-helix	trans	-60.5	-46.2	179.1	0	0	0	0	0	112.3	A475 F483	A475-G479 PolarHBondContact O-N 2.93Å; G479-F483 WeakPolarHBondContact O-CB 3.46Å; G479-F483 PolarHBondContact O-N 3.21Å
480	T	87.1	Confident	89.4	Confident	13 Å²	13	56 Å²	56	8%	0.08	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-47.3	178.5	-51.3	0	0	0	0	111	F49 M253 L430 T476 C477 I478 A482 F483 S484	F49-T480 WeakPolarHBondContact CZ-OG1 3.43Å; M253-T480 HydrophobicContact CB-CG2 4.34Å; M253-T480 HydrophobicContact CG-CG2 3.98Å; L430-T480 HydrophobicContact CD1-CG2 3.67Å; L430-T480 HydrophobicContact CD2-CG2 4.49Å; T476-T480 WeakPolarHBondContact O-CB 3.44Å; T476-T480 PolarHBondContact O-N 3.33Å; T476-T480 PolarHBondContact O-OG1 3.48Å; C477-T480 PolarHBondContact O-N 3.2Å; I478-T480 PolarHBondContact O-N 3.47Å; T480-A482 PolarHBondContact O-N 3.22Å; T480-F483 PolarHBondContact O-N 3.05Å; T480-S484 PolarHBondContact O-N 2.71Å; T480-S484 PolarHBondContact O-OG 3.43Å
481	F	88.3	Confident	88.9	Confident	32 Å²	32	55.6 Å²	55.6	14%	0.14	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-45.4	178.8	-179.2	-95.5	0	0	0	112.3	M427 L430 L431 I434 C477 I478 F483 S484 L485 M515	M427-F481 HydrophobicContact CB-CE2 4.35Å; M427-F481 HydrophobicContact CE-CD2 3.45Å; M427-F481 VanDerWaalsContact CE-CD2 3.45Å; M427-F481 HydrophobicContact CE-CE2 3.47Å; M427-F481 VanDerWaalsContact CE-CE2 3.47Å; M427-F481 HydrophobicContact CE-CG 4.09Å; M427-F481 HydrophobicContact CE-CZ 4.12Å; M427-F481 WeakPolarHBondContact CE-O 3.45Å; M427-F481 HydrophobicContact SD-CD2 4.23Å; L430-F481 HydrophobicContact CB-CB 4.38Å; L430-F481 HydrophobicContact CB-CD2 4.37Å; L431-F481 HydrophobicContact CB-CD2 4.4Å; L431-F481 HydrophobicContact CB-CE2 4.03Å; L431-F481 HydrophobicContact CD1-CE1 4.48Å; L431-F481 HydrophobicContact CD1-CE2 4.44Å; L431-F481 HydrophobicContact CD1-CZ 4.22Å; I434-F481 HydrophobicContact CD1-CB 4.49Å; C477-F481 WeakPolarHBondContact O-CB 3.23Å; C477-F481 PolarHBondContact O-N 3.12Å; I478-F481 PolarHBondContact O-N 2.99Å; F481-F483 VanDerWaalsContact C-N 3.33Å; F481-F483 PolarHBondContact O-N 3.46Å; F481-S484 VanDerWaalsContact CA-OG 3.23Å; F481-S484 WeakPolarHBondContact CA-OG 3.34Å; F481-S484 PolarHBondContact O-N 3.06Å; F481-S484 PolarHBondContact O-OG 3.02Å; F481-L485 HydrophobicContact CD1-CD1 4.07Å; F481-L485 HydrophobicContact CE1-CD1 3.5Å; F481-L485 HydrophobicContact CE1-CG 4.32Å; F481-L485 HydrophobicContact CZ-CD1 3.95Å; F481-L485 HydrophobicContact CZ-CG 4.48Å; F481-L485 PolarHBondContact O-N 2.98Å; F481-M515 HydrophobicContact CE2-CE 3.76Å; F481-M515 HydrophobicContact CZ-CE 3.66Å
482	A	89.3	Confident	88.5	Confident	41 Å²	41	55.9 Å²	55.9	34%	0.339	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-44.7	175.7	0	0	0	0	0	111.2	I478 T480 S484 L485 I486	I478-A482 VanDerWaalsContact O-CB 3.3Å; I478-A482 WeakPolarHBondContact O-CB 3.27Å; I478-A482 PolarHBondContact O-N 3.41Å; T480-A482 PolarHBondContact O-N 3.22Å; A482-S484 PolarHBondContact O-N 3.11Å; A482-L485 PolarHBondContact O-N 3.21Å; A482-I486 WeakPolarHBondContact O-CD1 3.07Å; A482-I486 VanDerWaalsContact O-CG1 3.27Å; A482-I486 WeakPolarHBondContact O-CG1 3.32Å; A482-I486 PolarHBondContact O-N 3.47Å
483	F	84.9	Confident	88	Confident	45 Å²	45	51.6 Å²	51.6	20%	0.197	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-41.2	-179.4	-178	-102.7	0	0	0	112.7	P249 M253 G479 T480 F481 L485 I486 K487	P249-F483 HydrophobicContact CB-CD1 4.07Å; P249-F483 HydrophobicContact CB-CD2 4.17Å; P249-F483 HydrophobicContact CB-CE1 3.55Å; P249-F483 HydrophobicContact CB-CE2 3.62Å; P249-F483 HydrophobicContact CB-CG 4.38Å; P249-F483 HydrophobicContact CB-CZ 3.3Å; P249-F483 HydrophobicContact CG-CD2 4.48Å; P249-F483 HydrophobicContact CG-CE1 4.23Å; P249-F483 HydrophobicContact CG-CE2 3.59Å; P249-F483 HydrophobicContact CG-CZ 3.46Å; P249-F483 VanDerWaalsContact CG-CZ 3.46Å; M253-F483 HydrophobicContact CE-CD1 3.77Å; M253-F483 HydrophobicContact CE-CE1 3.7Å; M253-F483 HydrophobicContact CG-CD1 3.5Å; M253-F483 HydrophobicContact CG-CE1 3.98Å; M253-F483 HydrophobicContact SD-CD1 3.41Å; M253-F483 WeakPolarHBondContact SD-CD1 3.23Å; M253-F483 HydrophobicContact SD-CE1 3.98Å; M253-F483 HydrophobicContact SD-CG 4.43Å; G479-F483 WeakPolarHBondContact O-CB 3.46Å; G479-F483 PolarHBondContact O-N 3.21Å; T480-F483 PolarHBondContact O-N 3.05Å; F481-F483 VanDerWaalsContact C-N 3.33Å; F481-F483 PolarHBondContact O-N 3.46Å; F483-L485 VanDerWaalsContact C-N 3.28Å; F483-L485 PolarHBondContact O-N 3.22Å; F483-I486 PolarHBondContact O-N 3.47Å; F483-I486 VanDerWaalsContact O-N 3.14Å; F483-K487 HydrophobicContact CD2-CG 4.17Å; F483-K487 HydrophobicContact CE1-CB 4.17Å; F483-K487 HydrophobicContact CE1-CG 4.18Å; F483-K487 HydrophobicContact CE2-CB 4.27Å; F483-K487 HydrophobicContact CE2-CG 3.44Å; F483-K487 VanDerWaalsContact CE2-CG 3.44Å; F483-K487 HydrophobicContact CZ-CB 3.92Å; F483-K487 HydrophobicContact CZ-CG 3.44Å; F483-K487 VanDerWaalsContact CZ-CG 3.44Å; F483-K487 PolarHBondContact O-N 2.9Å
484	S	83.6	Confident	87.1	Confident	15 Å²	15	55.7 Å²	55.7	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-30	174.5	32.5	0	0	0	0	114.5	M253 M427 T480 F481 A482 Y488	M253-S484 WeakPolarHBondContact SD-CA 3.35Å; M253-S484 WeakPolarHBondContact SD-CB 3.5Å; M253-S484 PolarHBondContact SD-N 3.32Å; M253-S484 VanDerWaalsContact SD-N 3.43Å; M427-S484 WeakPolarHBondContact CE-OG 3.49Å; M427-S484 WeakPolarHBondContact SD-CB 3.26Å; M427-S484 PolarHBondContact SD-OG 3.32Å; T480-S484 PolarHBondContact O-N 2.71Å; T480-S484 PolarHBondContact O-OG 3.43Å; F481-S484 VanDerWaalsContact CA-OG 3.23Å; F481-S484 WeakPolarHBondContact CA-OG 3.34Å; F481-S484 PolarHBondContact O-N 3.06Å; F481-S484 PolarHBondContact O-OG 3.02Å; A482-S484 PolarHBondContact O-N 3.11Å; S484-Y488 WeakPolarHBondContact O-CA 3.49Å; S484-Y488 PolarHBondContact O-N 3.03Å
485	L	85.3	Confident	86.2	Confident	83 Å²	83	62.2 Å²	62.2	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-72.7	-41	172	-68.9	176.3	0	0	0	111.1	M427 F481 A482 F483 W508	M427-L485 HydrophobicContact CE-CD2 3.66Å; M427-L485 HydrophobicContact CE-CG 3.65Å; F481-L485 HydrophobicContact CD1-CD1 4.07Å; F481-L485 HydrophobicContact CE1-CD1 3.5Å; F481-L485 HydrophobicContact CE1-CG 4.32Å; F481-L485 HydrophobicContact CZ-CD1 3.95Å; F481-L485 HydrophobicContact CZ-CG 4.48Å; F481-L485 PolarHBondContact O-N 2.98Å; A482-L485 PolarHBondContact O-N 3.21Å; F483-L485 VanDerWaalsContact C-N 3.28Å; F483-L485 PolarHBondContact O-N 3.22Å; L485-W508 HydrophobicContact CD2-CH2 4.24Å
486	I	86.8	Confident	85.7	Confident	129 Å²	129	65.3 Å²	65.3	66%	0.662	36%	0.355	S	S	*	.	H	α-helix	trans	-69.2	-40.8	-178.6	-66.2	163.5	0	0	0	111.7	A482 F483	A482-I486 WeakPolarHBondContact O-CD1 3.07Å; A482-I486 VanDerWaalsContact O-CG1 3.27Å; A482-I486 WeakPolarHBondContact O-CG1 3.32Å; A482-I486 PolarHBondContact O-N 3.47Å; F483-I486 PolarHBondContact O-N 3.47Å; F483-I486 VanDerWaalsContact O-N 3.14Å
487	K	83.5	Confident	85.5	Confident	123 Å²	123	65.4 Å²	65.4	54%	0.535	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	31.7	-179.1	-68.2	-64.3	-169.5	172.2	0	112.5	F483 T489	F483-K487 HydrophobicContact CD2-CG 4.17Å; F483-K487 HydrophobicContact CE1-CB 4.17Å; F483-K487 HydrophobicContact CE1-CG 4.18Å; F483-K487 HydrophobicContact CE2-CB 4.27Å; F483-K487 HydrophobicContact CE2-CG 3.44Å; F483-K487 VanDerWaalsContact CE2-CG 3.44Å; F483-K487 HydrophobicContact CZ-CB 3.92Å; F483-K487 HydrophobicContact CZ-CG 3.44Å; F483-K487 VanDerWaalsContact CZ-CG 3.44Å; F483-K487 PolarHBondContact O-N 2.9Å; K487-T489 PolarHBondContact O-N 3.13Å
488	Y	83.9	Confident	85.6	Confident	79 Å²	79	69.4 Å²	69.4	31%	0.31	38%	0.376	S	S	.	.			trans	-56	125.4	177.2	172.3	-100	0	0	0	110.9	Y422 S484 P490 W508	Y422-Y488 HydrophobicContact CE1-CE2 4.13Å; Y422-Y488 PolarHBondContact OH-OH 3.5Å; S484-Y488 WeakPolarHBondContact O-CA 3.49Å; S484-Y488 PolarHBondContact O-N 3.03Å; Y488-P490 HydrophobicContact CE1-CB 4.39Å; Y488-W508 AromaticContact CD2-CZ2 3.86Å; Y488-W508 HydrophobicContact CD2-CZ2 3.86Å; Y488-W508 HydrophobicContact CE1-CZ2 4.46Å; Y488-W508 AromaticContact CE2-CZ2 3.62Å; Y488-W508 HydrophobicContact CE2-CZ2 3.62Å; Y488-W508 HydrophobicContact CG-CZ2 4.36Å; Y488-W508 AromaticContact CZ-CZ2 3.93Å; Y488-W508 AromaticContact CZ-NE1 3.75Å; Y488-W508 PolarHBondContact OH-NE1 3.26Å
489	T	81.7	Confident	85.7	Confident	83 Å²	83	65.3 Å²	65.3	51%	0.509	36%	0.355	S	S	.	.			trans	-112.1	130	172.6	49.7	0	0	0	0	109.2	Y421 K487	Y421-T489 PolarHBondContact OH-O 2.84Å; K487-T489 PolarHBondContact O-N 3.13Å
490	P	85.8	Confident	85.9	Confident	61 Å²	61	64.6 Å²	64.6	40%	0.396	34%	0.342	S	S	.	.			trans	-67.9	141.8	178.7	27	-32.2	0	0	0	110.4	Y488 Y504	Y488-P490 HydrophobicContact CE1-CB 4.39Å; P490-Y504 HydrophobicContact CB-CD1 4.45Å; P490-Y504 HydrophobicContact CB-CE1 3.76Å
491	L	87.1	Confident	86.2	Confident	16 Å²	16	73.6 Å²	73.6	8%	0.084	38%	0.375	C	S	.	.			trans	-58.4	137.2	176.3	177.3	65.4	0	0	0	111	Q417 L418 Y421 Y422 Y499 Y504	Q417-L491 HydrophobicContact CB-CD2 4.24Å; L418-L491 HydrophobicContact CD2-CD2 3.98Å; Y421-L491 HydrophobicContact CD1-CB 3.97Å; Y421-L491 HydrophobicContact CD1-CD1 4.35Å; Y421-L491 HydrophobicContact CD2-CD1 3.77Å; Y421-L491 HydrophobicContact CE1-CB 4.12Å; Y421-L491 HydrophobicContact CE2-CD1 4.31Å; Y421-L491 HydrophobicContact CG-CB 4.27Å; Y421-L491 HydrophobicContact CG-CD1 3.77Å; Y421-L491 HydrophobicContact CG-CD2 4.33Å; Y421-L491 HydrophobicContact CG-CG 4.33Å; Y422-L491 HydrophobicContact CE2-CB 4.12Å; Y422-L491 HydrophobicContact CE2-CD2 4.2Å; L491-Y499 HydrophobicContact CB-CD2 4.49Å; L491-Y499 HydrophobicContact CB-CE2 4.48Å; L491-Y499 HydrophobicContact CD2-CD2 4.27Å; L491-Y499 HydrophobicContact CD2-CE1 4.48Å; L491-Y499 HydrophobicContact CD2-CE2 3.67Å; L491-Y499 HydrophobicContact CG-CD2 4.15Å; L491-Y499 HydrophobicContact CG-CE2 3.67Å; L491-Y499 WeakPolarHBondContact O-CD2 3.18Å; L491-Y504 PolarHBondContact O-OH 3.31Å
492	K	87.3	Confident	86.6	Confident	106 Å²	106	75.6 Å²	75.6	46%	0.461	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.3	170.6	-64.1	-176.7	-178.1	-177.7	0	109.6	Y497	K492-Y497 WeakPolarHBondContact CA-O 3.37Å
493	Y	84.9	Confident	86.8	Confident	13 Å²	13	73.7 Å²	73.7	5%	0.051	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.2	173.1	179.4	-114.9	0	0	0	111.1	I167 M413 Y414 N495 V496 Y497	I167-Y493 HydrophobicContact CD1-CD1 4.5Å; I167-Y493 HydrophobicContact CD1-CE1 3.49Å; I167-Y493 VanDerWaalsContact CD1-CE1 3.49Å; I167-Y493 WeakPolarHBondContact CD1-OH 3.23Å; M413-Y493 HydrophobicContact CE-CE2 4.18Å; M413-Y493 HydrophobicContact CG-CE2 4.12Å; Y414-Y493 HydrophobicContact CD1-CD1 4.27Å; Y414-Y493 HydrophobicContact CD1-CG 4.29Å; Y414-Y493 AromaticContact CE1-CD1 3.51Å; Y414-Y493 HydrophobicContact CE1-CD1 3.51Å; Y414-Y493 HydrophobicContact CE1-CE1 4.23Å; Y414-Y493 AromaticContact CE1-CG 3.93Å; Y414-Y493 HydrophobicContact CE1-CG 3.93Å; Y493-N495 PolarHBondContact O-N 3.38Å; Y493-V496 PolarHBondContact O-N 3.07Å; Y493-V496 VanDerWaalsContact O-N 3.09Å; Y493-Y497 PolarHBondContact N-O 2.87Å; Y493-Y497 PolarHBondContact O-N 3.45Å
494	N	76.7	Confident	87.2	Confident	87 Å²	87	73.6 Å²	73.6	47%	0.465	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	29	-175.2	-70	-3.4	0	0	0	114.2	V496	N494-V496 WeakPolarHBondContact O-CG2 3.4Å; N494-V496 PolarHBondContact O-N 3.08Å
495	N	74.9	Confident	87.7	Confident	146 Å²	146	79 Å²	79	78%	0.781	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	0.2	-173	-62.5	-44.6	0	0	0	116.5	Y493	Y493-N495 PolarHBondContact O-N 3.38Å
496	V	83.4	Confident	88.2	Confident	128 Å²	128	78.1 Å²	78.1	78%	0.776	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-46.5	-177.4	176.9	0	0	0	0	111	Y493 N494	Y493-V496 PolarHBondContact O-N 3.07Å; Y493-V496 VanDerWaalsContact O-N 3.09Å; N494-V496 WeakPolarHBondContact O-CG2 3.4Å; N494-V496 PolarHBondContact O-N 3.08Å
497	Y	88	Confident	88.5	Confident	41 Å²	41	72 Å²	72	16%	0.161	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128.8	-175.7	177.7	-90.5	0	0	0	111.2	S169 I171 Y414 K492 Y493 Y499	S169-Y497 WeakPolarHBondContact O-CE2 3.49Å; I171-Y497 WeakPolarHBondContact CG2-OH 3.42Å; I171-Y497 PolarHBondContact N-OH 2.83Å; I171-Y497 VanDerWaalsContact N-OH 3.11Å; Y414-Y497 AromaticContact CD1-CD1 3.74Å; Y414-Y497 HydrophobicContact CD1-CD1 3.74Å; Y414-Y497 AromaticContact CD1-CE1 3.66Å; Y414-Y497 HydrophobicContact CD1-CE1 3.66Å; Y414-Y497 HydrophobicContact CD1-CG 4.44Å; Y414-Y497 AromaticContact CE1-CD1 3.45Å; Y414-Y497 HydrophobicContact CE1-CD1 3.45Å; Y414-Y497 VanDerWaalsContact CE1-CD1 3.45Å; Y414-Y497 HydrophobicContact CE1-CD2 4.15Å; Y414-Y497 AromaticContact CE1-CE1 3.69Å; Y414-Y497 HydrophobicContact CE1-CE1 3.69Å; Y414-Y497 HydrophobicContact CE1-CE2 4.37Å; Y414-Y497 AromaticContact CE1-CG 3.7Å; Y414-Y497 HydrophobicContact CE1-CG 3.7Å; Y414-Y497 HydrophobicContact CG-CE1 4.41Å; K492-Y497 WeakPolarHBondContact CA-O 3.37Å; Y493-Y497 PolarHBondContact N-O 2.87Å; Y493-Y497 PolarHBondContact O-N 3.45Å; Y497-Y499 HydrophobicContact CD1-CD2 4.23Å; Y497-Y499 HydrophobicContact CD1-CE2 4.2Å; Y497-Y499 HydrophobicContact CE1-CD1 4.15Å; Y497-Y499 HydrophobicContact CE1-CD2 4.16Å; Y497-Y499 HydrophobicContact CE1-CE1 4.33Å; Y497-Y499 HydrophobicContact CE1-CE2 4.31Å; Y497-Y499 HydrophobicContact CE1-CG 4.06Å
498	V	93	Very high	88.9	Confident	83 Å²	83	70.1 Å²	70.1	50%	0.503	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.9	178.1	-178.5	0	0	0	0	108.1	Y504	V498-Y504 WeakPolarHBondContact CG1-OH 3.5Å
499	Y	93.8	Very high	89.5	Confident	5 Å²	5	71.2 Å²	71.2	2%	0.02	35%	0.35	C	S	.	.			trans	-67.5	146.4	179.7	-73.2	-102.2	0	0	0	111	I171 Y414 Q417 L418 L491 Y497 Y504	I171-Y499 HydrophobicContact CD1-CD1 4.46Å; I171-Y499 HydrophobicContact CD1-CE1 4.37Å; Y414-Y499 WeakPolarHBondContact CA-OH 3.48Å; Y414-Y499 HydrophobicContact CD1-CE1 4.39Å; Y414-Y499 PolarHBondContact O-OH 3.26Å; Q417-Y499 WeakPolarHBondContact CB-OH 3.35Å; Q417-Y499 PolarHBondContact OE1-OH 3.24Å; Q417-Y499 VanDerWaalsContact OE1-OH 3.05Å; L418-Y499 HydrophobicContact CD1-CD1 4.31Å; L418-Y499 HydrophobicContact CD1-CE1 4.15Å; L418-Y499 HydrophobicContact CD2-CD1 4.05Å; L418-Y499 HydrophobicContact CD2-CE1 4.02Å; L418-Y499 HydrophobicContact CG-CD1 4.21Å; L418-Y499 HydrophobicContact CG-CE1 3.8Å; L491-Y499 HydrophobicContact CB-CD2 4.49Å; L491-Y499 HydrophobicContact CB-CE2 4.48Å; L491-Y499 HydrophobicContact CD2-CD2 4.27Å; L491-Y499 HydrophobicContact CD2-CE1 4.48Å; L491-Y499 HydrophobicContact CD2-CE2 3.67Å; L491-Y499 HydrophobicContact CG-CD2 4.15Å; L491-Y499 HydrophobicContact CG-CE2 3.67Å; L491-Y499 WeakPolarHBondContact O-CD2 3.18Å; Y497-Y499 HydrophobicContact CD1-CD2 4.23Å; Y497-Y499 HydrophobicContact CD1-CE2 4.2Å; Y497-Y499 HydrophobicContact CE1-CD1 4.15Å; Y497-Y499 HydrophobicContact CE1-CD2 4.16Å; Y497-Y499 HydrophobicContact CE1-CE1 4.33Å; Y497-Y499 HydrophobicContact CE1-CE2 4.31Å; Y497-Y499 HydrophobicContact CE1-CG 4.06Å; Y499-Y504 HydrophobicContact CG-CE1 4.48Å; Y499-Y504 PolarHBondContact N-OH 3.27Å; Y499-Y504 WeakPolarHBondContact O-CE2 3.41Å; Y499-Y504 PolarHBondContact O-OH 3.05Å
500	P	94.6	Very high	90.1	Very high	28 Å²	28	68.3 Å²	68.3	18%	0.182	33%	0.331	C	S	.	.			trans	-65.6	159.7	170.7	29.1	-34.9	0	0	0	110.7	I171 W502 G503 Y504	I171-P500 HydrophobicContact CG2-CG 3.76Å; P500-W502 HydrophobicContact CB-CG 4.35Å; P500-W502 HydrophobicContact CG-CD2 3.99Å; P500-W502 HydrophobicContact CG-CG 4.26Å; P500-W502 HydrophobicContact CG-CZ2 3.77Å; P500-W502 VanDerWaalsContact CG-NE1 3.29Å; P500-W502 PolarHBondContact O-N 2.82Å; P500-W502 VanDerWaalsContact O-N 3.14Å; P500-G503 WeakPolarHBondContact O-CA 3.36Å; P500-G503 PolarHBondContact O-N 3.45Å; P500-Y504 PolarHBondContact O-N 3.04Å
501	W	94.4	Very high	90.4	Very high	202 Å²	202	65.6 Å²	65.6	77%	0.765	31%	0.314	S	S	*	.	H	α-helix	trans	-54.9	-37.2	-176.9	72	-91.8	0	0	0	112.9	G503 Y504 F505	W501-G503 VanDerWaalsContact C-N 3.3Å; W501-G503 PolarHBondContact O-N 3.34Å; W501-Y504 PolarHBondContact O-N 3.25Å; W501-F505 PolarHBondContact O-N 3.2Å
502	W	94.9	Very high	90.7	Very high	74 Å²	74	68.4 Å²	68.4	28%	0.28	33%	0.328	S	S	.	.	H	α-helix	trans	-69.4	-29.2	178.8	66.3	-105.4	0	0	0	111.8	I171 D172 P500 F505 I506	I171-W502 HydrophobicContact CB-CH2 4.24Å; I171-W502 HydrophobicContact CD1-CH2 3.84Å; I171-W502 HydrophobicContact CD1-CZ3 4.04Å; I171-W502 HydrophobicContact CG1-CH2 3.81Å; I171-W502 HydrophobicContact CG1-CZ3 4.48Å; I171-W502 HydrophobicContact CG2-CH2 3.58Å; I171-W502 HydrophobicContact CG2-CZ2 3.6Å; I171-W502 HydrophobicContact CG2-CZ3 4.49Å; D172-W502 WeakPolarHBondContact OD1-CZ2 3.47Å; D172-W502 PolarHBondContact OD1-NE1 3.4Å; P500-W502 HydrophobicContact CB-CG 4.35Å; P500-W502 HydrophobicContact CG-CD2 3.99Å; P500-W502 HydrophobicContact CG-CG 4.26Å; P500-W502 HydrophobicContact CG-CZ2 3.77Å; P500-W502 VanDerWaalsContact CG-NE1 3.29Å; P500-W502 PolarHBondContact O-N 2.82Å; P500-W502 VanDerWaalsContact O-N 3.14Å; W502-F505 WeakPolarHBondContact O-CB 3.37Å; W502-F505 PolarHBondContact O-N 3.02Å; W502-I506 HydrophobicContact CE3-CD1 3.55Å; W502-I506 HydrophobicContact CE3-CG1 4.44Å; W502-I506 HydrophobicContact CZ3-CD1 3.63Å; W502-I506 WeakPolarHBondContact O-CG1 3.46Å; W502-I506 PolarHBondContact O-N 3.16Å
503	G	94.4	Very high	91.1	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-44.1	174.4	0	0	0	0	0	111.4	P500 W501 F505 I506 G507	P500-G503 WeakPolarHBondContact O-CA 3.36Å; P500-G503 PolarHBondContact O-N 3.45Å; W501-G503 VanDerWaalsContact C-N 3.3Å; W501-G503 PolarHBondContact O-N 3.34Å; G503-F505 VanDerWaalsContact C-N 3.32Å; G503-F505 PolarHBondContact O-N 2.93Å; G503-I506 PolarHBondContact O-N 3.15Å; G503-G507 PolarHBondContact O-N 3.42Å
504	Y	93.1	Very high	91.6	Very high	43 Å²	43	65 Å²	65	17%	0.169	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-37.8	172.1	-60.6	-55.4	0	0	0	112.3	P490 L491 V498 Y499 P500 W501 G507 W508	P490-Y504 HydrophobicContact CB-CD1 4.45Å; P490-Y504 HydrophobicContact CB-CE1 3.76Å; L491-Y504 PolarHBondContact O-OH 3.31Å; V498-Y504 WeakPolarHBondContact CG1-OH 3.5Å; Y499-Y504 HydrophobicContact CG-CE1 4.48Å; Y499-Y504 PolarHBondContact N-OH 3.27Å; Y499-Y504 WeakPolarHBondContact O-CE2 3.41Å; Y499-Y504 PolarHBondContact O-OH 3.05Å; P500-Y504 PolarHBondContact O-N 3.04Å; W501-Y504 PolarHBondContact O-N 3.25Å; Y504-G507 PolarHBondContact O-N 3.46Å; Y504-W508 PolarHBondContact O-N 3.43Å
505	F	94.8	Very high	92.4	Very high	129 Å²	129	62 Å²	62	57%	0.566	30%	0.303	S	S	*	.	H	α-helix	trans	-61.1	-44.9	175.3	176.4	-102.1	0	0	0	111.7	W501 W502 G503 W508 L509	W501-F505 PolarHBondContact O-N 3.2Å; W502-F505 WeakPolarHBondContact O-CB 3.37Å; W502-F505 PolarHBondContact O-N 3.02Å; G503-F505 VanDerWaalsContact C-N 3.32Å; G503-F505 PolarHBondContact O-N 2.93Å; F505-W508 PolarHBondContact O-N 3Å; F505-L509 WeakPolarHBondContact O-CB 3.17Å; F505-L509 PolarHBondContact O-N 2.87Å
506	I	94.8	Very high	93.4	Very high	64 Å²	64	57.7 Å²	57.7	33%	0.328	28%	0.282	S	S	.	.	H	α-helix	trans	-61.9	-43.7	173.4	-68.7	174.2	0	0	0	110.8	W502 G503 W508 L509 L510	W502-I506 HydrophobicContact CE3-CD1 3.55Å; W502-I506 HydrophobicContact CE3-CG1 4.44Å; W502-I506 HydrophobicContact CZ3-CD1 3.63Å; W502-I506 WeakPolarHBondContact O-CG1 3.46Å; W502-I506 PolarHBondContact O-N 3.16Å; G503-I506 PolarHBondContact O-N 3.15Å; I506-W508 PolarHBondContact O-N 2.89Å; I506-L509 WeakPolarHBondContact O-CB 3.34Å; I506-L509 PolarHBondContact O-N 2.04Å; I506-L509 VanDerWaalsContact O-N 3.15Å; I506-L510 HydrophobicContact CG2-CD1 4.25Å; I506-L510 HydrophobicContact CG2-CG 4.42Å; I506-L510 WeakPolarHBondContact O-CG 3.33Å; I506-L510 PolarHBondContact O-N 3.37Å
507	G	93.2	Very high	94	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-54.6	-50.3	175.2	0	0	0	0	0	112.3	Y422 G503 Y504 L509 L510 A511	Y422-G507 WeakPolarHBondContact CB-O 3.49Å; Y422-G507 VanDerWaalsContact CD2-CA 3.46Å; G503-G507 PolarHBondContact O-N 3.42Å; Y504-G507 PolarHBondContact O-N 3.46Å; G507-L509 VanDerWaalsContact C-N 3.33Å; G507-L509 PolarHBondContact O-N 3.01Å; G507-L510 WeakPolarHBondContact O-CB 3.29Å; G507-L510 PolarHBondContact O-N 3.2Å; G507-A511 PolarHBondContact O-N 3.41Å
508	W	93.1	Very high	94.3	Very high	84 Å²	84	51 Å²	51	32%	0.318	25%	0.246	S	C	.	.	H	α-helix	trans	-64.8	-35.4	176	-82.9	107	0	0	0	113.3	L485 Y488 Y504 F505 I506 L510 A511 L512	L485-W508 HydrophobicContact CD2-CH2 4.24Å; Y488-W508 AromaticContact CD2-CZ2 3.86Å; Y488-W508 HydrophobicContact CD2-CZ2 3.86Å; Y488-W508 HydrophobicContact CE1-CZ2 4.46Å; Y488-W508 AromaticContact CE2-CZ2 3.62Å; Y488-W508 HydrophobicContact CE2-CZ2 3.62Å; Y488-W508 HydrophobicContact CG-CZ2 4.36Å; Y488-W508 AromaticContact CZ-CZ2 3.93Å; Y488-W508 AromaticContact CZ-NE1 3.75Å; Y488-W508 PolarHBondContact OH-NE1 3.26Å; Y504-W508 PolarHBondContact O-N 3.43Å; F505-W508 PolarHBondContact O-N 3Å; I506-W508 PolarHBondContact O-N 2.89Å; W508-L510 VanDerWaalsContact C-N 3.33Å; W508-A511 HydrophobicContact CE3-CB 4.5Å; W508-A511 PolarHBondContact O-N 3.3Å; W508-L512 VanDerWaalsContact O-CB 3.29Å; W508-L512 WeakPolarHBondContact O-CB 3.45Å; W508-L512 VanDerWaalsContact O-CG 3.23Å; W508-L512 WeakPolarHBondContact O-CG 3.39Å; W508-L512 PolarHBondContact O-N 2.65Å
509	L	95.2	Very high	94.4	Very high	103 Å²	103	50 Å²	50	54%	0.539	24%	0.242	S	C	.	.	H	α-helix	trans	-62.1	-42	173.6	-174.6	67.3	0	0	0	111.3	F505 I506 G507 L512 S513	F505-L509 WeakPolarHBondContact O-CB 3.17Å; F505-L509 PolarHBondContact O-N 2.87Å; I506-L509 WeakPolarHBondContact O-CB 3.34Å; I506-L509 PolarHBondContact O-N 2.04Å; I506-L509 VanDerWaalsContact O-N 3.15Å; G507-L509 VanDerWaalsContact C-N 3.33Å; G507-L509 PolarHBondContact O-N 3.01Å; L509-L512 PolarHBondContact O-N 3.24Å; L509-S513 WeakPolarHBondContact O-CB 3.21Å; L509-S513 PolarHBondContact O-N 2.75Å
510	L	94.6	Very high	94.5	Very high	22 Å²	22	55.2 Å²	55.2	12%	0.115	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-47.7	174.9	-69.5	169.8	0	0	0	111.1	L96 F419 A423 I506 G507 W508 S513	L96-L510 HydrophobicContact CD1-CD2 4.37Å; L96-L510 HydrophobicContact CD2-CD2 4.02Å; F419-L510 HydrophobicContact CD2-CD1 3.96Å; F419-L510 HydrophobicContact CE1-CD2 4.18Å; F419-L510 HydrophobicContact CE2-CD1 4.04Å; F419-L510 HydrophobicContact CE2-CD2 4.34Å; F419-L510 HydrophobicContact CG-CD1 4.34Å; F419-L510 HydrophobicContact CZ-CD1 4.47Å; F419-L510 HydrophobicContact CZ-CD2 3.99Å; A423-L510 HydrophobicContact CB-CB 4.06Å; A423-L510 HydrophobicContact CB-CD1 4.48Å; I506-L510 HydrophobicContact CG2-CD1 4.25Å; I506-L510 HydrophobicContact CG2-CG 4.42Å; I506-L510 WeakPolarHBondContact O-CG 3.33Å; I506-L510 PolarHBondContact O-N 3.37Å; G507-L510 WeakPolarHBondContact O-CB 3.29Å; G507-L510 PolarHBondContact O-N 3.2Å; W508-L510 VanDerWaalsContact C-N 3.33Å; L510-S513 PolarHBondContact O-N 3.22Å; L510-S513 PolarHBondContact O-OG 3.08Å
511	A	92.6	Very high	94.6	Very high	3 Å²	3	56.3 Å²	56.3	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-49.5	177.7	0	0	0	0	0	111.9	G507 W508 S513 S514 M515	G507-A511 PolarHBondContact O-N 3.41Å; W508-A511 HydrophobicContact CE3-CB 4.5Å; W508-A511 PolarHBondContact O-N 3.3Å; A511-S513 VanDerWaalsContact C-N 3.26Å; A511-S513 PolarHBondContact O-N 3.14Å; A511-S514 PolarHBondContact O-OG 2.89Å; A511-M515 WeakPolarHBondContact O-CG 3.37Å
512	L	94.1	Very high	94.6	Very high	75 Å²	75	48.3 Å²	48.3	39%	0.393	24%	0.242	S	C	.	.	H	α-helix	trans	-67.2	-26.5	-177.9	-70.2	172.1	0	0	0	113	W508 L509 S514 M515 V516	W508-L512 VanDerWaalsContact O-CB 3.29Å; W508-L512 WeakPolarHBondContact O-CB 3.45Å; W508-L512 VanDerWaalsContact O-CG 3.23Å; W508-L512 WeakPolarHBondContact O-CG 3.39Å; W508-L512 PolarHBondContact O-N 2.65Å; L509-L512 PolarHBondContact O-N 3.24Å; L512-S514 PolarHBondContact O-N 3.41Å; L512-S514 VanDerWaalsContact O-N 3.16Å; L512-M515 PolarHBondContact O-N 3.09Å; L512-V516 HydrophobicContact CB-CG2 4.17Å; L512-V516 HydrophobicContact CD2-CG2 4.24Å; L512-V516 VanDerWaalsContact O-CB 3.27Å; L512-V516 WeakPolarHBondContact O-CB 2.9Å; L512-V516 VanDerWaalsContact O-CG2 3.27Å; L512-V516 WeakPolarHBondContact O-CG2 3.21Å; L512-V516 PolarHBondContact O-N 2.94Å
513	S	95.1	Very high	94.6	Very high	47 Å²	47	49.4 Å²	49.4	33%	0.329	26%	0.256	S	S	.	.	H	α-helix	trans	-55.2	-34.6	-179	72.3	0	0	0	0	113.2	V92 L509 L510 A511 C517	V92-S513 WeakPolarHBondContact CG1-OG 3.35Å; L509-S513 WeakPolarHBondContact O-CB 3.21Å; L509-S513 PolarHBondContact O-N 2.75Å; L510-S513 PolarHBondContact O-N 3.22Å; L510-S513 PolarHBondContact O-OG 3.08Å; A511-S513 VanDerWaalsContact C-N 3.26Å; A511-S513 PolarHBondContact O-N 3.14Å; S513-C517 PolarHBondContact O-SG 2.84Å
514	S	94.6	Very high	94.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-90.5	-42.8	176.4	64.3	0	0	0	0	112.5	I93 M432 A511 L512 V516 C517	I93-S514 VanDerWaalsContact CG1-CB 3.44Å; M432-S514 VanDerWaalsContact CE-O 3.32Å; M432-S514 WeakPolarHBondContact CE-O 3.28Å; A511-S514 PolarHBondContact O-OG 2.89Å; L512-S514 PolarHBondContact O-N 3.41Å; L512-S514 VanDerWaalsContact O-N 3.16Å; S514-V516 VanDerWaalsContact C-N 3.3Å; S514-V516 PolarHBondContact O-N 2.82Å; S514-C517 WeakPolarHBondContact O-CB 3.37Å; S514-C517 PolarHBondContact O-N 3.43Å
515	M	93.7	Very high	94.8	Very high	24 Å²	24	55.6 Å²	55.6	12%	0.118	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-36.7	-175.4	-64.5	171.7	70.2	0	0	112.4	C428 L431 F481 A511 L512 C517 P519	C428-M515 HydrophobicContact CB-CG 4.47Å; L431-M515 HydrophobicContact CB-CE 4.5Å; L431-M515 HydrophobicContact CD2-CB 3.72Å; L431-M515 HydrophobicContact CD2-CE 3.55Å; L431-M515 HydrophobicContact CD2-CG 3.81Å; F481-M515 HydrophobicContact CE2-CE 3.76Å; F481-M515 HydrophobicContact CZ-CE 3.66Å; A511-M515 WeakPolarHBondContact O-CG 3.37Å; L512-M515 PolarHBondContact O-N 3.09Å; M515-C517 VanDerWaalsContact C-N 3.32Å; M515-C517 PolarHBondContact O-N 3Å; M515-P519 WeakPolarHBondContact O-CD 3.21Å
516	V	95.2	Very high	94.7	Very high	56 Å²	56	51.6 Å²	51.6	34%	0.339	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-17.5	-175.8	174.1	0	0	0	0	112.2	L512 S514 I518 P519 L520	L512-V516 HydrophobicContact CB-CG2 4.17Å; L512-V516 HydrophobicContact CD2-CG2 4.24Å; L512-V516 VanDerWaalsContact O-CB 3.27Å; L512-V516 WeakPolarHBondContact O-CB 2.9Å; L512-V516 VanDerWaalsContact O-CG2 3.27Å; L512-V516 WeakPolarHBondContact O-CG2 3.21Å; L512-V516 PolarHBondContact O-N 2.94Å; S514-V516 VanDerWaalsContact C-N 3.3Å; S514-V516 PolarHBondContact O-N 2.82Å; V516-I518 PolarHBondContact O-N 3.14Å; V516-P519 VanDerWaalsContact O-CD 3.25Å; V516-P519 WeakPolarHBondContact O-CD 3.09Å; V516-P519 WeakPolarHBondContact O-CG 3.04Å; V516-L520 HydrophobicContact CG1-CD1 3.42Å; V516-L520 VanDerWaalsContact CG1-CD1 3.42Å; V516-L520 HydrophobicContact CG1-CD2 4.37Å; V516-L520 HydrophobicContact CG1-CG 3.49Å; V516-L520 VanDerWaalsContact CG1-CG 3.49Å; V516-L520 WeakPolarHBondContact O-CB 3.28Å; V516-L520 WeakPolarHBondContact O-CG 3.38Å; V516-L520 PolarHBondContact O-N 3.22Å; V516-L520 VanDerWaalsContact O-N 3.07Å
517	C	96	Very high	94.7	Very high	27 Å²	27	52.1 Å²	52.1	18%	0.182	28%	0.275	C	S	.	.	H	α-helix	trans	-56	-38	176.6	-67.3	0	0	0	0	112.7	S513 S514 M515 W521	S513-C517 PolarHBondContact O-SG 2.84Å; S514-C517 WeakPolarHBondContact O-CB 3.37Å; S514-C517 PolarHBondContact O-N 3.43Å; M515-C517 VanDerWaalsContact C-N 3.32Å; M515-C517 PolarHBondContact O-N 3Å; C517-W521 WeakPolarHBondContact O-CB 3.49Å; C517-W521 PolarHBondContact O-N 3.21Å
518	I	95.1	Very high	94.7	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-61.6	-178.5	-54.7	169.7	0	0	0	111.3	L86 M432 F435 V516 L520 W521 M522	L86-I518 HydrophobicContact CD2-CD1 3.71Å; L86-I518 HydrophobicContact CD2-CG1 4.2Å; L86-I518 HydrophobicContact CG-CD1 4.49Å; M432-I518 HydrophobicContact CE-CD1 4.21Å; M432-I518 HydrophobicContact SD-CD1 3.77Å; M432-I518 HydrophobicContact SD-CG1 4.41Å; F435-I518 HydrophobicContact CB-CD1 4.04Å; F435-I518 HydrophobicContact CD1-CG2 4.12Å; F435-I518 HydrophobicContact CD2-CD1 3.36Å; F435-I518 HydrophobicContact CD2-CG2 4.26Å; F435-I518 HydrophobicContact CE1-CG2 4.21Å; F435-I518 HydrophobicContact CE2-CD1 3.95Å; F435-I518 HydrophobicContact CE2-CG2 4.33Å; F435-I518 HydrophobicContact CG-CD1 3.86Å; F435-I518 HydrophobicContact CG-CG2 4.13Å; F435-I518 HydrophobicContact CZ-CG2 4.31Å; V516-I518 PolarHBondContact O-N 3.14Å; I518-L520 PolarHBondContact O-N 3.43Å; I518-W521 PolarHBondContact O-N 3.34Å; I518-M522 HydrophobicContact CG2-CE 3.73Å; I518-M522 HydrophobicContact CG2-SD 4.3Å; I518-M522 WeakPolarHBondContact O-CG 3.05Å; I518-M522 PolarHBondContact O-N 3.4Å
519	P	95.6	Very high	94.7	Very high	64 Å²	64	53.2 Å²	53.2	42%	0.416	29%	0.291	S	S	.	.	H	α-helix	trans	-64.4	-37.7	-178.3	25.2	-35.3	0	0	0	112.6	M515 V516 W521 M522 V523	M515-P519 WeakPolarHBondContact O-CD 3.21Å; V516-P519 VanDerWaalsContact O-CD 3.25Å; V516-P519 WeakPolarHBondContact O-CD 3.09Å; V516-P519 WeakPolarHBondContact O-CG 3.04Å; P519-W521 VanDerWaalsContact C-N 3.33Å; P519-W521 PolarHBondContact O-N 3.08Å; P519-M522 PolarHBondContact O-N 3.25Å; P519-V523 WeakPolarHBondContact O-CG2 3.3Å; P519-V523 PolarHBondContact O-N 3.42Å
520	L	95.7	Very high	94.4	Very high	113 Å²	113	56.4 Å²	56.4	59%	0.592	30%	0.303	S	S	*	.	H	α-helix	trans	-62.1	-42.1	176.6	-74.6	-176.5	0	0	0	111.8	V516 I518 V523 Y524	V516-L520 HydrophobicContact CG1-CD1 3.42Å; V516-L520 VanDerWaalsContact CG1-CD1 3.42Å; V516-L520 HydrophobicContact CG1-CD2 4.37Å; V516-L520 HydrophobicContact CG1-CG 3.49Å; V516-L520 VanDerWaalsContact CG1-CG 3.49Å; V516-L520 WeakPolarHBondContact O-CB 3.28Å; V516-L520 WeakPolarHBondContact O-CG 3.38Å; V516-L520 PolarHBondContact O-N 3.22Å; V516-L520 VanDerWaalsContact O-N 3.07Å; I518-L520 PolarHBondContact O-N 3.43Å; L520-V523 PolarHBondContact O-N 2.94Å; L520-Y524 VanDerWaalsContact O-CB 3.31Å; L520-Y524 WeakPolarHBondContact O-CB 3.27Å; L520-Y524 PolarHBondContact O-N 3.36Å
521	W	96.1	Very high	94.3	Very high	51 Å²	51	57.1 Å²	57.1	19%	0.193	32%	0.316	C	S	.	.	H	α-helix	trans	-66.7	-41.2	178.3	-165.2	-95.5	0	0	0	112.1	E84 G85 Y88 C517 I518 P519 V523 Y524 K525	E84-W521 HydrophobicContact CG-CZ2 4.02Å; E84-W521 WeakPolarHBondContact OE1-CZ2 3.42Å; E84-W521 VanDerWaalsContact OE2-CZ2 3.27Å; E84-W521 WeakPolarHBondContact OE2-CZ2 3.36Å; E84-W521 PolarHBondContact OE2-NE1 3.39Å; G85-W521 VanDerWaalsContact N-CD1 3.34Å; Y88-W521 HydrophobicContact CD2-CD2 4.14Å; Y88-W521 AromaticContact CD2-CE3 3.93Å; Y88-W521 HydrophobicContact CD2-CE3 3.93Å; Y88-W521 HydrophobicContact CD2-CH2 4.35Å; Y88-W521 HydrophobicContact CD2-CZ3 4.04Å; Y88-W521 AromaticContact CE2-CD2 3.99Å; Y88-W521 HydrophobicContact CE2-CD2 3.99Å; Y88-W521 AromaticContact CE2-CE2 3.89Å; Y88-W521 AromaticContact CE2-CE3 3.78Å; Y88-W521 HydrophobicContact CE2-CE3 3.78Å; Y88-W521 AromaticContact CE2-CH2 3.4Å; Y88-W521 HydrophobicContact CE2-CH2 3.4Å; Y88-W521 AromaticContact CE2-CZ2 3.61Å; Y88-W521 HydrophobicContact CE2-CZ2 3.61Å; Y88-W521 AromaticContact CE2-CZ3 3.49Å; Y88-W521 HydrophobicContact CE2-CZ3 3.49Å; Y88-W521 VanDerWaalsContact CE2-CZ3 3.49Å; Y88-W521 AromaticContact CZ-CH2 3.75Å; Y88-W521 AromaticContact CZ-CZ3 3.97Å; C517-W521 WeakPolarHBondContact O-CB 3.49Å; C517-W521 PolarHBondContact O-N 3.21Å; I518-W521 PolarHBondContact O-N 3.34Å; P519-W521 VanDerWaalsContact C-N 3.33Å; P519-W521 PolarHBondContact O-N 3.08Å; W521-V523 VanDerWaalsContact C-N 3.34Å; W521-V523 PolarHBondContact O-N 2.96Å; W521-Y524 HydrophobicContact CE3-CD1 4.38Å; W521-Y524 HydrophobicContact CH2-CE1 4.43Å; W521-Y524 HydrophobicContact CZ3-CD1 4.38Å; W521-Y524 PolarHBondContact O-N 3.2Å; W521-K525 VanDerWaalsContact CE2-CE 3.46Å; W521-K525 VanDerWaalsContact NE1-CE 3.3Å; W521-K525 PolarHBondContact O-N 3.24Å
522	M	95.2	Very high	94.3	Very high	35 Å²	35	60.6 Å²	60.6	17%	0.172	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-47.5	174.9	-72	180	176.2	0	0	111.2	L82 F83 F435 I518 P519 K525 L526	L82-M522 HydrophobicContact CD1-CB 4.17Å; L82-M522 HydrophobicContact CD1-CG 4.04Å; L82-M522 HydrophobicContact CG-CG 4.17Å; L82-M522 WeakPolarHBondContact O-CG 3.34Å; F83-M522 HydrophobicContact CD1-CE 3.53Å; F83-M522 HydrophobicContact CD2-CE 4.34Å; F83-M522 HydrophobicContact CE1-CE 3.34Å; F83-M522 HydrophobicContact CE2-CE 4.15Å; F83-M522 HydrophobicContact CG-CE 4.05Å; F83-M522 HydrophobicContact CZ-CE 3.67Å; F435-M522 HydrophobicContact CD1-CE 4.49Å; F435-M522 HydrophobicContact CE1-CE 4.49Å; I518-M522 HydrophobicContact CG2-CE 3.73Å; I518-M522 HydrophobicContact CG2-SD 4.3Å; I518-M522 WeakPolarHBondContact O-CG 3.05Å; I518-M522 PolarHBondContact O-N 3.4Å; P519-M522 PolarHBondContact O-N 3.25Å; M522-K525 PolarHBondContact O-N 3.04Å; M522-L526 VanDerWaalsContact O-CB 3.31Å; M522-L526 WeakPolarHBondContact O-CB 3.35Å; M522-L526 WeakPolarHBondContact O-CD1 3.48Å; M522-L526 WeakPolarHBondContact O-CG 3.23Å; M522-L526 PolarHBondContact O-N 2.91Å
523	V	95.6	Very high	94.2	Very high	96 Å²	96	62.5 Å²	62.5	58%	0.582	35%	0.347	S	S	*	.	H	α-helix	trans	-63.8	-44.1	177.4	172.7	0	0	0	0	111.3	P519 L520 W521 L526 S527	P519-V523 WeakPolarHBondContact O-CG2 3.3Å; P519-V523 PolarHBondContact O-N 3.42Å; L520-V523 PolarHBondContact O-N 2.94Å; W521-V523 VanDerWaalsContact C-N 3.34Å; W521-V523 PolarHBondContact O-N 2.96Å; V523-L526 PolarHBondContact O-N 3.25Å; V523-S527 WeakPolarHBondContact O-CB 3.37Å; V523-S527 PolarHBondContact O-N 2.82Å; V523-S527 PolarHBondContact O-OG 2.91Å
524	Y	95.9	Very high	94	Very high	125 Å²	125	68.1 Å²	68.1	49%	0.49	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-47.3	177.4	173	-106.8	0	0	0	112.6	L520 W521 S527 T528	L520-Y524 VanDerWaalsContact O-CB 3.31Å; L520-Y524 WeakPolarHBondContact O-CB 3.27Å; L520-Y524 PolarHBondContact O-N 3.36Å; W521-Y524 HydrophobicContact CE3-CD1 4.38Å; W521-Y524 HydrophobicContact CH2-CE1 4.43Å; W521-Y524 HydrophobicContact CZ3-CD1 4.38Å; W521-Y524 PolarHBondContact O-N 3.2Å; Y524-S527 WeakPolarHBondContact CA-OG 3.45Å; Y524-S527 PolarHBondContact O-N 3.35Å; Y524-S527 PolarHBondContact O-OG 3.11Å; Y524-T528 HydrophobicContact CD2-CG2 4.04Å; Y524-T528 HydrophobicContact CE2-CG2 3.68Å; Y524-T528 WeakPolarHBondContact O-CB 3.48Å; Y524-T528 WeakPolarHBondContact O-CG2 3.24Å; Y524-T528 PolarHBondContact O-N 3.47Å; Y524-T528 VanDerWaalsContact O-N 3.09Å; Y524-T528 PolarHBondContact O-OG1 3.35Å
525	K	93.9	Very high	93.9	Very high	49 Å²	49	73.2 Å²	73.2	21%	0.213	39%	0.39	C	S	.	.	H	α-helix	trans	-68.4	-40.1	178.5	-73.2	-68.2	-172.2	173.5	0	112.5	E84 W521 M522 S527 T528 T529 L540	E84-K525 WeakPolarHBondContact OE2-CE 3.41Å; E84-K525 IonicContact OE2-NZ 2.72Å; E84-K525 PolarHBondContact OE2-NZ 3.06Å; W521-K525 VanDerWaalsContact CE2-CE 3.46Å; W521-K525 VanDerWaalsContact NE1-CE 3.3Å; W521-K525 PolarHBondContact O-N 3.24Å; M522-K525 PolarHBondContact O-N 3.04Å; K525-S527 VanDerWaalsContact C-N 3.31Å; K525-S527 PolarHBondContact O-N 3.4Å; K525-T528 PolarHBondContact O-N 3.46Å; K525-T528 PolarHBondContact O-OG1 3.21Å; K525-T529 WeakPolarHBondContact O-CB 3.36Å; K525-T529 PolarHBondContact O-N 3.39Å; K525-T529 VanDerWaalsContact O-N 3.07Å; K525-T529 PolarHBondContact O-OG1 3.36Å; K525-L540 HydrophobicContact CB-CD1 3.9Å; K525-L540 HydrophobicContact CB-CD2 4.05Å; K525-L540 HydrophobicContact CD-CD2 4.39Å
526	L	93.9	Very high	93.8	Very high	45 Å²	45	75 Å²	75	24%	0.236	40%	0.395	C	S	.	.	H	α-helix	trans	-66.6	-32.7	177.4	-73.8	170.3	0	0	0	112.5	L82 M522 V523 L533 R536 I537 L540	L82-L526 HydrophobicContact CD1-CD1 4.34Å; L82-L526 HydrophobicContact CD1-CD2 4.38Å; L82-L526 HydrophobicContact CD1-CG 4.1Å; M522-L526 VanDerWaalsContact O-CB 3.31Å; M522-L526 WeakPolarHBondContact O-CB 3.35Å; M522-L526 WeakPolarHBondContact O-CD1 3.48Å; M522-L526 WeakPolarHBondContact O-CG 3.23Å; M522-L526 PolarHBondContact O-N 2.91Å; V523-L526 PolarHBondContact O-N 3.25Å; L526-L533 HydrophobicContact CD2-CD1 4.41Å; L526-R536 HydrophobicContact CD2-CB 4.43Å; L526-R536 VanDerWaalsContact O-CD 3.27Å; L526-R536 WeakPolarHBondContact O-CD 3.43Å; L526-R536 PolarHBondContact O-NH1 3.28Å; L526-I537 HydrophobicContact CD2-CG1 3.73Å; L526-L540 HydrophobicContact CD2-CD1 3.91Å; L526-L540 HydrophobicContact CG-CD1 4.32Å
527	S	93.6	Very high	93.7	Very high	75 Å²	75	75.7 Å²	75.7	52%	0.524	40%	0.396	S	S	.	.	H	α-helix	trans	-78.9	-31.2	178.2	52.4	0	0	0	0	113.5	V523 Y524 K525	V523-S527 WeakPolarHBondContact O-CB 3.37Å; V523-S527 PolarHBondContact O-N 2.82Å; V523-S527 PolarHBondContact O-OG 2.91Å; Y524-S527 WeakPolarHBondContact CA-OG 3.45Å; Y524-S527 PolarHBondContact O-N 3.35Å; Y524-S527 PolarHBondContact O-OG 3.11Å; K525-S527 VanDerWaalsContact C-N 3.31Å; K525-S527 PolarHBondContact O-N 3.4Å
528	T	93.4	Very high	93.6	Very high	71 Å²	71	80.4 Å²	80.4	44%	0.436	42%	0.415	S	S	.	.	H	α-helix	trans	-90.9	-24.7	-176.2	51.2	0	0	0	0	114.5	Y524 K525	Y524-T528 HydrophobicContact CD2-CG2 4.04Å; Y524-T528 HydrophobicContact CE2-CG2 3.68Å; Y524-T528 WeakPolarHBondContact O-CB 3.48Å; Y524-T528 WeakPolarHBondContact O-CG2 3.24Å; Y524-T528 PolarHBondContact O-N 3.47Å; Y524-T528 VanDerWaalsContact O-N 3.09Å; Y524-T528 PolarHBondContact O-OG1 3.35Å; K525-T528 PolarHBondContact O-N 3.46Å; K525-T528 PolarHBondContact O-OG1 3.21Å
529	T	92.8	Very high	93.4	Very high	36 Å²	36	83 Å²	83	22%	0.221	44%	0.437	C	S	.	.	S	Bend	trans	-72.7	133.1	179.3	-52.9	0	0	0	0	110.3	K525 R536	K525-T529 WeakPolarHBondContact O-CB 3.36Å; K525-T529 PolarHBondContact O-N 3.39Å; K525-T529 VanDerWaalsContact O-N 3.07Å; K525-T529 PolarHBondContact O-OG1 3.36Å; T529-R536 HydrophobicContact CG2-CB 4.36Å; T529-R536 HydrophobicContact CG2-CG 4.07Å; T529-R536 VanDerWaalsContact O-CD 3.23Å; T529-R536 WeakPolarHBondContact O-CD 3.42Å; T529-R536 PolarHBondContact O-NE 3.14Å; T529-R536 PolarHBondContact O-NH1 3.1Å
530	Q	90.3	Very high	93.3	Very high	169 Å²	169	80.4 Å²	80.4	79%	0.79	42%	0.419	S	S	*	.			trans	-73.6	156.7	178.5	-66.3	-72.6	-14.7	0	0	111.5
531	G	92.2	Very high	93.2	Very high	37 Å²	37	77 Å²	77	38%	0.381	40%	0.403	S	S	.	.	S	Bend	trans	105.3	-172.2	178	0	0	0	0	0	114.2	R536	G531-R536 VanDerWaalsContact O-CZ 3.27Å; G531-R536 PolarHBondContact O-NE 3.31Å; G531-R536 PolarHBondContact O-NH2 2.84Å
532	T	93.4	Very high	93.1	Very high	77 Å²	77	78 Å²	78	47%	0.472	42%	0.415	S	S	.	.			trans	-75.9	161.1	175.3	63.3	0	0	0	0	111.5	K534 E535 R536	T532-K534 PolarHBondContact O-N 3.08Å; T532-E535 WeakPolarHBondContact CB-OE2 3.42Å; T532-E535 PolarHBondContact N-OE2 3.19Å; T532-E535 PolarHBondContact O-N 3.15Å; T532-E535 VanDerWaalsContact O-N 3.15Å; T532-E535 VanDerWaalsContact OG1-CG 3.28Å; T532-E535 WeakPolarHBondContact OG1-CG 3.43Å; T532-E535 PolarHBondContact OG1-N 3.01Å; T532-E535 PolarHBondContact OG1-OE2 3.21Å; T532-R536 VanDerWaalsContact O-CG 3.23Å; T532-R536 WeakPolarHBondContact O-CG 3.26Å; T532-R536 PolarHBondContact O-N 3.08Å
533	L	90.2	Very high	92.9	Very high	115 Å²	115	77.7 Å²	77.7	60%	0.602	42%	0.416	S	S	*	.	H	α-helix	trans	-54.7	-39.1	179.8	-176	66.3	0	0	0	112.5	L526 I537	L526-L533 HydrophobicContact CD2-CD1 4.41Å; L533-I537 HydrophobicContact CD1-CD1 4.17Å; L533-I537 HydrophobicContact CD1-CG1 4.49Å; L533-I537 HydrophobicContact CG-CD1 3.96Å; L533-I537 VanDerWaalsContact O-CG1 3.28Å; L533-I537 WeakPolarHBondContact O-CG1 3.43Å; L533-I537 PolarHBondContact O-N 3.13Å
534	K	91.4	Very high	92.7	Very high	164 Å²	164	75.6 Å²	75.6	71%	0.713	41%	0.405	S	S	*	.	H	α-helix	trans	-66.2	-46.8	178.6	-172.8	179.5	177.6	-176.4	0	111.8	T532 R536 I537 Q538	T532-K534 PolarHBondContact O-N 3.08Å; K534-R536 VanDerWaalsContact C-N 3.35Å; K534-I537 PolarHBondContact O-N 3.25Å; K534-Q538 WeakPolarHBondContact O-CB 3.31Å; K534-Q538 PolarHBondContact O-N 3.49Å
535	E	92.1	Very high	92.2	Very high	108 Å²	108	76.3 Å²	76.3	51%	0.505	42%	0.418	S	S	.	.	H	α-helix	trans	-63.3	-41.6	177.2	-70.4	162.7	160.7	0	0	111.4	T532 Q538 A539	T532-E535 WeakPolarHBondContact CB-OE2 3.42Å; T532-E535 PolarHBondContact N-OE2 3.19Å; T532-E535 PolarHBondContact O-N 3.15Å; T532-E535 VanDerWaalsContact O-N 3.15Å; T532-E535 VanDerWaalsContact OG1-CG 3.28Å; T532-E535 WeakPolarHBondContact OG1-CG 3.43Å; T532-E535 PolarHBondContact OG1-N 3.01Å; T532-E535 PolarHBondContact OG1-OE2 3.21Å; E535-Q538 PolarHBondContact O-N 3.32Å; E535-A539 WeakPolarHBondContact O-CB 3.46Å; E535-A539 PolarHBondContact O-N 2.76Å
536	R	93.3	Very high	91.8	Very high	61 Å²	61	78.4 Å²	78.4	23%	0.23	43%	0.431	C	S	.	.	H	α-helix	trans	-60.1	-49.2	176.4	-67.7	175.9	-162	-152.3	-5.4	111.5	L526 T529 G531 T532 K534 A539 L540	L526-R536 HydrophobicContact CD2-CB 4.43Å; L526-R536 VanDerWaalsContact O-CD 3.27Å; L526-R536 WeakPolarHBondContact O-CD 3.43Å; L526-R536 PolarHBondContact O-NH1 3.28Å; T529-R536 HydrophobicContact CG2-CB 4.36Å; T529-R536 HydrophobicContact CG2-CG 4.07Å; T529-R536 VanDerWaalsContact O-CD 3.23Å; T529-R536 WeakPolarHBondContact O-CD 3.42Å; T529-R536 PolarHBondContact O-NE 3.14Å; T529-R536 PolarHBondContact O-NH1 3.1Å; G531-R536 VanDerWaalsContact O-CZ 3.27Å; G531-R536 PolarHBondContact O-NE 3.31Å; G531-R536 PolarHBondContact O-NH2 2.84Å; T532-R536 VanDerWaalsContact O-CG 3.23Å; T532-R536 WeakPolarHBondContact O-CG 3.26Å; T532-R536 PolarHBondContact O-N 3.08Å; K534-R536 VanDerWaalsContact C-N 3.35Å; R536-A539 PolarHBondContact O-N 3.45Å; R536-L540 WeakPolarHBondContact O-CB 3.34Å; R536-L540 WeakPolarHBondContact O-CD1 3.45Å; R536-L540 WeakPolarHBondContact O-CG 3.48Å; R536-L540 PolarHBondContact O-N 3.06Å
537	I	93.1	Very high	91.5	Very high	71 Å²	71	76.9 Å²	76.9	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-45.9	178.4	-69.6	168.3	0	0	0	110.1	L526 L533 K534 A539 L540 V541	L526-I537 HydrophobicContact CD2-CG1 3.73Å; L533-I537 HydrophobicContact CD1-CD1 4.17Å; L533-I537 HydrophobicContact CD1-CG1 4.49Å; L533-I537 HydrophobicContact CG-CD1 3.96Å; L533-I537 VanDerWaalsContact O-CG1 3.28Å; L533-I537 WeakPolarHBondContact O-CG1 3.43Å; L533-I537 PolarHBondContact O-N 3.13Å; K534-I537 PolarHBondContact O-N 3.25Å; I537-A539 PolarHBondContact O-N 3.33Å; I537-L540 PolarHBondContact O-N 3.04Å; I537-V541 HydrophobicContact CG2-CG2 4.21Å; I537-V541 WeakPolarHBondContact O-CB 3.2Å; I537-V541 WeakPolarHBondContact O-CG2 3.16Å; I537-V541 PolarHBondContact O-N 3.18Å
538	Q	92.6	Very high	91	Very high	125 Å²	125	75.6 Å²	75.6	58%	0.584	41%	0.413	S	S	*	.	H	α-helix	trans	-60.7	-44.3	-180	-172.2	170.5	-3.9	0	0	111.6	K534 E535 L540 V541 T542	K534-Q538 WeakPolarHBondContact O-CB 3.31Å; K534-Q538 PolarHBondContact O-N 3.49Å; E535-Q538 PolarHBondContact O-N 3.32Å; Q538-L540 PolarHBondContact O-N 2.91Å; Q538-V541 PolarHBondContact O-N 3.11Å; Q538-T542 WeakPolarHBondContact O-CB 3.35Å; Q538-T542 PolarHBondContact O-N 3.12Å; Q538-T542 VanDerWaalsContact O-N 3.11Å; Q538-T542 PolarHBondContact O-OG1 2.99Å
539	A	92.1	Very high	90.3	Very high	55 Å²	55	76.5 Å²	76.5	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-63.3	-41.1	176.2	0	0	0	0	0	112.7	E535 R536 I537 T542	E535-A539 WeakPolarHBondContact O-CB 3.46Å; E535-A539 PolarHBondContact O-N 2.76Å; R536-A539 PolarHBondContact O-N 3.45Å; I537-A539 PolarHBondContact O-N 3.33Å; A539-T542 PolarHBondContact O-N 3.36Å
540	L	93.3	Very high	89.7	Confident	10 Å²	10	75 Å²	75	5%	0.052	40%	0.402	C	S	.	.	H	α-helix	trans	-79.8	-16.4	-177.1	-65.1	169.4	0	0	0	114	S80 P81 L82 K525 L526 R536 I537 Q538	S80-L540 CarbonylContact C-O 3.33Å; S80-L540 PolarHBondContact OG-O 3.15Å; P81-L540 HydrophobicContact CB-CD2 3.87Å; P81-L540 WeakPolarHBondContact CD-O 3.44Å; L82-L540 HydrophobicContact CB-CB 3.88Å; L82-L540 WeakPolarHBondContact CB-O 3.5Å; L82-L540 HydrophobicContact CD1-CB 4.45Å; L82-L540 HydrophobicContact CD1-CD1 4.19Å; L82-L540 PolarHBondContact N-O 2.98Å; K525-L540 HydrophobicContact CB-CD1 3.9Å; K525-L540 HydrophobicContact CB-CD2 4.05Å; K525-L540 HydrophobicContact CD-CD2 4.39Å; L526-L540 HydrophobicContact CD2-CD1 3.91Å; L526-L540 HydrophobicContact CG-CD1 4.32Å; R536-L540 WeakPolarHBondContact O-CB 3.34Å; R536-L540 WeakPolarHBondContact O-CD1 3.45Å; R536-L540 WeakPolarHBondContact O-CG 3.48Å; R536-L540 PolarHBondContact O-N 3.06Å; I537-L540 PolarHBondContact O-N 3.04Å; Q538-L540 PolarHBondContact O-N 2.91Å
541	V	93.4	Very high	88.8	Confident	41 Å²	41	73.7 Å²	73.7	25%	0.248	39%	0.394	C	S	.	.	H	α-helix	trans	-91.7	-18.7	173.1	166.3	0	0	0	0	111.7	L82 V443 I537 Q538	L82-V541 HydrophobicContact CD2-CG2 4.03Å; V443-V541 HydrophobicContact CG1-CB 4.11Å; V443-V541 HydrophobicContact CG1-CG1 3.46Å; V443-V541 VanDerWaalsContact CG1-CG1 3.46Å; V443-V541 HydrophobicContact CG1-CG2 3.81Å; I537-V541 HydrophobicContact CG2-CG2 4.21Å; I537-V541 WeakPolarHBondContact O-CB 3.2Å; I537-V541 WeakPolarHBondContact O-CG2 3.16Å; I537-V541 PolarHBondContact O-N 3.18Å; Q538-V541 PolarHBondContact O-N 3.11Å
542	T	92.5	Very high	87.8	Confident	74 Å²	74	77.4 Å²	77.4	45%	0.454	40%	0.396	S	S	.	.	S	Bend	trans	-74.3	128.3	179.6	-59	0	0	0	0	110.3	Q538 A539	Q538-T542 WeakPolarHBondContact O-CB 3.35Å; Q538-T542 PolarHBondContact O-N 3.12Å; Q538-T542 VanDerWaalsContact O-N 3.11Å; Q538-T542 PolarHBondContact O-OG1 2.99Å; A539-T542 PolarHBondContact O-N 3.36Å
543	P	92.7	Very high	86.9	Confident	27 Å²	27	76.4 Å²	76.4	18%	0.175	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-69.1	158.4	176.8	28.9	-35	0	0	0	111.8	K78 I79 Y444 L547	K78-P543 CarbonylContact O-C 3.24Å; K78-P543 WeakPolarHBondContact O-CA 3.35Å; I79-P543 WeakPolarHBondContact O-CA 3.47Å; I79-P543 WeakPolarHBondContact O-CB 3.27Å; Y444-P543 HydrophobicContact CD2-CB 4.14Å; Y444-P543 HydrophobicContact CD2-CG 4.34Å; Y444-P543 HydrophobicContact CE2-CB 3.69Å; Y444-P543 HydrophobicContact CE2-CG 3.92Å; P543-L547 HydrophobicContact CB-CD1 3.99Å
544	S	90.7	Very high	86.1	Confident	52 Å²	52	75.6 Å²	75.6	36%	0.364	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-68.7	140.9	179.9	-165.5	0	0	0	0	112.4	K78 D546 L547	K78-S544 PolarHBondContact O-N 3.47Å; S544-D546 WeakPolarHBondContact CB-OD1 3.26Å; S544-D546 PolarHBondContact O-N 2.98Å; S544-D546 PolarHBondContact OG-OD1 3.1Å; S544-D546 VanDerWaalsContact OG-OD1 3.07Å; S544-L547 PolarHBondContact O-N 2.93Å
545	D	85.7	Confident	85.3	Confident	140 Å²	140	73.9 Å²	73.9	75%	0.749	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-16.6	178.4	-64.6	-45.5	0	0	0	114	L547	D545-L547 VanDerWaalsContact C-N 3.31Å
546	D	85.6	Confident	84.4	Confident	94 Å²	94	77.3 Å²	77.3	50%	0.503	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.3	-178.2	81.2	-15.5	0	0	0	113.9	K78 S544	K78-D546 WeakPolarHBondContact CD-OD1 3.39Å; K78-D546 WeakPolarHBondContact CE-OD2 3.15Å; K78-D546 IonicContact NZ-OD1 3.2Å; K78-D546 PolarHBondContact NZ-OD1 3.09Å; K78-D546 VanDerWaalsContact NZ-OD1 3.08Å; K78-D546 IonicContact NZ-OD2 2.8Å; K78-D546 PolarHBondContact NZ-OD2 2.98Å; S544-D546 WeakPolarHBondContact CB-OD1 3.26Å; S544-D546 PolarHBondContact O-N 2.98Å; S544-D546 PolarHBondContact OG-OD1 3.1Å; S544-D546 VanDerWaalsContact OG-OD1 3.07Å
547	L	87.9	Confident	83.6	Confident	13 Å²	13	77.5 Å²	77.5	7%	0.068	39%	0.387	C	S	.	.	S	Bend	trans	-69.5	150.3	173.2	-75.3	172.5	0	0	0	111.1	Y67 T68 K78 I79 P543 S544 D545 K549	Y67-L547 HydrophobicContact CE1-CD1 4.32Å; Y67-L547 HydrophobicContact CE1-CD2 4.1Å; T68-L547 HydrophobicContact CG2-CD2 3.92Å; K78-L547 HydrophobicContact CB-CD1 4.36Å; K78-L547 HydrophobicContact CB-CD2 3.96Å; K78-L547 HydrophobicContact CB-CG 4.22Å; K78-L547 HydrophobicContact CD-CD2 3.95Å; I79-L547 HydrophobicContact CD1-CD1 4.18Å; P543-L547 HydrophobicContact CB-CD1 3.99Å; S544-L547 PolarHBondContact O-N 2.93Å; D545-L547 VanDerWaalsContact C-N 3.31Å; L547-K549 PolarHBondContact O-N 3.05Å; L547-K549 VanDerWaalsContact O-N 3.08Å
548	P	82	Confident	82.6	Confident	48 Å²	48	79.9 Å²	79.9	31%	0.312	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-57.6	116.9	175.3	-23	34.3	0	0	0	110.7	Y67 Y279	Y67-P548 HydrophobicContact CE2-CB 4.15Å; Y67-P548 HydrophobicContact CE2-CG 4.34Å; Y67-P548 PolarHBondContact OH-O 3.46Å; Y67-P548 VanDerWaalsContact OH-O 3.11Å; Y279-P548 HydrophobicContact CE2-CB 3.89Å; Y279-P548 HydrophobicContact CE2-CG 4Å
549	K	79.3	Confident	81.7	Confident	89 Å²	89	77 Å²	77	39%	0.387	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-79.3	130.7	175.3	-62.1	-175.4	-179.2	-178.4	0	109.3	L547 E553 Q554 L557	L547-K549 PolarHBondContact O-N 3.05Å; L547-K549 VanDerWaalsContact O-N 3.08Å; K549-E553 HydrophobicContact CB-CB 4.45Å; K549-Q554 HydrophobicContact CB-CG 4.03Å; K549-Q554 PolarHBondContact O-NE2 3.11Å; K549-L557 HydrophobicContact CD-CD1 3.77Å
550	T	78.9	Confident	80.7	Confident	6 Å²	6	80.4 Å²	80.4	4%	0.037	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-62.1	156.2	177.7	60.5	0	0	0	0	111.2	N452 D455 R552 E553 Q554	N452-T550 VanDerWaalsContact OD1-CG2 3.3Å; N452-T550 WeakPolarHBondContact OD1-CG2 3.26Å; D455-T550 HydrophobicContact CB-CG2 3.96Å; T550-R552 PolarHBondContact O-N 3.4Å; T550-E553 PolarHBondContact N-OE2 3.45Å; T550-E553 PolarHBondContact O-N 2.94Å; T550-E553 WeakPolarHBondContact OG1-CB 3.25Å; T550-E553 VanDerWaalsContact OG1-CG 3.31Å; T550-E553 WeakPolarHBondContact OG1-CG 3.35Å; T550-E553 PolarHBondContact OG1-N 3.49Å; T550-Q554 WeakPolarHBondContact O-CG 3.35Å; T550-Q554 PolarHBondContact O-N 2.62Å
551	K	72.3	Confident	79.3	Confident	141 Å²	141	87.8 Å²	87.8	61%	0.613	44%	0.439	S	S	*	.	H	α-helix	trans	-54.2	-40.7	175	-71.9	179	-177.2	178.2	0	112.7	D455 E553 Q554 E555	D455-K551 PolarHBondContact OD1-N 3.23Å; K551-E553 VanDerWaalsContact C-N 3.34Å; K551-E553 PolarHBondContact O-N 2.99Å; K551-Q554 PolarHBondContact O-N 2.86Å; K551-E555 WeakPolarHBondContact O-CB 3.38Å; K551-E555 VanDerWaalsContact O-CG 3.3Å; K551-E555 WeakPolarHBondContact O-CG 3.33Å; K551-E555 PolarHBondContact O-N 3.48Å
552	R	70.7	Confident	77.2	Confident	114 Å²	114	90.7 Å²	90.7	43%	0.43	46%	0.457	S	S	.	.	H	α-helix	trans	-61.5	-39.6	176	-72	-176.5	178.3	141.5	11.4	112.5	D451 E454 T550 R556	D451-R552 IonicContact OD1-NH1 3.95Å; E454-R552 IonicContact OE1-CZ 2.61Å; E454-R552 IonicContact OE1-NH1 2.83Å; E454-R552 IonicContact OE1-NH2 3.38Å; E454-R552 PolarHBondContact OE1-NH2 3.19Å; E454-R552 IonicContact OE2-CZ 3.2Å; E454-R552 IonicContact OE2-NH1 3.63Å; E454-R552 PolarHBondContact OE2-NH1 2.99Å; E454-R552 IonicContact OE2-NH2 2.67Å; T550-R552 PolarHBondContact O-N 3.4Å; R552-R556 WeakPolarHBondContact O-CB 3.31Å; R552-R556 WeakPolarHBondContact O-CG 3.34Å; R552-R556 PolarHBondContact O-N 3.49Å
553	E	74.1	Confident	74.9	Confident	56 Å²	56	92.2 Å²	92.2	26%	0.262	47%	0.468	S	S	.	.	H	α-helix	trans	-70.9	-38.7	175.9	-76.4	176.8	158	0	0	111.9	K549 T550 K551 R556 L557	K549-E553 HydrophobicContact CB-CB 4.45Å; T550-E553 PolarHBondContact N-OE2 3.45Å; T550-E553 PolarHBondContact O-N 2.94Å; T550-E553 WeakPolarHBondContact OG1-CB 3.25Å; T550-E553 VanDerWaalsContact OG1-CG 3.31Å; T550-E553 WeakPolarHBondContact OG1-CG 3.35Å; T550-E553 PolarHBondContact OG1-N 3.49Å; K551-E553 VanDerWaalsContact C-N 3.34Å; K551-E553 PolarHBondContact O-N 2.99Å; E553-R556 PolarHBondContact O-N 3.28Å; E553-L557 WeakPolarHBondContact O-CB 3.41Å; E553-L557 VanDerWaalsContact O-CG 3.26Å; E553-L557 WeakPolarHBondContact O-CG 3.49Å; E553-L557 PolarHBondContact O-N 2.96Å
554	Q	74.6	Confident	72.6	Confident	99 Å²	99	100.2 Å²	100.2	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-44.7	173.8	-67.7	178.2	4.6	0	0	111.3	K549 T550 K551 L557 L558	K549-Q554 HydrophobicContact CB-CG 4.03Å; K549-Q554 PolarHBondContact O-NE2 3.11Å; T550-Q554 WeakPolarHBondContact O-CG 3.35Å; T550-Q554 PolarHBondContact O-N 2.62Å; K551-Q554 PolarHBondContact O-N 2.86Å; Q554-L557 PolarHBondContact O-N 3.31Å; Q554-L558 WeakPolarHBondContact O-CB 3.05Å; Q554-L558 VanDerWaalsContact O-CG 3.28Å; Q554-L558 WeakPolarHBondContact O-CG 3.29Å; Q554-L558 PolarHBondContact O-N 3Å
555	E	73.5	Confident	70.1	Confident	127 Å²	127	105 Å²	105	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-61.7	-43.5	175.1	-74.6	168.9	-174.6	0	0	111.9	K551 L558 A559	K551-E555 WeakPolarHBondContact O-CB 3.38Å; K551-E555 VanDerWaalsContact O-CG 3.3Å; K551-E555 WeakPolarHBondContact O-CG 3.33Å; K551-E555 PolarHBondContact O-N 3.48Å; E555-L558 PolarHBondContact O-N 3.28Å; E555-A559 WeakPolarHBondContact O-CB 3.4Å; E555-A559 PolarHBondContact O-N 2.81Å
556	R	74.3	Confident	68.1	Low	180 Å²	180	105.6 Å²	105.6	68%	0.679	53%	0.527	S	S	*	.	H	α-helix	trans	-63	-42.5	174.4	-78	-179.2	-172.7	172.5	4.3	112.5	R552 E553 A559 I560	R552-R556 WeakPolarHBondContact O-CB 3.31Å; R552-R556 WeakPolarHBondContact O-CG 3.34Å; R552-R556 PolarHBondContact O-N 3.49Å; E553-R556 PolarHBondContact O-N 3.28Å; R556-A559 PolarHBondContact O-N 3.3Å; R556-I560 WeakPolarHBondContact O-CG1 3.3Å; R556-I560 PolarHBondContact O-N 3.03Å
557	L	75.3	Confident	65.7	Low	66 Å²	66	106.4 Å²	106.4	35%	0.346	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-44.4	177.2	-74.2	169.3	0	0	0	110.8	K549 E553 Q554 A559 I560 F561	K549-L557 HydrophobicContact CD-CD1 3.77Å; E553-L557 WeakPolarHBondContact O-CB 3.41Å; E553-L557 VanDerWaalsContact O-CG 3.26Å; E553-L557 WeakPolarHBondContact O-CG 3.49Å; E553-L557 PolarHBondContact O-N 2.96Å; Q554-L557 PolarHBondContact O-N 3.31Å; L557-A559 VanDerWaalsContact C-N 3.32Å; L557-A559 PolarHBondContact O-N 3.27Å; L557-I560 WeakPolarHBondContact O-CB 3.45Å; L557-I560 PolarHBondContact O-N 2.9Å; L557-F561 WeakPolarHBondContact O-CD2 3.43Å; L557-F561 PolarHBondContact O-N 2.83Å
558	L	73.6	Confident	63.2	Low	120 Å²	120	111.7 Å²	111.7	63%	0.628	57%	0.573	S	S	*	*	H	α-helix	trans	-62.1	-39.2	175.5	-73.5	166.6	0	0	0	111.9	Q554 E555 I560 F561 V562	Q554-L558 WeakPolarHBondContact O-CB 3.05Å; Q554-L558 VanDerWaalsContact O-CG 3.28Å; Q554-L558 WeakPolarHBondContact O-CG 3.29Å; Q554-L558 PolarHBondContact O-N 3Å; E555-L558 PolarHBondContact O-N 3.28Å; L558-I560 VanDerWaalsContact C-N 3.27Å; L558-I560 PolarHBondContact O-N 3.01Å; L558-F561 PolarHBondContact O-N 3.16Å; L558-V562 PolarHBondContact O-N 3.31Å
559	A	72.6	Confident	60.8	Low	65 Å²	65	113.4 Å²	113.4	54%	0.537	59%	0.592	S	S	.	*	H	α-helix	trans	-64.2	-28.2	176.2	0	0	0	0	0	113.6	E555 R556 L557 F561	E555-A559 WeakPolarHBondContact O-CB 3.4Å; E555-A559 PolarHBondContact O-N 2.81Å; R556-A559 PolarHBondContact O-N 3.3Å; L557-A559 VanDerWaalsContact C-N 3.32Å; L557-A559 PolarHBondContact O-N 3.27Å; A559-F561 VanDerWaalsContact C-N 3.3Å
560	I	72.4	Confident	58.5	Low	127 Å²	127	115 Å²	115	65%	0.651	61%	0.61	S	S	*	*	H	α-helix	trans	-71.7	-26.3	173.8	-66.5	162.8	0	0	0	111.5	R556 L557 L558	R556-I560 WeakPolarHBondContact O-CG1 3.3Å; R556-I560 PolarHBondContact O-N 3.03Å; L557-I560 WeakPolarHBondContact O-CB 3.45Å; L557-I560 PolarHBondContact O-N 2.9Å; L558-I560 VanDerWaalsContact C-N 3.27Å; L558-I560 PolarHBondContact O-N 3.01Å
561	F	62.8	Low	56.1	Low	164 Å²	164	120.2 Å²	120.2	72%	0.719	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	2.9	-178.4	-68.7	-68.6	0	0	0	114.3	L557 L558 A559 P563	L557-F561 WeakPolarHBondContact O-CD2 3.43Å; L557-F561 PolarHBondContact O-N 2.83Å; L558-F561 PolarHBondContact O-N 3.16Å; A559-F561 VanDerWaalsContact C-N 3.3Å; F561-P563 VanDerWaalsContact O-CD 3.31Å; F561-P563 WeakPolarHBondContact O-CD 3.46Å
562	V	49.7	Very low	54.1	Low	103 Å²	103	121 Å²	121	62%	0.624	65%	0.652	S	S	*	*	S	Bend	trans	-73.2	115.4	166.7	-177.7	0	0	0	0	106.6	L558 E564	L558-V562 PolarHBondContact O-N 3.31Å; V562-E564 PolarHBondContact O-N 2.74Å
563	P	45.1	Very low	52.3	Low	105 Å²	105	119 Å²	119	68%	0.682	67%	0.668	S	S	*	*			trans	-58.3	135.9	170.6	-11.9	26.5	0	0	0	107.3	F561 D565	F561-P563 VanDerWaalsContact O-CD 3.31Å; F561-P563 WeakPolarHBondContact O-CD 3.46Å; P563-D565 PolarHBondContact O-N 3.09Å
564	E	43.1	Very low	50.1	Low	195 Å²	195	126.8 Å²	126.8	91%	0.911	70%	0.696	S	S	*	*			trans	-58	96.3	162.2	-78.4	-178.4	153.7	0	0	106.6	V562 D566	V562-E564 PolarHBondContact O-N 2.74Å; E564-D566 PolarHBondContact O-N 3.07Å; E564-D566 VanDerWaalsContact O-N 3.13Å
565	D	39.1	Very low	48.3	Very low	153 Å²	153	132 Å²	132	82%	0.818	72%	0.718	S	S	*	*			trans	-67.1	114.2	169.4	-129.3	0.6	0	0	0	105.6	P563 S567	P563-D565 PolarHBondContact O-N 3.09Å; D565-S567 VanDerWaalsContact C-N 3.3Å; D565-S567 PolarHBondContact O-N 3.14Å
566	D	42.8	Very low	46.5	Very low	152 Å²	152	131.2 Å²	131.2	81%	0.813	72%	0.724	S	S	*	*			trans	-64.8	89.1	179.9	-148.4	0.1	0	0	0	107.9	E564	E564-D566 PolarHBondContact O-N 3.07Å; E564-D566 VanDerWaalsContact O-N 3.13Å
567	S	35.8	Very low	44.6	Very low	111 Å²	111	129.3 Å²	129.3	78%	0.776	73%	0.731	S	S	*	*			trans	-122	68.9	174.1	79.7	0	0	0	0	110.8	D565	D565-S567 VanDerWaalsContact C-N 3.3Å; D565-S567 PolarHBondContact O-N 3.14Å
568	T	34.6	Very low	42.5	Very low	124 Å²	124	131.3 Å²	131.3	76%	0.761	75%	0.751	S	S	*	*			trans	-83.8	129.4	146	42.6	0	0	0	0	109.2
569	A	33	Very low	40.6	Very low	85 Å²	85	132.3 Å²	132.3	70%	0.702	75%	0.753	S	S	*	*			trans	77.8	104.5	161	0	0	0	0	0	118.1
570	T	30.2	Very low	38.7	Very low	123 Å²	123	138.7 Å²	138.7	76%	0.755	76%	0.763	S	S	*	*				163.2	142.4	86.9	39.5	0	0	0	0	113.4
571	T	29.4	Very low	36.8	Very low	114 Å²	114	140 Å²	140	70%	0.699	77%	0.771	S	S	*	*			trans	69.4	114.7	143.9	45.4	0	0	0	0	122.2
572	N	30.1	Very low	35.5	Very low	157 Å²	157	137 Å²	137	84%	0.84	77%	0.77	S	S	*	*				51.7	111	126.3	-64.9	-14.3	0	0	0	119.8
573	G	32.6	Very low	35.1	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	78%	0.78	S	S	*	*			trans	8.4	123.6	148.5	0	0	0	0	0	120.4
574	Y	28.7	Very low	34.7	Very low	218 Å²	218	145.4 Å²	145.4	86%	0.855	81%	0.81	S	S	*	*				-167.4	122.4	129.5	-133.8	-100.3	0	0	0	109
575	F	36.5	Very low	34.3	Very low	209 Å²	209	142.9 Å²	142.9	92%	0.917	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-97.6	123.4	158.6	-85.2	-83.3	0	0	0	107.2
576	P	33.9	Very low	34	Very low	111 Å²	111	142.4 Å²	142.4	72%	0.721	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-101.3	126.3	157.9	27.2	-13.1	0	0	0	110.3
577	V	36.1	Very low	33.5	Very low	139 Å²	139	141.8 Å²	141.8	84%	0.842	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.9	135.4	159.6	174.3	0	0	0	0	107.9
578	S	29.9	Very low	33.4	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	81%	0.805	S	S	*	*			trans	-167.3	111.5	140.1	66.7	0	0	0	0	108.3
579	E	33.4	Very low	33.3	Very low	141 Å²	141	144.9 Å²	144.9	66%	0.659	81%	0.808	S	S	*	*				59.3	119	89.3	-105.4	-160.3	139.6	0	0	116
580	R	33.6	Very low	33.4	Very low	199 Å²	199	148.9 Å²	148.9	75%	0.751	82%	0.815	S	S	*	*			trans	67.3	121.7	150.9	-60	-178.9	-166.2	-166.2	3.1	119.1
581	D	32.7	Very low	33.6	Very low	154 Å²	154	150.7 Å²	150.7	82%	0.824	82%	0.819	S	S	*	*				-165.3	122	97.4	-92.9	-23.9	0	0	0	113
582	S	36.1	Very low	33.9	Very low	100 Å²	100	153.5 Å²	153.5	70%	0.699	83%	0.828	S	S	*	*			trans	-74.1	131	153.8	43.7	0	0	0	0	109.6
583	T	41.3	Very low	34.2	Very low	136 Å²	136	153.3 Å²	153.3	83%	0.834	83%	0.828	S	S	*	*			trans	165.6	111.4	131.8	33	0	0	0	0	111.5
584	L	35.9	Very low	34.4	Very low	249 Å²	249	160.5 Å²	160.5	100%	1.304	83%	0.833	S	S	*	*				-169.9	0	110.5	-103.8	161.2	0	0	0	110.2

Retrieved 584 of 584 residues in 346.3 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).