A0A2K5U2T0_MACFA Loading...

Elongation of very long chain fatty acids protein 2

Catalyzes the first and rate-limiting reaction of the four reactions that constitute the long-chain fatty acids elongation cycle. This endoplasmic reticulum-bound enzymatic process allows the addition of 2 carbons to the chain of long- and very long-chain fatty acids (VLCFAs) per cycle. Acts specifically toward polyunsaturated acyl-CoA with the higher activity toward C20:4(n-6) acyl-CoA. Condensing enzyme that catalyzes the synthesis of polyunsaturated very long chain fatty acid (C20- and C22-PUFA). May participate to the production of polyunsaturated VLCFAs of different chain lengths that are involved in multiple biological processes as precursors of membrane lipids and lipid mediators.

AlphaFold DB , UniProt , Accession A0A2K5U2T0, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene ELOVL2, Length 296 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	63.2	Low	80.3	Confident	203 Å²	203	111.4 Å²	111.4	100%	1	55%	0.55	S	S	*	*				0	-44.2	0	-154.7	173.7	-73.7	0	0	110.4	H3 L4 K5	M1-H3 PolarHBondContact O-N 3.17Å; M1-L4 PolarHBondContact O-N 3.18Å; M1-K5 PolarHBondContact O-N 3.38Å; M1-K5 VanDerWaalsContact O-N 3.12Å
2	E	76.6	Confident	80.2	Confident	166 Å²	166	103.5 Å²	103.5	78%	0.776	51%	0.512	S	S	*	.	H	α-helix	trans	-59.7	-43.8	176	-64.4	-176.4	157.3	0	0	114.4	L4 K5 A6	E2-L4 VanDerWaalsContact C-N 3.32Å; E2-L4 PolarHBondContact O-N 3.42Å; E2-K5 PolarHBondContact O-N 2.86Å; E2-A6 WeakPolarHBondContact O-CB 3.14Å; E2-A6 PolarHBondContact O-N 3.48Å
3	H	81	Confident	80.1	Confident	170 Å²	170	100 Å²	100	79%	0.787	51%	0.509	S	S	*	.	H	α-helix	trans	-61.6	-36.9	176.3	-68.9	-65.7	0	0	0	113.8	M1 K5 F7	M1-H3 PolarHBondContact O-N 3.17Å; H3-K5 VanDerWaalsContact C-N 3.35Å; H3-F7 VanDerWaalsContact O-CB 3.31Å; H3-F7 WeakPolarHBondContact O-CB 3.33Å; H3-F7 PolarHBondContact O-N 3.13Å
4	L	80.4	Confident	80.1	Confident	96 Å²	96	102 Å²	102	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-68.1	-38.6	176.4	-88.6	158	0	0	0	111	M1 E2 D8 F40	M1-L4 PolarHBondContact O-N 3.18Å; E2-L4 VanDerWaalsContact C-N 3.32Å; E2-L4 PolarHBondContact O-N 3.42Å; L4-D8 WeakPolarHBondContact O-CB 3.38Å; L4-D8 PolarHBondContact O-N 3.25Å; L4-F40 HydrophobicContact CD2-CZ 4.43Å
5	K	81.9	Confident	80	Confident	139 Å²	139	96.3 Å²	96.3	60%	0.604	49%	0.485	S	S	*	.	H	α-helix	trans	-67.5	-46.3	176.5	-171.7	176.6	178.1	-177.4	0	111.5	M1 E2 H3 F7 D8 D9	M1-K5 PolarHBondContact O-N 3.38Å; M1-K5 VanDerWaalsContact O-N 3.12Å; E2-K5 PolarHBondContact O-N 2.86Å; H3-K5 VanDerWaalsContact C-N 3.35Å; K5-F7 VanDerWaalsContact C-N 3.3Å; K5-F7 PolarHBondContact O-N 3.47Å; K5-D8 WeakPolarHBondContact O-CB 3.15Å; K5-D8 PolarHBondContact O-N 3.25Å; K5-D9 WeakPolarHBondContact O-CB 3.49Å; K5-D9 PolarHBondContact O-N 3.1Å
6	A	81.6	Confident	79.9	Confident	58 Å²	58	93.3 Å²	93.3	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-59.8	-40.7	176	0	0	0	0	0	112.2	E2 D9 E10	E2-A6 WeakPolarHBondContact O-CB 3.14Å; E2-A6 PolarHBondContact O-N 3.48Å; A6-D9 PolarHBondContact O-N 3.16Å; A6-E10 WeakPolarHBondContact O-CB 3.31Å; A6-E10 PolarHBondContact O-N 3.33Å
7	F	84.3	Confident	79.8	Confident	101 Å²	101	96.5 Å²	96.5	44%	0.443	49%	0.489	S	S	.	.	H	α-helix	trans	-67.4	-39.9	175.5	-178.3	-111.8	0	0	0	112.7	H3 K5 E10 I11 L36	H3-F7 VanDerWaalsContact O-CB 3.31Å; H3-F7 WeakPolarHBondContact O-CB 3.33Å; H3-F7 PolarHBondContact O-N 3.13Å; K5-F7 VanDerWaalsContact C-N 3.3Å; K5-F7 PolarHBondContact O-N 3.47Å; F7-E10 PolarHBondContact O-N 3.12Å; F7-I11 HydrophobicContact CD1-CD1 3.89Å; F7-I11 HydrophobicContact CE1-CD1 3.31Å; F7-I11 HydrophobicContact CE1-CG1 4.36Å; F7-I11 HydrophobicContact CE2-CD1 4.07Å; F7-I11 HydrophobicContact CE2-CG1 4.38Å; F7-I11 HydrophobicContact CG-CD1 4.49Å; F7-I11 HydrophobicContact CZ-CD1 3.43Å; F7-I11 VanDerWaalsContact CZ-CD1 3.43Å; F7-I11 HydrophobicContact CZ-CG1 4.21Å; F7-I11 WeakPolarHBondContact O-CG1 3.3Å; F7-I11 PolarHBondContact O-N 2.96Å; F7-L36 HydrophobicContact CD1-CD1 4.48Å; F7-L36 HydrophobicContact CD1-CD2 3.93Å; F7-L36 HydrophobicContact CE1-CD2 3.81Å
8	D	84.3	Confident	79.6	Confident	29 Å²	29	96.8 Å²	96.8	16%	0.155	49%	0.49	C	S	.	.	H	α-helix	trans	-59.9	-47.5	172.5	-167.4	36.3	0	0	0	111	L4 K5 E10 I11 N12 S34 L36	L4-D8 WeakPolarHBondContact O-CB 3.38Å; L4-D8 PolarHBondContact O-N 3.25Å; K5-D8 WeakPolarHBondContact O-CB 3.15Å; K5-D8 PolarHBondContact O-N 3.25Å; D8-E10 VanDerWaalsContact C-N 3.31Å; D8-E10 PolarHBondContact O-N 2.88Å; D8-I11 PolarHBondContact O-N 3.5Å; D8-N12 WeakPolarHBondContact O-CB 3.41Å; D8-N12 PolarHBondContact O-N 3.47Å; D8-N12 PolarHBondContact O-ND2 2.82Å; D8-N12 PolarHBondContact OD1-ND2 2.81Å; D8-N12 PolarHBondContact OD2-ND2 3.43Å; D8-S34 WeakPolarHBondContact OD1-CB 3.28Å; D8-S34 PolarHBondContact OD1-OG 3.26Å; D8-S34 VanDerWaalsContact OD2-CB 3.31Å; D8-S34 WeakPolarHBondContact OD2-CB 3.32Å; D8-S34 PolarHBondContact OD2-OG 3.47Å; D8-L36 HydrophobicContact CB-CD1 3.52Å; D8-L36 HydrophobicContact CB-CG 4.22Å; D8-L36 WeakPolarHBondContact OD1-CG 3.39Å
9	D	83.1	Confident	79.4	Confident	90 Å²	90	97.4 Å²	97.4	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-60.4	-41.3	179.1	-66.3	-27.1	0	0	0	111	K5 A6 N12 A13	K5-D9 WeakPolarHBondContact O-CB 3.49Å; K5-D9 PolarHBondContact O-N 3.1Å; A6-D9 PolarHBondContact O-N 3.16Å; D9-N12 PolarHBondContact O-N 3.48Å; D9-A13 WeakPolarHBondContact O-CB 3.27Å; D9-A13 PolarHBondContact O-N 3.38Å
10	E	85.3	Confident	79.4	Confident	138 Å²	138	93.8 Å²	93.8	65%	0.645	48%	0.478	S	S	*	.	H	α-helix	trans	-64.6	-45.1	176.2	-171.2	178.1	-174.3	0	0	112.4	A6 F7 D8 A13 F14	A6-E10 WeakPolarHBondContact O-CB 3.31Å; A6-E10 PolarHBondContact O-N 3.33Å; F7-E10 PolarHBondContact O-N 3.12Å; D8-E10 VanDerWaalsContact C-N 3.31Å; D8-E10 PolarHBondContact O-N 2.88Å; E10-A13 PolarHBondContact O-N 3.09Å; E10-F14 WeakPolarHBondContact O-CB 3.26Å; E10-F14 PolarHBondContact O-N 3.49Å
11	I	81.6	Confident	79.4	Confident	35 Å²	35	95.1 Å²	95.1	18%	0.179	49%	0.492	C	S	.	.	H	α-helix	trans	-62.5	-46.9	175.8	-74.7	176.8	0	0	0	110.8	F7 D8 A13 F14 L15 Y35 L36	F7-I11 HydrophobicContact CD1-CD1 3.89Å; F7-I11 HydrophobicContact CE1-CD1 3.31Å; F7-I11 HydrophobicContact CE1-CG1 4.36Å; F7-I11 HydrophobicContact CE2-CD1 4.07Å; F7-I11 HydrophobicContact CE2-CG1 4.38Å; F7-I11 HydrophobicContact CG-CD1 4.49Å; F7-I11 HydrophobicContact CZ-CD1 3.43Å; F7-I11 VanDerWaalsContact CZ-CD1 3.43Å; F7-I11 HydrophobicContact CZ-CG1 4.21Å; F7-I11 WeakPolarHBondContact O-CG1 3.3Å; F7-I11 PolarHBondContact O-N 2.96Å; D8-I11 PolarHBondContact O-N 3.5Å; I11-A13 VanDerWaalsContact C-N 3.33Å; I11-A13 PolarHBondContact O-N 3.21Å; I11-F14 PolarHBondContact O-N 2.87Å; I11-L15 HydrophobicContact CG2-CD1 3.8Å; I11-L15 HydrophobicContact CG2-CG 4.42Å; I11-L15 VanDerWaalsContact O-CG 3.28Å; I11-L15 WeakPolarHBondContact O-CG 3.29Å; I11-L15 PolarHBondContact O-N 3.29Å; I11-Y35 HydrophobicContact CG2-CD1 4.01Å; I11-L36 HydrophobicContact CD1-CD2 3.87Å
12	N	79.4	Confident	80.5	Confident	17 Å²	17	86.3 Å²	86.3	9%	0.091	45%	0.448	C	S	.	.	H	α-helix	trans	-64.5	-40.8	-179.2	-72.8	-59.2	0	0	0	110.8	D8 D9 L15 D16 R22	D8-N12 WeakPolarHBondContact O-CB 3.41Å; D8-N12 PolarHBondContact O-N 3.47Å; D8-N12 PolarHBondContact O-ND2 2.82Å; D8-N12 PolarHBondContact OD1-ND2 2.81Å; D8-N12 PolarHBondContact OD2-ND2 3.43Å; D9-N12 PolarHBondContact O-N 3.48Å; N12-L15 PolarHBondContact O-N 3.36Å; N12-D16 WeakPolarHBondContact O-CB 3.5Å; N12-D16 PolarHBondContact O-N 3.45Å; N12-R22 PolarHBondContact OD1-NH1 3.2Å; N12-R22 PolarHBondContact OD1-NH2 2.78Å
13	A	79.3	Confident	80.9	Confident	58 Å²	58	79.6 Å²	79.6	48%	0.479	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-41.2	174.9	0	0	0	0	0	112.4	D9 E10 I11 D16 N17	D9-A13 WeakPolarHBondContact O-CB 3.27Å; D9-A13 PolarHBondContact O-N 3.38Å; E10-A13 PolarHBondContact O-N 3.09Å; I11-A13 VanDerWaalsContact C-N 3.33Å; I11-A13 PolarHBondContact O-N 3.21Å; A13-D16 PolarHBondContact O-N 2.77Å; A13-N17 WeakPolarHBondContact O-CB 3.41Å; A13-N17 PolarHBondContact O-N 3.35Å
14	F	79.9	Confident	81.2	Confident	128 Å²	128	76.2 Å²	76.2	56%	0.561	41%	0.413	S	S	*	.	H	α-helix	trans	-60.7	-45.9	174.5	172.2	-99.6	0	0	0	111.8	E10 I11 N17 M18	E10-F14 WeakPolarHBondContact O-CB 3.26Å; E10-F14 PolarHBondContact O-N 3.49Å; I11-F14 PolarHBondContact O-N 2.87Å; F14-N17 PolarHBondContact O-N 2.92Å; F14-M18 HydrophobicContact CE1-CE 3.88Å; F14-M18 HydrophobicContact CE1-SD 4.42Å; F14-M18 HydrophobicContact CZ-CE 4.43Å; F14-M18 HydrophobicContact CZ-SD 4.4Å; F14-M18 WeakPolarHBondContact O-CB 3.04Å; F14-M18 PolarHBondContact O-N 2.87Å
15	L	78.3	Confident	81.6	Confident	17 Å²	17	74.8 Å²	74.8	9%	0.089	40%	0.401	C	S	.	.	H	α-helix	trans	-66.1	-41	178.9	-69.5	169.1	0	0	0	112.1	I11 N12 N17 M18 F19 Y35 W158 W163	I11-L15 HydrophobicContact CG2-CD1 3.8Å; I11-L15 HydrophobicContact CG2-CG 4.42Å; I11-L15 VanDerWaalsContact O-CG 3.28Å; I11-L15 WeakPolarHBondContact O-CG 3.29Å; I11-L15 PolarHBondContact O-N 3.29Å; N12-L15 PolarHBondContact O-N 3.36Å; L15-N17 VanDerWaalsContact C-N 3.32Å; L15-N17 PolarHBondContact O-N 3.31Å; L15-M18 HydrophobicContact CD2-CE 3.81Å; L15-M18 PolarHBondContact O-N 3.18Å; L15-F19 HydrophobicContact CD2-CD2 4.44Å; L15-F19 HydrophobicContact CD2-CE2 4.18Å; L15-F19 PolarHBondContact O-N 3.12Å; L15-Y35 HydrophobicContact CD1-CD1 4.33Å; L15-Y35 HydrophobicContact CD1-CG 4.16Å; L15-W158 HydrophobicContact CD1-CH2 3.8Å; L15-W158 HydrophobicContact CD1-CZ3 3.77Å; L15-W163 HydrophobicContact CB-CH2 4Å; L15-W163 HydrophobicContact CB-CZ2 4.43Å
16	D	77.8	Confident	82	Confident	48 Å²	48	68.1 Å²	68.1	26%	0.257	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-34.8	177.2	-69.8	1.7	0	0	0	111.3	N12 A13 G20 R22	N12-D16 WeakPolarHBondContact O-CB 3.5Å; N12-D16 PolarHBondContact O-N 3.45Å; A13-D16 PolarHBondContact O-N 2.77Å; D16-G20 CarbonylContact O-C 3.59Å; D16-G20 WeakPolarHBondContact O-CA 3.4Å; D16-G20 PolarHBondContact O-N 2.82Å; D16-R22 IonicContact OD1-CZ 3.36Å; D16-R22 IonicContact OD1-NE 2.96Å; D16-R22 PolarHBondContact OD1-NE 3.43Å; D16-R22 IonicContact OD1-NH2 3.11Å; D16-R22 PolarHBondContact OD1-NH2 2.93Å; D16-R22 VanDerWaalsContact OD1-NH2 3.11Å
17	N	78.6	Confident	82.3	Confident	147 Å²	147	70.7 Å²	70.7	79%	0.786	37%	0.369	S	S	*	.	H	α-helix	trans	-68.9	-34.6	172.7	-170	34.1	0	0	0	112.3	A13 F14 L15	A13-N17 WeakPolarHBondContact O-CB 3.41Å; A13-N17 PolarHBondContact O-N 3.35Å; F14-N17 PolarHBondContact O-N 2.92Å; L15-N17 VanDerWaalsContact C-N 3.32Å; L15-N17 PolarHBondContact O-N 3.31Å
18	M	76.3	Confident	82.5	Confident	102 Å²	102	68.6 Å²	68.6	50%	0.502	38%	0.377	S	S	.	.	H	α-helix	trans	-78.3	-39.2	-178.8	-177.8	170.6	51.2	0	0	113.2	F14 L15	F14-M18 HydrophobicContact CE1-CE 3.88Å; F14-M18 HydrophobicContact CE1-SD 4.42Å; F14-M18 HydrophobicContact CZ-CE 4.43Å; F14-M18 HydrophobicContact CZ-SD 4.4Å; F14-M18 WeakPolarHBondContact O-CB 3.04Å; F14-M18 PolarHBondContact O-N 2.87Å; L15-M18 HydrophobicContact CD2-CE 3.81Å; L15-M18 PolarHBondContact O-N 3.18Å
19	F	75.9	Confident	82.8	Confident	109 Å²	109	69.9 Å²	69.9	48%	0.478	38%	0.379	S	S	.	.	H	α-helix	trans	-111.6	-7.7	-173.5	-65.9	-61.6	0	0	0	114.4	L15 W163	L15-F19 HydrophobicContact CD2-CD2 4.44Å; L15-F19 HydrophobicContact CD2-CE2 4.18Å; L15-F19 PolarHBondContact O-N 3.12Å; F19-W163 HydrophobicContact CB-CD2 3.79Å; F19-W163 HydrophobicContact CB-CE3 4.38Å; F19-W163 HydrophobicContact CB-CG 4.2Å; F19-W163 HydrophobicContact CB-CH2 4.38Å; F19-W163 HydrophobicContact CB-CZ2 3.68Å; F19-W163 HydrophobicContact CD2-CE3 4.33Å; F19-W163 AromaticContact CD2-CH2 3.94Å; F19-W163 HydrophobicContact CD2-CH2 3.94Å; F19-W163 HydrophobicContact CD2-CZ2 4.07Å; F19-W163 HydrophobicContact CD2-CZ3 4.05Å; F19-W163 HydrophobicContact CG-CD2 4.37Å; F19-W163 HydrophobicContact CG-CZ2 4.34Å
20	G	78.6	Confident	83.3	Confident	25 Å²	25	72 Å²	72	26%	0.258	38%	0.384	S	S	.	.			trans	86.7	-171.2	-176.2	0	0	0	0	0	113.1	D16 W163	D16-G20 CarbonylContact O-C 3.59Å; D16-G20 WeakPolarHBondContact O-CA 3.4Å; D16-G20 PolarHBondContact O-N 2.82Å; G20-W163 PolarHBondContact O-NE1 3.22Å
21	P	81.1	Confident	83.4	Confident	121 Å²	121	66.7 Å²	66.7	79%	0.786	36%	0.36	S	S	*	.	S	Bend	trans	-65.5	138.8	-176.6	27.6	-34.2	0	0	0	111.6
22	R	85.1	Confident	83.8	Confident	18 Å²	18	65 Å²	65	7%	0.068	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-72.6	155.2	175.4	-59.9	-173.9	-164.7	177	6.2	112	N12 D16 S24 D33 N162 W163	N12-R22 PolarHBondContact OD1-NH1 3.2Å; N12-R22 PolarHBondContact OD1-NH2 2.78Å; D16-R22 IonicContact OD1-CZ 3.36Å; D16-R22 IonicContact OD1-NE 2.96Å; D16-R22 PolarHBondContact OD1-NE 3.43Å; D16-R22 IonicContact OD1-NH2 3.11Å; D16-R22 PolarHBondContact OD1-NH2 2.93Å; D16-R22 VanDerWaalsContact OD1-NH2 3.11Å; R22-S24 PolarHBondContact O-N 3.41Å; R22-D33 PolarHBondContact NH1-O 2.95Å; R22-N162 CarbonylContact C-O 3.04Å; R22-N162 VanDerWaalsContact CA-O 3.29Å; R22-N162 WeakPolarHBondContact CA-O 3.31Å; R22-N162 WeakPolarHBondContact CB-O 3.46Å; R22-N162 WeakPolarHBondContact CD-OD1 3.49Å; R22-N162 HydrophobicContact CG-CB 4.27Å; R22-W163 HydrophobicContact CG-CH2 4.41Å; R22-W163 HydrophobicContact CG-CZ2 3.79Å
23	D	85.9	Confident	84.2	Confident	25 Å²	25	67.6 Å²	67.6	13%	0.134	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.1	120	175.7	-164.5	-50.4	0	0	0	110.7	R25 V26 N162 P165	D23-R25 PolarHBondContact O-N 3.29Å; D23-R25 WeakPolarHBondContact OD1-CB 3.48Å; D23-R25 VanDerWaalsContact OD1-CG 3.24Å; D23-R25 WeakPolarHBondContact OD1-CG 3.27Å; D23-R25 IonicContact OD1-CZ 2.76Å; D23-R25 PolarHBondContact OD1-N 3.42Å; D23-R25 IonicContact OD1-NE 3.91Å; D23-R25 PolarHBondContact OD1-NE 3.42Å; D23-R25 IonicContact OD1-NH2 3.45Å; D23-R25 IonicContact OD2-CZ 3.01Å; D23-R25 VanDerWaalsContact OD2-CZ 3.29Å; D23-R25 IonicContact OD2-NE 3.29Å; D23-R25 PolarHBondContact OD2-NE 2.84Å; D23-R25 VanDerWaalsContact OD2-NE 3.12Å; D23-R25 IonicContact OD2-NH2 3.21Å; D23-R25 PolarHBondContact OD2-NH2 3.35Å; D23-V26 HydrophobicContact CB-CG2 4.39Å; D23-V26 WeakPolarHBondContact O-CG2 3.05Å; D23-V26 PolarHBondContact O-N 3.02Å; D23-N162 PolarHBondContact N-O 3.36Å; D23-P165 HydrophobicContact CB-CG 3.89Å; D23-P165 WeakPolarHBondContact OD2-CD 3.33Å; D23-P165 VanDerWaalsContact OD2-CG 3.28Å; D23-P165 WeakPolarHBondContact OD2-CG 3.41Å
24	S	87.3	Confident	84.6	Confident	99 Å²	99	65.7 Å²	65.7	69%	0.692	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-62.2	-24.6	-179.1	63	0	0	0	0	113.8	R22 V26 R27	R22-S24 PolarHBondContact O-N 3.41Å; S24-V26 VanDerWaalsContact C-N 3.26Å; S24-V26 PolarHBondContact O-N 3.01Å; S24-R27 PolarHBondContact O-N 2.98Å
25	R	88.8	Confident	85	Confident	66 Å²	66	62 Å²	62	25%	0.249	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-69.1	-23.6	-174.3	-61.7	174.8	-71.3	-173.9	-2.6	113.4	D23 W29 L102 C166	D23-R25 PolarHBondContact O-N 3.29Å; D23-R25 WeakPolarHBondContact OD1-CB 3.48Å; D23-R25 VanDerWaalsContact OD1-CG 3.24Å; D23-R25 WeakPolarHBondContact OD1-CG 3.27Å; D23-R25 IonicContact OD1-CZ 2.76Å; D23-R25 PolarHBondContact OD1-N 3.42Å; D23-R25 IonicContact OD1-NE 3.91Å; D23-R25 PolarHBondContact OD1-NE 3.42Å; D23-R25 IonicContact OD1-NH2 3.45Å; D23-R25 IonicContact OD2-CZ 3.01Å; D23-R25 VanDerWaalsContact OD2-CZ 3.29Å; D23-R25 IonicContact OD2-NE 3.29Å; D23-R25 PolarHBondContact OD2-NE 2.84Å; D23-R25 VanDerWaalsContact OD2-NE 3.12Å; D23-R25 IonicContact OD2-NH2 3.21Å; D23-R25 PolarHBondContact OD2-NH2 3.35Å; R25-W29 PolarHBondContact O-NE1 3.01Å; R25-L102 PolarHBondContact NH1-O 3.23Å; R25-L102 PolarHBondContact NH2-O 3.08Å; R25-C166 PolarHBondContact NH2-SG 3.46Å
26	V	89.4	Confident	85.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-104.1	0.3	-177.5	-57.9	0	0	0	0	113.4	D23 S24 W29 L32 L161 P165	D23-V26 HydrophobicContact CB-CG2 4.39Å; D23-V26 WeakPolarHBondContact O-CG2 3.05Å; D23-V26 PolarHBondContact O-N 3.02Å; S24-V26 VanDerWaalsContact C-N 3.26Å; S24-V26 PolarHBondContact O-N 3.01Å; V26-W29 HydrophobicContact CB-CD2 4.16Å; V26-W29 HydrophobicContact CB-CE3 4.05Å; V26-W29 HydrophobicContact CB-CZ3 4.37Å; V26-W29 HydrophobicContact CG1-CD2 4.4Å; V26-W29 HydrophobicContact CG1-CE3 3.97Å; V26-W29 HydrophobicContact CG1-CH2 4.03Å; V26-W29 HydrophobicContact CG1-CZ2 4.43Å; V26-W29 HydrophobicContact CG1-CZ3 3.77Å; V26-W29 VanDerWaalsContact O-CB 3.27Å; V26-W29 WeakPolarHBondContact O-CB 3.4Å; V26-W29 PolarHBondContact O-N 2.91Å; V26-L32 HydrophobicContact CB-CD1 3.88Å; V26-L32 HydrophobicContact CG2-CD1 4.32Å; V26-L161 WeakPolarHBondContact CG2-O 3.46Å; V26-P165 HydrophobicContact CG1-CB 3.68Å; V26-P165 HydrophobicContact CG1-CG 3.95Å
27	R	88.3	Confident	86.1	Confident	111 Å²	111	61.7 Å²	61.7	42%	0.419	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	139.8	177.2	-70	-63.7	-148.7	176.2	3.1	110.8	S24 W29	S24-R27 PolarHBondContact O-N 2.98Å; R27-W29 PolarHBondContact O-N 3.13Å
28	G	88.6	Confident	86.8	Confident	58 Å²	58	54.7 Å²	54.7	60%	0.598	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-3	-176.6	0	0	0	0	0	114.3	D33	G28-D33 WeakPolarHBondContact CA-OD2 3.5Å; G28-D33 PolarHBondContact N-OD1 3.44Å; G28-D33 PolarHBondContact N-OD2 2.92Å
29	W	91.7	Very high	87.5	Confident	55 Å²	55	54.3 Å²	54.3	21%	0.208	29%	0.29	C	S	.	.			trans	-75.1	145	176.3	-69	15.4	0	0	0	110.4	R25 V26 R27 M31 L32 A113 K114 W117	R25-W29 PolarHBondContact O-NE1 3.01Å; V26-W29 HydrophobicContact CB-CD2 4.16Å; V26-W29 HydrophobicContact CB-CE3 4.05Å; V26-W29 HydrophobicContact CB-CZ3 4.37Å; V26-W29 HydrophobicContact CG1-CD2 4.4Å; V26-W29 HydrophobicContact CG1-CE3 3.97Å; V26-W29 HydrophobicContact CG1-CH2 4.03Å; V26-W29 HydrophobicContact CG1-CZ2 4.43Å; V26-W29 HydrophobicContact CG1-CZ3 3.77Å; V26-W29 VanDerWaalsContact O-CB 3.27Å; V26-W29 WeakPolarHBondContact O-CB 3.4Å; V26-W29 PolarHBondContact O-N 2.91Å; R27-W29 PolarHBondContact O-N 3.13Å; W29-M31 PolarHBondContact O-N 2.64Å; W29-L32 HydrophobicContact CB-CB 4.37Å; W29-L32 HydrophobicContact CB-CD1 3.96Å; W29-L32 HydrophobicContact CB-CG 4.3Å; W29-L32 HydrophobicContact CE3-CD1 3.94Å; W29-L32 PolarHBondContact O-N 3.24Å; W29-A113 HydrophobicContact CH2-CB 3.75Å; W29-A113 HydrophobicContact CZ3-CB 4.21Å; W29-A113 WeakPolarHBondContact CZ3-O 3.3Å; W29-K114 HydrophobicContact CH2-CB 4.43Å; W29-K114 HydrophobicContact CH2-CG 3.79Å; W29-K114 HydrophobicContact CZ2-CG 4.07Å; W29-W117 HydrophobicContact CE3-CB 3.78Å; W29-W117 AromaticContact CE3-CD1 3.88Å; W29-W117 AromaticContact CE3-CG 3.94Å; W29-W117 HydrophobicContact CE3-CG 3.94Å; W29-W117 HydrophobicContact CZ3-CB 3.76Å; W29-W117 HydrophobicContact CZ3-CG 4.41Å
30	F	92.3	Very high	88.4	Confident	134 Å²	134	53.7 Å²	53.7	59%	0.588	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	126	-176.4	-179.3	-105	0	0	0	111.4	L32 W117 F121	F30-L32 VanDerWaalsContact C-N 3.28Å; F30-L32 PolarHBondContact O-N 3.32Å; F30-W117 HydrophobicContact CB-CZ2 3.93Å; F30-W117 HydrophobicContact CD1-CZ2 4Å; F30-W117 HydrophobicContact CG-CZ2 4.44Å; F30-W117 PolarHBondContact O-NE1 3.27Å; F30-F121 HydrophobicContact CE1-CE2 4.29Å
31	M	88.5	Confident	89.2	Confident	27 Å²	27	55.5 Å²	55.5	13%	0.133	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	16.5	-179.3	-59.9	173.3	61.4	0	0	116.7	W29 P37 L41 Y120 F154 W158	W29-M31 PolarHBondContact O-N 2.64Å; M31-P37 HydrophobicContact CE-CB 4.1Å; M31-P37 HydrophobicContact CG-CB 4.23Å; M31-L41 HydrophobicContact CE-CD1 3.31Å; M31-L41 HydrophobicContact SD-CD1 4.43Å; M31-Y120 HydrophobicContact CB-CE1 4.24Å; M31-F154 HydrophobicContact CE-CZ 3.85Å; M31-W158 PolarHBondContact O-NE1 3.4Å; M31-W158 VanDerWaalsContact O-NE1 3.15Å
32	L	90	Very high	89.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-25.7	176	-67	-169.8	0	0	0	114.2	V26 W29 F30 S34 Y120 L161 N162	V26-L32 HydrophobicContact CB-CD1 3.88Å; V26-L32 HydrophobicContact CG2-CD1 4.32Å; W29-L32 HydrophobicContact CB-CB 4.37Å; W29-L32 HydrophobicContact CB-CD1 3.96Å; W29-L32 HydrophobicContact CB-CG 4.3Å; W29-L32 HydrophobicContact CE3-CD1 3.94Å; W29-L32 PolarHBondContact O-N 3.24Å; F30-L32 VanDerWaalsContact C-N 3.28Å; F30-L32 PolarHBondContact O-N 3.32Å; L32-S34 VanDerWaalsContact C-N 3.32Å; L32-S34 PolarHBondContact O-N 2.99Å; L32-Y120 HydrophobicContact CD2-CD1 4.13Å; L32-Y120 HydrophobicContact CD2-CE1 3.94Å; L32-L161 HydrophobicContact CD1-CB 3.99Å; L32-L161 HydrophobicContact CD1-CD1 4.17Å; L32-L161 HydrophobicContact CD2-CB 4Å; L32-L161 HydrophobicContact CD2-CD1 3.94Å; L32-N162 PolarHBondContact O-ND2 2.85Å; L32-N162 PolarHBondContact O-OD1 3.23Å; L32-N162 VanDerWaalsContact O-OD1 3.1Å
33	D	86.9	Confident	90.3	Very high	72 Å²	72	52 Å²	52	39%	0.385	27%	0.269	S	S	.	.	S	Bend	trans	-67.3	-33.1	-177.4	-68.2	-38.5	0	0	0	113.6	R22 G28	R22-D33 PolarHBondContact NH1-O 2.95Å; G28-D33 WeakPolarHBondContact CA-OD2 3.5Å; G28-D33 PolarHBondContact N-OD1 3.44Å; G28-D33 PolarHBondContact N-OD2 2.92Å
34	S	87.6	Confident	90.8	Very high	18 Å²	18	55.8 Å²	55.8	13%	0.126	29%	0.288	C	S	.	.			trans	-123.7	142.7	-179.6	165.4	0	0	0	0	110.4	D8 L32 L36 P37 W158	D8-S34 WeakPolarHBondContact OD1-CB 3.28Å; D8-S34 PolarHBondContact OD1-OG 3.26Å; D8-S34 VanDerWaalsContact OD2-CB 3.31Å; D8-S34 WeakPolarHBondContact OD2-CB 3.32Å; D8-S34 PolarHBondContact OD2-OG 3.47Å; L32-S34 VanDerWaalsContact C-N 3.32Å; L32-S34 PolarHBondContact O-N 2.99Å; S34-L36 WeakPolarHBondContact OG-CB 3.26Å; S34-L36 PolarHBondContact OG-N 2.98Å; S34-L36 VanDerWaalsContact OG-N 3.07Å; S34-P37 WeakPolarHBondContact O-CD 3.42Å; S34-P37 VanDerWaalsContact OG-CD 3.32Å; S34-P37 WeakPolarHBondContact OG-CD 3.35Å; S34-W158 PolarHBondContact O-NE1 3.21Å; S34-W158 VanDerWaalsContact O-NE1 3.1Å
35	Y	87.9	Confident	91.2	Very high	50 Å²	50	51.3 Å²	51.3	20%	0.196	26%	0.256	C	S	.	.	S	Bend	trans	-78.4	-21.4	172.8	-177.4	-123.4	0	0	0	112.8	I11 L15 T38 F39 N155 W158	I11-Y35 HydrophobicContact CG2-CD1 4.01Å; L15-Y35 HydrophobicContact CD1-CD1 4.33Å; L15-Y35 HydrophobicContact CD1-CG 4.16Å; Y35-T38 HydrophobicContact CE2-CG2 4.22Å; Y35-T38 WeakPolarHBondContact O-CB 3.39Å; Y35-T38 PolarHBondContact O-N 2.83Å; Y35-F39 HydrophobicContact CD1-CB 4.3Å; Y35-F39 HydrophobicContact CE1-CB 3.98Å; Y35-F39 HydrophobicContact CE1-CD2 4.29Å; Y35-F39 HydrophobicContact CE1-CG 4.45Å; Y35-F39 PolarHBondContact O-N 3.46Å; Y35-N155 WeakPolarHBondContact CE2-OD1 3.47Å; Y35-N155 PolarHBondContact OH-OD1 3.28Å; Y35-W158 AromaticContact CD2-CD2 3.63Å; Y35-W158 HydrophobicContact CD2-CD2 3.63Å; Y35-W158 AromaticContact CD2-CE3 3.52Å; Y35-W158 HydrophobicContact CD2-CE3 3.52Å; Y35-W158 HydrophobicContact CD2-CG 4.19Å; Y35-W158 HydrophobicContact CD2-CH2 4.3Å; Y35-W158 HydrophobicContact CD2-CZ2 4.37Å; Y35-W158 AromaticContact CD2-CZ3 3.88Å; Y35-W158 HydrophobicContact CD2-CZ3 3.88Å; Y35-W158 HydrophobicContact CE2-CD2 4.46Å; Y35-W158 HydrophobicContact CE2-CE3 4.22Å; Y35-W158 HydrophobicContact CG-CE3 4.3Å; Y35-W158 HydrophobicContact CG-CH2 4.32Å; Y35-W158 HydrophobicContact CG-CZ2 4.48Å; Y35-W158 HydrophobicContact CG-CZ3 4.22Å
36	L	88.9	Confident	91.5	Very high	13 Å²	13	52 Å²	52	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-57	-45.9	-175.1	-72.3	-177.5	0	0	0	113.6	F7 D8 I11 S34 T38 F39 F40	F7-L36 HydrophobicContact CD1-CD1 4.48Å; F7-L36 HydrophobicContact CD1-CD2 3.93Å; F7-L36 HydrophobicContact CE1-CD2 3.81Å; D8-L36 HydrophobicContact CB-CD1 3.52Å; D8-L36 HydrophobicContact CB-CG 4.22Å; D8-L36 WeakPolarHBondContact OD1-CG 3.39Å; I11-L36 HydrophobicContact CD1-CD2 3.87Å; S34-L36 WeakPolarHBondContact OG-CB 3.26Å; S34-L36 PolarHBondContact OG-N 2.98Å; S34-L36 VanDerWaalsContact OG-N 3.07Å; L36-T38 VanDerWaalsContact C-N 3.3Å; L36-T38 PolarHBondContact O-N 3.26Å; L36-F39 PolarHBondContact O-N 3.49Å; L36-F40 HydrophobicContact CB-CD2 4.01Å; L36-F40 HydrophobicContact CB-CE2 3.88Å; L36-F40 HydrophobicContact CD1-CE2 4.35Å; L36-F40 HydrophobicContact CD2-CE2 4.05Å; L36-F40 HydrophobicContact CG-CE2 4.33Å; L36-F40 WeakPolarHBondContact O-CB 3.45Å; L36-F40 WeakPolarHBondContact O-CD2 3.4Å; L36-F40 WeakPolarHBondContact O-CG 3.36Å; L36-F40 PolarHBondContact O-N 3.15Å
37	P	91.3	Very high	91.8	Very high	46 Å²	46	56.7 Å²	56.7	30%	0.299	29%	0.289	S	S	.	.	H	α-helix	trans	-56.3	-43.5	177.3	-26.3	35.2	0	0	0	113	M31 S34 L41	M31-P37 HydrophobicContact CE-CB 4.1Å; M31-P37 HydrophobicContact CG-CB 4.23Å; S34-P37 WeakPolarHBondContact O-CD 3.42Å; S34-P37 VanDerWaalsContact OG-CD 3.32Å; S34-P37 WeakPolarHBondContact OG-CD 3.35Å; P37-L41 WeakPolarHBondContact O-CB 3.48Å; P37-L41 VanDerWaalsContact O-CG 3.32Å; P37-L41 WeakPolarHBondContact O-CG 3.22Å; P37-L41 PolarHBondContact O-N 3.14Å
38	T	92.3	Very high	92.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-46.3	179.2	-48.8	0	0	0	0	111.2	Y35 L36 T42 Y120 F154 W158	Y35-T38 HydrophobicContact CE2-CG2 4.22Å; Y35-T38 WeakPolarHBondContact O-CB 3.39Å; Y35-T38 PolarHBondContact O-N 2.83Å; L36-T38 VanDerWaalsContact C-N 3.3Å; L36-T38 PolarHBondContact O-N 3.26Å; T38-T42 PolarHBondContact O-N 3.14Å; T38-T42 PolarHBondContact O-OG1 2.9Å; T38-Y120 HydrophobicContact CG2-CE2 4.26Å; T38-Y120 PolarHBondContact OG1-OH 2.83Å; T38-F154 HydrophobicContact CG2-CD1 3.66Å; T38-F154 HydrophobicContact CG2-CE1 3.54Å; T38-F154 HydrophobicContact CG2-CE2 4.45Å; T38-F154 HydrophobicContact CG2-CG 4.2Å; T38-F154 HydrophobicContact CG2-CZ 3.95Å; T38-F154 WeakPolarHBondContact O-CE1 3.38Å; T38-W158 HydrophobicContact CG2-CB 3.93Å; T38-W158 HydrophobicContact CG2-CG 4.33Å
39	F	91.4	Very high	92.3	Very high	93 Å²	93	51.2 Å²	51.2	41%	0.408	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-50.2	177.2	179.3	-104.8	0	0	0	111.4	Y35 L36 L41 T42 V43	Y35-F39 HydrophobicContact CD1-CB 4.3Å; Y35-F39 HydrophobicContact CE1-CB 3.98Å; Y35-F39 HydrophobicContact CE1-CD2 4.29Å; Y35-F39 HydrophobicContact CE1-CG 4.45Å; Y35-F39 PolarHBondContact O-N 3.46Å; L36-F39 PolarHBondContact O-N 3.49Å; F39-L41 PolarHBondContact O-N 3.43Å; F39-T42 WeakPolarHBondContact O-CB 3.28Å; F39-T42 PolarHBondContact O-N 2.93Å; F39-T42 VanDerWaalsContact O-N 3.13Å; F39-V43 HydrophobicContact CD1-CG2 4.25Å; F39-V43 HydrophobicContact CE1-CG2 3.86Å; F39-V43 HydrophobicContact CE2-CG2 4.15Å; F39-V43 HydrophobicContact CZ-CG2 3.8Å; F39-V43 WeakPolarHBondContact O-CG2 3.45Å; F39-V43 PolarHBondContact O-N 2.86Å
40	F	93.8	Very high	92.3	Very high	96 Å²	96	56.3 Å²	56.3	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-43.6	-179.7	-78.2	-57.9	0	0	0	112.5	L4 L36 T42 V43 I44	L4-F40 HydrophobicContact CD2-CZ 4.43Å; L36-F40 HydrophobicContact CB-CD2 4.01Å; L36-F40 HydrophobicContact CB-CE2 3.88Å; L36-F40 HydrophobicContact CD1-CE2 4.35Å; L36-F40 HydrophobicContact CD2-CE2 4.05Å; L36-F40 HydrophobicContact CG-CE2 4.33Å; L36-F40 WeakPolarHBondContact O-CB 3.45Å; L36-F40 WeakPolarHBondContact O-CD2 3.4Å; L36-F40 WeakPolarHBondContact O-CG 3.36Å; L36-F40 PolarHBondContact O-N 3.15Å; F40-T42 VanDerWaalsContact C-N 3.29Å; F40-T42 PolarHBondContact O-N 2.99Å; F40-V43 PolarHBondContact O-N 3.15Å; F40-I44 WeakPolarHBondContact O-CB 3.5Å; F40-I44 VanDerWaalsContact O-CG1 3.27Å; F40-I44 WeakPolarHBondContact O-CG1 3.31Å; F40-I44 PolarHBondContact O-N 3.2Å
41	L	95.3	Very high	92.4	Very high	64 Å²	64	54.9 Å²	54.9	34%	0.335	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-36.4	175.8	-74.4	173.6	0	0	0	112.1	M31 P37 F39 I44 Y45 F154	M31-L41 HydrophobicContact CE-CD1 3.31Å; M31-L41 HydrophobicContact SD-CD1 4.43Å; P37-L41 WeakPolarHBondContact O-CB 3.48Å; P37-L41 VanDerWaalsContact O-CG 3.32Å; P37-L41 WeakPolarHBondContact O-CG 3.22Å; P37-L41 PolarHBondContact O-N 3.14Å; F39-L41 PolarHBondContact O-N 3.43Å; L41-I44 PolarHBondContact O-N 3.18Å; L41-Y45 VanDerWaalsContact O-CB 3.27Å; L41-Y45 WeakPolarHBondContact O-CB 3.36Å; L41-Y45 PolarHBondContact O-N 3.37Å; L41-F154 HydrophobicContact CB-CE1 3.89Å; L41-F154 HydrophobicContact CD1-CE1 4.17Å; L41-F154 HydrophobicContact CD1-CZ 4.03Å
42	T	95.5	Very high	92.6	Very high	13 Å²	13	54.3 Å²	54.3	8%	0.08	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-43.2	173.9	-55.3	0	0	0	0	111.3	T38 F39 F40 Y45 L46 A151 N155	T38-T42 PolarHBondContact O-N 3.14Å; T38-T42 PolarHBondContact O-OG1 2.9Å; F39-T42 WeakPolarHBondContact O-CB 3.28Å; F39-T42 PolarHBondContact O-N 2.93Å; F39-T42 VanDerWaalsContact O-N 3.13Å; F40-T42 VanDerWaalsContact C-N 3.29Å; F40-T42 PolarHBondContact O-N 2.99Å; T42-Y45 WeakPolarHBondContact O-CB 3.41Å; T42-Y45 PolarHBondContact O-N 2.87Å; T42-L46 WeakPolarHBondContact O-CG 3.4Å; T42-L46 PolarHBondContact O-N 2.93Å; T42-A151 HydrophobicContact CG2-CB 4.19Å; T42-N155 WeakPolarHBondContact CG2-ND2 3.46Å; T42-N155 PolarHBondContact OG1-ND2 3.29Å
43	V	95.4	Very high	92.7	Very high	51 Å²	51	56.9 Å²	56.9	31%	0.309	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-46.2	175.9	174.8	0	0	0	0	110.9	F39 F40 Y45 L46 L47	F39-V43 HydrophobicContact CD1-CG2 4.25Å; F39-V43 HydrophobicContact CE1-CG2 3.86Å; F39-V43 HydrophobicContact CE2-CG2 4.15Å; F39-V43 HydrophobicContact CZ-CG2 3.8Å; F39-V43 WeakPolarHBondContact O-CG2 3.45Å; F39-V43 PolarHBondContact O-N 2.86Å; F40-V43 PolarHBondContact O-N 3.15Å; V43-Y45 VanDerWaalsContact C-N 3.29Å; V43-Y45 PolarHBondContact O-N 3.46Å; V43-L46 PolarHBondContact O-N 3.4Å; V43-L47 HydrophobicContact CG1-CD1 3.82Å; V43-L47 HydrophobicContact CG1-CG 4.23Å; V43-L47 WeakPolarHBondContact O-CB 3.41Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.33Å; V43-L47 PolarHBondContact O-N 3.15Å
44	I	95.6	Very high	92.9	Very high	105 Å²	105	60 Å²	60	54%	0.538	30%	0.299	S	S	.	.	H	α-helix	trans	-58.8	-43.4	175.9	-71	166.2	0	0	0	110.4	F40 L41 L47 S48	F40-I44 WeakPolarHBondContact O-CB 3.5Å; F40-I44 VanDerWaalsContact O-CG1 3.27Å; F40-I44 WeakPolarHBondContact O-CG1 3.31Å; F40-I44 PolarHBondContact O-N 3.2Å; L41-I44 PolarHBondContact O-N 3.18Å; I44-L47 PolarHBondContact O-N 2.54Å; I44-S48 VanDerWaalsContact O-CB 3.26Å; I44-S48 WeakPolarHBondContact O-CB 3.32Å; I44-S48 PolarHBondContact O-N 3.17Å
45	Y	95.9	Very high	93.2	Very high	5 Å²	5	65 Å²	65	2%	0.02	32%	0.316	C	S	.	.	H	α-helix	trans	-56.7	-51.5	175.5	163.7	-109.8	0	0	0	111.8	L41 T42 V43 L47 S48 I49 F127 T130 V147 H150 A151	L41-Y45 VanDerWaalsContact O-CB 3.27Å; L41-Y45 WeakPolarHBondContact O-CB 3.36Å; L41-Y45 PolarHBondContact O-N 3.37Å; T42-Y45 WeakPolarHBondContact O-CB 3.41Å; T42-Y45 PolarHBondContact O-N 2.87Å; V43-Y45 VanDerWaalsContact C-N 3.29Å; V43-Y45 PolarHBondContact O-N 3.46Å; Y45-L47 PolarHBondContact O-N 2.82Å; Y45-S48 WeakPolarHBondContact O-CB 3.45Å; Y45-S48 PolarHBondContact O-N 3.27Å; Y45-S48 PolarHBondContact O-OG 2.77Å; Y45-I49 HydrophobicContact CE1-CD1 4.09Å; Y45-I49 HydrophobicContact CE2-CD1 4.03Å; Y45-I49 PolarHBondContact O-N 3.48Å; Y45-F127 AromaticContact CD1-CD1 3.91Å; Y45-F127 HydrophobicContact CD1-CD1 3.91Å; Y45-F127 AromaticContact CD1-CE1 3.76Å; Y45-F127 HydrophobicContact CD1-CE1 3.76Å; Y45-F127 HydrophobicContact CD1-CZ 4.29Å; Y45-F127 HydrophobicContact CD2-CB 3.64Å; Y45-F127 AromaticContact CD2-CD1 3.49Å; Y45-F127 HydrophobicContact CD2-CD1 3.49Å; Y45-F127 VanDerWaalsContact CD2-CD1 3.49Å; Y45-F127 HydrophobicContact CD2-CD2 4.41Å; Y45-F127 HydrophobicContact CD2-CE1 4.19Å; Y45-F127 AromaticContact CD2-CG 3.62Å; Y45-F127 HydrophobicContact CD2-CG 3.62Å; Y45-F127 HydrophobicContact CE1-CD1 4.12Å; Y45-F127 HydrophobicContact CE1-CE1 4.06Å; Y45-F127 HydrophobicContact CE2-CB 4.14Å; Y45-F127 AromaticContact CE2-CD1 3.7Å; Y45-F127 HydrophobicContact CE2-CD1 3.7Å; Y45-F127 HydrophobicContact CE2-CE1 4.44Å; Y45-F127 HydrophobicContact CE2-CG 4.19Å; Y45-F127 HydrophobicContact CG-CB 4.3Å; Y45-F127 AromaticContact CG-CD1 3.58Å; Y45-F127 HydrophobicContact CG-CD1 3.58Å; Y45-F127 HydrophobicContact CG-CD2 4.24Å; Y45-F127 AromaticContact CG-CE1 3.82Å; Y45-F127 HydrophobicContact CG-CE1 3.82Å; Y45-F127 HydrophobicContact CG-CE2 4.45Å; Y45-F127 AromaticContact CG-CG 3.81Å; Y45-F127 HydrophobicContact CG-CG 3.81Å; Y45-F127 HydrophobicContact CG-CZ 4.26Å; Y45-T130 HydrophobicContact CE2-CG2 4.1Å; Y45-T130 WeakPolarHBondContact CE2-OG1 3.32Å; Y45-T130 PolarHBondContact OH-OG1 3.31Å; Y45-T130 VanDerWaalsContact OH-OG1 3.08Å; Y45-V147 HydrophobicContact CE1-CG1 4.28Å; Y45-H150 HydrophobicContact CE1-CB 4.4Å; Y45-A151 HydrophobicContact CD1-CB 4.47Å; Y45-A151 HydrophobicContact CE1-CB 4.17Å
46	L	95.7	Very high	93.5	Very high	80 Å²	80	62.9 Å²	62.9	42%	0.419	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-42.6	179	-66.7	175.4	0	0	0	112.3	T42 V43 S48 I49 W50 V147	T42-L46 WeakPolarHBondContact O-CG 3.4Å; T42-L46 PolarHBondContact O-N 2.93Å; V43-L46 PolarHBondContact O-N 3.4Å; L46-S48 VanDerWaalsContact C-N 3.31Å; L46-S48 PolarHBondContact O-N 2.86Å; L46-I49 PolarHBondContact O-N 3.28Å; L46-W50 PolarHBondContact O-N 3.07Å; L46-V147 HydrophobicContact CD2-CG1 3.68Å
47	L	95.2	Very high	93.6	Very high	99 Å²	99	69.9 Å²	69.9	52%	0.518	34%	0.338	S	S	.	.	H	α-helix	trans	-63.4	-37.3	175.4	-71.3	175.9	0	0	0	111.8	V43 I44 Y45 I49 W50 L51	V43-L47 HydrophobicContact CG1-CD1 3.82Å; V43-L47 HydrophobicContact CG1-CG 4.23Å; V43-L47 WeakPolarHBondContact O-CB 3.41Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.33Å; V43-L47 PolarHBondContact O-N 3.15Å; I44-L47 PolarHBondContact O-N 2.54Å; Y45-L47 PolarHBondContact O-N 2.82Å; L47-I49 VanDerWaalsContact C-N 3.26Å; L47-I49 PolarHBondContact O-N 3.34Å; L47-W50 PolarHBondContact O-N 3.3Å; L47-L51 VanDerWaalsContact O-CB 3.28Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 PolarHBondContact O-N 3.49Å
48	S	94.2	Very high	93.6	Very high	32 Å²	32	74.9 Å²	74.9	22%	0.224	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-34.2	178.7	80.7	0	0	0	0	111.9	I44 Y45 L46 G52	I44-S48 VanDerWaalsContact O-CB 3.26Å; I44-S48 WeakPolarHBondContact O-CB 3.32Å; I44-S48 PolarHBondContact O-N 3.17Å; Y45-S48 WeakPolarHBondContact O-CB 3.45Å; Y45-S48 PolarHBondContact O-N 3.27Å; Y45-S48 PolarHBondContact O-OG 2.77Å; L46-S48 VanDerWaalsContact C-N 3.31Å; L46-S48 PolarHBondContact O-N 2.86Å; S48-G52 VanDerWaalsContact O-CA 3.27Å; S48-G52 WeakPolarHBondContact O-CA 3.28Å; S48-G52 PolarHBondContact O-N 3.43Å
49	I	93.6	Very high	93.6	Very high	22 Å²	22	80.9 Å²	80.9	11%	0.113	39%	0.385	C	S	.	.	H	α-helix	trans	-65.4	-49.7	174.9	-62.8	165.4	0	0	0	109.8	Y45 L46 L47 N53 T130 I142 V147	Y45-I49 HydrophobicContact CE1-CD1 4.09Å; Y45-I49 HydrophobicContact CE2-CD1 4.03Å; Y45-I49 PolarHBondContact O-N 3.48Å; L46-I49 PolarHBondContact O-N 3.28Å; L47-I49 VanDerWaalsContact C-N 3.26Å; L47-I49 PolarHBondContact O-N 3.34Å; I49-N53 WeakPolarHBondContact O-CB 3.39Å; I49-N53 PolarHBondContact O-N 2.99Å; I49-N53 VanDerWaalsContact O-N 3.09Å; I49-N53 PolarHBondContact O-ND2 3.43Å; I49-T130 HydrophobicContact CD1-CG2 3.78Å; I49-T130 HydrophobicContact CG1-CG2 3.71Å; I49-I142 HydrophobicContact CG2-CG2 4.29Å; I49-V147 HydrophobicContact CD1-CG1 4.22Å; I49-V147 HydrophobicContact CD1-CG2 3.99Å
50	W	92	Very high	93.6	Very high	163 Å²	163	81.5 Å²	81.5	62%	0.617	40%	0.398	S	S	*	.	H	α-helix	trans	-65.9	-52.8	-178.7	179	83.7	0	0	0	112	L46 L47 N53 K54	L46-W50 PolarHBondContact O-N 3.07Å; L47-W50 PolarHBondContact O-N 3.3Å; W50-N53 PolarHBondContact O-N 2.89Å; W50-K54 HydrophobicContact CH2-CD 4.33Å; W50-K54 HydrophobicContact CZ2-CD 4.46Å; W50-K54 PolarHBondContact O-N 3.05Å; W50-K54 VanDerWaalsContact O-N 3.1Å
51	L	93.9	Very high	93.5	Very high	103 Å²	103	79.6 Å²	79.6	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-66.7	-42.3	-177.7	-176.5	60.7	0	0	0	111.4	L47 N53 K54 Y55	L47-L51 VanDerWaalsContact O-CB 3.28Å; L47-L51 WeakPolarHBondContact O-CB 3.46Å; L47-L51 PolarHBondContact O-N 3.49Å; L51-N53 PolarHBondContact O-N 3.01Å; L51-K54 PolarHBondContact O-N 3.16Å; L51-Y55 WeakPolarHBondContact O-CB 3.33Å; L51-Y55 PolarHBondContact O-N 3.4Å
52	G	91.9	Very high	93.3	Very high	16 Å²	16	80.4 Å²	80.4	17%	0.165	41%	0.405	C	S	.	.	H	α-helix	trans	-64.1	-40.1	178.6	0	0	0	0	0	112.2	S48 Y55 M56	S48-G52 VanDerWaalsContact O-CA 3.27Å; S48-G52 WeakPolarHBondContact O-CA 3.28Å; S48-G52 PolarHBondContact O-N 3.43Å; G52-Y55 PolarHBondContact O-N 3.23Å; G52-M56 VanDerWaalsContact O-CB 3.29Å; G52-M56 WeakPolarHBondContact O-CB 3.48Å; G52-M56 VanDerWaalsContact O-CG 3.26Å; G52-M56 WeakPolarHBondContact O-CG 3.49Å; G52-M56 PolarHBondContact O-N 2.95Å
53	N	91.6	Very high	93	Very high	54 Å²	54	85.3 Å²	85.3	29%	0.289	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-41.4	173.8	-83.1	-56.6	0	0	0	112.2	I49 W50 L51 M56 K57 T139	I49-N53 WeakPolarHBondContact O-CB 3.39Å; I49-N53 PolarHBondContact O-N 2.99Å; I49-N53 VanDerWaalsContact O-N 3.09Å; I49-N53 PolarHBondContact O-ND2 3.43Å; W50-N53 PolarHBondContact O-N 2.89Å; L51-N53 PolarHBondContact O-N 3.01Å; N53-M56 PolarHBondContact O-N 2.8Å; N53-K57 PolarHBondContact O-N 2.92Å; N53-K57 VanDerWaalsContact O-N 3.16Å; N53-T139 WeakPolarHBondContact OD1-CG2 3.31Å
54	K	92.8	Very high	92.8	Very high	137 Å²	137	84.2 Å²	84.2	60%	0.596	43%	0.431	S	S	*	.	H	α-helix	trans	-61.8	-44.2	175.3	-172.4	175.5	-178.1	178.9	0	111.4	W50 L51 K57	W50-K54 HydrophobicContact CH2-CD 4.33Å; W50-K54 HydrophobicContact CZ2-CD 4.46Å; W50-K54 PolarHBondContact O-N 3.05Å; W50-K54 VanDerWaalsContact O-N 3.1Å; L51-K54 PolarHBondContact O-N 3.16Å; K54-K57 WeakPolarHBondContact O-CB 3.27Å; K54-K57 PolarHBondContact O-N 3.28Å
55	Y	93.3	Very high	92.5	Very high	123 Å²	123	84.3 Å²	84.3	48%	0.482	43%	0.425	S	S	.	.	H	α-helix	trans	-66.7	-40.9	178.9	179.8	-105.3	0	0	0	112.9	L51 G52 K57 R59	L51-Y55 WeakPolarHBondContact O-CB 3.33Å; L51-Y55 PolarHBondContact O-N 3.4Å; G52-Y55 PolarHBondContact O-N 3.23Å; Y55-K57 VanDerWaalsContact C-N 3.29Å; Y55-K57 PolarHBondContact O-N 3.45Å; Y55-R59 VanDerWaalsContact CZ-NE 3.28Å; Y55-R59 PolarHBondContact OH-NE 3.31Å; Y55-R59 PolarHBondContact OH-NH1 2.96Å; Y55-R59 PolarHBondContact OH-NH2 2.67Å; Y55-R59 VanDerWaalsContact OH-NH2 3.13Å
56	M	93	Very high	92.3	Very high	5 Å²	5	86.7 Å²	86.7	3%	0.025	45%	0.451	C	S	.	.	H	α-helix	trans	-79.6	-6.8	-178.9	-69.3	-62.1	-61.8	0	0	113.9	G52 N53 N58 R59 P60 L62 V134 L135 K137	G52-M56 VanDerWaalsContact O-CB 3.29Å; G52-M56 WeakPolarHBondContact O-CB 3.48Å; G52-M56 VanDerWaalsContact O-CG 3.26Å; G52-M56 WeakPolarHBondContact O-CG 3.49Å; G52-M56 PolarHBondContact O-N 2.95Å; N53-M56 PolarHBondContact O-N 2.8Å; M56-N58 VanDerWaalsContact C-N 3.33Å; M56-N58 PolarHBondContact O-N 3.14Å; M56-R59 HydrophobicContact CE-CB 4.39Å; M56-R59 PolarHBondContact O-N 3.31Å; M56-R59 HydrophobicContact SD-CB 4.32Å; M56-P60 VanDerWaalsContact CE-O 3.31Å; M56-P60 WeakPolarHBondContact CE-O 3.32Å; M56-L62 HydrophobicContact CE-CG 4.4Å; M56-V134 HydrophobicContact CG-CG1 4.31Å; M56-L135 WeakPolarHBondContact CE-O 3.23Å; M56-L135 HydrophobicContact SD-CD2 4.21Å; M56-K137 HydrophobicContact CB-CG 4.47Å; M56-K137 HydrophobicContact CE-CD 4.41Å; M56-K137 HydrophobicContact CE-CG 4Å; M56-K137 WeakPolarHBondContact O-CE 3.48Å; M56-K137 PolarHBondContact O-NZ 2.83Å
57	K	91.1	Very high	92.2	Very high	160 Å²	160	87.6 Å²	87.6	70%	0.696	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-50.3	-179.1	-172.3	176.6	178.5	180	0	111.7	N53 K54 Y55 K137	N53-K57 PolarHBondContact O-N 2.92Å; N53-K57 VanDerWaalsContact O-N 3.16Å; K54-K57 WeakPolarHBondContact O-CB 3.27Å; K54-K57 PolarHBondContact O-N 3.28Å; Y55-K57 VanDerWaalsContact C-N 3.29Å; Y55-K57 PolarHBondContact O-N 3.45Å; K57-K137 PolarHBondContact O-NZ 3.2Å; K57-K137 VanDerWaalsContact O-NZ 3.12Å
58	N	92.9	Very high	92.1	Very high	152 Å²	152	83.4 Å²	83.4	81%	0.813	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	11.1	-175.3	-60.5	-21	0	0	0	113.8	M56	M56-N58 VanDerWaalsContact C-N 3.33Å; M56-N58 PolarHBondContact O-N 3.14Å
59	R	91.6	Very high	92.1	Very high	126 Å²	126	83.8 Å²	83.8	48%	0.475	44%	0.435	S	S	.	.	S	Bend	trans	-114	151.9	-178.8	-66.2	-175.3	179.6	-118.2	0.8	111.6	Y55 M56 K137	Y55-R59 VanDerWaalsContact CZ-NE 3.28Å; Y55-R59 PolarHBondContact OH-NE 3.31Å; Y55-R59 PolarHBondContact OH-NH1 2.96Å; Y55-R59 PolarHBondContact OH-NH2 2.67Å; Y55-R59 VanDerWaalsContact OH-NH2 3.13Å; M56-R59 HydrophobicContact CE-CB 4.39Å; M56-R59 PolarHBondContact O-N 3.31Å; M56-R59 HydrophobicContact SD-CB 4.32Å; R59-K137 WeakPolarHBondContact O-CD 3.41Å; R59-K137 PolarHBondContact O-NZ 3.29Å
60	P	90.8	Very high	92.2	Very high	105 Å²	105	88.8 Å²	88.8	68%	0.682	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-68	157.5	169.9	29.6	-34.4	0	0	0	111	M56	M56-P60 VanDerWaalsContact CE-O 3.31Å; M56-P60 WeakPolarHBondContact CE-O 3.32Å
61	A	92.4	Very high	92.5	Very high	57 Å²	57	82.2 Å²	82.2	47%	0.471	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66.6	136.5	174.9	0	0	0	0	0	110.8	R136 K137	A61-R136 WeakPolarHBondContact CB-O 3.39Å; A61-K137 HydrophobicContact CB-CB 4.25Å; A61-K137 HydrophobicContact CB-CD 4.29Å; A61-K137 HydrophobicContact CB-CG 4.11Å
62	L	90.6	Very high	92.5	Very high	81 Å²	81	77.7 Å²	77.7	42%	0.424	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-79.9	137.5	-179.6	-62.3	178.4	0	0	0	111.7	M56 L64 L135	M56-L62 HydrophobicContact CE-CG 4.4Å; L62-L64 HydrophobicContact CB-CD1 4.24Å; L62-L64 HydrophobicContact CB-CD2 4.21Å; L62-L64 HydrophobicContact CB-CG 3.9Å; L62-L64 PolarHBondContact O-N 3.48Å; L62-L135 HydrophobicContact CD1-CB 4.31Å; L62-L135 HydrophobicContact CD1-CD2 4.18Å; L62-L135 PolarHBondContact N-O 2.78Å; L62-L135 VanDerWaalsContact N-O 3.08Å
63	S	89.5	Confident	92.7	Very high	115 Å²	115	81.4 Å²	81.4	80%	0.804	43%	0.428	S	S	*	.			trans	-87.2	94.1	170.4	-174.6	0	0	0	0	109.6
64	L	90.7	Very high	93	Very high	28 Å²	28	80.6 Å²	80.6	15%	0.147	43%	0.433	C	S	.	.			trans	-103.5	30.9	-176.5	-62.1	173.5	0	0	0	112.2	L62 G66 I67 L68 F132 L135	L62-L64 HydrophobicContact CB-CD1 4.24Å; L62-L64 HydrophobicContact CB-CD2 4.21Å; L62-L64 HydrophobicContact CB-CG 3.9Å; L62-L64 PolarHBondContact O-N 3.48Å; L64-G66 PolarHBondContact O-N 2.78Å; L64-I67 HydrophobicContact CD2-CD1 4.08Å; L64-I67 PolarHBondContact O-N 3.08Å; L64-L68 HydrophobicContact CB-CD1 3.51Å; L64-L68 HydrophobicContact CD1-CD1 4.48Å; L64-L68 WeakPolarHBondContact O-CB 3.46Å; L64-L68 VanDerWaalsContact O-CD1 3.28Å; L64-L68 WeakPolarHBondContact O-CD1 3.24Å; L64-L68 PolarHBondContact O-N 2.6Å; L64-F132 HydrophobicContact CD1-CD1 4Å; L64-L135 HydrophobicContact CD1-CB 3.9Å; L64-L135 HydrophobicContact CD1-CD1 3.96Å
65	R	89.4	Confident	93.2	Very high	107 Å²	107	74.4 Å²	74.4	40%	0.404	41%	0.406	S	S	.	.	H	α-helix	trans	-53.3	-54.3	-170	173.6	140.4	-176.3	-146.3	5.1	113.3	I67 L68 T69 V191	R65-I67 PolarHBondContact O-N 3.1Å; R65-L68 PolarHBondContact O-N 2.83Å; R65-T69 PolarHBondContact O-N 2.97Å; R65-T69 PolarHBondContact O-OG1 3.43Å; R65-T69 VanDerWaalsContact O-OG1 3.08Å; R65-V191 HydrophobicContact CB-CG1 3.99Å; R65-V191 HydrophobicContact CG-CG1 3.44Å; R65-V191 VanDerWaalsContact CG-CG1 3.44Å; R65-V191 PolarHBondContact NE-O 2.98Å
66	G	91.7	Very high	93.4	Very high	56 Å²	56	69.4 Å²	69.4	58%	0.577	39%	0.388	S	S	*	.	H	α-helix	trans	-61.7	-44	-179.5	0	0	0	0	0	113	L64 T69 L70	L64-G66 PolarHBondContact O-N 2.78Å; G66-T69 PolarHBondContact O-N 3.4Å; G66-L70 PolarHBondContact O-N 3.47Å
67	I	95	Very high	93.7	Very high	98 Å²	98	74.3 Å²	74.3	50%	0.503	41%	0.414	S	S	.	.	H	α-helix	trans	-63.4	-46.3	178.4	-63.5	170.6	0	0	0	110.6	L64 R65 T69 L70 Y71 F132	L64-I67 HydrophobicContact CD2-CD1 4.08Å; L64-I67 PolarHBondContact O-N 3.08Å; R65-I67 PolarHBondContact O-N 3.1Å; I67-T69 VanDerWaalsContact C-N 3.33Å; I67-T69 PolarHBondContact O-N 3.25Å; I67-L70 PolarHBondContact O-N 3.41Å; I67-Y71 WeakPolarHBondContact O-CB 3.42Å; I67-Y71 PolarHBondContact O-N 2.95Å; I67-F132 HydrophobicContact CG2-CE1 3.86Å; I67-F132 HydrophobicContact CG2-CZ 3.88Å
68	L	93.1	Very high	94	Very high	12 Å²	12	68.4 Å²	68.4	6%	0.063	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-40.2	177	-95.1	72.3	0	0	0	111.4	L64 R65 Y71 N72 F132 R136 V191	L64-L68 HydrophobicContact CB-CD1 3.51Å; L64-L68 HydrophobicContact CD1-CD1 4.48Å; L64-L68 WeakPolarHBondContact O-CB 3.46Å; L64-L68 VanDerWaalsContact O-CD1 3.28Å; L64-L68 WeakPolarHBondContact O-CD1 3.24Å; L64-L68 PolarHBondContact O-N 2.6Å; R65-L68 PolarHBondContact O-N 2.83Å; L68-Y71 PolarHBondContact O-N 3.37Å; L68-N72 WeakPolarHBondContact O-CB 3.21Å; L68-N72 PolarHBondContact O-N 2.94Å; L68-N72 PolarHBondContact O-ND2 3.34Å; L68-F132 HydrophobicContact CD1-CB 4.17Å; L68-F132 HydrophobicContact CD1-CD1 3.65Å; L68-F132 HydrophobicContact CD1-CD2 4.25Å; L68-F132 HydrophobicContact CD1-CE1 4.07Å; L68-F132 HydrophobicContact CD1-CG 3.77Å; L68-F132 HydrophobicContact CG-CD2 4.47Å; L68-F132 HydrophobicContact CG-CG 4.35Å; L68-R136 VanDerWaalsContact CD2-NH1 3.28Å; L68-V191 HydrophobicContact CB-CG2 4.05Å
69	T	93.6	Very high	94.2	Very high	40 Å²	40	61.2 Å²	61.2	25%	0.245	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-47.8	177.3	-62.9	0	0	0	0	111	R65 G66 I67 L73 F192	R65-T69 PolarHBondContact O-N 2.97Å; R65-T69 PolarHBondContact O-OG1 3.43Å; R65-T69 VanDerWaalsContact O-OG1 3.08Å; G66-T69 PolarHBondContact O-N 3.4Å; I67-T69 VanDerWaalsContact C-N 3.33Å; I67-T69 PolarHBondContact O-N 3.25Å; T69-L73 VanDerWaalsContact O-CB 3.31Å; T69-L73 WeakPolarHBondContact O-CB 3.13Å; T69-L73 PolarHBondContact O-N 3.3Å; T69-F192 HydrophobicContact CG2-CE2 4.15Å; T69-F192 HydrophobicContact CG2-CZ 4.08Å
70	L	96.1	Very high	94.5	Very high	126 Å²	126	57.1 Å²	57.1	66%	0.66	34%	0.344	S	S	*	.	H	α-helix	trans	-63.5	-43.8	178	-178.2	62.4	0	0	0	111.9	G66 I67 L73 G74	G66-L70 PolarHBondContact O-N 3.47Å; I67-L70 PolarHBondContact O-N 3.41Å; L70-L73 PolarHBondContact O-N 2.77Å; L70-G74 PolarHBondContact O-N 3.05Å
71	Y	96.7	Very high	94.9	Very high	25 Å²	25	57.2 Å²	57.2	10%	0.098	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-52.8	177.5	168.4	-97.3	0	0	0	111.9	I67 L68 L73 G74 I75 V125 L128 D129 F132 Y184	I67-Y71 WeakPolarHBondContact O-CB 3.42Å; I67-Y71 PolarHBondContact O-N 2.95Å; L68-Y71 PolarHBondContact O-N 3.37Å; Y71-L73 VanDerWaalsContact C-N 3.29Å; Y71-L73 PolarHBondContact O-N 3.16Å; Y71-G74 PolarHBondContact O-N 3.19Å; Y71-G74 VanDerWaalsContact O-N 3.15Å; Y71-I75 HydrophobicContact CD2-CG1 4.29Å; Y71-I75 HydrophobicContact CE1-CG1 4.29Å; Y71-I75 HydrophobicContact CE2-CD1 4.14Å; Y71-I75 HydrophobicContact CE2-CG1 3.88Å; Y71-I75 WeakPolarHBondContact O-CG1 3.42Å; Y71-I75 PolarHBondContact O-N 3.37Å; Y71-V125 HydrophobicContact CE2-CG1 4.13Å; Y71-L128 HydrophobicContact CD2-CB 4.5Å; Y71-L128 HydrophobicContact CD2-CD1 4.24Å; Y71-L128 HydrophobicContact CE2-CB 3.78Å; Y71-L128 HydrophobicContact CE2-CD1 3.93Å; Y71-L128 HydrophobicContact CE2-CG 4.48Å; Y71-D129 WeakPolarHBondContact CE1-OD1 3.26Å; Y71-D129 VanDerWaalsContact CZ-OD1 3.22Å; Y71-D129 PolarHBondContact OH-OD1 3.41Å; Y71-F132 HydrophobicContact CD1-CD2 4.14Å; Y71-F132 AromaticContact CD1-CE2 3.66Å; Y71-F132 HydrophobicContact CD1-CE2 3.66Å; Y71-F132 AromaticContact CD2-CE2 3.81Å; Y71-F132 HydrophobicContact CD2-CE2 3.81Å; Y71-F132 HydrophobicContact CD2-CZ 4.44Å; Y71-F132 HydrophobicContact CE1-CD2 4.2Å; Y71-F132 AromaticContact CE1-CE2 3.97Å; Y71-F132 HydrophobicContact CE1-CE2 3.97Å; Y71-F132 HydrophobicContact CE2-CE2 4.1Å; Y71-F132 HydrophobicContact CG-CD2 4.48Å; Y71-F132 AromaticContact CG-CE2 3.56Å; Y71-F132 HydrophobicContact CG-CE2 3.56Å; Y71-F132 HydrophobicContact CG-CZ 4.27Å; Y71-Y184 AromaticContact CE1-CE1 3.98Å; Y71-Y184 HydrophobicContact CE1-CE1 3.98Å
72	N	95.6	Very high	95.2	Very high	9 Å²	9	54.5 Å²	54.5	5%	0.048	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-38.7	179.2	-74.6	-66.8	0	0	0	111.2	L68 T76 Y184 Y187	L68-N72 WeakPolarHBondContact O-CB 3.21Å; L68-N72 PolarHBondContact O-N 2.94Å; L68-N72 PolarHBondContact O-ND2 3.34Å; N72-T76 WeakPolarHBondContact O-CB 3.42Å; N72-T76 PolarHBondContact O-N 3.48Å; N72-T76 PolarHBondContact O-OG1 3.27Å; N72-Y184 WeakPolarHBondContact OD1-CD1 3.39Å; N72-Y187 VanDerWaalsContact OD1-CB 3.26Å; N72-Y187 WeakPolarHBondContact OD1-CB 3.2Å
73	L	96.1	Very high	95.5	Very high	94 Å²	94	52 Å²	52	49%	0.492	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-45.6	174.6	179.6	62.3	0	0	0	111.5	T69 L70 Y71 I75 T76 L77	T69-L73 VanDerWaalsContact O-CB 3.31Å; T69-L73 WeakPolarHBondContact O-CB 3.13Å; T69-L73 PolarHBondContact O-N 3.3Å; L70-L73 PolarHBondContact O-N 2.77Å; Y71-L73 VanDerWaalsContact C-N 3.29Å; Y71-L73 PolarHBondContact O-N 3.16Å; L73-I75 PolarHBondContact O-N 2.99Å; L73-T76 WeakPolarHBondContact O-CB 3.35Å; L73-T76 PolarHBondContact O-N 3Å; L73-L77 HydrophobicContact CD1-CD1 4.24Å; L73-L77 HydrophobicContact CD1-CG 4.24Å; L73-L77 HydrophobicContact CG-CD1 4.1Å; L73-L77 HydrophobicContact CG-CG 4.49Å; L73-L77 WeakPolarHBondContact O-CG 3.27Å; L73-L77 PolarHBondContact O-N 2.99Å
74	G	97.1	Very high	95.9	Very high	37 Å²	37	48.7 Å²	48.7	38%	0.381	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-46.5	178.2	0	0	0	0	0	112.5	L70 Y71 L77 L78	L70-G74 PolarHBondContact O-N 3.05Å; Y71-G74 PolarHBondContact O-N 3.19Å; Y71-G74 VanDerWaalsContact O-N 3.15Å; G74-L77 PolarHBondContact O-N 3.29Å; G74-L78 WeakPolarHBondContact O-CB 3.34Å; G74-L78 PolarHBondContact O-N 3.25Å
75	I	97.4	Very high	96.2	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-67	-38.6	177.4	-57.3	-66.1	0	0	0	111.5	Y71 L73 L78 S79 V125 Y184	Y71-I75 HydrophobicContact CD2-CG1 4.29Å; Y71-I75 HydrophobicContact CE1-CG1 4.29Å; Y71-I75 HydrophobicContact CE2-CD1 4.14Å; Y71-I75 HydrophobicContact CE2-CG1 3.88Å; Y71-I75 WeakPolarHBondContact O-CG1 3.42Å; Y71-I75 PolarHBondContact O-N 3.37Å; L73-I75 PolarHBondContact O-N 2.99Å; I75-L78 PolarHBondContact O-N 3.1Å; I75-S79 VanDerWaalsContact O-CB 3.3Å; I75-S79 WeakPolarHBondContact O-CB 3.26Å; I75-S79 PolarHBondContact O-N 3.15Å; I75-S79 PolarHBondContact O-OG 3.32Å; I75-V125 HydrophobicContact CD1-CB 4.3Å; I75-V125 HydrophobicContact CD1-CG1 3.69Å; I75-Y184 HydrophobicContact CB-CD1 3.83Å; I75-Y184 HydrophobicContact CB-CD2 4.26Å; I75-Y184 HydrophobicContact CB-CE1 4.01Å; I75-Y184 HydrophobicContact CB-CE2 4.44Å; I75-Y184 HydrophobicContact CB-CG 3.96Å; I75-Y184 HydrophobicContact CG1-CD1 4.37Å; I75-Y184 HydrophobicContact CG1-CE1 4.17Å; I75-Y184 HydrophobicContact CG2-CD1 3.84Å; I75-Y184 HydrophobicContact CG2-CD2 3.44Å; I75-Y184 VanDerWaalsContact CG2-CD2 3.44Å; I75-Y184 HydrophobicContact CG2-CE1 3.79Å; I75-Y184 HydrophobicContact CG2-CE2 3.4Å; I75-Y184 VanDerWaalsContact CG2-CE2 3.4Å; I75-Y184 HydrophobicContact CG2-CG 3.67Å
76	T	97.7	Very high	96.5	Very high	17 Å²	17	44.1 Å²	44.1	10%	0.104	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-46.8	173.3	-66.6	0	0	0	0	111.5	N72 L73 S79 A80 I181 Y184 S185	N72-T76 WeakPolarHBondContact O-CB 3.42Å; N72-T76 PolarHBondContact O-N 3.48Å; N72-T76 PolarHBondContact O-OG1 3.27Å; L73-T76 WeakPolarHBondContact O-CB 3.35Å; L73-T76 PolarHBondContact O-N 3Å; T76-S79 PolarHBondContact O-N 2.7Å; T76-A80 WeakPolarHBondContact O-CB 3.46Å; T76-A80 PolarHBondContact O-N 2.99Å; T76-I181 HydrophobicContact CG2-CG2 4.19Å; T76-Y184 WeakPolarHBondContact OG1-CB 3.13Å; T76-S185 WeakPolarHBondContact CG2-OG 3.24Å; T76-S185 PolarHBondContact OG1-N 3.19Å
77	L	97.9	Very high	96.8	Very high	108 Å²	108	45.5 Å²	45.5	57%	0.565	25%	0.252	S	S	*	.	H	α-helix	trans	-66.5	-42.8	179.5	-69.4	174.2	0	0	0	111.9	L73 G74 S79 A80 Y81	L73-L77 HydrophobicContact CD1-CD1 4.24Å; L73-L77 HydrophobicContact CD1-CG 4.24Å; L73-L77 HydrophobicContact CG-CD1 4.1Å; L73-L77 HydrophobicContact CG-CG 4.49Å; L73-L77 WeakPolarHBondContact O-CG 3.27Å; L73-L77 PolarHBondContact O-N 2.99Å; G74-L77 PolarHBondContact O-N 3.29Å; L77-S79 VanDerWaalsContact C-N 3.31Å; L77-S79 PolarHBondContact O-N 3.39Å; L77-A80 PolarHBondContact O-N 2.75Å; L77-Y81 PolarHBondContact O-N 2.65Å
78	L	97.8	Very high	96.8	Very high	37 Å²	37	44.6 Å²	44.6	19%	0.194	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-42.9	173.9	-179.7	61.4	0	0	0	111.2	G74 I75 A80 Y81 M82 W118	G74-L78 WeakPolarHBondContact O-CB 3.34Å; G74-L78 PolarHBondContact O-N 3.25Å; I75-L78 PolarHBondContact O-N 3.1Å; L78-A80 VanDerWaalsContact C-N 3.34Å; L78-A80 PolarHBondContact O-N 3.39Å; L78-Y81 HydrophobicContact CD1-CD1 4.33Å; L78-Y81 PolarHBondContact O-N 3.35Å; L78-M82 HydrophobicContact CD1-CG 4.47Å; L78-M82 HydrophobicContact CG-CE 4.13Å; L78-M82 HydrophobicContact CG-SD 4.41Å; L78-M82 VanDerWaalsContact O-CG 3.31Å; L78-M82 WeakPolarHBondContact O-CG 3.42Å; L78-M82 PolarHBondContact O-N 3.03Å; L78-W118 HydrophobicContact CD1-CE3 4.08Å
79	S	98	Very high	96.8	Very high	1 Å²	1	44 Å²	44	1%	0.007	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-37.2	177	-54.6	0	0	0	0	112.1	I75 T76 L77 L83 H180	I75-S79 VanDerWaalsContact O-CB 3.3Å; I75-S79 WeakPolarHBondContact O-CB 3.26Å; I75-S79 PolarHBondContact O-N 3.15Å; I75-S79 PolarHBondContact O-OG 3.32Å; T76-S79 PolarHBondContact O-N 2.7Å; L77-S79 VanDerWaalsContact C-N 3.31Å; L77-S79 PolarHBondContact O-N 3.39Å; S79-L83 VanDerWaalsContact O-CB 3.3Å; S79-L83 WeakPolarHBondContact O-CB 3.2Å; S79-L83 PolarHBondContact O-N 2.98Å; S79-H180 WeakPolarHBondContact OG-CB 3.21Å
80	A	98.2	Very high	96.8	Very high	39 Å²	39	43 Å²	43	32%	0.322	24%	0.238	S	C	.	.	H	α-helix	trans	-65.7	-43.8	174.3	0	0	0	0	0	112	T76 L77 L78 L83 A84 I181	T76-A80 WeakPolarHBondContact O-CB 3.46Å; T76-A80 PolarHBondContact O-N 2.99Å; L77-A80 PolarHBondContact O-N 2.75Å; L78-A80 VanDerWaalsContact C-N 3.34Å; L78-A80 PolarHBondContact O-N 3.39Å; A80-L83 PolarHBondContact O-N 3.38Å; A80-A84 WeakPolarHBondContact O-CB 3.49Å; A80-A84 PolarHBondContact O-N 2.85Å; A80-I181 HydrophobicContact CB-CD1 4Å; A80-I181 HydrophobicContact CB-CG1 4.22Å
81	Y	98.1	Very high	96.6	Very high	107 Å²	107	47.3 Å²	47.3	42%	0.42	25%	0.246	S	C	.	.	H	α-helix	trans	-58.4	-51.2	173.4	165.9	-102.5	0	0	0	111.5	L77 L78 L83 A84 E85 W118	L77-Y81 PolarHBondContact O-N 2.65Å; L78-Y81 HydrophobicContact CD1-CD1 4.33Å; L78-Y81 PolarHBondContact O-N 3.35Å; Y81-L83 VanDerWaalsContact C-N 3.33Å; Y81-L83 PolarHBondContact O-N 2.86Å; Y81-A84 PolarHBondContact O-N 3.35Å; Y81-E85 HydrophobicContact CD2-CG 3.89Å; Y81-E85 HydrophobicContact CE1-CG 4.42Å; Y81-E85 HydrophobicContact CE2-CG 3.41Å; Y81-E85 VanDerWaalsContact CE2-CG 3.41Å; Y81-E85 WeakPolarHBondContact O-CB 3.46Å; Y81-E85 PolarHBondContact O-N 3.08Å; Y81-W118 AromaticContact CE1-CD1 3.97Å; Y81-W118 HydrophobicContact CE1-CG 4.31Å
82	M	98.1	Very high	96.4	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-42.2	179.3	-68.9	-176.4	-59.6	0	0	112.2	L78 L86 V115 W118 Y119	L78-M82 HydrophobicContact CD1-CG 4.47Å; L78-M82 HydrophobicContact CG-CE 4.13Å; L78-M82 HydrophobicContact CG-SD 4.41Å; L78-M82 VanDerWaalsContact O-CG 3.31Å; L78-M82 WeakPolarHBondContact O-CG 3.42Å; L78-M82 PolarHBondContact O-N 3.03Å; M82-L86 WeakPolarHBondContact O-CB 3.05Å; M82-L86 VanDerWaalsContact O-CG 3.25Å; M82-L86 WeakPolarHBondContact O-CG 3.28Å; M82-L86 PolarHBondContact O-N 3.13Å; M82-V115 HydrophobicContact CB-CG1 3.96Å; M82-V115 HydrophobicContact CG-CG1 4.06Å; M82-W118 HydrophobicContact CG-CB 4.25Å; M82-W118 HydrophobicContact SD-CB 4.15Å; M82-Y119 HydrophobicContact CE-CD2 4.34Å; M82-Y119 WeakPolarHBondContact SD-CA 3.46Å; M82-Y119 HydrophobicContact SD-CD2 4.21Å; M82-Y119 PolarHBondContact SD-N 2.95Å; M82-Y119 VanDerWaalsContact SD-N 3.45Å
83	L	98.2	Very high	96	Very high	27 Å²	27	53 Å²	53	14%	0.141	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-50.4	176.8	177	63.5	0	0	0	111.6	S79 A80 Y81 L86 I87 T174 F178 I181	S79-L83 VanDerWaalsContact O-CB 3.3Å; S79-L83 WeakPolarHBondContact O-CB 3.2Å; S79-L83 PolarHBondContact O-N 2.98Å; A80-L83 PolarHBondContact O-N 3.38Å; Y81-L83 VanDerWaalsContact C-N 3.33Å; Y81-L83 PolarHBondContact O-N 2.86Å; L83-L86 PolarHBondContact O-N 3.11Å; L83-I87 HydrophobicContact CD1-CD1 3.72Å; L83-I87 HydrophobicContact CD1-CG1 4.31Å; L83-I87 HydrophobicContact CG-CD1 3.97Å; L83-I87 WeakPolarHBondContact O-CG1 3.28Å; L83-I87 PolarHBondContact O-N 3.34Å; L83-I87 VanDerWaalsContact O-N 3.07Å; L83-T174 HydrophobicContact CD1-CG2 3.86Å; L83-T174 WeakPolarHBondContact CD1-O 3.46Å; L83-F178 HydrophobicContact CD1-CB 4.14Å; L83-F178 HydrophobicContact CD2-CB 4Å; L83-F178 HydrophobicContact CD2-CD2 4.02Å; L83-I181 HydrophobicContact CB-CD1 4.18Å; L83-I181 HydrophobicContact CD2-CD1 3.53Å
84	A	97.8	Very high	95.7	Very high	46 Å²	46	51.5 Å²	51.5	38%	0.38	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-48	-179	0	0	0	0	0	111	A80 Y81 L86 I87 L88	A80-A84 WeakPolarHBondContact O-CB 3.49Å; A80-A84 PolarHBondContact O-N 2.85Å; Y81-A84 PolarHBondContact O-N 3.35Å; A84-L86 PolarHBondContact O-N 2.74Å; A84-I87 PolarHBondContact O-N 3.34Å; A84-L88 WeakPolarHBondContact O-CB 3.36Å; A84-L88 VanDerWaalsContact O-CG 3.26Å; A84-L88 WeakPolarHBondContact O-CG 3.33Å; A84-L88 PolarHBondContact O-N 3.45Å
85	E	97.1	Very high	95.4	Very high	39 Å²	39	50.6 Å²	50.6	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-40.2	179.6	-78.1	-67.1	126.9	0	0	112.7	Y81 L88 S89 R111 V115	Y81-E85 HydrophobicContact CD2-CG 3.89Å; Y81-E85 HydrophobicContact CE1-CG 4.42Å; Y81-E85 HydrophobicContact CE2-CG 3.41Å; Y81-E85 VanDerWaalsContact CE2-CG 3.41Å; Y81-E85 WeakPolarHBondContact O-CB 3.46Å; Y81-E85 PolarHBondContact O-N 3.08Å; E85-L88 PolarHBondContact O-N 2.95Å; E85-S89 WeakPolarHBondContact O-CB 3.43Å; E85-S89 PolarHBondContact O-N 3.31Å; E85-S89 PolarHBondContact O-OG 3.03Å; E85-R111 IonicContact OE1-CZ 3.6Å; E85-R111 IonicContact OE1-NH2 2.76Å; E85-R111 PolarHBondContact OE1-NH2 2.92Å; E85-R111 IonicContact OE2-CZ 3.96Å; E85-R111 VanDerWaalsContact OE2-CZ 3.25Å; E85-R111 IonicContact OE2-NE 2.66Å; E85-R111 PolarHBondContact OE2-NE 3.43Å; E85-R111 IonicContact OE2-NH2 2.9Å; E85-R111 PolarHBondContact OE2-NH2 3.45Å; E85-V115 HydrophobicContact CB-CG1 4.23Å; E85-V115 HydrophobicContact CB-CG2 3.51Å; E85-V115 HydrophobicContact CG-CG2 4.31Å
86	L	96.4	Very high	94.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-43.6	176.1	-76	167.5	0	0	0	111.5	M82 L83 A84 T90 V112 V115 L116 F170 P173	M82-L86 WeakPolarHBondContact O-CB 3.05Å; M82-L86 VanDerWaalsContact O-CG 3.25Å; M82-L86 WeakPolarHBondContact O-CG 3.28Å; M82-L86 PolarHBondContact O-N 3.13Å; L83-L86 PolarHBondContact O-N 3.11Å; A84-L86 PolarHBondContact O-N 2.74Å; L86-T90 WeakPolarHBondContact O-CB 3.41Å; L86-T90 VanDerWaalsContact O-CG2 3.3Å; L86-T90 WeakPolarHBondContact O-CG2 3.38Å; L86-T90 PolarHBondContact O-N 2.87Å; L86-T90 PolarHBondContact O-OG1 2.89Å; L86-V112 HydrophobicContact CD2-CG1 4.13Å; L86-V115 HydrophobicContact CD1-CG1 4.24Å; L86-V115 HydrophobicContact CD2-CB 4.16Å; L86-V115 HydrophobicContact CD2-CG1 4.09Å; L86-V115 HydrophobicContact CG-CB 4.3Å; L86-V115 HydrophobicContact CG-CG1 3.7Å; L86-L116 HydrophobicContact CD2-CD2 4.08Å; L86-F170 HydrophobicContact CD2-CB 4.49Å; L86-P173 HydrophobicContact CD1-CB 3.93Å
87	I	96.3	Very high	94.3	Very high	85 Å²	85	59 Å²	59	44%	0.436	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-48.3	177.8	-69.5	169.6	0	0	0	110.6	L83 A84 T90 W91 T174	L83-I87 HydrophobicContact CD1-CD1 3.72Å; L83-I87 HydrophobicContact CD1-CG1 4.31Å; L83-I87 HydrophobicContact CG-CD1 3.97Å; L83-I87 WeakPolarHBondContact O-CG1 3.28Å; L83-I87 PolarHBondContact O-N 3.34Å; L83-I87 VanDerWaalsContact O-N 3.07Å; A84-I87 PolarHBondContact O-N 3.34Å; I87-T90 PolarHBondContact O-N 2.59Å; I87-T90 PolarHBondContact O-OG1 3.49Å; I87-W91 WeakPolarHBondContact O-CB 3.43Å; I87-W91 PolarHBondContact O-N 3.37Å; I87-T174 HydrophobicContact CG1-CG2 4.25Å
88	L	95.3	Very high	93.7	Very high	79 Å²	79	57.4 Å²	57.4	41%	0.414	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-47	-179.8	-69.7	172.1	0	0	0	111.6	A84 E85 T90 W91 E92	A84-L88 WeakPolarHBondContact O-CB 3.36Å; A84-L88 VanDerWaalsContact O-CG 3.26Å; A84-L88 WeakPolarHBondContact O-CG 3.33Å; A84-L88 PolarHBondContact O-N 3.45Å; E85-L88 PolarHBondContact O-N 2.95Å; L88-T90 VanDerWaalsContact C-N 3.33Å; L88-T90 PolarHBondContact O-N 3.2Å; L88-W91 PolarHBondContact O-N 3.3Å; L88-E92 WeakPolarHBondContact O-CB 3.08Å; L88-E92 WeakPolarHBondContact O-CG 3.48Å; L88-E92 PolarHBondContact O-N 3.48Å
89	S	93.6	Very high	93.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-42.8	-179.7	-54.3	0	0	0	0	111.9	E85 G93 R111	E85-S89 WeakPolarHBondContact O-CB 3.43Å; E85-S89 PolarHBondContact O-N 3.31Å; E85-S89 PolarHBondContact O-OG 3.03Å; S89-G93 PolarHBondContact O-N 2.9Å; S89-R111 WeakPolarHBondContact OG-CD 3.37Å; S89-R111 WeakPolarHBondContact OG-CG 3.42Å; S89-R111 PolarHBondContact OG-NE 2.88Å
90	T	93.1	Very high	92.8	Very high	18 Å²	18	56.7 Å²	56.7	11%	0.11	30%	0.301	C	S	.	.	H	α-helix	trans	-75.7	-32.6	-178.7	54.4	0	0	0	0	112.7	L86 I87 L88 G94 Y95 V112 F170	L86-T90 WeakPolarHBondContact O-CB 3.41Å; L86-T90 VanDerWaalsContact O-CG2 3.3Å; L86-T90 WeakPolarHBondContact O-CG2 3.38Å; L86-T90 PolarHBondContact O-N 2.87Å; L86-T90 PolarHBondContact O-OG1 2.89Å; I87-T90 PolarHBondContact O-N 2.59Å; I87-T90 PolarHBondContact O-OG1 3.49Å; L88-T90 VanDerWaalsContact C-N 3.33Å; L88-T90 PolarHBondContact O-N 3.2Å; T90-G94 PolarHBondContact O-N 3.01Å; T90-Y95 HydrophobicContact CG2-CD1 3.36Å; T90-Y95 HydrophobicContact CG2-CD2 4.21Å; T90-Y95 HydrophobicContact CG2-CE1 3.67Å; T90-Y95 HydrophobicContact CG2-CE2 4.45Å; T90-Y95 HydrophobicContact CG2-CG 3.69Å; T90-Y95 WeakPolarHBondContact O-CB 3.11Å; T90-Y95 PolarHBondContact O-N 3.43Å; T90-V112 HydrophobicContact CG2-CG2 4Å; T90-F170 HydrophobicContact CG2-CD2 3.37Å; T90-F170 HydrophobicContact CG2-CE2 3.59Å; T90-F170 HydrophobicContact CG2-CG 3.96Å; T90-F170 HydrophobicContact CG2-CZ 4.33Å
91	W	93.2	Very high	92.3	Very high	218 Å²	218	56.3 Å²	56.3	83%	0.826	29%	0.294	S	S	*	.	H	α-helix	trans	-68.3	-50.6	173.9	-173.7	-85.2	0	0	0	112	I87 L88 G93 G94	I87-W91 WeakPolarHBondContact O-CB 3.43Å; I87-W91 PolarHBondContact O-N 3.37Å; L88-W91 PolarHBondContact O-N 3.3Å; W91-G93 VanDerWaalsContact C-N 3.3Å; W91-G93 PolarHBondContact O-N 3.42Å; W91-G94 PolarHBondContact O-N 2.89Å
92	E	91.1	Very high	91.8	Very high	131 Å²	131	52.6 Å²	52.6	61%	0.612	28%	0.281	S	S	*	.	H	α-helix	trans	-64.2	-36.6	177.6	-70.8	170.6	-168.7	0	0	111.7	L88 G94 R111	L88-E92 WeakPolarHBondContact O-CB 3.08Å; L88-E92 WeakPolarHBondContact O-CG 3.48Å; L88-E92 PolarHBondContact O-N 3.48Å; E92-G94 PolarHBondContact O-N 2.84Å; E92-R111 IonicContact OE1-NH1 3.12Å; E92-R111 IonicContact OE2-NH1 4Å; E92-R111 PolarHBondContact OE2-NH1 3.44Å
93	G	88.1	Confident	91.2	Very high	22 Å²	22	57.9 Å²	57.9	23%	0.227	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.3	176.3	0	0	0	0	0	115.2	S89 W91 Y95 A108	S89-G93 PolarHBondContact O-N 2.9Å; W91-G93 VanDerWaalsContact C-N 3.3Å; W91-G93 PolarHBondContact O-N 3.42Å; G93-Y95 VanDerWaalsContact C-N 3.29Å; G93-Y95 PolarHBondContact O-N 3.42Å; G93-A108 VanDerWaalsContact CA-CB 3.45Å
94	G	90.7	Very high	90.4	Very high	63 Å²	63	60.6 Å²	60.6	65%	0.649	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	36	179.8	0	0	0	0	0	113.9	T90 W91 E92 N96	T90-G94 PolarHBondContact O-N 3.01Å; W91-G94 PolarHBondContact O-N 2.89Å; E92-G94 PolarHBondContact O-N 2.84Å; G94-N96 PolarHBondContact O-N 3.37Å
95	Y	90.8	Very high	89.6	Confident	18 Å²	18	59.2 Å²	59.2	7%	0.071	32%	0.324	C	S	.	.			trans	-58.4	134.9	-176	-93.1	-137.4	0	0	0	112.1	T90 G93 L97 Q100 A105 A108 D109 V112 F170	T90-Y95 HydrophobicContact CG2-CD1 3.36Å; T90-Y95 HydrophobicContact CG2-CD2 4.21Å; T90-Y95 HydrophobicContact CG2-CE1 3.67Å; T90-Y95 HydrophobicContact CG2-CE2 4.45Å; T90-Y95 HydrophobicContact CG2-CG 3.69Å; T90-Y95 WeakPolarHBondContact O-CB 3.11Å; T90-Y95 PolarHBondContact O-N 3.43Å; G93-Y95 VanDerWaalsContact C-N 3.29Å; G93-Y95 PolarHBondContact O-N 3.42Å; Y95-L97 PolarHBondContact O-N 2.95Å; Y95-Q100 HydrophobicContact CD1-CB 4.22Å; Y95-Q100 HydrophobicContact CD1-CG 3.63Å; Y95-Q100 HydrophobicContact CD2-CG 4.36Å; Y95-Q100 HydrophobicContact CE1-CG 3.72Å; Y95-Q100 HydrophobicContact CE2-CG 4.43Å; Y95-Q100 HydrophobicContact CG-CG 3.95Å; Y95-A105 HydrophobicContact CD2-CB 3.89Å; Y95-A105 HydrophobicContact CE2-CB 3.38Å; Y95-A108 HydrophobicContact CE2-CB 4.44Å; Y95-D109 PolarHBondContact OH-OD1 3.03Å; Y95-V112 HydrophobicContact CE1-CG2 4.35Å; Y95-F170 AromaticContact CD1-CD1 3.95Å; Y95-F170 HydrophobicContact CD1-CD1 3.95Å; Y95-F170 AromaticContact CD1-CE1 3.92Å; Y95-F170 HydrophobicContact CD1-CE1 3.92Å; Y95-F170 HydrophobicContact CD1-CG 4.25Å; Y95-F170 HydrophobicContact CD1-CZ 4.22Å; Y95-F170 HydrophobicContact CE1-CD1 4.1Å; Y95-F170 HydrophobicContact CE1-CG 4.21Å
96	N	86.7	Confident	89.2	Confident	86 Å²	86	59.5 Å²	59.5	46%	0.46	34%	0.337	S	S	.	.			trans	-82	112.7	172.6	-174.7	-22	0	0	0	110.5	G94 Q98 C99	G94-N96 PolarHBondContact O-N 3.37Å; N96-Q98 PolarHBondContact O-N 3.16Å; N96-Q98 WeakPolarHBondContact OD1-CB 3.46Å; N96-Q98 PolarHBondContact OD1-N 2.91Å; N96-C99 WeakPolarHBondContact CB-O 3.46Å; N96-C99 CarbonylContact O-C 3.46Å; N96-C99 PolarHBondContact O-N 3.27Å; N96-C99 PolarHBondContact OD1-N 3.34Å
97	L	85.4	Confident	88.9	Confident	114 Å²	114	67.6 Å²	67.6	60%	0.597	38%	0.375	S	S	*	.	S	Bend	trans	-64.8	-19.6	179.5	-66.2	178.9	0	0	0	114.2	Y95 F170 H219	Y95-L97 PolarHBondContact O-N 2.95Å; L97-F170 HydrophobicContact CD2-CZ 3.96Å; L97-H219 PolarHBondContact O-CD2 3.02Å; L97-H219 VanDerWaalsContact O-CD2 3.23Å; L97-H219 PolarHBondContact O-NE2 3.36Å
98	Q	85.3	Confident	88.6	Confident	74 Å²	74	64.1 Å²	64.1	35%	0.346	36%	0.359	S	S	.	.	S	Bend	trans	-81.5	-47.3	176.4	174.4	159	20.1	0	0	111.5	N96 S222	N96-Q98 PolarHBondContact O-N 3.16Å; N96-Q98 WeakPolarHBondContact OD1-CB 3.46Å; N96-Q98 PolarHBondContact OD1-N 2.91Å; Q98-S222 PolarHBondContact O-OG 3.02Å; Q98-S222 VanDerWaalsContact O-OG 3.06Å
99	C	85.5	Confident	88.5	Confident	10 Å²	10	60.4 Å²	60.4	7%	0.068	34%	0.339	C	S	.	.			trans	-159.2	125.7	176	-162.9	0	0	0	0	109.3	N96 Q168 A223 K226 C228	N96-C99 WeakPolarHBondContact CB-O 3.46Å; N96-C99 CarbonylContact O-C 3.46Å; N96-C99 PolarHBondContact O-N 3.27Å; N96-C99 PolarHBondContact OD1-N 3.34Å; C99-Q168 VanDerWaalsContact CA-NE2 3.33Å; C99-A223 HydrophobicContact CB-CB 4.32Å; C99-K226 WeakPolarHBondContact CB-O 3.46Å; C99-K226 PolarHBondContact SG-O 2.93Å; C99-K226 VanDerWaalsContact SG-O 3.42Å; C99-C228 VanDerWaalsContact CA-SG 3.59Å; C99-C228 HydrophobicContact CB-CB 3.53Å; C99-C228 WeakPolarHBondContact CB-SG 3.5Å; C99-C228 WeakPolarHBondContact SG-CB 3.32Å; C99-C228 PolarHBondContact SG-N 3.27Å; C99-C228 CovalentContact SG-SG 2.02Å; C99-C228 PolarHBondContact SG-SG 3.21Å
100	Q	90.4	Very high	88.4	Confident	14 Å²	14	63.7 Å²	63.7	7%	0.065	36%	0.356	C	S	.	.			trans	-124	123.5	179.1	-176.1	69.1	21.4	0	0	109.3	Y95 G167 Q168 C228	Y95-Q100 HydrophobicContact CD1-CB 4.22Å; Y95-Q100 HydrophobicContact CD1-CG 3.63Å; Y95-Q100 HydrophobicContact CD2-CG 4.36Å; Y95-Q100 HydrophobicContact CE1-CG 3.72Å; Y95-Q100 HydrophobicContact CE2-CG 4.43Å; Y95-Q100 HydrophobicContact CG-CG 3.95Å; Q100-G167 WeakPolarHBondContact O-CA 3.5Å; Q100-Q168 WeakPolarHBondContact O-CG 3.36Å; Q100-Q168 PolarHBondContact O-N 3.32Å; Q100-C228 VanDerWaalsContact C-SG 3.54Å; Q100-C228 PolarHBondContact N-SG 3.23Å
101	D	88.3	Confident	88.5	Confident	31 Å²	31	66.1 Å²	66.1	17%	0.166	36%	0.363	C	S	.	.			trans	-76.6	-172.7	174.8	66.3	55	0	0	0	112.4	T103 S104 G167 C228	D101-T103 PolarHBondContact OD1-N 3.19Å; D101-T103 PolarHBondContact OD1-OG1 2.62Å; D101-S104 WeakPolarHBondContact OD1-CB 3.29Å; D101-S104 PolarHBondContact OD1-N 2.76Å; D101-S104 PolarHBondContact OD1-OG 3.2Å; D101-S104 VanDerWaalsContact OD2-CB 3.3Å; D101-S104 WeakPolarHBondContact OD2-CB 3.48Å; D101-S104 PolarHBondContact OD2-OG 3.21Å; D101-G167 WeakPolarHBondContact O-CA 3.38Å; D101-C228 WeakPolarHBondContact CB-O 3.42Å
102	L	87	Confident	88.6	Confident	29 Å²	29	55.7 Å²	55.7	15%	0.152	32%	0.324	C	S	.	.	S	Bend	trans	-93.7	-6.7	-173.9	-61.3	173	0	0	0	114.5	R25 I164 C166 F230	R25-L102 PolarHBondContact NH1-O 3.23Å; R25-L102 PolarHBondContact NH2-O 3.08Å; L102-I164 HydrophobicContact CD1-CG2 3.98Å; L102-I164 HydrophobicContact CD2-CB 4.12Å; L102-I164 HydrophobicContact CD2-CG2 4.2Å; L102-C166 WeakPolarHBondContact CD2-O 3.15Å; L102-C166 PolarHBondContact O-SG 3.35Å; L102-F230 HydrophobicContact CD2-CD2 3.95Å; L102-F230 HydrophobicContact CD2-CE2 3.63Å; L102-F230 HydrophobicContact CG-CD2 4.26Å; L102-F230 HydrophobicContact CG-CE2 4.39Å
103	T	85.4	Confident	88.8	Confident	112 Å²	112	49.5 Å²	49.5	69%	0.687	30%	0.295	S	S	*	.	S	Bend	trans	-131.2	-16.7	-164.2	50.5	0	0	0	0	114.6	D101 A105	D101-T103 PolarHBondContact OD1-N 3.19Å; D101-T103 PolarHBondContact OD1-OG1 2.62Å; T103-A105 PolarHBondContact O-N 2.93Å
104	S	81.9	Confident	89.2	Confident	84 Å²	84	54.2 Å²	54.2	59%	0.587	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.7	-167.6	-74.3	0	0	0	0	115.1	D101	D101-S104 WeakPolarHBondContact OD1-CB 3.29Å; D101-S104 PolarHBondContact OD1-N 2.76Å; D101-S104 PolarHBondContact OD1-OG 3.2Å; D101-S104 VanDerWaalsContact OD2-CB 3.3Å; D101-S104 WeakPolarHBondContact OD2-CB 3.48Å; D101-S104 PolarHBondContact OD2-OG 3.21Å
105	A	81.4	Confident	89.5	Confident	17 Å²	17	51.2 Å²	51.2	14%	0.14	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	6.9	-174.4	0	0	0	0	0	114.3	Y95 T103 E107 A108 D109	Y95-A105 HydrophobicContact CD2-CB 3.89Å; Y95-A105 HydrophobicContact CE2-CB 3.38Å; T103-A105 PolarHBondContact O-N 2.93Å; A105-E107 PolarHBondContact O-N 3.28Å; A105-E107 VanDerWaalsContact O-N 3.16Å; A105-A108 HydrophobicContact CB-CB 4.09Å; A105-A108 WeakPolarHBondContact O-CB 3.25Å; A105-A108 PolarHBondContact O-N 3.42Å; A105-D109 WeakPolarHBondContact CA-OD2 3.32Å; A105-D109 WeakPolarHBondContact CB-OD1 3.46Å; A105-D109 PolarHBondContact N-OD2 3.43Å
106	G	87.6	Confident	89.7	Confident	44 Å²	44	50.4 Å²	50.4	45%	0.454	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	-116.6	168.1	0	0	0	0	0	113.9	A108 D109	G106-A108 VanDerWaalsContact C-N 3.27Å; G106-A108 PolarHBondContact O-N 3.19Å; G106-D109 PolarHBondContact N-OD2 2.95Å; G106-D109 WeakPolarHBondContact O-CB 3.49Å; G106-D109 PolarHBondContact O-N 2.83Å
107	E	89.1	Confident	90.2	Very high	171 Å²	171	48.3 Å²	48.3	80%	0.799	26%	0.261	S	S	*	.	H	α-helix	trans	-63.8	-31	179.9	-66	-167.3	164.5	0	0	113.1	A105 D109 I110 R111	A105-E107 PolarHBondContact O-N 3.28Å; A105-E107 VanDerWaalsContact O-N 3.16Å; E107-D109 VanDerWaalsContact C-N 3.31Å; E107-D109 PolarHBondContact O-N 3.43Å; E107-I110 PolarHBondContact O-N 3.19Å; E107-R111 PolarHBondContact O-N 3.41Å
108	A	91.6	Very high	90.8	Very high	12 Å²	12	47.4 Å²	47.4	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-35.1	176.8	0	0	0	0	0	111.6	G93 Y95 A105 G106 I110 R111 V112	G93-A108 VanDerWaalsContact CA-CB 3.45Å; Y95-A108 HydrophobicContact CE2-CB 4.44Å; A105-A108 HydrophobicContact CB-CB 4.09Å; A105-A108 WeakPolarHBondContact O-CB 3.25Å; A105-A108 PolarHBondContact O-N 3.42Å; G106-A108 VanDerWaalsContact C-N 3.27Å; G106-A108 PolarHBondContact O-N 3.19Å; A108-I110 VanDerWaalsContact C-N 3.31Å; A108-I110 PolarHBondContact O-N 3.48Å; A108-R111 PolarHBondContact O-N 2.95Å; A108-V112 WeakPolarHBondContact O-CG2 3.22Å; A108-V112 PolarHBondContact O-N 3.37Å
109	D	92.1	Very high	91.3	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-39.9	175	-72.1	-35.8	0	0	0	111.6	Y95 A105 G106 E107 V112 A113 C166	Y95-D109 PolarHBondContact OH-OD1 3.03Å; A105-D109 WeakPolarHBondContact CA-OD2 3.32Å; A105-D109 WeakPolarHBondContact CB-OD1 3.46Å; A105-D109 PolarHBondContact N-OD2 3.43Å; G106-D109 PolarHBondContact N-OD2 2.95Å; G106-D109 WeakPolarHBondContact O-CB 3.49Å; G106-D109 PolarHBondContact O-N 2.83Å; E107-D109 VanDerWaalsContact C-N 3.31Å; E107-D109 PolarHBondContact O-N 3.43Å; D109-V112 PolarHBondContact O-N 3Å; D109-A113 WeakPolarHBondContact O-CB 3.38Å; D109-A113 PolarHBondContact O-N 3.26Å; D109-C166 HydrophobicContact CB-CB 4.09Å
110	I	92.3	Very high	91.9	Very high	69 Å²	69	43.6 Å²	43.6	35%	0.354	23%	0.23	S	C	.	.	H	α-helix	trans	-67	-40.6	176.3	-62.1	169.5	0	0	0	110.3	E107 A108 A113 K114	E107-I110 PolarHBondContact O-N 3.19Å; A108-I110 VanDerWaalsContact C-N 3.31Å; A108-I110 PolarHBondContact O-N 3.48Å; I110-A113 PolarHBondContact O-N 2.84Å; I110-K114 HydrophobicContact CG2-CD 4.48Å; I110-K114 WeakPolarHBondContact O-CG 3.25Å; I110-K114 PolarHBondContact O-N 2.81Å
111	R	94.6	Very high	92.1	Very high	68 Å²	68	45.8 Å²	45.8	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-63.5	-46.2	176.3	-165	179.3	171.6	-176.7	-1	111	E85 S89 E92 E107 A108 A113 K114 V115	E85-R111 IonicContact OE1-CZ 3.6Å; E85-R111 IonicContact OE1-NH2 2.76Å; E85-R111 PolarHBondContact OE1-NH2 2.92Å; E85-R111 IonicContact OE2-CZ 3.96Å; E85-R111 VanDerWaalsContact OE2-CZ 3.25Å; E85-R111 IonicContact OE2-NE 2.66Å; E85-R111 PolarHBondContact OE2-NE 3.43Å; E85-R111 IonicContact OE2-NH2 2.9Å; E85-R111 PolarHBondContact OE2-NH2 3.45Å; S89-R111 WeakPolarHBondContact OG-CD 3.37Å; S89-R111 WeakPolarHBondContact OG-CG 3.42Å; S89-R111 PolarHBondContact OG-NE 2.88Å; E92-R111 IonicContact OE1-NH1 3.12Å; E92-R111 IonicContact OE2-NH1 4Å; E92-R111 PolarHBondContact OE2-NH1 3.44Å; E107-R111 PolarHBondContact O-N 3.41Å; A108-R111 PolarHBondContact O-N 2.95Å; R111-A113 PolarHBondContact O-N 3.46Å; R111-K114 WeakPolarHBondContact O-CB 3.48Å; R111-K114 PolarHBondContact O-N 2.91Å; R111-V115 WeakPolarHBondContact O-CG2 3.29Å; R111-V115 PolarHBondContact O-N 3.01Å; R111-V115 VanDerWaalsContact O-N 3.13Å
112	V	95.6	Very high	92.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-48.4	173.6	170.4	0	0	0	0	110.6	L86 T90 Y95 A108 D109 K114 V115 L116 C166 F170	L86-V112 HydrophobicContact CD2-CG1 4.13Å; T90-V112 HydrophobicContact CG2-CG2 4Å; Y95-V112 HydrophobicContact CE1-CG2 4.35Å; A108-V112 WeakPolarHBondContact O-CG2 3.22Å; A108-V112 PolarHBondContact O-N 3.37Å; D109-V112 PolarHBondContact O-N 3Å; V112-K114 VanDerWaalsContact C-N 3.32Å; V112-K114 PolarHBondContact O-N 3.43Å; V112-V115 PolarHBondContact O-N 2.89Å; V112-L116 HydrophobicContact CG1-CD1 4.06Å; V112-L116 HydrophobicContact CG1-CG 4.1Å; V112-L116 WeakPolarHBondContact O-CG 3.3Å; V112-L116 PolarHBondContact O-N 3.09Å; V112-C166 HydrophobicContact CB-CB 4.43Å; V112-C166 HydrophobicContact CG1-CB 4.16Å; V112-F170 HydrophobicContact CG1-CB 4.05Å
113	A	95.4	Very high	92.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-56.8	-43.5	178.4	0	0	0	0	0	112.6	W29 D109 I110 R111 V115 L116 W117 P165	W29-A113 HydrophobicContact CH2-CB 3.75Å; W29-A113 HydrophobicContact CZ3-CB 4.21Å; W29-A113 WeakPolarHBondContact CZ3-O 3.3Å; D109-A113 WeakPolarHBondContact O-CB 3.38Å; D109-A113 PolarHBondContact O-N 3.26Å; I110-A113 PolarHBondContact O-N 2.84Å; R111-A113 PolarHBondContact O-N 3.46Å; A113-V115 VanDerWaalsContact C-N 3.3Å; A113-V115 PolarHBondContact O-N 3.41Å; A113-L116 PolarHBondContact O-N 2.81Å; A113-W117 PolarHBondContact O-N 2.85Å; A113-P165 WeakPolarHBondContact CA-O 3.46Å; A113-P165 HydrophobicContact CB-CB 3.94Å; A113-P165 WeakPolarHBondContact CB-O 3.39Å
114	K	95.6	Very high	93.4	Very high	120 Å²	120	38.8 Å²	38.8	52%	0.522	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-40.1	175.8	-73.2	171.9	179.7	174.8	0	112	W29 I110 R111 V112 W117 W118	W29-K114 HydrophobicContact CH2-CB 4.43Å; W29-K114 HydrophobicContact CH2-CG 3.79Å; W29-K114 HydrophobicContact CZ2-CG 4.07Å; I110-K114 HydrophobicContact CG2-CD 4.48Å; I110-K114 WeakPolarHBondContact O-CG 3.25Å; I110-K114 PolarHBondContact O-N 2.81Å; R111-K114 WeakPolarHBondContact O-CB 3.48Å; R111-K114 PolarHBondContact O-N 2.91Å; V112-K114 VanDerWaalsContact C-N 3.32Å; V112-K114 PolarHBondContact O-N 3.43Å; K114-W117 WeakPolarHBondContact O-CB 3.44Å; K114-W117 PolarHBondContact O-N 3.35Å; K114-W118 PolarHBondContact O-N 3.25Å
115	V	96.8	Very high	94.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-72.2	-37.1	177.5	-174	0	0	0	0	111.1	M82 E85 L86 R111 V112 A113 W117 W118 Y119	M82-V115 HydrophobicContact CB-CG1 3.96Å; M82-V115 HydrophobicContact CG-CG1 4.06Å; E85-V115 HydrophobicContact CB-CG1 4.23Å; E85-V115 HydrophobicContact CB-CG2 3.51Å; E85-V115 HydrophobicContact CG-CG2 4.31Å; L86-V115 HydrophobicContact CD1-CG1 4.24Å; L86-V115 HydrophobicContact CD2-CB 4.16Å; L86-V115 HydrophobicContact CD2-CG1 4.09Å; L86-V115 HydrophobicContact CG-CB 4.3Å; L86-V115 HydrophobicContact CG-CG1 3.7Å; R111-V115 WeakPolarHBondContact O-CG2 3.29Å; R111-V115 PolarHBondContact O-N 3.01Å; R111-V115 VanDerWaalsContact O-N 3.13Å; V112-V115 PolarHBondContact O-N 2.89Å; A113-V115 VanDerWaalsContact C-N 3.3Å; A113-V115 PolarHBondContact O-N 3.41Å; V115-W117 PolarHBondContact O-N 3.2Å; V115-W118 WeakPolarHBondContact O-CB 3.5Å; V115-W118 PolarHBondContact O-N 3.34Å; V115-W118 VanDerWaalsContact O-N 3.14Å; V115-Y119 PolarHBondContact O-N 3.04Å
116	L	96.4	Very high	94.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-29.6	173.5	-65.6	-169.3	0	0	0	112.1	L86 V112 A113 Y119 Y120 W157 L161 P165 P173	L86-L116 HydrophobicContact CD2-CD2 4.08Å; V112-L116 HydrophobicContact CG1-CD1 4.06Å; V112-L116 HydrophobicContact CG1-CG 4.1Å; V112-L116 WeakPolarHBondContact O-CG 3.3Å; V112-L116 PolarHBondContact O-N 3.09Å; A113-L116 PolarHBondContact O-N 2.81Å; L116-Y119 WeakPolarHBondContact O-CB 3.47Å; L116-Y119 PolarHBondContact O-N 3.32Å; L116-Y120 PolarHBondContact O-N 2.86Å; L116-W157 HydrophobicContact CB-CZ3 4.35Å; L116-W157 HydrophobicContact CD1-CZ3 4.17Å; L116-W157 HydrophobicContact CD2-CH2 4.3Å; L116-W157 HydrophobicContact CD2-CZ3 4.13Å; L116-W157 HydrophobicContact CG-CZ3 4.46Å; L116-L161 HydrophobicContact CB-CD2 3.62Å; L116-P165 WeakPolarHBondContact CD1-O 3.4Å; L116-P173 HydrophobicContact CD2-CB 3.71Å; L116-P173 HydrophobicContact CD2-CG 3.59Å
117	W	96.8	Very high	95.1	Very high	42 Å²	42	34.3 Å²	34.3	16%	0.159	16%	0.157	C	C	.	.	H	α-helix	trans	-64.7	-44.5	169.2	178.5	89.4	0	0	0	112	W29 F30 A113 K114 V115 Y119 Y120 F121 L161	W29-W117 HydrophobicContact CE3-CB 3.78Å; W29-W117 AromaticContact CE3-CD1 3.88Å; W29-W117 AromaticContact CE3-CG 3.94Å; W29-W117 HydrophobicContact CE3-CG 3.94Å; W29-W117 HydrophobicContact CZ3-CB 3.76Å; W29-W117 HydrophobicContact CZ3-CG 4.41Å; F30-W117 HydrophobicContact CB-CZ2 3.93Å; F30-W117 HydrophobicContact CD1-CZ2 4Å; F30-W117 HydrophobicContact CG-CZ2 4.44Å; F30-W117 PolarHBondContact O-NE1 3.27Å; A113-W117 PolarHBondContact O-N 2.85Å; K114-W117 WeakPolarHBondContact O-CB 3.44Å; K114-W117 PolarHBondContact O-N 3.35Å; V115-W117 PolarHBondContact O-N 3.2Å; W117-Y119 PolarHBondContact O-N 3.07Å; W117-Y120 PolarHBondContact O-N 3.1Å; W117-F121 HydrophobicContact CH2-CB 4.48Å; W117-F121 HydrophobicContact CH2-CG 4.42Å; W117-F121 WeakPolarHBondContact O-CB 3.42Å; W117-F121 PolarHBondContact O-N 3.28Å; W117-L161 HydrophobicContact CB-CD1 4.38Å
118	W	97.4	Very high	95.4	Very high	96 Å²	96	29.3 Å²	29.3	36%	0.364	14%	0.136	S	C	.	.	H	α-helix	trans	-59.9	-37.5	171.7	-80.9	110.7	0	0	0	112	L78 Y81 M82 K114 V115 F121 S122	L78-W118 HydrophobicContact CD1-CE3 4.08Å; Y81-W118 AromaticContact CE1-CD1 3.97Å; Y81-W118 HydrophobicContact CE1-CG 4.31Å; M82-W118 HydrophobicContact CG-CB 4.25Å; M82-W118 HydrophobicContact SD-CB 4.15Å; K114-W118 PolarHBondContact O-N 3.25Å; V115-W118 WeakPolarHBondContact O-CB 3.5Å; V115-W118 PolarHBondContact O-N 3.34Å; V115-W118 VanDerWaalsContact O-N 3.14Å; W118-F121 HydrophobicContact CE3-CD1 4.26Å; W118-F121 HydrophobicContact CZ3-CD1 4.14Å; W118-F121 PolarHBondContact O-N 3.33Å; W118-S122 WeakPolarHBondContact O-CB 3.2Å; W118-S122 PolarHBondContact O-N 2.96Å
119	Y	97	Very high	95.5	Very high	3 Å²	3	29.3 Å²	29.3	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-47.8	175	-176.4	-87.9	0	0	0	111.8	M82 V115 L116 W117 S122 K123 M153 W157 P173 N176	M82-Y119 HydrophobicContact CE-CD2 4.34Å; M82-Y119 WeakPolarHBondContact SD-CA 3.46Å; M82-Y119 HydrophobicContact SD-CD2 4.21Å; M82-Y119 PolarHBondContact SD-N 2.95Å; M82-Y119 VanDerWaalsContact SD-N 3.45Å; V115-Y119 PolarHBondContact O-N 3.04Å; L116-Y119 WeakPolarHBondContact O-CB 3.47Å; L116-Y119 PolarHBondContact O-N 3.32Å; W117-Y119 PolarHBondContact O-N 3.07Å; Y119-S122 WeakPolarHBondContact O-CB 3.31Å; Y119-S122 PolarHBondContact O-N 3.15Å; Y119-S122 PolarHBondContact O-OG 3.4Å; Y119-K123 HydrophobicContact CE1-CD 4.47Å; Y119-K123 VanDerWaalsContact CE1-CE 3.42Å; Y119-K123 HydrophobicContact CE1-CG 4.48Å; Y119-K123 PolarHBondContact O-N 2.98Å; Y119-K123 WeakPolarHBondContact OH-CE 3.38Å; Y119-M153 HydrophobicContact CE1-CE 4.4Å; Y119-M153 WeakPolarHBondContact OH-CE 3.21Å; Y119-W157 AromaticContact CD1-CD2 3.67Å; Y119-W157 HydrophobicContact CD1-CD2 3.67Å; Y119-W157 AromaticContact CD1-CE2 3.73Å; Y119-W157 AromaticContact CD1-CE3 3.94Å; Y119-W157 HydrophobicContact CD1-CE3 3.94Å; Y119-W157 HydrophobicContact CD1-CG 4.19Å; Y119-W157 HydrophobicContact CD1-CH2 4.35Å; Y119-W157 HydrophobicContact CD1-CZ2 4.08Å; Y119-W157 HydrophobicContact CD1-CZ3 4.26Å; Y119-W157 AromaticContact CE1-CD1 3.82Å; Y119-W157 AromaticContact CE1-CD2 3.68Å; Y119-W157 HydrophobicContact CE1-CD2 3.68Å; Y119-W157 AromaticContact CE1-CE2 3.29Å; Y119-W157 HydrophobicContact CE1-CE3 4.36Å; Y119-W157 HydrophobicContact CE1-CG 4.03Å; Y119-W157 HydrophobicContact CE1-CH2 4.43Å; Y119-W157 AromaticContact CE1-CZ2 3.73Å; Y119-W157 HydrophobicContact CE1-CZ2 3.73Å; Y119-W157 AromaticContact CE1-NE1 3.38Å; Y119-P173 HydrophobicContact CD1-CB 4.44Å; Y119-P173 HydrophobicContact CD1-CG 4.35Å; Y119-P173 HydrophobicContact CD2-CB 3.85Å; Y119-P173 HydrophobicContact CE1-CG 4.36Å; Y119-P173 HydrophobicContact CE2-CB 3.95Å; Y119-P173 HydrophobicContact CG-CB 4.09Å; Y119-P173 HydrophobicContact CG-CG 4.47Å; Y119-N176 HydrophobicContact CE2-CB 4.12Å; Y119-N176 WeakPolarHBondContact CE2-OD1 3.32Å; Y119-N176 PolarHBondContact OH-OD1 3.47Å
120	Y	96.3	Very high	95.6	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-58.6	-48.6	173.4	161.2	-110.7	0	0	0	112	M31 L32 T38 L116 W117 S122 K123 F154 W157 W158 L161	M31-Y120 HydrophobicContact CB-CE1 4.24Å; L32-Y120 HydrophobicContact CD2-CD1 4.13Å; L32-Y120 HydrophobicContact CD2-CE1 3.94Å; T38-Y120 HydrophobicContact CG2-CE2 4.26Å; T38-Y120 PolarHBondContact OG1-OH 2.83Å; L116-Y120 PolarHBondContact O-N 2.86Å; W117-Y120 PolarHBondContact O-N 3.1Å; Y120-S122 VanDerWaalsContact C-N 3.26Å; Y120-S122 PolarHBondContact O-N 3.35Å; Y120-K123 WeakPolarHBondContact O-CB 3.41Å; Y120-K123 PolarHBondContact O-N 3.42Å; Y120-F154 AromaticContact CD2-CD2 3.88Å; Y120-F154 HydrophobicContact CD2-CD2 3.88Å; Y120-F154 AromaticContact CD2-CE2 3.84Å; Y120-F154 HydrophobicContact CD2-CE2 3.84Å; Y120-F154 HydrophobicContact CE1-CE2 4.32Å; Y120-F154 AromaticContact CE2-CD2 3.48Å; Y120-F154 HydrophobicContact CE2-CD2 3.48Å; Y120-F154 VanDerWaalsContact CE2-CD2 3.48Å; Y120-F154 AromaticContact CE2-CE2 3.16Å; Y120-F154 HydrophobicContact CE2-CE2 3.16Å; Y120-F154 HydrophobicContact CE2-CG 4.42Å; Y120-F154 AromaticContact CE2-CZ 3.94Å; Y120-F154 HydrophobicContact CE2-CZ 3.94Å; Y120-F154 WeakPolarHBondContact CE2-O 3.42Å; Y120-F154 AromaticContact CZ-CE2 3.46Å; Y120-F154 VanDerWaalsContact CZ-CE2 3.46Å; Y120-F154 AromaticContact CZ-CZ 3.91Å; Y120-W157 HydrophobicContact CD2-CB 3.9Å; Y120-W158 HydrophobicContact CD2-CB 4.49Å; Y120-W158 HydrophobicContact CE2-CB 3.8Å; Y120-L161 HydrophobicContact CD1-CD1 3.95Å; Y120-L161 HydrophobicContact CG-CD1 3.73Å
121	F	95.9	Very high	95.7	Very high	60 Å²	60	28.6 Å²	28.6	26%	0.263	13%	0.13	S	C	.	.	H	α-helix	trans	-60	-39.6	178.5	-175	-104.3	0	0	0	111.3	F30 W117 W118 K123 S124 V125	F30-F121 HydrophobicContact CE1-CE2 4.29Å; W117-F121 HydrophobicContact CH2-CB 4.48Å; W117-F121 HydrophobicContact CH2-CG 4.42Å; W117-F121 WeakPolarHBondContact O-CB 3.42Å; W117-F121 PolarHBondContact O-N 3.28Å; W118-F121 HydrophobicContact CE3-CD1 4.26Å; W118-F121 HydrophobicContact CZ3-CD1 4.14Å; W118-F121 PolarHBondContact O-N 3.33Å; F121-K123 PolarHBondContact O-N 3.21Å; F121-S124 WeakPolarHBondContact O-CB 3.29Å; F121-S124 PolarHBondContact O-N 3.03Å; F121-S124 PolarHBondContact O-OG 3.49Å; F121-V125 HydrophobicContact CD1-CG2 4.19Å; F121-V125 HydrophobicContact CE1-CG2 3.85Å; F121-V125 HydrophobicContact CZ-CG2 4.34Å; F121-V125 PolarHBondContact O-N 3.2Å
122	S	96.4	Very high	95.6	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-55.3	-37.8	176	81.2	0	0	0	0	111.9	W118 Y119 Y120 S124 V125 E126	W118-S122 WeakPolarHBondContact O-CB 3.2Å; W118-S122 PolarHBondContact O-N 2.96Å; Y119-S122 WeakPolarHBondContact O-CB 3.31Å; Y119-S122 PolarHBondContact O-N 3.15Å; Y119-S122 PolarHBondContact O-OG 3.4Å; Y120-S122 VanDerWaalsContact C-N 3.26Å; Y120-S122 PolarHBondContact O-N 3.35Å; S122-S124 VanDerWaalsContact C-N 3.29Å; S122-S124 PolarHBondContact O-N 2.89Å; S122-V125 CarbonylContact O-C 3.52Å; S122-V125 WeakPolarHBondContact O-CA 3.44Å; S122-V125 WeakPolarHBondContact O-CB 3.26Å; S122-V125 PolarHBondContact O-N 3.42Å; S122-E126 VanDerWaalsContact O-CG 3.26Å; S122-E126 WeakPolarHBondContact O-CG 3.34Å; S122-E126 PolarHBondContact O-N 3.44Å
123	K	95.7	Very high	95.5	Very high	3 Å²	3	27.7 Å²	27.7	1%	0.013	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-32	178.7	-54	-55.6	152.7	-161.5	0	113.4	Y119 Y120 F121 E126 F154 N176 H180	Y119-K123 HydrophobicContact CE1-CD 4.47Å; Y119-K123 VanDerWaalsContact CE1-CE 3.42Å; Y119-K123 HydrophobicContact CE1-CG 4.48Å; Y119-K123 PolarHBondContact O-N 2.98Å; Y119-K123 WeakPolarHBondContact OH-CE 3.38Å; Y120-K123 WeakPolarHBondContact O-CB 3.41Å; Y120-K123 PolarHBondContact O-N 3.42Å; F121-K123 PolarHBondContact O-N 3.21Å; K123-E126 WeakPolarHBondContact CD-OE2 3.32Å; K123-E126 IonicContact NZ-OE1 3.25Å; K123-E126 PolarHBondContact NZ-OE1 2.88Å; K123-E126 IonicContact NZ-OE2 3.68Å; K123-E126 PolarHBondContact NZ-OE2 3.49Å; K123-E126 PolarHBondContact O-N 2.88Å; K123-F154 HydrophobicContact CB-CB 4.26Å; K123-F154 HydrophobicContact CB-CD2 4.04Å; K123-N176 PolarHBondContact NZ-OD1 2.85Å; K123-H180 PolarHBondContact NZ-CE1 2.73Å; K123-H180 VanDerWaalsContact NZ-CE1 3.29Å
124	S	95.3	Very high	95.4	Very high	21 Å²	21	27.8 Å²	27.8	15%	0.147	13%	0.129	C	C	.	.	H	α-helix	trans	-66.7	-39	171.6	77.6	0	0	0	0	111.9	F121 S122 F127	F121-S124 WeakPolarHBondContact O-CB 3.29Å; F121-S124 PolarHBondContact O-N 3.03Å; F121-S124 PolarHBondContact O-OG 3.49Å; S122-S124 VanDerWaalsContact C-N 3.29Å; S122-S124 PolarHBondContact O-N 2.89Å; S124-F127 WeakPolarHBondContact O-CB 3.5Å; S124-F127 WeakPolarHBondContact O-CD2 3.49Å; S124-F127 PolarHBondContact O-N 3.05Å
125	V	96.3	Very high	95.2	Very high	37 Å²	37	24.2 Å²	24.2	22%	0.224	12%	0.115	C	C	.	.	H	α-helix	trans	-69.3	-37.4	178.1	-175.7	0	0	0	0	110.5	Y71 I75 F121 S122 F127 L128	Y71-V125 HydrophobicContact CE2-CG1 4.13Å; I75-V125 HydrophobicContact CD1-CB 4.3Å; I75-V125 HydrophobicContact CD1-CG1 3.69Å; F121-V125 HydrophobicContact CD1-CG2 4.19Å; F121-V125 HydrophobicContact CE1-CG2 3.85Å; F121-V125 HydrophobicContact CZ-CG2 4.34Å; F121-V125 PolarHBondContact O-N 3.2Å; S122-V125 CarbonylContact O-C 3.52Å; S122-V125 WeakPolarHBondContact O-CA 3.44Å; S122-V125 WeakPolarHBondContact O-CB 3.26Å; S122-V125 PolarHBondContact O-N 3.42Å; V125-F127 PolarHBondContact O-N 3.33Å; V125-F127 VanDerWaalsContact O-N 3.13Å; V125-L128 HydrophobicContact CG1-CD1 4.11Å; V125-L128 WeakPolarHBondContact O-CB 3.44Å; V125-L128 VanDerWaalsContact O-CG 3.26Å; V125-L128 WeakPolarHBondContact O-CG 3.41Å; V125-L128 PolarHBondContact O-N 2.98Å
126	E	95.6	Very high	95	Very high	1 Å²	1	28 Å²	28	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-63	-16.3	177.4	-67.9	177.9	-169	0	0	113.5	S122 K123 L128 D129 H150 H180 Y184	S122-E126 VanDerWaalsContact O-CG 3.26Å; S122-E126 WeakPolarHBondContact O-CG 3.34Å; S122-E126 PolarHBondContact O-N 3.44Å; K123-E126 WeakPolarHBondContact CD-OE2 3.32Å; K123-E126 IonicContact NZ-OE1 3.25Å; K123-E126 PolarHBondContact NZ-OE1 2.88Å; K123-E126 IonicContact NZ-OE2 3.68Å; K123-E126 PolarHBondContact NZ-OE2 3.49Å; K123-E126 PolarHBondContact O-N 2.88Å; E126-L128 PolarHBondContact O-N 2.85Å; E126-L128 VanDerWaalsContact O-N 3.16Å; E126-D129 VanDerWaalsContact O-CB 3.28Å; E126-D129 WeakPolarHBondContact O-CB 3.34Å; E126-D129 PolarHBondContact O-N 3.06Å; E126-H150 IonicContact OE2-CE1 2.74Å; E126-H180 IonicContact OE1-CE1 2.77Å; E126-H180 PolarHBondContact OE1-CE1 2.59Å; E126-H180 IonicContact OE1-ND1 2.89Å; E126-H180 PolarHBondContact OE1-ND1 3.38Å; E126-H180 IonicContact OE2-CE1 3Å; E126-H180 PolarHBondContact OE2-CE1 2.85Å; E126-Y184 WeakPolarHBondContact CG-OH 3.31Å
127	F	96	Very high	94.7	Very high	13 Å²	13	32.2 Å²	32.2	6%	0.057	15%	0.148	C	C	.	.	H	α-helix	trans	-57.3	-26.8	168.4	-70.2	-29.8	0	0	0	112.9	Y45 S124 V125 D129 T130 I131 H150 F154	Y45-F127 AromaticContact CD1-CD1 3.91Å; Y45-F127 HydrophobicContact CD1-CD1 3.91Å; Y45-F127 AromaticContact CD1-CE1 3.76Å; Y45-F127 HydrophobicContact CD1-CE1 3.76Å; Y45-F127 HydrophobicContact CD1-CZ 4.29Å; Y45-F127 HydrophobicContact CD2-CB 3.64Å; Y45-F127 AromaticContact CD2-CD1 3.49Å; Y45-F127 HydrophobicContact CD2-CD1 3.49Å; Y45-F127 VanDerWaalsContact CD2-CD1 3.49Å; Y45-F127 HydrophobicContact CD2-CD2 4.41Å; Y45-F127 HydrophobicContact CD2-CE1 4.19Å; Y45-F127 AromaticContact CD2-CG 3.62Å; Y45-F127 HydrophobicContact CD2-CG 3.62Å; Y45-F127 HydrophobicContact CE1-CD1 4.12Å; Y45-F127 HydrophobicContact CE1-CE1 4.06Å; Y45-F127 HydrophobicContact CE2-CB 4.14Å; Y45-F127 AromaticContact CE2-CD1 3.7Å; Y45-F127 HydrophobicContact CE2-CD1 3.7Å; Y45-F127 HydrophobicContact CE2-CE1 4.44Å; Y45-F127 HydrophobicContact CE2-CG 4.19Å; Y45-F127 HydrophobicContact CG-CB 4.3Å; Y45-F127 AromaticContact CG-CD1 3.58Å; Y45-F127 HydrophobicContact CG-CD1 3.58Å; Y45-F127 HydrophobicContact CG-CD2 4.24Å; Y45-F127 AromaticContact CG-CE1 3.82Å; Y45-F127 HydrophobicContact CG-CE1 3.82Å; Y45-F127 HydrophobicContact CG-CE2 4.45Å; Y45-F127 AromaticContact CG-CG 3.81Å; Y45-F127 HydrophobicContact CG-CG 3.81Å; Y45-F127 HydrophobicContact CG-CZ 4.26Å; S124-F127 WeakPolarHBondContact O-CB 3.5Å; S124-F127 WeakPolarHBondContact O-CD2 3.49Å; S124-F127 PolarHBondContact O-N 3.05Å; V125-F127 PolarHBondContact O-N 3.33Å; V125-F127 VanDerWaalsContact O-N 3.13Å; F127-D129 PolarHBondContact O-N 3Å; F127-T130 PolarHBondContact O-N 3.01Å; F127-I131 PolarHBondContact O-N 2.76Å; F127-H150 HydrophobicContact CD1-CB 4.15Å; F127-H150 HydrophobicContact CE1-CB 4.12Å; F127-H150 VanDerWaalsContact CE1-O 3.31Å; F127-H150 WeakPolarHBondContact CE1-O 3.37Å; F127-F154 HydrophobicContact CE1-CB 4.39Å; F127-F154 HydrophobicContact CE2-CB 4.46Å; F127-F154 AromaticContact CE2-CD1 3.59Å; F127-F154 HydrophobicContact CE2-CD1 3.59Å; F127-F154 HydrophobicContact CE2-CE1 4.01Å; F127-F154 HydrophobicContact CE2-CG 4.11Å; F127-F154 HydrophobicContact CZ-CB 3.74Å; F127-F154 AromaticContact CZ-CD1 3.59Å; F127-F154 HydrophobicContact CZ-CD1 3.59Å; F127-F154 HydrophobicContact CZ-CE1 4.45Å; F127-F154 AromaticContact CZ-CG 3.87Å; F127-F154 HydrophobicContact CZ-CG 3.87Å
128	L	95.3	Very high	94.3	Very high	65 Å²	65	34.7 Å²	34.7	34%	0.34	16%	0.16	S	C	.	.	H	α-helix	trans	-61.4	-26.5	175.4	-64.9	172.8	0	0	0	112.7	Y71 V125 E126 T130 I131 F132	Y71-L128 HydrophobicContact CD2-CB 4.5Å; Y71-L128 HydrophobicContact CD2-CD1 4.24Å; Y71-L128 HydrophobicContact CE2-CB 3.78Å; Y71-L128 HydrophobicContact CE2-CD1 3.93Å; Y71-L128 HydrophobicContact CE2-CG 4.48Å; V125-L128 HydrophobicContact CG1-CD1 4.11Å; V125-L128 WeakPolarHBondContact O-CB 3.44Å; V125-L128 VanDerWaalsContact O-CG 3.26Å; V125-L128 WeakPolarHBondContact O-CG 3.41Å; V125-L128 PolarHBondContact O-N 2.98Å; E126-L128 PolarHBondContact O-N 2.85Å; E126-L128 VanDerWaalsContact O-N 3.16Å; L128-T130 VanDerWaalsContact C-N 3.26Å; L128-T130 PolarHBondContact O-N 3.32Å; L128-I131 HydrophobicContact CD2-CD1 3.99Å; L128-I131 PolarHBondContact O-N 3.12Å; L128-F132 HydrophobicContact CB-CD2 4.34Å; L128-F132 HydrophobicContact CB-CE2 3.88Å; L128-F132 HydrophobicContact CB-CZ 4.44Å; L128-F132 WeakPolarHBondContact O-CD2 3.42Å; L128-F132 WeakPolarHBondContact O-CG 3.47Å; L128-F132 PolarHBondContact O-N 3.42Å
129	D	93.4	Very high	93.7	Very high	13 Å²	13	33.6 Å²	33.6	7%	0.07	16%	0.164	C	C	.	.	H	α-helix	trans	-52.7	-48.8	174.3	-74.1	-15.4	0	0	0	111.3	Y71 E126 F127 F132 F133 H150 Y184	Y71-D129 WeakPolarHBondContact CE1-OD1 3.26Å; Y71-D129 VanDerWaalsContact CZ-OD1 3.22Å; Y71-D129 PolarHBondContact OH-OD1 3.41Å; E126-D129 VanDerWaalsContact O-CB 3.28Å; E126-D129 WeakPolarHBondContact O-CB 3.34Å; E126-D129 PolarHBondContact O-N 3.06Å; F127-D129 PolarHBondContact O-N 3Å; D129-F132 PolarHBondContact O-N 3.13Å; D129-F133 VanDerWaalsContact O-CG 3.32Å; D129-F133 WeakPolarHBondContact O-CG 3.21Å; D129-F133 PolarHBondContact O-N 2.82Å; D129-H150 IonicContact OD2-CE1 3.85Å; D129-Y184 PolarHBondContact OD2-OH 3.2Å
130	T	93.8	Very high	93.1	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-71	-38.8	-176.9	-41.2	0	0	0	0	110.8	Y45 I49 F127 L128 F132 F133 V134 I142 H146	Y45-T130 HydrophobicContact CE2-CG2 4.1Å; Y45-T130 WeakPolarHBondContact CE2-OG1 3.32Å; Y45-T130 PolarHBondContact OH-OG1 3.31Å; Y45-T130 VanDerWaalsContact OH-OG1 3.08Å; I49-T130 HydrophobicContact CD1-CG2 3.78Å; I49-T130 HydrophobicContact CG1-CG2 3.71Å; F127-T130 PolarHBondContact O-N 3.01Å; L128-T130 VanDerWaalsContact C-N 3.26Å; L128-T130 PolarHBondContact O-N 3.32Å; T130-F132 VanDerWaalsContact C-N 3.31Å; T130-F132 PolarHBondContact O-N 2.69Å; T130-F133 WeakPolarHBondContact O-CB 3.45Å; T130-F133 PolarHBondContact O-N 3.34Å; T130-F133 VanDerWaalsContact O-N 3.14Å; T130-V134 WeakPolarHBondContact O-CG2 3.44Å; T130-V134 PolarHBondContact O-N 2.94Å; T130-I142 HydrophobicContact CG2-CD1 4.12Å; T130-I142 HydrophobicContact CG2-CG1 4.07Å; T130-I142 HydrophobicContact CG2-CG2 3.94Å; T130-H146 PolarHBondContact OG1-CD2 3.13Å; T130-H146 PolarHBondContact OG1-NE2 3.28Å
131	I	93.8	Very high	92.5	Very high	54 Å²	54	41.5 Å²	41.5	28%	0.277	21%	0.211	S	C	.	.	H	α-helix	trans	-60.3	-44.2	174.7	-66	165.8	0	0	0	109.6	F127 L128 F133 V134 L135	F127-I131 PolarHBondContact O-N 2.76Å; L128-I131 HydrophobicContact CD2-CD1 3.99Å; L128-I131 PolarHBondContact O-N 3.12Å; I131-F133 VanDerWaalsContact C-N 3.35Å; I131-F133 PolarHBondContact O-N 3.45Å; I131-V134 PolarHBondContact O-N 3.21Å; I131-L135 HydrophobicContact CG2-CD1 3.92Å; I131-L135 HydrophobicContact CG2-CG 4.3Å; I131-L135 WeakPolarHBondContact O-CB 3.38Å; I131-L135 VanDerWaalsContact O-CG 3.3Å; I131-L135 WeakPolarHBondContact O-CG 3.4Å; I131-L135 PolarHBondContact O-N 2.97Å
132	F	93.9	Very high	92.3	Very high	23 Å²	23	40.1 Å²	40.1	10%	0.101	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-38.1	174.5	-66.4	-46.5	0	0	0	112.7	L64 I67 L68 Y71 L128 D129 T130 L135 R136	L64-F132 HydrophobicContact CD1-CD1 4Å; I67-F132 HydrophobicContact CG2-CE1 3.86Å; I67-F132 HydrophobicContact CG2-CZ 3.88Å; L68-F132 HydrophobicContact CD1-CB 4.17Å; L68-F132 HydrophobicContact CD1-CD1 3.65Å; L68-F132 HydrophobicContact CD1-CD2 4.25Å; L68-F132 HydrophobicContact CD1-CE1 4.07Å; L68-F132 HydrophobicContact CD1-CG 3.77Å; L68-F132 HydrophobicContact CG-CD2 4.47Å; L68-F132 HydrophobicContact CG-CG 4.35Å; Y71-F132 HydrophobicContact CD1-CD2 4.14Å; Y71-F132 AromaticContact CD1-CE2 3.66Å; Y71-F132 HydrophobicContact CD1-CE2 3.66Å; Y71-F132 AromaticContact CD2-CE2 3.81Å; Y71-F132 HydrophobicContact CD2-CE2 3.81Å; Y71-F132 HydrophobicContact CD2-CZ 4.44Å; Y71-F132 HydrophobicContact CE1-CD2 4.2Å; Y71-F132 AromaticContact CE1-CE2 3.97Å; Y71-F132 HydrophobicContact CE1-CE2 3.97Å; Y71-F132 HydrophobicContact CE2-CE2 4.1Å; Y71-F132 HydrophobicContact CG-CD2 4.48Å; Y71-F132 AromaticContact CG-CE2 3.56Å; Y71-F132 HydrophobicContact CG-CE2 3.56Å; Y71-F132 HydrophobicContact CG-CZ 4.27Å; L128-F132 HydrophobicContact CB-CD2 4.34Å; L128-F132 HydrophobicContact CB-CE2 3.88Å; L128-F132 HydrophobicContact CB-CZ 4.44Å; L128-F132 WeakPolarHBondContact O-CD2 3.42Å; L128-F132 WeakPolarHBondContact O-CG 3.47Å; L128-F132 PolarHBondContact O-N 3.42Å; D129-F132 PolarHBondContact O-N 3.13Å; T130-F132 VanDerWaalsContact C-N 3.31Å; T130-F132 PolarHBondContact O-N 2.69Å; F132-L135 PolarHBondContact O-N 3.02Å; F132-R136 VanDerWaalsContact O-CB 3.28Å; F132-R136 WeakPolarHBondContact O-CB 3.33Å; F132-R136 VanDerWaalsContact O-CG 3.23Å; F132-R136 WeakPolarHBondContact O-CG 3.43Å; F132-R136 PolarHBondContact O-N 3.44Å
133	F	92.4	Very high	92	Very high	26 Å²	26	42.6 Å²	42.6	11%	0.114	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-42.7	173.8	-63.4	-24.9	0	0	0	112.2	D129 T130 I131 R136 K137 K138 Q141 I142 H146	D129-F133 VanDerWaalsContact O-CG 3.32Å; D129-F133 WeakPolarHBondContact O-CG 3.21Å; D129-F133 PolarHBondContact O-N 2.82Å; T130-F133 WeakPolarHBondContact O-CB 3.45Å; T130-F133 PolarHBondContact O-N 3.34Å; T130-F133 VanDerWaalsContact O-N 3.14Å; I131-F133 VanDerWaalsContact C-N 3.35Å; I131-F133 PolarHBondContact O-N 3.45Å; F133-R136 PolarHBondContact O-N 2.86Å; F133-K137 PolarHBondContact O-N 3.11Å; F133-K138 PolarHBondContact O-N 3.32Å; F133-Q141 HydrophobicContact CD1-CB 4.25Å; F133-Q141 HydrophobicContact CD2-CB 3.82Å; F133-Q141 HydrophobicContact CE1-CB 4.37Å; F133-Q141 HydrophobicContact CE2-CB 3.94Å; F133-Q141 HydrophobicContact CG-CB 3.99Å; F133-Q141 HydrophobicContact CZ-CB 4.23Å; F133-I142 HydrophobicContact CB-CD1 4.08Å; F133-I142 HydrophobicContact CB-CG1 3.8Å; F133-I142 HydrophobicContact CD2-CG1 4.19Å; F133-I142 HydrophobicContact CG-CG1 4.49Å; F133-H146 AromaticContact CE2-CE1 3.69Å
134	V	93.4	Very high	91.8	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.024	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-51	176.3	174.8	0	0	0	0	111	M56 T130 I131 R136 K137 I142	M56-V134 HydrophobicContact CG-CG1 4.31Å; T130-V134 WeakPolarHBondContact O-CG2 3.44Å; T130-V134 PolarHBondContact O-N 2.94Å; I131-V134 PolarHBondContact O-N 3.21Å; V134-R136 PolarHBondContact O-N 3.11Å; V134-K137 PolarHBondContact O-N 3.2Å; V134-I142 HydrophobicContact CG2-CD1 3.41Å; V134-I142 VanDerWaalsContact CG2-CD1 3.41Å
135	L	92.4	Very high	91.5	Very high	45 Å²	45	49.4 Å²	49.4	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-27.7	-178.7	-67.6	178.5	0	0	0	113.3	M56 L62 L64 I131 F132	M56-L135 WeakPolarHBondContact CE-O 3.23Å; M56-L135 HydrophobicContact SD-CD2 4.21Å; L62-L135 HydrophobicContact CD1-CB 4.31Å; L62-L135 HydrophobicContact CD1-CD2 4.18Å; L62-L135 PolarHBondContact N-O 2.78Å; L62-L135 VanDerWaalsContact N-O 3.08Å; L64-L135 HydrophobicContact CD1-CB 3.9Å; L64-L135 HydrophobicContact CD1-CD1 3.96Å; I131-L135 HydrophobicContact CG2-CD1 3.92Å; I131-L135 HydrophobicContact CG2-CG 4.3Å; I131-L135 WeakPolarHBondContact O-CB 3.38Å; I131-L135 VanDerWaalsContact O-CG 3.3Å; I131-L135 WeakPolarHBondContact O-CG 3.4Å; I131-L135 PolarHBondContact O-N 2.97Å; F132-L135 PolarHBondContact O-N 3.02Å
136	R	91.9	Very high	91.3	Very high	79 Å²	79	49 Å²	49	30%	0.298	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	3.6	175.5	-65.8	179.9	68	-159	1.5	113.7	A61 L68 F132 F133 V134 K138	A61-R136 WeakPolarHBondContact CB-O 3.39Å; L68-R136 VanDerWaalsContact CD2-NH1 3.28Å; F132-R136 VanDerWaalsContact O-CB 3.28Å; F132-R136 WeakPolarHBondContact O-CB 3.33Å; F132-R136 VanDerWaalsContact O-CG 3.23Å; F132-R136 WeakPolarHBondContact O-CG 3.43Å; F132-R136 PolarHBondContact O-N 3.44Å; F133-R136 PolarHBondContact O-N 2.86Å; V134-R136 PolarHBondContact O-N 3.11Å; R136-K138 HydrophobicContact CB-CG 3.99Å; R136-K138 PolarHBondContact O-N 2.89Å
137	K	89.1	Confident	91.2	Very high	89 Å²	89	50.5 Å²	50.5	39%	0.387	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	37.3	-173.5	-54.7	-174	84.9	162.4	0	112.7	M56 K57 R59 A61 F133 V134 T139	M56-K137 HydrophobicContact CB-CG 4.47Å; M56-K137 HydrophobicContact CE-CD 4.41Å; M56-K137 HydrophobicContact CE-CG 4Å; M56-K137 WeakPolarHBondContact O-CE 3.48Å; M56-K137 PolarHBondContact O-NZ 2.83Å; K57-K137 PolarHBondContact O-NZ 3.2Å; K57-K137 VanDerWaalsContact O-NZ 3.12Å; R59-K137 WeakPolarHBondContact O-CD 3.41Å; R59-K137 PolarHBondContact O-NZ 3.29Å; A61-K137 HydrophobicContact CB-CB 4.25Å; A61-K137 HydrophobicContact CB-CD 4.29Å; A61-K137 HydrophobicContact CB-CG 4.11Å; F133-K137 PolarHBondContact O-N 3.11Å; V134-K137 PolarHBondContact O-N 3.2Å; K137-T139 VanDerWaalsContact C-N 3.32Å; K137-T139 PolarHBondContact O-N 3.48Å
138	K	88.3	Confident	91.1	Very high	95 Å²	95	53.2 Å²	53.2	41%	0.413	27%	0.265	S	S	.	.			trans	-98	48.9	174.8	-63.3	-62.1	-175.2	-178.1	0	110.8	F133 R136 S140 Q141	F133-K138 PolarHBondContact O-N 3.32Å; R136-K138 HydrophobicContact CB-CG 3.99Å; R136-K138 PolarHBondContact O-N 2.89Å; K138-S140 PolarHBondContact O-N 3.21Å; K138-S140 VanDerWaalsContact O-N 3.15Å; K138-Q141 HydrophobicContact CB-CG 4.18Å; K138-Q141 VanDerWaalsContact CB-OE1 3.23Å; K138-Q141 WeakPolarHBondContact O-CB 3.33Å; K138-Q141 PolarHBondContact O-N 3.18Å
139	T	84.8	Confident	91	Very high	73 Å²	73	51.1 Å²	51.1	45%	0.448	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-60.9	-25.6	-175.7	54.1	0	0	0	0	113.5	N53 K137 Q141 I142	N53-T139 WeakPolarHBondContact OD1-CG2 3.31Å; K137-T139 VanDerWaalsContact C-N 3.32Å; K137-T139 PolarHBondContact O-N 3.48Å; T139-Q141 PolarHBondContact O-N 3.45Å; T139-Q141 VanDerWaalsContact O-N 3.15Å; T139-I142 WeakPolarHBondContact O-CB 3.36Å; T139-I142 PolarHBondContact O-N 2.88Å
140	S	84.8	Confident	91	Very high	95 Å²	95	51.2 Å²	51.2	66%	0.664	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-61.9	-18.4	172.6	65.2	0	0	0	0	113.9	K138	K138-S140 PolarHBondContact O-N 3.21Å; K138-S140 VanDerWaalsContact O-N 3.15Å
141	Q	85.1	Confident	91.1	Very high	75 Å²	75	51.9 Å²	51.9	35%	0.35	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-83.8	-21.2	174.4	-58.5	-170.1	-94.6	0	0	112.2	F133 K138 T139 T143	F133-Q141 HydrophobicContact CD1-CB 4.25Å; F133-Q141 HydrophobicContact CD2-CB 3.82Å; F133-Q141 HydrophobicContact CE1-CB 4.37Å; F133-Q141 HydrophobicContact CE2-CB 3.94Å; F133-Q141 HydrophobicContact CG-CB 3.99Å; F133-Q141 HydrophobicContact CZ-CB 4.23Å; K138-Q141 HydrophobicContact CB-CG 4.18Å; K138-Q141 VanDerWaalsContact CB-OE1 3.23Å; K138-Q141 WeakPolarHBondContact O-CB 3.33Å; K138-Q141 PolarHBondContact O-N 3.18Å; T139-Q141 PolarHBondContact O-N 3.45Å; T139-Q141 VanDerWaalsContact O-N 3.15Å; Q141-T143 PolarHBondContact O-N 3.21Å
142	I	90.1	Very high	91.1	Very high	30 Å²	30	50.5 Å²	50.5	15%	0.154	25%	0.254	C	S	.	.			trans	-82.1	75.2	178.2	-49	175.3	0	0	0	108.2	I49 T130 F133 V134 T139 V147	I49-I142 HydrophobicContact CG2-CG2 4.29Å; T130-I142 HydrophobicContact CG2-CD1 4.12Å; T130-I142 HydrophobicContact CG2-CG1 4.07Å; T130-I142 HydrophobicContact CG2-CG2 3.94Å; F133-I142 HydrophobicContact CB-CD1 4.08Å; F133-I142 HydrophobicContact CB-CG1 3.8Å; F133-I142 HydrophobicContact CD2-CG1 4.19Å; F133-I142 HydrophobicContact CG-CG1 4.49Å; V134-I142 HydrophobicContact CG2-CD1 3.41Å; V134-I142 VanDerWaalsContact CG2-CD1 3.41Å; T139-I142 WeakPolarHBondContact O-CB 3.36Å; T139-I142 PolarHBondContact O-N 2.88Å; I142-V147 HydrophobicContact CG2-CG2 3.57Å
143	T	91.2	Very high	91.1	Very high	53 Å²	53	50.1 Å²	50.1	33%	0.325	25%	0.252	S	S	.	.			trans	-84.9	164.1	178.6	64.8	0	0	0	0	111.2	Q141 L145 H146 V147	Q141-T143 PolarHBondContact O-N 3.21Å; T143-L145 VanDerWaalsContact C-N 3.26Å; T143-L145 PolarHBondContact O-N 2.86Å; T143-H146 WeakPolarHBondContact O-CB 3.45Å; T143-H146 PolarHBondContact O-N 3.24Å; T143-H146 VanDerWaalsContact O-N 3.16Å; T143-H146 PolarHBondContact OG1-N 3.45Å; T143-V147 PolarHBondContact O-N 3.44Å
144	F	90.8	Very high	91.2	Very high	146 Å²	146	48.9 Å²	48.9	64%	0.64	25%	0.247	S	C	*	.	H	α-helix	trans	-54.3	-45	170.7	174.4	-98.3	0	0	0	111.6	H146 V147 Y148 L248	F144-H146 VanDerWaalsContact C-N 3.3Å; F144-H146 PolarHBondContact O-N 2.92Å; F144-V147 PolarHBondContact O-N 2.94Å; F144-Y148 HydrophobicContact CE1-CG 4.38Å; F144-Y148 HydrophobicContact CZ-CD2 4.3Å; F144-Y148 HydrophobicContact CZ-CG 4.39Å; F144-Y148 WeakPolarHBondContact O-CB 3.47Å; F144-Y148 PolarHBondContact O-N 2.73Å; F144-L248 HydrophobicContact CD1-CD2 4.1Å; F144-L248 HydrophobicContact CE1-CD1 4.23Å; F144-L248 HydrophobicContact CE1-CD2 4.06Å
145	L	89.3	Confident	91.2	Very high	21 Å²	21	49.9 Å²	49.9	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-46	177.2	167.4	62.9	0	0	0	111.5	T143 H149 L245 L248 F249 F252	T143-L145 VanDerWaalsContact C-N 3.26Å; T143-L145 PolarHBondContact O-N 2.86Å; L145-H149 WeakPolarHBondContact O-CB 3.31Å; L145-H149 PolarHBondContact O-N 3.33Å; L145-L245 HydrophobicContact CD1-CD2 4.36Å; L145-L248 HydrophobicContact CB-CB 4.45Å; L145-L248 HydrophobicContact CD1-CB 3.51Å; L145-L248 HydrophobicContact CD1-CD1 4.01Å; L145-L248 HydrophobicContact CD1-CG 4.4Å; L145-L248 HydrophobicContact CG-CB 4.37Å; L145-F249 HydrophobicContact CD1-CD2 3.62Å; L145-F249 HydrophobicContact CD1-CE2 3.62Å; L145-F249 HydrophobicContact CD2-CD1 4.47Å; L145-F249 HydrophobicContact CD2-CD2 3.75Å; L145-F249 HydrophobicContact CD2-CE2 3.84Å; L145-F249 HydrophobicContact CD2-CG 4.1Å; L145-F249 HydrophobicContact CD2-CZ 4.24Å; L145-F249 HydrophobicContact CG-CD2 4.26Å; L145-F249 HydrophobicContact CG-CE2 4.12Å; L145-F252 HydrophobicContact CD2-CB 4.13Å
146	H	91.2	Very high	91.2	Very high	28 Å²	28	48.7 Å²	48.7	13%	0.13	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-54.3	179.1	-175.7	83.2	0	0	0	111.3	T130 F133 T143 F144 H149 H150	T130-H146 PolarHBondContact OG1-CD2 3.13Å; T130-H146 PolarHBondContact OG1-NE2 3.28Å; F133-H146 AromaticContact CE2-CE1 3.69Å; T143-H146 WeakPolarHBondContact O-CB 3.45Å; T143-H146 PolarHBondContact O-N 3.24Å; T143-H146 VanDerWaalsContact O-N 3.16Å; T143-H146 PolarHBondContact OG1-N 3.45Å; F144-H146 VanDerWaalsContact C-N 3.3Å; F144-H146 PolarHBondContact O-N 2.92Å; H146-H149 PolarHBondContact O-N 3.27Å; H146-H150 AromaticContact CD2-CD2 3.86Å; H146-H150 AromaticContact CE1-CD2 3.25Å; H146-H150 PolarHBondContact CE1-CD2 3.26Å; H146-H150 AromaticContact CE1-NE2 3.1Å; H146-H150 PolarHBondContact CE1-NE2 3.26Å; H146-H150 AromaticContact CG-CD2 3.97Å; H146-H150 AromaticContact ND1-CD2 3.66Å; H146-H150 AromaticContact ND1-NE2 3.65Å; H146-H150 AromaticContact NE2-CD2 3.4Å; H146-H150 PolarHBondContact NE2-CD2 3.31Å; H146-H150 AromaticContact NE2-NE2 3.69Å; H146-H150 PolarHBondContact O-CD2 2.89Å; H146-H150 VanDerWaalsContact O-CD2 3.23Å; H146-H150 PolarHBondContact O-N 3.49Å
147	V	94.8	Very high	91.3	Very high	33 Å²	33	45.5 Å²	45.5	20%	0.2	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-43.1	-176.9	-179.5	0	0	0	0	111.6	Y45 L46 I49 I142 T143 F144 A151	Y45-V147 HydrophobicContact CE1-CG1 4.28Å; L46-V147 HydrophobicContact CD2-CG1 3.68Å; I49-V147 HydrophobicContact CD1-CG1 4.22Å; I49-V147 HydrophobicContact CD1-CG2 3.99Å; I142-V147 HydrophobicContact CG2-CG2 3.57Å; T143-V147 PolarHBondContact O-N 3.44Å; F144-V147 PolarHBondContact O-N 2.94Å; V147-A151 WeakPolarHBondContact O-CB 3.49Å; V147-A151 PolarHBondContact O-N 3.23Å
148	Y	93.6	Very high	91.5	Very high	71 Å²	71	41.3 Å²	41.3	28%	0.278	22%	0.216	S	C	.	.	H	α-helix	trans	-56.4	-51.4	175.5	171.6	-103	0	0	0	110.9	F144 S152 Y241 T244 L245 L248	F144-Y148 HydrophobicContact CE1-CG 4.38Å; F144-Y148 HydrophobicContact CZ-CD2 4.3Å; F144-Y148 HydrophobicContact CZ-CG 4.39Å; F144-Y148 WeakPolarHBondContact O-CB 3.47Å; F144-Y148 PolarHBondContact O-N 2.73Å; Y148-S152 VanDerWaalsContact O-CB 3.24Å; Y148-S152 WeakPolarHBondContact O-CB 3.48Å; Y148-S152 PolarHBondContact O-N 3.47Å; Y148-S152 PolarHBondContact O-OG 3.38Å; Y148-Y241 HydrophobicContact CE1-CE2 4.15Å; Y148-T244 PolarHBondContact OH-OG1 2.84Å; Y148-L245 HydrophobicContact CD1-CD2 4.23Å; Y148-L245 HydrophobicContact CE1-CD2 4.03Å; Y148-L248 HydrophobicContact CD1-CD1 3.56Å; Y148-L248 HydrophobicContact CE1-CD1 3.8Å; Y148-L248 HydrophobicContact CG-CD1 4.35Å
149	H	93.5	Very high	91.7	Very high	21 Å²	21	38.4 Å²	38.4	10%	0.097	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-55.2	179.7	173.5	-96.2	0	0	0	112.1	L145 H146 A151 S152 M153 L245	L145-H149 WeakPolarHBondContact O-CB 3.31Å; L145-H149 PolarHBondContact O-N 3.33Å; H146-H149 PolarHBondContact O-N 3.27Å; H149-A151 PolarHBondContact O-N 2.93Å; H149-S152 PolarHBondContact O-N 2.87Å; H149-S152 PolarHBondContact O-OG 2.99Å; H149-M153 WeakPolarHBondContact NE2-CG 3.28Å; H149-M153 WeakPolarHBondContact O-CB 3.37Å; H149-M153 WeakPolarHBondContact O-CG 3.34Å; H149-M153 PolarHBondContact O-N 3.43Å; H149-L245 HydrophobicContact CB-CD2 4.31Å
150	H	93.8	Very high	92	Very high	14 Å²	14	35.6 Å²	35.6	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-63.1	-43.7	-176.7	-77.7	-81.9	0	0	0	112.2	Y45 E126 F127 D129 H146	Y45-H150 HydrophobicContact CE1-CB 4.4Å; E126-H150 IonicContact OE2-CE1 2.74Å; F127-H150 HydrophobicContact CD1-CB 4.15Å; F127-H150 HydrophobicContact CE1-CB 4.12Å; F127-H150 VanDerWaalsContact CE1-O 3.31Å; F127-H150 WeakPolarHBondContact CE1-O 3.37Å; D129-H150 IonicContact OD2-CE1 3.85Å; H146-H150 AromaticContact CD2-CD2 3.86Å; H146-H150 AromaticContact CE1-CD2 3.25Å; H146-H150 PolarHBondContact CE1-CD2 3.26Å; H146-H150 AromaticContact CE1-NE2 3.1Å; H146-H150 PolarHBondContact CE1-NE2 3.26Å; H146-H150 AromaticContact CG-CD2 3.97Å; H146-H150 AromaticContact ND1-CD2 3.66Å; H146-H150 AromaticContact ND1-NE2 3.65Å; H146-H150 AromaticContact NE2-CD2 3.4Å; H146-H150 PolarHBondContact NE2-CD2 3.31Å; H146-H150 AromaticContact NE2-NE2 3.69Å; H146-H150 PolarHBondContact O-CD2 2.89Å; H146-H150 VanDerWaalsContact O-CD2 3.23Å; H146-H150 PolarHBondContact O-N 3.49Å
151	A	94.1	Very high	92.4	Very high	15 Å²	15	31.1 Å²	31.1	12%	0.124	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-45.5	-179.8	0	0	0	0	0	112.1	T42 Y45 V147 H149 N155	T42-A151 HydrophobicContact CG2-CB 4.19Å; Y45-A151 HydrophobicContact CD1-CB 4.47Å; Y45-A151 HydrophobicContact CE1-CB 4.17Å; V147-A151 WeakPolarHBondContact O-CB 3.49Å; V147-A151 PolarHBondContact O-N 3.23Å; H149-A151 PolarHBondContact O-N 2.93Å; A151-N155 PolarHBondContact O-ND2 3.44Å
152	S	94.3	Very high	92.6	Very high	24 Å²	24	27.5 Å²	27.5	17%	0.168	14%	0.141	C	C	.	.	H	α-helix	trans	-71.8	-44	-178.1	59.6	0	0	0	0	112.6	Y148 H149 F154 N155 I156 Y241	Y148-S152 VanDerWaalsContact O-CB 3.24Å; Y148-S152 WeakPolarHBondContact O-CB 3.48Å; Y148-S152 PolarHBondContact O-N 3.47Å; Y148-S152 PolarHBondContact O-OG 3.38Å; H149-S152 PolarHBondContact O-N 2.87Å; H149-S152 PolarHBondContact O-OG 2.99Å; S152-F154 VanDerWaalsContact C-N 3.3Å; S152-F154 PolarHBondContact O-N 3.04Å; S152-N155 PolarHBondContact O-N 2.93Å; S152-N155 VanDerWaalsContact O-N 3.16Å; S152-I156 WeakPolarHBondContact O-CB 3.46Å; S152-I156 VanDerWaalsContact O-CG1 3.29Å; S152-I156 WeakPolarHBondContact O-CG1 3.44Å; S152-I156 PolarHBondContact O-N 3.42Å; S152-Y241 PolarHBondContact OG-OH 2.94Å
153	M	93.5	Very high	92.6	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.074	14%	0.14	C	C	.	.	H	α-helix	trans	-55.4	-44.8	-178.3	-77.6	-65.7	-78.6	0	0	112	Y119 H149 N155 I156 W157 Y241	Y119-M153 HydrophobicContact CE1-CE 4.4Å; Y119-M153 WeakPolarHBondContact OH-CE 3.21Å; H149-M153 WeakPolarHBondContact NE2-CG 3.28Å; H149-M153 WeakPolarHBondContact O-CB 3.37Å; H149-M153 WeakPolarHBondContact O-CG 3.34Å; H149-M153 PolarHBondContact O-N 3.43Å; M153-N155 VanDerWaalsContact C-N 3.34Å; M153-N155 PolarHBondContact O-N 3.45Å; M153-I156 PolarHBondContact O-N 3.14Å; M153-W157 WeakPolarHBondContact O-CB 3.39Å; M153-W157 VanDerWaalsContact O-CD1 3.22Å; M153-W157 PolarHBondContact O-N 3.33Å; M153-Y241 VanDerWaalsContact CG-OH 3.25Å; M153-Y241 WeakPolarHBondContact CG-OH 3.4Å; M153-Y241 HydrophobicContact SD-CE1 3.57Å; M153-Y241 VanDerWaalsContact SD-CE1 3.57Å; M153-Y241 PolarHBondContact SD-OH 3.44Å
154	F	94.8	Very high	92.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.1	-40.9	-177.9	-174.7	-128.7	0	0	0	112.4	M31 T38 L41 Y120 K123 F127 S152 W158	M31-F154 HydrophobicContact CE-CZ 3.85Å; T38-F154 HydrophobicContact CG2-CD1 3.66Å; T38-F154 HydrophobicContact CG2-CE1 3.54Å; T38-F154 HydrophobicContact CG2-CE2 4.45Å; T38-F154 HydrophobicContact CG2-CG 4.2Å; T38-F154 HydrophobicContact CG2-CZ 3.95Å; T38-F154 WeakPolarHBondContact O-CE1 3.38Å; L41-F154 HydrophobicContact CB-CE1 3.89Å; L41-F154 HydrophobicContact CD1-CE1 4.17Å; L41-F154 HydrophobicContact CD1-CZ 4.03Å; Y120-F154 AromaticContact CD2-CD2 3.88Å; Y120-F154 HydrophobicContact CD2-CD2 3.88Å; Y120-F154 AromaticContact CD2-CE2 3.84Å; Y120-F154 HydrophobicContact CD2-CE2 3.84Å; Y120-F154 HydrophobicContact CE1-CE2 4.32Å; Y120-F154 AromaticContact CE2-CD2 3.48Å; Y120-F154 HydrophobicContact CE2-CD2 3.48Å; Y120-F154 VanDerWaalsContact CE2-CD2 3.48Å; Y120-F154 AromaticContact CE2-CE2 3.16Å; Y120-F154 HydrophobicContact CE2-CE2 3.16Å; Y120-F154 HydrophobicContact CE2-CG 4.42Å; Y120-F154 AromaticContact CE2-CZ 3.94Å; Y120-F154 HydrophobicContact CE2-CZ 3.94Å; Y120-F154 WeakPolarHBondContact CE2-O 3.42Å; Y120-F154 AromaticContact CZ-CE2 3.46Å; Y120-F154 VanDerWaalsContact CZ-CE2 3.46Å; Y120-F154 AromaticContact CZ-CZ 3.91Å; K123-F154 HydrophobicContact CB-CB 4.26Å; K123-F154 HydrophobicContact CB-CD2 4.04Å; F127-F154 HydrophobicContact CE1-CB 4.39Å; F127-F154 HydrophobicContact CE2-CB 4.46Å; F127-F154 AromaticContact CE2-CD1 3.59Å; F127-F154 HydrophobicContact CE2-CD1 3.59Å; F127-F154 HydrophobicContact CE2-CE1 4.01Å; F127-F154 HydrophobicContact CE2-CG 4.11Å; F127-F154 HydrophobicContact CZ-CB 3.74Å; F127-F154 AromaticContact CZ-CD1 3.59Å; F127-F154 HydrophobicContact CZ-CD1 3.59Å; F127-F154 HydrophobicContact CZ-CE1 4.45Å; F127-F154 AromaticContact CZ-CG 3.87Å; F127-F154 HydrophobicContact CZ-CG 3.87Å; S152-F154 VanDerWaalsContact C-N 3.3Å; S152-F154 PolarHBondContact O-N 3.04Å; F154-W158 PolarHBondContact O-N 3.48Å
155	N	93.7	Very high	92.6	Very high	25 Å²	25	18.7 Å²	18.7	13%	0.134	10%	0.097	C	C	.	.	H	α-helix	trans	-72.5	-42.4	178	-70.9	-81.5	0	0	0	112.4	Y35 T42 A151 S152 M153 W157 W158 C159	Y35-N155 WeakPolarHBondContact CE2-OD1 3.47Å; Y35-N155 PolarHBondContact OH-OD1 3.28Å; T42-N155 WeakPolarHBondContact CG2-ND2 3.46Å; T42-N155 PolarHBondContact OG1-ND2 3.29Å; A151-N155 PolarHBondContact O-ND2 3.44Å; S152-N155 PolarHBondContact O-N 2.93Å; S152-N155 VanDerWaalsContact O-N 3.16Å; M153-N155 VanDerWaalsContact C-N 3.34Å; M153-N155 PolarHBondContact O-N 3.45Å; N155-W157 VanDerWaalsContact C-N 3.31Å; N155-W157 PolarHBondContact O-N 3.5Å; N155-W158 PolarHBondContact O-N 3.29Å; N155-C159 PolarHBondContact O-N 3.14Å
156	I	92.8	Very high	92.7	Very high	20 Å²	20	17.7 Å²	17.7	10%	0.103	9%	0.091	C	C	.	.	H	α-helix	trans	-60.1	-44.2	177.5	-70.8	169.1	0	0	0	110.4	S152 M153 W158 C159 V160 F237 Y241	S152-I156 WeakPolarHBondContact O-CB 3.46Å; S152-I156 VanDerWaalsContact O-CG1 3.29Å; S152-I156 WeakPolarHBondContact O-CG1 3.44Å; S152-I156 PolarHBondContact O-N 3.42Å; M153-I156 PolarHBondContact O-N 3.14Å; I156-W158 VanDerWaalsContact C-N 3.32Å; I156-W158 PolarHBondContact O-N 3.13Å; I156-C159 WeakPolarHBondContact O-CB 3.16Å; I156-C159 PolarHBondContact O-N 3.39Å; I156-C159 VanDerWaalsContact O-N 3.11Å; I156-V160 HydrophobicContact CG2-CG2 4.1Å; I156-V160 WeakPolarHBondContact O-CG2 3.27Å; I156-V160 PolarHBondContact O-N 3.45Å; I156-F237 HydrophobicContact CD1-CE1 4.28Å; I156-F237 HydrophobicContact CD1-CZ 4.06Å; I156-F237 HydrophobicContact CG1-CE1 4.13Å; I156-F237 HydrophobicContact CG1-CZ 3.96Å; I156-F237 HydrophobicContact CG2-CE1 3.89Å; I156-Y241 HydrophobicContact CD1-CD1 4.19Å; I156-Y241 HydrophobicContact CD1-CD2 3.66Å; I156-Y241 HydrophobicContact CD1-CE1 4.15Å; I156-Y241 HydrophobicContact CD1-CE2 3.62Å; I156-Y241 HydrophobicContact CD1-CG 3.96Å
157	W	94.1	Very high	92.7	Very high	13 Å²	13	16.3 Å²	16.3	5%	0.049	9%	0.085	C	C	.	.	H	α-helix	trans	-69.2	-28.2	-177.9	-87.2	93.2	0	0	0	114	L116 Y119 Y120 M153 N155 C159 V160 L161 P173	L116-W157 HydrophobicContact CB-CZ3 4.35Å; L116-W157 HydrophobicContact CD1-CZ3 4.17Å; L116-W157 HydrophobicContact CD2-CH2 4.3Å; L116-W157 HydrophobicContact CD2-CZ3 4.13Å; L116-W157 HydrophobicContact CG-CZ3 4.46Å; Y119-W157 AromaticContact CD1-CD2 3.67Å; Y119-W157 HydrophobicContact CD1-CD2 3.67Å; Y119-W157 AromaticContact CD1-CE2 3.73Å; Y119-W157 AromaticContact CD1-CE3 3.94Å; Y119-W157 HydrophobicContact CD1-CE3 3.94Å; Y119-W157 HydrophobicContact CD1-CG 4.19Å; Y119-W157 HydrophobicContact CD1-CH2 4.35Å; Y119-W157 HydrophobicContact CD1-CZ2 4.08Å; Y119-W157 HydrophobicContact CD1-CZ3 4.26Å; Y119-W157 AromaticContact CE1-CD1 3.82Å; Y119-W157 AromaticContact CE1-CD2 3.68Å; Y119-W157 HydrophobicContact CE1-CD2 3.68Å; Y119-W157 AromaticContact CE1-CE2 3.29Å; Y119-W157 HydrophobicContact CE1-CE3 4.36Å; Y119-W157 HydrophobicContact CE1-CG 4.03Å; Y119-W157 HydrophobicContact CE1-CH2 4.43Å; Y119-W157 AromaticContact CE1-CZ2 3.73Å; Y119-W157 HydrophobicContact CE1-CZ2 3.73Å; Y119-W157 AromaticContact CE1-NE1 3.38Å; Y120-W157 HydrophobicContact CD2-CB 3.9Å; M153-W157 WeakPolarHBondContact O-CB 3.39Å; M153-W157 VanDerWaalsContact O-CD1 3.22Å; M153-W157 PolarHBondContact O-N 3.33Å; N155-W157 VanDerWaalsContact C-N 3.31Å; N155-W157 PolarHBondContact O-N 3.5Å; W157-C159 VanDerWaalsContact C-N 3.34Å; W157-V160 HydrophobicContact CE3-CB 4.06Å; W157-V160 HydrophobicContact CE3-CG1 3.84Å; W157-V160 HydrophobicContact CH2-CG1 3.93Å; W157-V160 HydrophobicContact CZ3-CB 4.23Å; W157-V160 HydrophobicContact CZ3-CG1 3.49Å; W157-V160 VanDerWaalsContact CZ3-CG1 3.49Å; W157-V160 PolarHBondContact O-N 3.33Å; W157-L161 WeakPolarHBondContact O-CB 3.34Å; W157-L161 WeakPolarHBondContact O-CG 3.23Å; W157-L161 PolarHBondContact O-N 2.98Å; W157-P173 HydrophobicContact CH2-CB 4.45Å; W157-P173 HydrophobicContact CH2-CG 3.08Å; W157-P173 HydrophobicContact CZ2-CG 3.34Å; W157-P173 HydrophobicContact CZ3-CG 4.03Å
158	W	93.8	Very high	92.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.9	-43.4	169	-177.9	92.1	0	0	0	111.2	L15 M31 S34 Y35 T38 Y120 F154 N155 I156 N162 W163	L15-W158 HydrophobicContact CD1-CH2 3.8Å; L15-W158 HydrophobicContact CD1-CZ3 3.77Å; M31-W158 PolarHBondContact O-NE1 3.4Å; M31-W158 VanDerWaalsContact O-NE1 3.15Å; S34-W158 PolarHBondContact O-NE1 3.21Å; S34-W158 VanDerWaalsContact O-NE1 3.1Å; Y35-W158 AromaticContact CD2-CD2 3.63Å; Y35-W158 HydrophobicContact CD2-CD2 3.63Å; Y35-W158 AromaticContact CD2-CE3 3.52Å; Y35-W158 HydrophobicContact CD2-CE3 3.52Å; Y35-W158 HydrophobicContact CD2-CG 4.19Å; Y35-W158 HydrophobicContact CD2-CH2 4.3Å; Y35-W158 HydrophobicContact CD2-CZ2 4.37Å; Y35-W158 AromaticContact CD2-CZ3 3.88Å; Y35-W158 HydrophobicContact CD2-CZ3 3.88Å; Y35-W158 HydrophobicContact CE2-CD2 4.46Å; Y35-W158 HydrophobicContact CE2-CE3 4.22Å; Y35-W158 HydrophobicContact CG-CE3 4.3Å; Y35-W158 HydrophobicContact CG-CH2 4.32Å; Y35-W158 HydrophobicContact CG-CZ2 4.48Å; Y35-W158 HydrophobicContact CG-CZ3 4.22Å; T38-W158 HydrophobicContact CG2-CB 3.93Å; T38-W158 HydrophobicContact CG2-CG 4.33Å; Y120-W158 HydrophobicContact CD2-CB 4.49Å; Y120-W158 HydrophobicContact CE2-CB 3.8Å; F154-W158 PolarHBondContact O-N 3.48Å; N155-W158 PolarHBondContact O-N 3.29Å; I156-W158 VanDerWaalsContact C-N 3.32Å; I156-W158 PolarHBondContact O-N 3.13Å; W158-N162 WeakPolarHBondContact CZ2-ND2 3.27Å; W158-N162 PolarHBondContact O-N 3.31Å; W158-N162 PolarHBondContact O-ND2 3.47Å; W158-W163 HydrophobicContact CE3-CZ3 4.45Å; W158-W163 HydrophobicContact CH2-CH2 4.35Å; W158-W163 HydrophobicContact CH2-CZ3 4.48Å; W158-W163 HydrophobicContact CZ3-CH2 4.01Å; W158-W163 AromaticContact CZ3-CZ3 3.81Å; W158-W163 HydrophobicContact CZ3-CZ3 3.81Å
159	C	90.8	Very high	92.3	Very high	34 Å²	34	12.8 Å²	12.8	23%	0.23	7%	0.071	C	C	.	.	H	α-helix	trans	-65.6	-48.5	174.5	-60.8	0	0	0	0	111.3	N155 I156 W157 L161 N162 W163	N155-C159 PolarHBondContact O-N 3.14Å; I156-C159 WeakPolarHBondContact O-CB 3.16Å; I156-C159 PolarHBondContact O-N 3.39Å; I156-C159 VanDerWaalsContact O-N 3.11Å; W157-C159 VanDerWaalsContact C-N 3.34Å; C159-L161 VanDerWaalsContact C-N 3.27Å; C159-L161 PolarHBondContact O-N 3.37Å; C159-N162 PolarHBondContact O-N 3.3Å; C159-W163 HydrophobicContact CB-CE3 4.08Å; C159-W163 HydrophobicContact CB-CZ3 4.05Å; C159-W163 PolarHBondContact O-N 3.26Å; C159-W163 VanDerWaalsContact O-N 3.11Å
160	V	91.9	Very high	92.3	Very high	15 Å²	15	12 Å²	12	9%	0.091	7%	0.067	C	C	.	.	H	α-helix	trans	-54.9	-44.2	-179.8	171.2	0	0	0	0	111.1	I156 W157 N162 I164	I156-V160 HydrophobicContact CG2-CG2 4.1Å; I156-V160 WeakPolarHBondContact O-CG2 3.27Å; I156-V160 PolarHBondContact O-N 3.45Å; W157-V160 HydrophobicContact CE3-CB 4.06Å; W157-V160 HydrophobicContact CE3-CG1 3.84Å; W157-V160 HydrophobicContact CH2-CG1 3.93Å; W157-V160 HydrophobicContact CZ3-CB 4.23Å; W157-V160 HydrophobicContact CZ3-CG1 3.49Å; W157-V160 VanDerWaalsContact CZ3-CG1 3.49Å; W157-V160 PolarHBondContact O-N 3.33Å; V160-N162 PolarHBondContact O-N 3.22Å; V160-I164 HydrophobicContact CB-CG1 4.31Å; V160-I164 HydrophobicContact CG1-CD1 4.15Å; V160-I164 HydrophobicContact CG1-CG1 3.94Å; V160-I164 HydrophobicContact CG2-CD1 4.33Å; V160-I164 CarbonylContact O-C 3.45Å; V160-I164 VanDerWaalsContact O-CA 3.32Å; V160-I164 WeakPolarHBondContact O-CA 3.38Å; V160-I164 VanDerWaalsContact O-CG1 3.3Å; V160-I164 WeakPolarHBondContact O-CG1 3.41Å; V160-I164 PolarHBondContact O-N 3.14Å
161	L	92.7	Very high	92.3	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67.1	-36.4	177.9	-77.7	173.7	0	0	0	113.7	V26 L32 L116 W117 Y120 W157 C159 P165	V26-L161 WeakPolarHBondContact CG2-O 3.46Å; L32-L161 HydrophobicContact CD1-CB 3.99Å; L32-L161 HydrophobicContact CD1-CD1 4.17Å; L32-L161 HydrophobicContact CD2-CB 4Å; L32-L161 HydrophobicContact CD2-CD1 3.94Å; L116-L161 HydrophobicContact CB-CD2 3.62Å; W117-L161 HydrophobicContact CB-CD1 4.38Å; Y120-L161 HydrophobicContact CD1-CD1 3.95Å; Y120-L161 HydrophobicContact CG-CD1 3.73Å; W157-L161 WeakPolarHBondContact O-CB 3.34Å; W157-L161 WeakPolarHBondContact O-CG 3.23Å; W157-L161 PolarHBondContact O-N 2.98Å; C159-L161 VanDerWaalsContact C-N 3.27Å; C159-L161 PolarHBondContact O-N 3.37Å; L161-P165 HydrophobicContact CD2-CB 4.23Å; L161-P165 WeakPolarHBondContact O-CB 3.37Å
162	N	90.1	Very high	92.3	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-73	-26.1	-178.7	-86	-75.3	0	0	0	113.6	R22 D23 L32 W158 C159 V160	R22-N162 CarbonylContact C-O 3.04Å; R22-N162 VanDerWaalsContact CA-O 3.29Å; R22-N162 WeakPolarHBondContact CA-O 3.31Å; R22-N162 WeakPolarHBondContact CB-O 3.46Å; R22-N162 WeakPolarHBondContact CD-OD1 3.49Å; R22-N162 HydrophobicContact CG-CB 4.27Å; D23-N162 PolarHBondContact N-O 3.36Å; L32-N162 PolarHBondContact O-ND2 2.85Å; L32-N162 PolarHBondContact O-OD1 3.23Å; L32-N162 VanDerWaalsContact O-OD1 3.1Å; W158-N162 WeakPolarHBondContact CZ2-ND2 3.27Å; W158-N162 PolarHBondContact O-N 3.31Å; W158-N162 PolarHBondContact O-ND2 3.47Å; C159-N162 PolarHBondContact O-N 3.3Å; V160-N162 PolarHBondContact O-N 3.22Å
163	W	89.3	Confident	92.4	Very high	31 Å²	31	11.9 Å²	11.9	12%	0.117	6%	0.064	C	C	.	.	H	α-helix	trans	-116.3	-32.2	-177.2	-75.1	-82	0	0	0	114.9	L15 F19 G20 R22 W158 C159	L15-W163 HydrophobicContact CB-CH2 4Å; L15-W163 HydrophobicContact CB-CZ2 4.43Å; F19-W163 HydrophobicContact CB-CD2 3.79Å; F19-W163 HydrophobicContact CB-CE3 4.38Å; F19-W163 HydrophobicContact CB-CG 4.2Å; F19-W163 HydrophobicContact CB-CH2 4.38Å; F19-W163 HydrophobicContact CB-CZ2 3.68Å; F19-W163 HydrophobicContact CD2-CE3 4.33Å; F19-W163 AromaticContact CD2-CH2 3.94Å; F19-W163 HydrophobicContact CD2-CH2 3.94Å; F19-W163 HydrophobicContact CD2-CZ2 4.07Å; F19-W163 HydrophobicContact CD2-CZ3 4.05Å; F19-W163 HydrophobicContact CG-CD2 4.37Å; F19-W163 HydrophobicContact CG-CZ2 4.34Å; G20-W163 PolarHBondContact O-NE1 3.22Å; R22-W163 HydrophobicContact CG-CH2 4.41Å; R22-W163 HydrophobicContact CG-CZ2 3.79Å; W158-W163 HydrophobicContact CE3-CZ3 4.45Å; W158-W163 HydrophobicContact CH2-CH2 4.35Å; W158-W163 HydrophobicContact CH2-CZ3 4.48Å; W158-W163 HydrophobicContact CZ3-CH2 4.01Å; W158-W163 AromaticContact CZ3-CZ3 3.81Å; W158-W163 HydrophobicContact CZ3-CZ3 3.81Å; C159-W163 HydrophobicContact CB-CE3 4.08Å; C159-W163 HydrophobicContact CB-CZ3 4.05Å; C159-W163 PolarHBondContact O-N 3.26Å; C159-W163 VanDerWaalsContact O-N 3.11Å
164	I	91	Very high	92.5	Very high	12 Å²	12	12 Å²	12	6%	0.062	7%	0.066	C	C	.	.			trans	-139.8	59.5	-173.1	49.7	167.1	0	0	0	111.8	L102 V160 C166 S169 F230 P231 C234	L102-I164 HydrophobicContact CD1-CG2 3.98Å; L102-I164 HydrophobicContact CD2-CB 4.12Å; L102-I164 HydrophobicContact CD2-CG2 4.2Å; V160-I164 HydrophobicContact CB-CG1 4.31Å; V160-I164 HydrophobicContact CG1-CD1 4.15Å; V160-I164 HydrophobicContact CG1-CG1 3.94Å; V160-I164 HydrophobicContact CG2-CD1 4.33Å; V160-I164 CarbonylContact O-C 3.45Å; V160-I164 VanDerWaalsContact O-CA 3.32Å; V160-I164 WeakPolarHBondContact O-CA 3.38Å; V160-I164 VanDerWaalsContact O-CG1 3.3Å; V160-I164 WeakPolarHBondContact O-CG1 3.41Å; V160-I164 PolarHBondContact O-N 3.14Å; I164-C166 PolarHBondContact O-N 3.23Å; I164-S169 PolarHBondContact O-OG 2.78Å; I164-F230 HydrophobicContact CB-CE2 4.22Å; I164-F230 HydrophobicContact CB-CZ 3.88Å; I164-F230 HydrophobicContact CD1-CE1 4.13Å; I164-F230 HydrophobicContact CD1-CZ 3.7Å; I164-F230 HydrophobicContact CG1-CZ 4.36Å; I164-F230 HydrophobicContact CG2-CE1 4.45Å; I164-F230 HydrophobicContact CG2-CE2 4.27Å; I164-F230 HydrophobicContact CG2-CZ 3.94Å; I164-P231 HydrophobicContact CG2-CG 3.97Å; I164-C234 HydrophobicContact CD1-CB 3.71Å
165	P	91.8	Very high	92.6	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	-73.9	6.7	-172.2	31	-36.2	0	0	0	115.3	D23 V26 A113 L116 L161	D23-P165 HydrophobicContact CB-CG 3.89Å; D23-P165 WeakPolarHBondContact OD2-CD 3.33Å; D23-P165 VanDerWaalsContact OD2-CG 3.28Å; D23-P165 WeakPolarHBondContact OD2-CG 3.41Å; V26-P165 HydrophobicContact CG1-CB 3.68Å; V26-P165 HydrophobicContact CG1-CG 3.95Å; A113-P165 WeakPolarHBondContact CA-O 3.46Å; A113-P165 HydrophobicContact CB-CB 3.94Å; A113-P165 WeakPolarHBondContact CB-O 3.39Å; L116-P165 WeakPolarHBondContact CD1-O 3.4Å; L161-P165 HydrophobicContact CD2-CB 4.23Å; L161-P165 WeakPolarHBondContact O-CB 3.37Å
166	C	91.6	Very high	92.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	-157.1	-158	177.2	64.9	0	0	0	0	110.1	R25 L102 D109 V112 I164	R25-C166 PolarHBondContact NH2-SG 3.46Å; L102-C166 WeakPolarHBondContact CD2-O 3.15Å; L102-C166 PolarHBondContact O-SG 3.35Å; D109-C166 HydrophobicContact CB-CB 4.09Å; V112-C166 HydrophobicContact CB-CB 4.43Å; V112-C166 HydrophobicContact CG1-CB 4.16Å; I164-C166 PolarHBondContact O-N 3.23Å
167	G	90.7	Very high	93	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	65	-142.3	-179.9	0	0	0	0	0	111.7	Q100 D101 S169 F170	Q100-G167 WeakPolarHBondContact O-CA 3.5Å; D101-G167 WeakPolarHBondContact O-CA 3.38Å; G167-S169 PolarHBondContact O-N 3.45Å; G167-F170 WeakPolarHBondContact O-CD1 3.39Å; G167-F170 PolarHBondContact O-N 2.9Å; G167-F170 VanDerWaalsContact O-N 3.12Å
168	Q	90.1	Very high	93.1	Very high	10 Å²	10	16.1 Å²	16.1	5%	0.047	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-52.4	-23	-177.6	-77.5	-66	-68.6	0	0	116	C99 Q100 F170 H219 A223 F230	C99-Q168 VanDerWaalsContact CA-NE2 3.33Å; Q100-Q168 WeakPolarHBondContact O-CG 3.36Å; Q100-Q168 PolarHBondContact O-N 3.32Å; Q168-F170 PolarHBondContact O-N 3.24Å; Q168-H219 VanDerWaalsContact CD-CE1 3.41Å; Q168-H219 PolarHBondContact NE2-CE1 2.91Å; Q168-H219 PolarHBondContact OE1-CE1 3.14Å; Q168-H219 PolarHBondContact OE1-ND1 3.5Å; Q168-A223 HydrophobicContact CG-CB 3.99Å; Q168-F230 HydrophobicContact CB-CD1 4.26Å; Q168-F230 HydrophobicContact CB-CD2 3.72Å; Q168-F230 HydrophobicContact CB-CE1 4.3Å; Q168-F230 HydrophobicContact CB-CE2 3.77Å; Q168-F230 HydrophobicContact CB-CG 3.96Å; Q168-F230 HydrophobicContact CB-CZ 4.05Å; Q168-F230 HydrophobicContact CG-CB 4.39Å; Q168-F230 HydrophobicContact CG-CD2 4.18Å; Q168-F230 HydrophobicContact CG-CG 4.19Å
169	S	90.8	Very high	93.3	Very high	19 Å²	19	16.5 Å²	16.5	13%	0.133	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-60.9	-21.5	177.4	-58.5	0	0	0	0	114.1	I164 G167 F171 P173 F230	I164-S169 PolarHBondContact O-OG 2.78Å; G167-S169 PolarHBondContact O-N 3.45Å; S169-F171 PolarHBondContact O-N 3.29Å; S169-P173 WeakPolarHBondContact O-CD 3.38Å; S169-P173 WeakPolarHBondContact O-CG 3.3Å; S169-F230 WeakPolarHBondContact OG-CZ 3.37Å
170	F	93.3	Very high	93.6	Very high	5 Å²	5	15.2 Å²	15.2	2%	0.022	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-67.7	-33.1	-172.5	88.4	-74.6	0	0	0	114.4	L86 T90 Y95 L97 V112 G167 Q168 G172 P173 T174	L86-F170 HydrophobicContact CD2-CB 4.49Å; T90-F170 HydrophobicContact CG2-CD2 3.37Å; T90-F170 HydrophobicContact CG2-CE2 3.59Å; T90-F170 HydrophobicContact CG2-CG 3.96Å; T90-F170 HydrophobicContact CG2-CZ 4.33Å; Y95-F170 AromaticContact CD1-CD1 3.95Å; Y95-F170 HydrophobicContact CD1-CD1 3.95Å; Y95-F170 AromaticContact CD1-CE1 3.92Å; Y95-F170 HydrophobicContact CD1-CE1 3.92Å; Y95-F170 HydrophobicContact CD1-CG 4.25Å; Y95-F170 HydrophobicContact CD1-CZ 4.22Å; Y95-F170 HydrophobicContact CE1-CD1 4.1Å; Y95-F170 HydrophobicContact CE1-CG 4.21Å; L97-F170 HydrophobicContact CD2-CZ 3.96Å; V112-F170 HydrophobicContact CG1-CB 4.05Å; G167-F170 WeakPolarHBondContact O-CD1 3.39Å; G167-F170 PolarHBondContact O-N 2.9Å; G167-F170 VanDerWaalsContact O-N 3.12Å; Q168-F170 PolarHBondContact O-N 3.24Å; F170-G172 PolarHBondContact O-N 3.4Å; F170-P173 VanDerWaalsContact O-CD 3.3Å; F170-P173 WeakPolarHBondContact O-CD 3.43Å; F170-T174 PolarHBondContact O-N 2.88Å; F170-T174 VanDerWaalsContact O-N 3.07Å; F170-T174 PolarHBondContact O-OG1 3.29Å
171	F	94	Very high	93.8	Very high	40 Å²	40	16 Å²	16	18%	0.175	8%	0.08	C	C	.	.	H	α-helix	trans	-68.3	-40.5	-165.4	-175.5	-98.5	0	0	0	112.9	S169 T174 L175 L215 H219	S169-F171 PolarHBondContact O-N 3.29Å; F171-T174 WeakPolarHBondContact O-CB 3.27Å; F171-T174 PolarHBondContact O-N 3.34Å; F171-L175 HydrophobicContact CD1-CD1 4.05Å; F171-L175 HydrophobicContact CE1-CD1 3.37Å; F171-L175 HydrophobicContact CE1-CG 4.14Å; F171-L175 HydrophobicContact CZ-CD1 3.7Å; F171-L175 HydrophobicContact CZ-CG 4.23Å; F171-L175 PolarHBondContact O-N 2.66Å; F171-L175 VanDerWaalsContact O-N 3.11Å; F171-L215 HydrophobicContact CE1-CB 4.4Å; F171-H219 WeakPolarHBondContact CB-CE1 3.44Å; F171-H219 HydrophobicContact CD1-CB 3.48Å; F171-H219 VanDerWaalsContact CD1-CB 3.48Å; F171-H219 AromaticContact CD1-CD2 3.86Å; F171-H219 AromaticContact CD1-CG 3.44Å; F171-H219 VanDerWaalsContact CD1-CG 3.44Å; F171-H219 AromaticContact CD1-ND1 3.78Å; F171-H219 AromaticContact CD2-CD2 3.63Å; F171-H219 AromaticContact CD2-NE2 3.79Å; F171-H219 HydrophobicContact CE1-CB 3.52Å; F171-H219 AromaticContact CE1-CG 3.89Å; F171-H219 HydrophobicContact CG-CB 4.12Å; F171-H219 AromaticContact CG-CD2 3.55Å; F171-H219 AromaticContact CG-CE1 3.76Å; F171-H219 AromaticContact CG-CG 3.55Å; F171-H219 AromaticContact CG-ND1 3.69Å; F171-H219 AromaticContact CG-NE2 3.68Å; F171-H219 HydrophobicContact CZ-CB 4.2Å
172	G	93.8	Very high	94	Very high	9 Å²	9	18.8 Å²	18.8	9%	0.093	10%	0.095	C	C	.	.	H	α-helix	trans	-59.5	-54.3	176.4	0	0	0	0	0	112.8	F170 T174 L175 N176	F170-G172 PolarHBondContact O-N 3.4Å; G172-T174 VanDerWaalsContact C-N 3.31Å; G172-T174 PolarHBondContact O-N 2.85Å; G172-L175 PolarHBondContact O-N 2.89Å; G172-N176 VanDerWaalsContact O-CB 3.28Å; G172-N176 WeakPolarHBondContact O-CB 3.3Å; G172-N176 PolarHBondContact O-N 3.45Å
173	P	95.5	Very high	94.2	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.013	10%	0.099	C	C	.	.	H	α-helix	trans	-53.5	-40.2	171.4	-31.5	37.4	0	0	0	114.8	L86 L116 Y119 W157 S169 F170 N176 S177	L86-P173 HydrophobicContact CD1-CB 3.93Å; L116-P173 HydrophobicContact CD2-CB 3.71Å; L116-P173 HydrophobicContact CD2-CG 3.59Å; Y119-P173 HydrophobicContact CD1-CB 4.44Å; Y119-P173 HydrophobicContact CD1-CG 4.35Å; Y119-P173 HydrophobicContact CD2-CB 3.85Å; Y119-P173 HydrophobicContact CE1-CG 4.36Å; Y119-P173 HydrophobicContact CE2-CB 3.95Å; Y119-P173 HydrophobicContact CG-CB 4.09Å; Y119-P173 HydrophobicContact CG-CG 4.47Å; W157-P173 HydrophobicContact CH2-CB 4.45Å; W157-P173 HydrophobicContact CH2-CG 3.08Å; W157-P173 HydrophobicContact CZ2-CG 3.34Å; W157-P173 HydrophobicContact CZ3-CG 4.03Å; S169-P173 WeakPolarHBondContact O-CD 3.38Å; S169-P173 WeakPolarHBondContact O-CG 3.3Å; F170-P173 VanDerWaalsContact O-CD 3.3Å; F170-P173 WeakPolarHBondContact O-CD 3.43Å; P173-N176 PolarHBondContact O-N 2.71Å; P173-S177 VanDerWaalsContact O-CB 3.25Å; P173-S177 WeakPolarHBondContact O-CB 3.45Å; P173-S177 PolarHBondContact O-N 2.79Å; P173-S177 PolarHBondContact O-OG 3.07Å
174	T	96.7	Very high	94.5	Very high	18 Å²	18	18.3 Å²	18.3	11%	0.11	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-54.4	176.8	-60.1	0	0	0	0	110.4	L83 I87 F170 F171 G172 N176 S177 F178	L83-T174 HydrophobicContact CD1-CG2 3.86Å; L83-T174 WeakPolarHBondContact CD1-O 3.46Å; I87-T174 HydrophobicContact CG1-CG2 4.25Å; F170-T174 PolarHBondContact O-N 2.88Å; F170-T174 VanDerWaalsContact O-N 3.07Å; F170-T174 PolarHBondContact O-OG1 3.29Å; F171-T174 WeakPolarHBondContact O-CB 3.27Å; F171-T174 PolarHBondContact O-N 3.34Å; G172-T174 VanDerWaalsContact C-N 3.31Å; G172-T174 PolarHBondContact O-N 2.85Å; T174-N176 VanDerWaalsContact C-N 3.35Å; T174-N176 PolarHBondContact O-N 2.98Å; T174-S177 PolarHBondContact O-N 2.96Å; T174-F178 PolarHBondContact O-N 2.69Å; T174-F178 VanDerWaalsContact O-N 3.14Å
175	L	96.7	Very high	94.7	Very high	36 Å²	36	19.8 Å²	19.8	19%	0.188	11%	0.105	C	C	.	.	H	α-helix	trans	-65.6	-38.2	178.4	-66.1	-178.1	0	0	0	112.3	F171 G172 F178 I179 Q212 L215	F171-L175 HydrophobicContact CD1-CD1 4.05Å; F171-L175 HydrophobicContact CE1-CD1 3.37Å; F171-L175 HydrophobicContact CE1-CG 4.14Å; F171-L175 HydrophobicContact CZ-CD1 3.7Å; F171-L175 HydrophobicContact CZ-CG 4.23Å; F171-L175 PolarHBondContact O-N 2.66Å; F171-L175 VanDerWaalsContact O-N 3.11Å; G172-L175 PolarHBondContact O-N 2.89Å; L175-F178 PolarHBondContact O-N 3.19Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 3.32Å; L175-Q212 HydrophobicContact CB-CG 3.63Å; L175-L215 HydrophobicContact CD1-CB 3.71Å; L175-L215 HydrophobicContact CD1-CD1 4.19Å
176	N	96.5	Very high	94.8	Very high	7 Å²	7	21.1 Å²	21.1	4%	0.037	11%	0.11	C	C	.	.	H	α-helix	trans	-64.6	-41.2	177.8	-178.3	-111.9	0	0	0	112	Y119 K123 G172 P173 T174 F178 I179 H180	Y119-N176 HydrophobicContact CE2-CB 4.12Å; Y119-N176 WeakPolarHBondContact CE2-OD1 3.32Å; Y119-N176 PolarHBondContact OH-OD1 3.47Å; K123-N176 PolarHBondContact NZ-OD1 2.85Å; G172-N176 VanDerWaalsContact O-CB 3.28Å; G172-N176 WeakPolarHBondContact O-CB 3.3Å; G172-N176 PolarHBondContact O-N 3.45Å; P173-N176 PolarHBondContact O-N 2.71Å; T174-N176 VanDerWaalsContact C-N 3.35Å; T174-N176 PolarHBondContact O-N 2.98Å; N176-F178 VanDerWaalsContact C-N 3.33Å; N176-F178 PolarHBondContact O-N 3.3Å; N176-I179 PolarHBondContact O-N 3.06Å; N176-H180 PolarHBondContact ND2-CD2 2.77Å; N176-H180 VanDerWaalsContact ND2-CD2 3.32Å; N176-H180 PolarHBondContact ND2-NE2 3.29Å; N176-H180 VanDerWaalsContact ND2-NE2 3.18Å; N176-H180 WeakPolarHBondContact O-CB 3.3Å; N176-H180 PolarHBondContact O-CD2 3.49Å; N176-H180 PolarHBondContact O-N 2.94Å; N176-H180 PolarHBondContact OD1-NE2 2.85Å
177	S	97.3	Very high	94.7	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-42.8	176.7	-59.8	0	0	0	0	110.7	P173 T174 I179 H180 I181	P173-S177 VanDerWaalsContact O-CB 3.25Å; P173-S177 WeakPolarHBondContact O-CB 3.45Å; P173-S177 PolarHBondContact O-N 2.79Å; P173-S177 PolarHBondContact O-OG 3.07Å; T174-S177 PolarHBondContact O-N 2.96Å; S177-I179 PolarHBondContact O-N 3.36Å; S177-H180 PolarHBondContact O-N 2.8Å; S177-I181 VanDerWaalsContact O-CG1 3.32Å; S177-I181 WeakPolarHBondContact O-CG1 3.19Å; S177-I181 PolarHBondContact O-N 3.33Å
178	F	97.8	Very high	94.8	Very high	100 Å²	100	25.4 Å²	25.4	44%	0.439	13%	0.131	S	C	.	.	H	α-helix	trans	-58.2	-48.3	172.9	175	-107.7	0	0	0	112.7	L83 T174 L175 N176 H180 I181 L182	L83-F178 HydrophobicContact CD1-CB 4.14Å; L83-F178 HydrophobicContact CD2-CB 4Å; L83-F178 HydrophobicContact CD2-CD2 4.02Å; T174-F178 PolarHBondContact O-N 2.69Å; T174-F178 VanDerWaalsContact O-N 3.14Å; L175-F178 PolarHBondContact O-N 3.19Å; N176-F178 VanDerWaalsContact C-N 3.33Å; N176-F178 PolarHBondContact O-N 3.3Å; F178-H180 VanDerWaalsContact C-N 3.31Å; F178-H180 PolarHBondContact O-N 3.25Å; F178-I181 WeakPolarHBondContact O-CB 3.48Å; F178-I181 PolarHBondContact O-N 3.24Å; F178-L182 HydrophobicContact CE1-CD1 3.95Å; F178-L182 HydrophobicContact CZ-CD1 3.97Å; F178-L182 PolarHBondContact O-N 3.37Å
179	I	96.9	Very high	94.8	Very high	7 Å²	7	28.1 Å²	28.1	4%	0.036	15%	0.145	C	C	.	.	H	α-helix	trans	-65.6	-35.3	177.2	-66.5	-58.9	0	0	0	111.9	L175 N176 S177 L182 M183 A208 Q209 Q212	L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 3.32Å; N176-I179 PolarHBondContact O-N 3.06Å; S177-I179 PolarHBondContact O-N 3.36Å; I179-L182 PolarHBondContact O-N 3.33Å; I179-M183 WeakPolarHBondContact O-CB 3.28Å; I179-M183 PolarHBondContact O-N 3.44Å; I179-A208 HydrophobicContact CD1-CB 3.64Å; I179-Q209 HydrophobicContact CG2-CG 3.51Å; I179-Q212 HydrophobicContact CG1-CB 3.99Å; I179-Q212 HydrophobicContact CG1-CG 3.98Å; I179-Q212 VanDerWaalsContact CG1-OE1 3.29Å
180	H	96.2	Very high	94.7	Very high	7 Å²	7	29 Å²	29	3%	0.032	15%	0.151	C	C	.	.	H	α-helix	trans	-65.3	-39.9	176.6	-84.6	-137.7	0	0	0	111.5	S79 K123 E126 N176 S177 F178 L182 M183 Y184	S79-H180 WeakPolarHBondContact OG-CB 3.21Å; K123-H180 PolarHBondContact NZ-CE1 2.73Å; K123-H180 VanDerWaalsContact NZ-CE1 3.29Å; E126-H180 IonicContact OE1-CE1 2.77Å; E126-H180 PolarHBondContact OE1-CE1 2.59Å; E126-H180 IonicContact OE1-ND1 2.89Å; E126-H180 PolarHBondContact OE1-ND1 3.38Å; E126-H180 IonicContact OE2-CE1 3Å; E126-H180 PolarHBondContact OE2-CE1 2.85Å; N176-H180 PolarHBondContact ND2-CD2 2.77Å; N176-H180 VanDerWaalsContact ND2-CD2 3.32Å; N176-H180 PolarHBondContact ND2-NE2 3.29Å; N176-H180 VanDerWaalsContact ND2-NE2 3.18Å; N176-H180 WeakPolarHBondContact O-CB 3.3Å; N176-H180 PolarHBondContact O-CD2 3.49Å; N176-H180 PolarHBondContact O-N 2.94Å; N176-H180 PolarHBondContact OD1-NE2 2.85Å; S177-H180 PolarHBondContact O-N 2.8Å; F178-H180 VanDerWaalsContact C-N 3.31Å; F178-H180 PolarHBondContact O-N 3.25Å; H180-L182 VanDerWaalsContact C-N 3.28Å; H180-L182 PolarHBondContact O-N 2.96Å; H180-M183 VanDerWaalsContact CD2-CE 3.41Å; H180-M183 WeakPolarHBondContact CD2-CE 3.4Å; H180-M183 WeakPolarHBondContact NE2-CE 3Å; H180-M183 PolarHBondContact O-N 3.22Å; H180-Y184 HydrophobicContact CB-CD2 4.06Å; H180-Y184 HydrophobicContact CB-CE2 4.3Å; H180-Y184 AromaticContact CG-CE2 4Å; H180-Y184 AromaticContact ND1-CE2 3.51Å; H180-Y184 WeakPolarHBondContact O-CB 3.48Å; H180-Y184 VanDerWaalsContact O-CD2 3.31Å; H180-Y184 WeakPolarHBondContact O-CD2 3.44Å; H180-Y184 PolarHBondContact O-N 3.33Å
181	I	97.5	Very high	94.5	Very high	33 Å²	33	29.5 Å²	29.5	17%	0.169	16%	0.155	C	C	.	.	H	α-helix	trans	-53.7	-48.8	171.8	-65.3	162.5	0	0	0	110.2	T76 A80 L83 S177 F178 S185	T76-I181 HydrophobicContact CG2-CG2 4.19Å; A80-I181 HydrophobicContact CB-CD1 4Å; A80-I181 HydrophobicContact CB-CG1 4.22Å; L83-I181 HydrophobicContact CB-CD1 4.18Å; L83-I181 HydrophobicContact CD2-CD1 3.53Å; S177-I181 VanDerWaalsContact O-CG1 3.32Å; S177-I181 WeakPolarHBondContact O-CG1 3.19Å; S177-I181 PolarHBondContact O-N 3.33Å; F178-I181 WeakPolarHBondContact O-CB 3.48Å; F178-I181 PolarHBondContact O-N 3.24Å; I181-S185 WeakPolarHBondContact O-CB 3.47Å; I181-S185 PolarHBondContact O-N 3.07Å; I181-S185 PolarHBondContact O-OG 3.34Å
182	L	96.6	Very high	94.2	Very high	58 Å²	58	30.9 Å²	30.9	30%	0.304	16%	0.161	S	C	.	.	H	α-helix	trans	-67.3	-44.2	-179.2	-59.4	179.5	0	0	0	112.3	F178 I179 H180 Y186 L205	F178-L182 HydrophobicContact CE1-CD1 3.95Å; F178-L182 HydrophobicContact CZ-CD1 3.97Å; F178-L182 PolarHBondContact O-N 3.37Å; I179-L182 PolarHBondContact O-N 3.33Å; H180-L182 VanDerWaalsContact C-N 3.28Å; H180-L182 PolarHBondContact O-N 2.96Å; L182-Y186 WeakPolarHBondContact O-CB 3.42Å; L182-Y186 PolarHBondContact O-N 3.32Å; L182-L205 HydrophobicContact CB-CD2 3.58Å
183	M	94.9	Very high	93.8	Very high	20 Å²	20	34.5 Å²	34.5	10%	0.099	18%	0.183	C	C	.	.	H	α-helix	trans	-67.4	-48.9	-177.5	177.8	179.9	45.1	0	0	112.2	I179 H180 Y186 Y187	I179-M183 WeakPolarHBondContact O-CB 3.28Å; I179-M183 PolarHBondContact O-N 3.44Å; H180-M183 VanDerWaalsContact CD2-CE 3.41Å; H180-M183 WeakPolarHBondContact CD2-CE 3.4Å; H180-M183 WeakPolarHBondContact NE2-CE 3Å; H180-M183 PolarHBondContact O-N 3.22Å; M183-Y186 WeakPolarHBondContact O-CB 3.34Å; M183-Y186 PolarHBondContact O-N 2.98Å; M183-Y187 HydrophobicContact CG-CD2 3.97Å; M183-Y187 HydrophobicContact CG-CE2 3.43Å; M183-Y187 VanDerWaalsContact CG-CE2 3.43Å; M183-Y187 PolarHBondContact O-N 3.17Å; M183-Y187 HydrophobicContact SD-CE2 3.78Å
184	Y	95.3	Very high	93.5	Very high	1 Å²	1	38.5 Å²	38.5	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-71.8	-31.5	179.9	-78.1	-81.6	0	0	0	112	Y71 N72 I75 T76 E126 D129 H180 Y187 G188	Y71-Y184 AromaticContact CE1-CE1 3.98Å; Y71-Y184 HydrophobicContact CE1-CE1 3.98Å; N72-Y184 WeakPolarHBondContact OD1-CD1 3.39Å; I75-Y184 HydrophobicContact CB-CD1 3.83Å; I75-Y184 HydrophobicContact CB-CD2 4.26Å; I75-Y184 HydrophobicContact CB-CE1 4.01Å; I75-Y184 HydrophobicContact CB-CE2 4.44Å; I75-Y184 HydrophobicContact CB-CG 3.96Å; I75-Y184 HydrophobicContact CG1-CD1 4.37Å; I75-Y184 HydrophobicContact CG1-CE1 4.17Å; I75-Y184 HydrophobicContact CG2-CD1 3.84Å; I75-Y184 HydrophobicContact CG2-CD2 3.44Å; I75-Y184 VanDerWaalsContact CG2-CD2 3.44Å; I75-Y184 HydrophobicContact CG2-CE1 3.79Å; I75-Y184 HydrophobicContact CG2-CE2 3.4Å; I75-Y184 VanDerWaalsContact CG2-CE2 3.4Å; I75-Y184 HydrophobicContact CG2-CG 3.67Å; T76-Y184 WeakPolarHBondContact OG1-CB 3.13Å; E126-Y184 WeakPolarHBondContact CG-OH 3.31Å; D129-Y184 PolarHBondContact OD2-OH 3.2Å; H180-Y184 HydrophobicContact CB-CD2 4.06Å; H180-Y184 HydrophobicContact CB-CE2 4.3Å; H180-Y184 AromaticContact CG-CE2 4Å; H180-Y184 AromaticContact ND1-CE2 3.51Å; H180-Y184 WeakPolarHBondContact O-CB 3.48Å; H180-Y184 VanDerWaalsContact O-CD2 3.31Å; H180-Y184 WeakPolarHBondContact O-CD2 3.44Å; H180-Y184 PolarHBondContact O-N 3.33Å; Y184-Y187 HydrophobicContact CD1-CD2 4.42Å; Y184-Y187 PolarHBondContact O-N 2.82Å; Y184-G188 PolarHBondContact O-N 2.72Å
185	S	94.4	Very high	93.2	Very high	43 Å²	43	40.5 Å²	40.5	30%	0.301	22%	0.22	S	C	.	.	H	α-helix	trans	-60.9	-45.3	167.6	-63.4	0	0	0	0	111.2	T76 I181 Y187 G188 L189	T76-S185 WeakPolarHBondContact CG2-OG 3.24Å; T76-S185 PolarHBondContact OG1-N 3.19Å; I181-S185 WeakPolarHBondContact O-CB 3.47Å; I181-S185 PolarHBondContact O-N 3.07Å; I181-S185 PolarHBondContact O-OG 3.34Å; S185-Y187 PolarHBondContact O-N 3.1Å; S185-G188 PolarHBondContact O-N 3.39Å; S185-L189 WeakPolarHBondContact O-CB 3.27Å; S185-L189 VanDerWaalsContact O-CG 3.27Å; S185-L189 WeakPolarHBondContact O-CG 3.34Å; S185-L189 PolarHBondContact O-N 2.92Å
186	Y	93.8	Very high	92.8	Very high	28 Å²	28	43.9 Å²	43.9	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-45.2	174.6	178.6	-82.2	0	0	0	111.9	L182 M183 L189 S190 L199 W201 K202 L205	L182-Y186 WeakPolarHBondContact O-CB 3.42Å; L182-Y186 PolarHBondContact O-N 3.32Å; M183-Y186 WeakPolarHBondContact O-CB 3.34Å; M183-Y186 PolarHBondContact O-N 2.98Å; Y186-L189 PolarHBondContact O-N 2.75Å; Y186-S190 VanDerWaalsContact O-CB 3.31Å; Y186-S190 WeakPolarHBondContact O-CB 3.33Å; Y186-S190 PolarHBondContact O-N 3.5Å; Y186-L199 HydrophobicContact CD2-CB 4.39Å; Y186-L199 HydrophobicContact CD2-CD2 3.82Å; Y186-L199 HydrophobicContact CE2-CB 3.63Å; Y186-L199 HydrophobicContact CE2-CD1 4.34Å; Y186-L199 HydrophobicContact CE2-CD2 3.94Å; Y186-L199 HydrophobicContact CE2-CG 4.16Å; Y186-W201 HydrophobicContact CD2-CD2 4.32Å; Y186-W201 HydrophobicContact CD2-CE3 4.42Å; Y186-W201 AromaticContact CD2-CH2 4Å; Y186-W201 HydrophobicContact CD2-CH2 4Å; Y186-W201 AromaticContact CD2-CZ2 3.85Å; Y186-W201 HydrophobicContact CD2-CZ2 3.85Å; Y186-W201 HydrophobicContact CD2-CZ3 4.29Å; Y186-W201 HydrophobicContact CG-CH2 4.41Å; Y186-K202 HydrophobicContact CE1-CG 4.36Å; Y186-K202 HydrophobicContact CE2-CB 3.86Å; Y186-K202 HydrophobicContact CE2-CG 4.32Å; Y186-K202 WeakPolarHBondContact OH-CB 3.36Å; Y186-K202 WeakPolarHBondContact OH-CD 3.34Å; Y186-L205 HydrophobicContact CD1-CD1 4.17Å; Y186-L205 HydrophobicContact CD2-CD1 3.47Å; Y186-L205 VanDerWaalsContact CD2-CD1 3.47Å; Y186-L205 HydrophobicContact CE2-CD1 4.24Å; Y186-L205 HydrophobicContact CG-CD1 3.45Å; Y186-L205 VanDerWaalsContact CG-CD1 3.45Å
187	Y	90.6	Very high	92.3	Very high	77 Å²	77	51.8 Å²	51.8	30%	0.302	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-44.1	178.3	-68.1	-25.1	0	0	0	112.4	N72 M183 Y184 S185 L189 S190 V191	N72-Y187 VanDerWaalsContact OD1-CB 3.26Å; N72-Y187 WeakPolarHBondContact OD1-CB 3.2Å; M183-Y187 HydrophobicContact CG-CD2 3.97Å; M183-Y187 HydrophobicContact CG-CE2 3.43Å; M183-Y187 VanDerWaalsContact CG-CE2 3.43Å; M183-Y187 PolarHBondContact O-N 3.17Å; M183-Y187 HydrophobicContact SD-CE2 3.78Å; Y184-Y187 HydrophobicContact CD1-CD2 4.42Å; Y184-Y187 PolarHBondContact O-N 2.82Å; S185-Y187 PolarHBondContact O-N 3.1Å; Y187-L189 PolarHBondContact O-N 3.26Å; Y187-S190 WeakPolarHBondContact CA-OG 3.46Å; Y187-S190 PolarHBondContact O-N 3.33Å; Y187-S190 VanDerWaalsContact O-N 3.13Å; Y187-S190 PolarHBondContact O-OG 2.73Å; Y187-V191 WeakPolarHBondContact O-CG2 3.37Å; Y187-V191 PolarHBondContact O-N 2.98Å
188	G	91.3	Very high	91.9	Very high	12 Å²	12	58.5 Å²	58.5	12%	0.124	29%	0.294	C	S	.	.	H	α-helix	trans	-58	-45.5	174.9	0	0	0	0	0	112.3	Y184 S185 V191 F192	Y184-G188 PolarHBondContact O-N 2.72Å; S185-G188 PolarHBondContact O-N 3.39Å; G188-V191 WeakPolarHBondContact O-CB 3.37Å; G188-V191 WeakPolarHBondContact O-CG2 3.44Å; G188-V191 PolarHBondContact O-N 3.24Å; G188-F192 WeakPolarHBondContact O-CD2 3.36Å
189	L	90.7	Very high	91.6	Very high	67 Å²	67	54.3 Å²	54.3	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-66.4	-36.7	175.2	-67.8	176.4	0	0	0	112.2	S185 Y186 Y187 V191 F192 M195 L199	S185-L189 WeakPolarHBondContact O-CB 3.27Å; S185-L189 VanDerWaalsContact O-CG 3.27Å; S185-L189 WeakPolarHBondContact O-CG 3.34Å; S185-L189 PolarHBondContact O-N 2.92Å; Y186-L189 PolarHBondContact O-N 2.75Å; Y187-L189 PolarHBondContact O-N 3.26Å; L189-V191 PolarHBondContact O-N 3.34Å; L189-V191 VanDerWaalsContact O-N 3.12Å; L189-F192 PolarHBondContact O-N 3.27Å; L189-M195 HydrophobicContact CD2-CE 4.14Å; L189-M195 WeakPolarHBondContact O-CB 3.45Å; L189-L199 HydrophobicContact CB-CD1 4.35Å; L189-L199 HydrophobicContact CB-CD2 3.99Å; L189-L199 HydrophobicContact CD1-CD2 4.23Å
190	S	88.8	Confident	91.3	Very high	37 Å²	37	63 Å²	63	26%	0.259	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-13.5	179.2	81.9	0	0	0	0	113.9	Y186 Y187 F192 H196	Y186-S190 VanDerWaalsContact O-CB 3.31Å; Y186-S190 WeakPolarHBondContact O-CB 3.33Å; Y186-S190 PolarHBondContact O-N 3.5Å; Y187-S190 WeakPolarHBondContact CA-OG 3.46Å; Y187-S190 PolarHBondContact O-N 3.33Å; Y187-S190 VanDerWaalsContact O-N 3.13Å; Y187-S190 PolarHBondContact O-OG 2.73Å; S190-F192 PolarHBondContact O-N 3.36Å; S190-H196 PolarHBondContact O-NE2 3.29Å
191	V	89.2	Confident	91	Very high	16 Å²	16	65.9 Å²	65.9	10%	0.097	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-26.7	172.4	-175.2	0	0	0	0	111.3	R65 L68 Y187 G188 L189 P193	R65-V191 HydrophobicContact CB-CG1 3.99Å; R65-V191 HydrophobicContact CG-CG1 3.44Å; R65-V191 VanDerWaalsContact CG-CG1 3.44Å; R65-V191 PolarHBondContact NE-O 2.98Å; L68-V191 HydrophobicContact CB-CG2 4.05Å; Y187-V191 WeakPolarHBondContact O-CG2 3.37Å; Y187-V191 PolarHBondContact O-N 2.98Å; G188-V191 WeakPolarHBondContact O-CB 3.37Å; G188-V191 WeakPolarHBondContact O-CG2 3.44Å; G188-V191 PolarHBondContact O-N 3.24Å; L189-V191 PolarHBondContact O-N 3.34Å; L189-V191 VanDerWaalsContact O-N 3.12Å; V191-P193 WeakPolarHBondContact O-CD 3.47Å
192	F	88.4	Confident	90.5	Very high	69 Å²	69	69.2 Å²	69.2	30%	0.303	33%	0.333	S	S	.	.	S	Bend	trans	-93.2	115.2	-178.9	-59	-98.2	0	0	0	110.7	T69 G188 L189 S190 S194 M195 H196	T69-F192 HydrophobicContact CG2-CE2 4.15Å; T69-F192 HydrophobicContact CG2-CZ 4.08Å; G188-F192 WeakPolarHBondContact O-CD2 3.36Å; L189-F192 PolarHBondContact O-N 3.27Å; S190-F192 PolarHBondContact O-N 3.36Å; F192-S194 PolarHBondContact O-N 3.47Å; F192-M195 HydrophobicContact CB-CB 4.15Å; F192-M195 HydrophobicContact CB-CG 3.75Å; F192-M195 WeakPolarHBondContact O-CB 2.95Å; F192-M195 PolarHBondContact O-N 2.88Å; F192-H196 PolarHBondContact O-CD2 3.21Å
193	P	85.5	Confident	90.1	Very high	85 Å²	85	70.7 Å²	70.7	55%	0.552	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-58.6	-33.6	179.6	-25.7	35.2	0	0	0	113.5	V191 M195 H196	V191-P193 WeakPolarHBondContact O-CD 3.47Å; P193-M195 PolarHBondContact O-N 3.47Å; P193-H196 WeakPolarHBondContact O-CB 3.24Å; P193-H196 PolarHBondContact O-N 2.83Å
194	S	89.2	Confident	89.9	Confident	86 Å²	86	76 Å²	76	60%	0.601	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-60.4	-28	174.7	51.1	0	0	0	0	113.1	F192	F192-S194 PolarHBondContact O-N 3.47Å
195	M	89.3	Confident	89.7	Confident	61 Å²	61	76.6 Å²	76.6	30%	0.3	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-84.3	-16.4	-178.1	-64.6	-55.4	-68.3	0	0	113.2	L189 F192 P193 K197 Y198 L199	L189-M195 HydrophobicContact CD2-CE 4.14Å; L189-M195 WeakPolarHBondContact O-CB 3.45Å; F192-M195 HydrophobicContact CB-CB 4.15Å; F192-M195 HydrophobicContact CB-CG 3.75Å; F192-M195 WeakPolarHBondContact O-CB 2.95Å; F192-M195 PolarHBondContact O-N 2.88Å; P193-M195 PolarHBondContact O-N 3.47Å; M195-K197 PolarHBondContact O-N 2.94Å; M195-K197 VanDerWaalsContact O-N 3.13Å; M195-Y198 HydrophobicContact CE-CD2 4.4Å; M195-Y198 PolarHBondContact O-N 3.33Å; M195-Y198 HydrophobicContact SD-CD2 4.32Å; M195-L199 WeakPolarHBondContact O-CG 3.18Å; M195-L199 PolarHBondContact O-N 3.19Å
196	H	87.6	Confident	89.4	Confident	106 Å²	106	75 Å²	75	49%	0.491	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-56.4	-35.5	-174.2	-71.2	-176.1	0	0	0	113.4	S190 F192 P193 Y198 L199	S190-H196 PolarHBondContact O-NE2 3.29Å; F192-H196 PolarHBondContact O-CD2 3.21Å; P193-H196 WeakPolarHBondContact O-CB 3.24Å; P193-H196 PolarHBondContact O-N 2.83Å; H196-Y198 PolarHBondContact O-N 2.96Å; H196-L199 PolarHBondContact O-N 3.42Å
197	K	87.6	Confident	89.3	Confident	174 Å²	174	76.7 Å²	76.7	76%	0.757	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-60.7	-32.2	176.7	-176	-179.5	176.8	-176.5	0	112.8	M195	M195-K197 PolarHBondContact O-N 2.94Å; M195-K197 VanDerWaalsContact O-N 3.13Å
198	Y	89.1	Confident	89.4	Confident	141 Å²	141	74.5 Å²	74.5	55%	0.553	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-89.8	-8.9	-175.9	-53.9	-81.4	0	0	0	112.9	M195 H196 W200	M195-Y198 HydrophobicContact CE-CD2 4.4Å; M195-Y198 PolarHBondContact O-N 3.33Å; M195-Y198 HydrophobicContact SD-CD2 4.32Å; H196-Y198 PolarHBondContact O-N 2.96Å; Y198-W200 VanDerWaalsContact C-N 3.25Å; Y198-W200 PolarHBondContact O-N 3.23Å
199	L	91.3	Very high	89.5	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.063	36%	0.355	C	S	.	.			trans	-89.9	36.3	-176.4	-65.6	178.6	0	0	0	113.3	Y186 L189 M195 H196 W201	Y186-L199 HydrophobicContact CD2-CB 4.39Å; Y186-L199 HydrophobicContact CD2-CD2 3.82Å; Y186-L199 HydrophobicContact CE2-CB 3.63Å; Y186-L199 HydrophobicContact CE2-CD1 4.34Å; Y186-L199 HydrophobicContact CE2-CD2 3.94Å; Y186-L199 HydrophobicContact CE2-CG 4.16Å; L189-L199 HydrophobicContact CB-CD1 4.35Å; L189-L199 HydrophobicContact CB-CD2 3.99Å; L189-L199 HydrophobicContact CD1-CD2 4.23Å; M195-L199 WeakPolarHBondContact O-CG 3.18Å; M195-L199 PolarHBondContact O-N 3.19Å; H196-L199 PolarHBondContact O-N 3.42Å; L199-W201 HydrophobicContact CD2-CZ2 4.21Å; L199-W201 PolarHBondContact O-N 3.09Å
200	W	90.1	Very high	89.5	Confident	189 Å²	189	73.2 Å²	73.2	72%	0.716	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.4	179.6	58.9	-90.4	0	0	0	113.3	Y198 K202 Y204	Y198-W200 VanDerWaalsContact C-N 3.25Å; Y198-W200 PolarHBondContact O-N 3.23Å; W200-K202 VanDerWaalsContact C-N 3.25Å; W200-K202 PolarHBondContact O-N 2.98Å; W200-Y204 AromaticContact CE3-CE2 3.96Å; W200-Y204 HydrophobicContact CE3-CE2 3.96Å; W200-Y204 HydrophobicContact CZ3-CD2 4.18Å; W200-Y204 AromaticContact CZ3-CE2 3.51Å; W200-Y204 HydrophobicContact CZ3-CE2 3.51Å
201	W	90.3	Very high	89.7	Confident	69 Å²	69	75.2 Å²	75.2	26%	0.261	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	11.2	-174.2	54.9	-83.8	0	0	0	114.6	Y186 L199 K203 Y204 L205	Y186-W201 HydrophobicContact CD2-CD2 4.32Å; Y186-W201 HydrophobicContact CD2-CE3 4.42Å; Y186-W201 AromaticContact CD2-CH2 4Å; Y186-W201 HydrophobicContact CD2-CH2 4Å; Y186-W201 AromaticContact CD2-CZ2 3.85Å; Y186-W201 HydrophobicContact CD2-CZ2 3.85Å; Y186-W201 HydrophobicContact CD2-CZ3 4.29Å; Y186-W201 HydrophobicContact CG-CH2 4.41Å; L199-W201 HydrophobicContact CD2-CZ2 4.21Å; L199-W201 PolarHBondContact O-N 3.09Å; W201-K203 PolarHBondContact O-N 3.14Å; W201-K203 VanDerWaalsContact O-N 3.14Å; W201-Y204 HydrophobicContact CB-CD2 3.95Å; W201-Y204 PolarHBondContact O-N 2.87Å; W201-L205 HydrophobicContact CE3-CD1 3.8Å; W201-L205 HydrophobicContact CE3-CD2 4.38Å; W201-L205 HydrophobicContact CE3-CG 3.69Å; W201-L205 HydrophobicContact CH2-CD1 4.13Å; W201-L205 HydrophobicContact CZ3-CD1 3.46Å; W201-L205 VanDerWaalsContact CZ3-CD1 3.46Å; W201-L205 HydrophobicContact CZ3-CD2 3.74Å; W201-L205 HydrophobicContact CZ3-CG 3.47Å; W201-L205 VanDerWaalsContact CZ3-CG 3.47Å; W201-L205 PolarHBondContact O-N 3Å
202	K	87.6	Confident	90	Very high	103 Å²	103	75.1 Å²	75.1	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-50.5	-39	175.4	-171	-176.2	175.9	178.2	0	113.2	Y186 W200 L205 T206	Y186-K202 HydrophobicContact CE1-CG 4.36Å; Y186-K202 HydrophobicContact CE2-CB 3.86Å; Y186-K202 HydrophobicContact CE2-CG 4.32Å; Y186-K202 WeakPolarHBondContact OH-CB 3.36Å; Y186-K202 WeakPolarHBondContact OH-CD 3.34Å; W200-K202 VanDerWaalsContact C-N 3.25Å; W200-K202 PolarHBondContact O-N 2.98Å; K202-L205 WeakPolarHBondContact O-CB 3.31Å; K202-L205 PolarHBondContact O-N 3.27Å; K202-T206 PolarHBondContact O-N 3.26Å
203	K	86.9	Confident	90.2	Very high	89 Å²	89	72.1 Å²	72.1	39%	0.387	34%	0.34	S	S	.	.	H	α-helix	trans	-65.6	-39.1	179.2	-177.5	-177.1	173	-172	0	111.8	W201 L205 T206 Q207 Y253 Y257	W201-K203 PolarHBondContact O-N 3.14Å; W201-K203 VanDerWaalsContact O-N 3.14Å; K203-L205 VanDerWaalsContact C-N 3.32Å; K203-T206 PolarHBondContact O-N 3.33Å; K203-Q207 WeakPolarHBondContact O-CG 3.5Å; K203-Q207 PolarHBondContact O-N 3.05Å; K203-Q207 VanDerWaalsContact O-N 3.09Å; K203-Y253 WeakPolarHBondContact CE-OH 3.3Å; K203-Y253 HydrophobicContact CG-CE2 4.29Å; K203-Y257 HydrophobicContact CB-CD1 4.43Å; K203-Y257 HydrophobicContact CB-CE1 4.08Å; K203-Y257 HydrophobicContact CD-CD1 4.49Å; K203-Y257 HydrophobicContact CG-CD1 4.22Å; K203-Y257 HydrophobicContact CG-CE1 4.29Å; K203-Y257 HydrophobicContact CG-CG 4.46Å
204	Y	91.7	Very high	90.5	Very high	131 Å²	131	71.8 Å²	71.8	51%	0.514	34%	0.337	S	S	.	.	H	α-helix	trans	-69.2	-31.3	179.4	-59.8	-73.2	0	0	0	111.8	W200 W201 Q207 A208	W200-Y204 AromaticContact CE3-CE2 3.96Å; W200-Y204 HydrophobicContact CE3-CE2 3.96Å; W200-Y204 HydrophobicContact CZ3-CD2 4.18Å; W200-Y204 AromaticContact CZ3-CE2 3.51Å; W200-Y204 HydrophobicContact CZ3-CE2 3.51Å; W201-Y204 HydrophobicContact CB-CD2 3.95Å; W201-Y204 PolarHBondContact O-N 2.87Å; Y204-Q207 VanDerWaalsContact CD1-OE1 3.27Å; Y204-Q207 PolarHBondContact O-N 3.4Å; Y204-A208 WeakPolarHBondContact O-CB 3.34Å; Y204-A208 PolarHBondContact O-N 2.9Å
205	L	90.7	Very high	90.8	Very high	13 Å²	13	71.6 Å²	71.6	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-57.9	-48.4	169.8	-84.7	167	0	0	0	112.1	L182 Y186 W201 K202 K203 Q207 A208 Q209	L182-L205 HydrophobicContact CB-CD2 3.58Å; Y186-L205 HydrophobicContact CD1-CD1 4.17Å; Y186-L205 HydrophobicContact CD2-CD1 3.47Å; Y186-L205 VanDerWaalsContact CD2-CD1 3.47Å; Y186-L205 HydrophobicContact CE2-CD1 4.24Å; Y186-L205 HydrophobicContact CG-CD1 3.45Å; Y186-L205 VanDerWaalsContact CG-CD1 3.45Å; W201-L205 HydrophobicContact CE3-CD1 3.8Å; W201-L205 HydrophobicContact CE3-CD2 4.38Å; W201-L205 HydrophobicContact CE3-CG 3.69Å; W201-L205 HydrophobicContact CH2-CD1 4.13Å; W201-L205 HydrophobicContact CZ3-CD1 3.46Å; W201-L205 VanDerWaalsContact CZ3-CD1 3.46Å; W201-L205 HydrophobicContact CZ3-CD2 3.74Å; W201-L205 HydrophobicContact CZ3-CG 3.47Å; W201-L205 VanDerWaalsContact CZ3-CG 3.47Å; W201-L205 PolarHBondContact O-N 3Å; K202-L205 WeakPolarHBondContact O-CB 3.31Å; K202-L205 PolarHBondContact O-N 3.27Å; K203-L205 VanDerWaalsContact C-N 3.32Å; L205-Q207 VanDerWaalsContact C-N 3.29Å; L205-Q207 PolarHBondContact O-N 3.37Å; L205-A208 PolarHBondContact O-N 2.92Å; L205-Q209 WeakPolarHBondContact O-CG 3.16Å; L205-Q209 PolarHBondContact O-N 3.24Å
206	T	88.5	Confident	90.9	Very high	9 Å²	9	68.8 Å²	68.8	6%	0.055	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-34.7	178.7	-49.7	0	0	0	0	111.9	K202 K203 Q209 L210 F252 Y253 Y257	K202-T206 PolarHBondContact O-N 3.26Å; K203-T206 PolarHBondContact O-N 3.33Å; T206-Q209 PolarHBondContact O-N 3.38Å; T206-L210 PolarHBondContact O-N 3.13Å; T206-L210 VanDerWaalsContact O-N 3.14Å; T206-F252 HydrophobicContact CG2-CD1 4.18Å; T206-F252 HydrophobicContact CG2-CE1 4.14Å; T206-Y253 HydrophobicContact CG2-CD2 3.91Å; T206-Y257 HydrophobicContact CG2-CE2 4.29Å
207	Q	90.6	Very high	91.1	Very high	65 Å²	65	65.6 Å²	65.6	30%	0.304	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-42.3	172.6	-69.3	176.7	-26	0	0	111.7	K203 Y204 L205 Q209 L210 V211 Y253	K203-Q207 WeakPolarHBondContact O-CG 3.5Å; K203-Q207 PolarHBondContact O-N 3.05Å; K203-Q207 VanDerWaalsContact O-N 3.09Å; Y204-Q207 VanDerWaalsContact CD1-OE1 3.27Å; Y204-Q207 PolarHBondContact O-N 3.4Å; L205-Q207 VanDerWaalsContact C-N 3.29Å; L205-Q207 PolarHBondContact O-N 3.37Å; Q207-Q209 VanDerWaalsContact C-N 3.35Å; Q207-Q209 PolarHBondContact O-N 3.45Å; Q207-L210 PolarHBondContact O-N 2.66Å; Q207-V211 WeakPolarHBondContact O-CG2 3.28Å; Q207-V211 PolarHBondContact O-N 3.34Å; Q207-Y253 HydrophobicContact CG-CE2 3.91Å; Q207-Y253 PolarHBondContact NE2-OH 2.94Å; Q207-Y253 VanDerWaalsContact NE2-OH 3.13Å
208	A	93.7	Very high	91.3	Very high	30 Å²	30	61.4 Å²	61.4	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-39.1	176.8	0	0	0	0	0	112.1	I179 Y204 L205 V211 Q212	I179-A208 HydrophobicContact CD1-CB 3.64Å; Y204-A208 WeakPolarHBondContact O-CB 3.34Å; Y204-A208 PolarHBondContact O-N 2.9Å; L205-A208 PolarHBondContact O-N 2.92Å; A208-V211 PolarHBondContact O-N 3.49Å; A208-Q212 WeakPolarHBondContact O-CB 3.39Å; A208-Q212 PolarHBondContact O-N 3.12Å
209	Q	92.3	Very high	91.5	Very high	28 Å²	28	55.4 Å²	55.4	13%	0.131	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-43.5	171.9	-75.9	172.2	-46.1	0	0	112.3	I179 L205 T206 Q207 Q212 F213 F249	I179-Q209 HydrophobicContact CG2-CG 3.51Å; L205-Q209 WeakPolarHBondContact O-CG 3.16Å; L205-Q209 PolarHBondContact O-N 3.24Å; T206-Q209 PolarHBondContact O-N 3.38Å; Q207-Q209 VanDerWaalsContact C-N 3.35Å; Q207-Q209 PolarHBondContact O-N 3.45Å; Q209-Q212 WeakPolarHBondContact O-CB 3.36Å; Q209-Q212 PolarHBondContact O-N 2.96Å; Q209-F213 WeakPolarHBondContact O-CD2 3.33Å; Q209-F213 WeakPolarHBondContact O-CG 3.25Å; Q209-F213 PolarHBondContact O-N 2.83Å; Q209-F249 HydrophobicContact CB-CD1 4.43Å; Q209-F249 HydrophobicContact CB-CE1 4.12Å; Q209-F249 HydrophobicContact CG-CE1 4.48Å
210	L	91.2	Very high	91.4	Very high	24 Å²	24	55.2 Å²	55.2	13%	0.126	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-43.3	176	-77.8	167.8	0	0	0	111.9	T206 Q207 Q212 F213 V214 F249 L250 Y253	T206-L210 PolarHBondContact O-N 3.13Å; T206-L210 VanDerWaalsContact O-N 3.14Å; Q207-L210 PolarHBondContact O-N 2.66Å; L210-Q212 VanDerWaalsContact C-N 3.32Å; L210-Q212 PolarHBondContact O-N 3.22Å; L210-F213 PolarHBondContact O-N 2.94Å; L210-V214 WeakPolarHBondContact O-CG2 3.3Å; L210-V214 PolarHBondContact O-N 2.9Å; L210-V214 VanDerWaalsContact O-N 3.14Å; L210-F249 HydrophobicContact CD2-CB 3.65Å; L210-F249 HydrophobicContact CG-CB 4.38Å; L210-L250 HydrophobicContact CD1-CD2 4.05Å; L210-L250 HydrophobicContact CD2-CD2 3.98Å; L210-L250 HydrophobicContact CD2-CG 3.94Å; L210-Y253 HydrophobicContact CD1-CD2 4.41Å; L210-Y253 HydrophobicContact CD1-CG 4.32Å
211	V	93.9	Very high	91.3	Very high	80 Å²	80	49.5 Å²	49.5	49%	0.485	25%	0.249	S	C	.	.	H	α-helix	trans	-61.1	-42.2	176	171.3	0	0	0	0	110.8	Q207 A208 F213 V214 L215	Q207-V211 WeakPolarHBondContact O-CG2 3.28Å; Q207-V211 PolarHBondContact O-N 3.34Å; A208-V211 PolarHBondContact O-N 3.49Å; V211-F213 VanDerWaalsContact C-N 3.31Å; V211-F213 PolarHBondContact O-N 2.94Å; V211-V214 PolarHBondContact O-N 3Å; V211-L215 HydrophobicContact CG1-CD1 3.77Å; V211-L215 HydrophobicContact CG1-CG 4.07Å; V211-L215 WeakPolarHBondContact O-CB 3.32Å; V211-L215 VanDerWaalsContact O-CG 3.32Å; V211-L215 WeakPolarHBondContact O-CG 3.46Å; V211-L215 PolarHBondContact O-N 3.33Å
212	Q	94.9	Very high	91.2	Very high	13 Å²	13	47.8 Å²	47.8	6%	0.061	25%	0.247	C	C	.	.	H	α-helix	trans	-53.3	-46.9	175.3	-173.4	-145.6	-62.3	0	0	111.8	L175 I179 A208 Q209 L210 T216	L175-Q212 HydrophobicContact CB-CG 3.63Å; I179-Q212 HydrophobicContact CG1-CB 3.99Å; I179-Q212 HydrophobicContact CG1-CG 3.98Å; I179-Q212 VanDerWaalsContact CG1-OE1 3.29Å; A208-Q212 WeakPolarHBondContact O-CB 3.39Å; A208-Q212 PolarHBondContact O-N 3.12Å; Q209-Q212 WeakPolarHBondContact O-CB 3.36Å; Q209-Q212 PolarHBondContact O-N 2.96Å; L210-Q212 VanDerWaalsContact C-N 3.32Å; L210-Q212 PolarHBondContact O-N 3.22Å; Q212-T216 WeakPolarHBondContact O-CB 3.36Å; Q212-T216 PolarHBondContact O-N 2.89Å; Q212-T216 PolarHBondContact O-OG1 3.45Å
213	F	91.9	Very high	91.2	Very high	7 Å²	7	42.9 Å²	42.9	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-43.8	179.5	-58.8	-39.1	0	0	0	112.2	Q209 L210 V211 L215 T216 I217 M242 L245 V246 F249	Q209-F213 WeakPolarHBondContact O-CD2 3.33Å; Q209-F213 WeakPolarHBondContact O-CG 3.25Å; Q209-F213 PolarHBondContact O-N 2.83Å; L210-F213 PolarHBondContact O-N 2.94Å; V211-F213 VanDerWaalsContact C-N 3.31Å; V211-F213 PolarHBondContact O-N 2.94Å; F213-L215 PolarHBondContact O-N 3.4Å; F213-T216 PolarHBondContact O-N 3.42Å; F213-I217 WeakPolarHBondContact O-CG1 3.38Å; F213-I217 PolarHBondContact O-N 2.97Å; F213-M242 HydrophobicContact CB-CG 4.06Å; F213-M242 HydrophobicContact CB-SD 3.93Å; F213-M242 HydrophobicContact CD1-CG 4.48Å; F213-M242 HydrophobicContact CD1-SD 3.28Å; F213-M242 WeakPolarHBondContact CD1-SD 3.26Å; F213-M242 HydrophobicContact CE1-SD 4.05Å; F213-M242 HydrophobicContact CG-SD 3.9Å; F213-L245 HydrophobicContact CE1-CD1 4.07Å; F213-L245 HydrophobicContact CE2-CB 4.39Å; F213-L245 HydrophobicContact CZ-CB 4.35Å; F213-L245 HydrophobicContact CZ-CD1 4.34Å; F213-V246 HydrophobicContact CB-CG2 3.52Å; F213-V246 HydrophobicContact CD2-CG2 4.35Å; F213-V246 HydrophobicContact CG-CG2 4.3Å; F213-F249 HydrophobicContact CD2-CD2 4.49Å; F213-F249 HydrophobicContact CE2-CB 4.23Å; F213-F249 HydrophobicContact CE2-CD1 4.1Å; F213-F249 AromaticContact CE2-CD2 3.45Å; F213-F249 HydrophobicContact CE2-CD2 3.45Å; F213-F249 VanDerWaalsContact CE2-CD2 3.45Å; F213-F249 HydrophobicContact CE2-CE1 4.31Å; F213-F249 AromaticContact CE2-CE2 3.67Å; F213-F249 HydrophobicContact CE2-CE2 3.67Å; F213-F249 AromaticContact CE2-CG 3.67Å; F213-F249 HydrophobicContact CE2-CG 3.67Å; F213-F249 HydrophobicContact CE2-CZ 4.1Å; F213-F249 AromaticContact CZ-CD2 3.96Å; F213-F249 HydrophobicContact CZ-CD2 3.96Å; F213-F249 AromaticContact CZ-CE2 3.71Å; F213-F249 HydrophobicContact CZ-CE2 3.71Å; F213-F249 HydrophobicContact CZ-CZ 4.09Å
214	V	92.8	Very high	91.2	Very high	78 Å²	78	40.9 Å²	40.9	47%	0.473	22%	0.221	S	C	.	.	H	α-helix	trans	-63	-43.1	177.9	174	0	0	0	0	111.5	L210 V211 T216 I217 T218	L210-V214 WeakPolarHBondContact O-CG2 3.3Å; L210-V214 PolarHBondContact O-N 2.9Å; L210-V214 VanDerWaalsContact O-N 3.14Å; V211-V214 PolarHBondContact O-N 3Å; V214-T216 VanDerWaalsContact C-N 3.34Å; V214-T216 PolarHBondContact O-N 3.12Å; V214-I217 PolarHBondContact O-N 3.07Å; V214-T218 WeakPolarHBondContact O-CB 3.12Å; V214-T218 PolarHBondContact O-N 3.18Å; V214-T218 PolarHBondContact O-OG1 3.45Å
215	L	94.4	Very high	90.9	Very high	81 Å²	81	40.1 Å²	40.1	42%	0.424	23%	0.229	S	C	.	.	H	α-helix	trans	-62.5	-42.4	175.6	-70.3	175.8	0	0	0	111.3	F171 L175 V211 F213 T218 H219	F171-L215 HydrophobicContact CE1-CB 4.4Å; L175-L215 HydrophobicContact CD1-CB 3.71Å; L175-L215 HydrophobicContact CD1-CD1 4.19Å; V211-L215 HydrophobicContact CG1-CD1 3.77Å; V211-L215 HydrophobicContact CG1-CG 4.07Å; V211-L215 WeakPolarHBondContact O-CB 3.32Å; V211-L215 VanDerWaalsContact O-CG 3.32Å; V211-L215 WeakPolarHBondContact O-CG 3.46Å; V211-L215 PolarHBondContact O-N 3.33Å; F213-L215 PolarHBondContact O-N 3.4Å; L215-T218 PolarHBondContact O-N 3.15Å; L215-H219 WeakPolarHBondContact O-CB 3.5Å; L215-H219 PolarHBondContact O-N 2.95Å
216	T	92.8	Very high	90.7	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-40.7	178.7	-52	0	0	0	0	111.8	Q212 F213 V214 T220 M242	Q212-T216 WeakPolarHBondContact O-CB 3.36Å; Q212-T216 PolarHBondContact O-N 2.89Å; Q212-T216 PolarHBondContact O-OG1 3.45Å; F213-T216 PolarHBondContact O-N 3.42Å; V214-T216 VanDerWaalsContact C-N 3.34Å; V214-T216 PolarHBondContact O-N 3.12Å; T216-T220 WeakPolarHBondContact O-CB 3.43Å; T216-T220 PolarHBondContact O-N 3.45Å; T216-T220 PolarHBondContact O-OG1 3.37Å; T216-M242 HydrophobicContact CG2-CE 3.63Å
217	I	91.4	Very high	90.4	Very high	39 Å²	39	50 Å²	50	20%	0.2	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-48.2	173.4	-68.7	165.9	0	0	0	110	F213 V214 H219 T220 M221 M242 V246	F213-I217 WeakPolarHBondContact O-CG1 3.38Å; F213-I217 PolarHBondContact O-N 2.97Å; V214-I217 PolarHBondContact O-N 3.07Å; I217-H219 VanDerWaalsContact C-N 3.35Å; I217-H219 PolarHBondContact O-N 2.72Å; I217-T220 PolarHBondContact O-N 3.06Å; I217-T220 VanDerWaalsContact O-N 3.17Å; I217-M221 HydrophobicContact CG2-CG 4.08Å; I217-M221 WeakPolarHBondContact O-CB 3.43Å; I217-M221 VanDerWaalsContact O-CG 3.29Å; I217-M221 WeakPolarHBondContact O-CG 3.44Å; I217-M221 PolarHBondContact O-N 3.23Å; I217-M242 HydrophobicContact CD1-CB 4.03Å; I217-M242 HydrophobicContact CD1-CG 3.8Å; I217-M242 HydrophobicContact CG1-CB 3.67Å; I217-M242 HydrophobicContact CG1-CG 3.48Å; I217-M242 VanDerWaalsContact CG1-CG 3.48Å; I217-V246 HydrophobicContact CD1-CG2 3.95Å
218	T	92.1	Very high	90	Very high	86 Å²	86	48.8 Å²	48.8	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-45.6	-177.9	-55.2	0	0	0	0	111.5	V214 L215 M221 S222	V214-T218 WeakPolarHBondContact O-CB 3.12Å; V214-T218 PolarHBondContact O-N 3.18Å; V214-T218 PolarHBondContact O-OG1 3.45Å; L215-T218 PolarHBondContact O-N 3.15Å; T218-M221 PolarHBondContact O-N 3Å; T218-S222 PolarHBondContact O-N 3.39Å
219	H	92.5	Very high	89.4	Confident	15 Å²	15	50.6 Å²	50.6	7%	0.069	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-47.6	174.7	177.7	-89.4	0	0	0	111.4	L97 Q168 F171 L215 I217 M221 S222 A223	L97-H219 PolarHBondContact O-CD2 3.02Å; L97-H219 VanDerWaalsContact O-CD2 3.23Å; L97-H219 PolarHBondContact O-NE2 3.36Å; Q168-H219 VanDerWaalsContact CD-CE1 3.41Å; Q168-H219 PolarHBondContact NE2-CE1 2.91Å; Q168-H219 PolarHBondContact OE1-CE1 3.14Å; Q168-H219 PolarHBondContact OE1-ND1 3.5Å; F171-H219 WeakPolarHBondContact CB-CE1 3.44Å; F171-H219 HydrophobicContact CD1-CB 3.48Å; F171-H219 VanDerWaalsContact CD1-CB 3.48Å; F171-H219 AromaticContact CD1-CD2 3.86Å; F171-H219 AromaticContact CD1-CG 3.44Å; F171-H219 VanDerWaalsContact CD1-CG 3.44Å; F171-H219 AromaticContact CD1-ND1 3.78Å; F171-H219 AromaticContact CD2-CD2 3.63Å; F171-H219 AromaticContact CD2-NE2 3.79Å; F171-H219 HydrophobicContact CE1-CB 3.52Å; F171-H219 AromaticContact CE1-CG 3.89Å; F171-H219 HydrophobicContact CG-CB 4.12Å; F171-H219 AromaticContact CG-CD2 3.55Å; F171-H219 AromaticContact CG-CE1 3.76Å; F171-H219 AromaticContact CG-CG 3.55Å; F171-H219 AromaticContact CG-ND1 3.69Å; F171-H219 AromaticContact CG-NE2 3.68Å; F171-H219 HydrophobicContact CZ-CB 4.2Å; L215-H219 WeakPolarHBondContact O-CB 3.5Å; L215-H219 PolarHBondContact O-N 2.95Å; I217-H219 VanDerWaalsContact C-N 3.35Å; I217-H219 PolarHBondContact O-N 2.72Å; H219-M221 VanDerWaalsContact C-N 3.34Å; H219-M221 PolarHBondContact O-N 3.34Å; H219-S222 WeakPolarHBondContact O-CB 3.25Å; H219-S222 PolarHBondContact O-N 3.4Å; H219-S222 VanDerWaalsContact O-N 3.1Å; H219-S222 PolarHBondContact O-OG 3.4Å; H219-A223 PolarHBondContact O-N 3.48Å
220	T	89.4	Confident	89	Confident	9 Å²	9	50.1 Å²	50.1	6%	0.055	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-40.1	178.5	-50.8	0	0	0	0	112.2	T216 I217 S222 A223 V224 L235 Q238 S239	T216-T220 WeakPolarHBondContact O-CB 3.43Å; T216-T220 PolarHBondContact O-N 3.45Å; T216-T220 PolarHBondContact O-OG1 3.37Å; I217-T220 PolarHBondContact O-N 3.06Å; I217-T220 VanDerWaalsContact O-N 3.17Å; T220-S222 VanDerWaalsContact C-N 3.32Å; T220-S222 PolarHBondContact O-N 3.11Å; T220-A223 PolarHBondContact O-N 3.36Å; T220-V224 PolarHBondContact O-N 3.48Å; T220-L235 HydrophobicContact CG2-CB 4.02Å; T220-L235 HydrophobicContact CG2-CD2 3.79Å; T220-L235 WeakPolarHBondContact CG2-O 3.08Å; T220-Q238 HydrophobicContact CG2-CB 4.28Å; T220-Q238 HydrophobicContact CG2-CG 4.09Å; T220-S239 VanDerWaalsContact CG2-OG 3.27Å; T220-S239 WeakPolarHBondContact CG2-OG 3.48Å
221	M	87.6	Confident	88.7	Confident	69 Å²	69	51.5 Å²	51.5	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-68.1	-30.7	175.8	-67.3	-64	83.7	0	0	112.6	I217 T218 H219 A223 V224 V225 S239	I217-M221 HydrophobicContact CG2-CG 4.08Å; I217-M221 WeakPolarHBondContact O-CB 3.43Å; I217-M221 VanDerWaalsContact O-CG 3.29Å; I217-M221 WeakPolarHBondContact O-CG 3.44Å; I217-M221 PolarHBondContact O-N 3.23Å; T218-M221 PolarHBondContact O-N 3Å; H219-M221 VanDerWaalsContact C-N 3.34Å; H219-M221 PolarHBondContact O-N 3.34Å; M221-A223 VanDerWaalsContact C-N 3.27Å; M221-A223 PolarHBondContact O-N 3.17Å; M221-V224 HydrophobicContact CE-CB 4.43Å; M221-V224 HydrophobicContact CE-CG2 3.84Å; M221-V224 WeakPolarHBondContact O-CB 3.43Å; M221-V224 PolarHBondContact O-N 2.65Å; M221-V224 VanDerWaalsContact O-N 3.1Å; M221-V225 WeakPolarHBondContact O-CG2 3.31Å; M221-V225 PolarHBondContact O-N 3.1Å; M221-V225 VanDerWaalsContact O-N 3.1Å; M221-S239 WeakPolarHBondContact CE-OG 3.45Å
222	S	88.5	Confident	88.2	Confident	32 Å²	32	53.7 Å²	53.7	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-35.4	176.2	79.6	0	0	0	0	112.3	Q98 T218 H219 T220 V224 V225 K226	Q98-S222 PolarHBondContact O-OG 3.02Å; Q98-S222 VanDerWaalsContact O-OG 3.06Å; T218-S222 PolarHBondContact O-N 3.39Å; H219-S222 WeakPolarHBondContact O-CB 3.25Å; H219-S222 PolarHBondContact O-N 3.4Å; H219-S222 VanDerWaalsContact O-N 3.1Å; H219-S222 PolarHBondContact O-OG 3.4Å; T220-S222 VanDerWaalsContact C-N 3.32Å; T220-S222 PolarHBondContact O-N 3.11Å; S222-V224 VanDerWaalsContact C-N 3.34Å; S222-V225 PolarHBondContact O-N 3.38Å; S222-K226 PolarHBondContact O-N 3.49Å
223	A	87.1	Confident	87.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	34%	0.336	C	S	.	.	H	α-helix	trans	-71.9	-25	173.3	0	0	0	0	0	113.5	C99 Q168 H219 T220 M221 K226 P227 L235	C99-A223 HydrophobicContact CB-CB 4.32Å; Q168-A223 HydrophobicContact CG-CB 3.99Å; H219-A223 PolarHBondContact O-N 3.48Å; T220-A223 PolarHBondContact O-N 3.36Å; M221-A223 VanDerWaalsContact C-N 3.27Å; M221-A223 PolarHBondContact O-N 3.17Å; A223-K226 CarbonylContact O-C 3.38Å; A223-P227 WeakPolarHBondContact O-CA 3.47Å; A223-L235 HydrophobicContact CB-CD1 4.01Å; A223-L235 HydrophobicContact CB-CD2 4.17Å
224	V	86.2	Confident	87.4	Confident	46 Å²	46	57 Å²	57	28%	0.279	35%	0.347	S	S	.	.	H	α-helix	trans	-71.1	-39.4	171.2	164	0	0	0	0	111.3	T220 M221 S222 F232 L235	T220-V224 PolarHBondContact O-N 3.48Å; M221-V224 HydrophobicContact CE-CB 4.43Å; M221-V224 HydrophobicContact CE-CG2 3.84Å; M221-V224 WeakPolarHBondContact O-CB 3.43Å; M221-V224 PolarHBondContact O-N 2.65Å; M221-V224 VanDerWaalsContact O-N 3.1Å; S222-V224 VanDerWaalsContact C-N 3.34Å; V224-F232 HydrophobicContact CB-CE2 4.44Å; V224-F232 HydrophobicContact CG1-CE2 3.87Å; V224-F232 HydrophobicContact CG2-CD2 4.35Å; V224-F232 HydrophobicContact CG2-CE2 4Å; V224-L235 HydrophobicContact CG2-CB 3.95Å; V224-L235 HydrophobicContact CG2-CD1 3.92Å
225	V	86.6	Confident	87.1	Confident	115 Å²	115	53.7 Å²	53.7	70%	0.697	33%	0.326	S	S	*	.	H	α-helix	trans	-74	-40.4	-179.1	175.6	0	0	0	0	112	M221 S222	M221-V225 WeakPolarHBondContact O-CG2 3.31Å; M221-V225 PolarHBondContact O-N 3.1Å; M221-V225 VanDerWaalsContact O-N 3.1Å; S222-V225 PolarHBondContact O-N 3.38Å
226	K	86.1	Confident	86.7	Confident	121 Å²	121	53.6 Å²	53.6	53%	0.526	33%	0.325	S	S	.	.	S	Bend	trans	-119.5	88.6	174.8	-68	-156.6	-161.8	162.6	0	110.1	C99 S222 A223 C228	C99-K226 WeakPolarHBondContact CB-O 3.46Å; C99-K226 PolarHBondContact SG-O 2.93Å; C99-K226 VanDerWaalsContact SG-O 3.42Å; S222-K226 PolarHBondContact O-N 3.49Å; A223-K226 CarbonylContact O-C 3.38Å; K226-C228 PolarHBondContact O-N 2.88Å
227	P	82.9	Confident	86.5	Confident	109 Å²	109	58.5 Å²	58.5	71%	0.708	35%	0.347	S	S	*	.			trans	-67.6	131.3	-177	26.9	-33.4	0	0	0	111	A223	A223-P227 WeakPolarHBondContact O-CA 3.47Å
228	C	81.6	Confident	86.3	Confident	39 Å²	39	58.7 Å²	58.7	26%	0.264	35%	0.347	S	S	.	.			trans	-112.1	13.4	175.4	59.4	0	0	0	0	113	C99 Q100 D101 K226	C99-C228 VanDerWaalsContact CA-SG 3.59Å; C99-C228 HydrophobicContact CB-CB 3.53Å; C99-C228 WeakPolarHBondContact CB-SG 3.5Å; C99-C228 WeakPolarHBondContact SG-CB 3.32Å; C99-C228 PolarHBondContact SG-N 3.27Å; C99-C228 CovalentContact SG-SG 2.02Å; C99-C228 PolarHBondContact SG-SG 3.21Å; Q100-C228 VanDerWaalsContact C-SG 3.54Å; Q100-C228 PolarHBondContact N-SG 3.23Å; D101-C228 WeakPolarHBondContact CB-O 3.42Å; K226-C228 PolarHBondContact O-N 2.88Å
229	G	80.5	Confident	86.1	Confident	68 Å²	68	55.3 Å²	55.3	70%	0.701	33%	0.327	S	S	*	.	S	Bend	trans	93.1	4.3	-176.6	0	0	0	0	0	114.8
230	F	84.6	Confident	86	Confident	19 Å²	19	57.5 Å²	57.5	8%	0.083	34%	0.344	C	S	.	.			trans	-69.9	139	168	-162.9	-87.2	0	0	0	110.9	L102 I164 Q168 S169 F232 C234 L235	L102-F230 HydrophobicContact CD2-CD2 3.95Å; L102-F230 HydrophobicContact CD2-CE2 3.63Å; L102-F230 HydrophobicContact CG-CD2 4.26Å; L102-F230 HydrophobicContact CG-CE2 4.39Å; I164-F230 HydrophobicContact CB-CE2 4.22Å; I164-F230 HydrophobicContact CB-CZ 3.88Å; I164-F230 HydrophobicContact CD1-CE1 4.13Å; I164-F230 HydrophobicContact CD1-CZ 3.7Å; I164-F230 HydrophobicContact CG1-CZ 4.36Å; I164-F230 HydrophobicContact CG2-CE1 4.45Å; I164-F230 HydrophobicContact CG2-CE2 4.27Å; I164-F230 HydrophobicContact CG2-CZ 3.94Å; Q168-F230 HydrophobicContact CB-CD1 4.26Å; Q168-F230 HydrophobicContact CB-CD2 3.72Å; Q168-F230 HydrophobicContact CB-CE1 4.3Å; Q168-F230 HydrophobicContact CB-CE2 3.77Å; Q168-F230 HydrophobicContact CB-CG 3.96Å; Q168-F230 HydrophobicContact CB-CZ 4.05Å; Q168-F230 HydrophobicContact CG-CB 4.39Å; Q168-F230 HydrophobicContact CG-CD2 4.18Å; Q168-F230 HydrophobicContact CG-CG 4.19Å; S169-F230 WeakPolarHBondContact OG-CZ 3.37Å; F230-F232 PolarHBondContact O-N 3.35Å; F230-C234 HydrophobicContact CE1-CB 4Å; F230-L235 HydrophobicContact CD1-CD1 4.3Å; F230-L235 HydrophobicContact CD1-CD2 3.51Å; F230-L235 HydrophobicContact CD1-CG 3.74Å; F230-L235 HydrophobicContact CE1-CD2 3.78Å; F230-L235 HydrophobicContact CE1-CG 4.22Å; F230-L235 HydrophobicContact CG-CD2 4.44Å
231	P	85.1	Confident	86.1	Confident	52 Å²	52	57.7 Å²	57.7	34%	0.338	34%	0.344	S	S	.	.			trans	-59.4	119.3	-175.3	-26.1	34.5	0	0	0	113.9	I164 G233 C234 L235	I164-P231 HydrophobicContact CG2-CG 3.97Å; P231-G233 VanDerWaalsContact C-N 3.34Å; P231-G233 PolarHBondContact O-N 3.1Å; P231-C234 HydrophobicContact CB-CB 4.33Å; P231-C234 WeakPolarHBondContact O-CB 3.29Å; P231-C234 PolarHBondContact O-N 3.4Å; P231-L235 PolarHBondContact O-N 2.83Å
232	F	84.2	Confident	86.2	Confident	127 Å²	127	55 Å²	55	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-59.7	-40.6	-176.7	-176.2	-101	0	0	0	113.2	V224 F230 C234 L235 I236	V224-F232 HydrophobicContact CB-CE2 4.44Å; V224-F232 HydrophobicContact CG1-CE2 3.87Å; V224-F232 HydrophobicContact CG2-CD2 4.35Å; V224-F232 HydrophobicContact CG2-CE2 4Å; F230-F232 PolarHBondContact O-N 3.35Å; F232-C234 VanDerWaalsContact C-N 3.28Å; F232-C234 PolarHBondContact O-N 3.35Å; F232-L235 WeakPolarHBondContact O-CB 3.45Å; F232-L235 PolarHBondContact O-N 3.41Å; F232-L235 VanDerWaalsContact O-N 3.1Å; F232-I236 HydrophobicContact CD1-CG1 3.97Å; F232-I236 HydrophobicContact CE1-CD1 4Å; F232-I236 HydrophobicContact CE1-CG1 3.52Å; F232-I236 HydrophobicContact CE2-CD1 4.19Å; F232-I236 HydrophobicContact CE2-CG1 4.32Å; F232-I236 HydrophobicContact CZ-CD1 3.66Å; F232-I236 HydrophobicContact CZ-CG1 3.72Å; F232-I236 PolarHBondContact O-N 2.78Å
233	G	83.8	Confident	86.3	Confident	53 Å²	53	58.1 Å²	58.1	55%	0.546	34%	0.344	S	S	.	.	H	α-helix	trans	-57.5	-40.2	177.8	0	0	0	0	0	112.8	P231 I236 F237	P231-G233 VanDerWaalsContact C-N 3.34Å; P231-G233 PolarHBondContact O-N 3.1Å; G233-I236 PolarHBondContact O-N 3.1Å; G233-F237 WeakPolarHBondContact O-CB 3.5Å; G233-F237 PolarHBondContact O-N 2.96Å
234	C	85.8	Confident	86.5	Confident	37 Å²	37	60.4 Å²	60.4	25%	0.25	36%	0.358	C	S	.	.	H	α-helix	trans	-66.8	-37.6	176.7	-62.5	0	0	0	0	112.2	I164 F230 P231 F232 F237 Q238	I164-C234 HydrophobicContact CD1-CB 3.71Å; F230-C234 HydrophobicContact CE1-CB 4Å; P231-C234 HydrophobicContact CB-CB 4.33Å; P231-C234 WeakPolarHBondContact O-CB 3.29Å; P231-C234 PolarHBondContact O-N 3.4Å; F232-C234 VanDerWaalsContact C-N 3.28Å; F232-C234 PolarHBondContact O-N 3.35Å; C234-F237 PolarHBondContact O-N 3.21Å; C234-Q238 VanDerWaalsContact O-CB 3.24Å; C234-Q238 WeakPolarHBondContact O-CB 3.47Å; C234-Q238 PolarHBondContact O-N 3.27Å
235	L	86.1	Confident	86.7	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-43.2	176.7	-61.6	174.8	0	0	0	111.8	T220 A223 V224 F230 P231 F232 S239	T220-L235 HydrophobicContact CG2-CB 4.02Å; T220-L235 HydrophobicContact CG2-CD2 3.79Å; T220-L235 WeakPolarHBondContact CG2-O 3.08Å; A223-L235 HydrophobicContact CB-CD1 4.01Å; A223-L235 HydrophobicContact CB-CD2 4.17Å; V224-L235 HydrophobicContact CG2-CB 3.95Å; V224-L235 HydrophobicContact CG2-CD1 3.92Å; F230-L235 HydrophobicContact CD1-CD1 4.3Å; F230-L235 HydrophobicContact CD1-CD2 3.51Å; F230-L235 HydrophobicContact CD1-CG 3.74Å; F230-L235 HydrophobicContact CE1-CD2 3.78Å; F230-L235 HydrophobicContact CE1-CG 4.22Å; F230-L235 HydrophobicContact CG-CD2 4.44Å; P231-L235 PolarHBondContact O-N 2.83Å; F232-L235 WeakPolarHBondContact O-CB 3.45Å; F232-L235 PolarHBondContact O-N 3.41Å; F232-L235 VanDerWaalsContact O-N 3.1Å; L235-S239 WeakPolarHBondContact O-CB 3.16Å; L235-S239 PolarHBondContact O-N 3.46Å; L235-S239 PolarHBondContact O-OG 2.93Å
236	I	86.4	Confident	86.9	Confident	79 Å²	79	53.7 Å²	53.7	41%	0.405	32%	0.317	S	S	.	.	H	α-helix	trans	-65.9	-46	176.5	-62.9	-57.5	0	0	0	110.7	F232 G233 Q238 S239 S240	F232-I236 HydrophobicContact CD1-CG1 3.97Å; F232-I236 HydrophobicContact CE1-CD1 4Å; F232-I236 HydrophobicContact CE1-CG1 3.52Å; F232-I236 HydrophobicContact CE2-CD1 4.19Å; F232-I236 HydrophobicContact CE2-CG1 4.32Å; F232-I236 HydrophobicContact CZ-CD1 3.66Å; F232-I236 HydrophobicContact CZ-CG1 3.72Å; F232-I236 PolarHBondContact O-N 2.78Å; G233-I236 PolarHBondContact O-N 3.1Å; I236-Q238 PolarHBondContact O-N 2.77Å; I236-S239 PolarHBondContact O-N 2.89Å; I236-S240 WeakPolarHBondContact O-CB 3.4Å; I236-S240 PolarHBondContact O-N 3Å; I236-S240 PolarHBondContact O-OG 3.3Å
237	F	87.9	Confident	87.2	Confident	105 Å²	105	52.7 Å²	52.7	46%	0.461	32%	0.316	S	S	.	.	H	α-helix	trans	-56.7	-52	176	177.2	-98.3	0	0	0	111.4	I156 G233 C234 S239 S240 Y241	I156-F237 HydrophobicContact CD1-CE1 4.28Å; I156-F237 HydrophobicContact CD1-CZ 4.06Å; I156-F237 HydrophobicContact CG1-CE1 4.13Å; I156-F237 HydrophobicContact CG1-CZ 3.96Å; I156-F237 HydrophobicContact CG2-CE1 3.89Å; G233-F237 WeakPolarHBondContact O-CB 3.5Å; G233-F237 PolarHBondContact O-N 2.96Å; C234-F237 PolarHBondContact O-N 3.21Å; F237-S239 VanDerWaalsContact C-N 3.31Å; F237-S239 PolarHBondContact O-N 2.9Å; F237-S240 PolarHBondContact O-N 3.25Å; F237-S240 PolarHBondContact O-OG 2.95Å; F237-Y241 PolarHBondContact O-N 3.46Å
238	Q	88.3	Confident	87.5	Confident	42 Å²	42	49.2 Å²	49.2	20%	0.196	29%	0.292	C	S	.	.	H	α-helix	trans	-55.2	-45.8	177.4	175.1	65.7	2.9	0	0	111.9	T220 C234 I236 Y241 M242	T220-Q238 HydrophobicContact CG2-CB 4.28Å; T220-Q238 HydrophobicContact CG2-CG 4.09Å; C234-Q238 VanDerWaalsContact O-CB 3.24Å; C234-Q238 WeakPolarHBondContact O-CB 3.47Å; C234-Q238 PolarHBondContact O-N 3.27Å; I236-Q238 PolarHBondContact O-N 2.77Å; Q238-Y241 PolarHBondContact O-N 3.37Å; Q238-M242 WeakPolarHBondContact O-CB 3.35Å; Q238-M242 PolarHBondContact O-N 3.47Å
239	S	88.1	Confident	87.8	Confident	16 Å²	16	48.4 Å²	48.4	11%	0.112	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-41.8	-178.9	-56.9	0	0	0	0	112	T220 M221 L235 I236 F237 M242 L243	T220-S239 VanDerWaalsContact CG2-OG 3.27Å; T220-S239 WeakPolarHBondContact CG2-OG 3.48Å; M221-S239 WeakPolarHBondContact CE-OG 3.45Å; L235-S239 WeakPolarHBondContact O-CB 3.16Å; L235-S239 PolarHBondContact O-N 3.46Å; L235-S239 PolarHBondContact O-OG 2.93Å; I236-S239 PolarHBondContact O-N 2.89Å; F237-S239 VanDerWaalsContact C-N 3.31Å; F237-S239 PolarHBondContact O-N 2.9Å; S239-M242 PolarHBondContact O-N 2.85Å; S239-L243 WeakPolarHBondContact O-CB 3.42Å; S239-L243 PolarHBondContact O-N 3.07Å
240	S	89.8	Confident	88.2	Confident	61 Å²	61	49 Å²	49	43%	0.427	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-45.6	176.6	74.2	0	0	0	0	111.6	I236 F237 L243 T244	I236-S240 WeakPolarHBondContact O-CB 3.4Å; I236-S240 PolarHBondContact O-N 3Å; I236-S240 PolarHBondContact O-OG 3.3Å; F237-S240 PolarHBondContact O-N 3.25Å; F237-S240 PolarHBondContact O-OG 2.95Å; S240-L243 WeakPolarHBondContact O-CB 3.33Å; S240-L243 PolarHBondContact O-N 3.49Å; S240-T244 WeakPolarHBondContact O-CG2 3.04Å; S240-T244 PolarHBondContact O-N 3.47Å
241	Y	90.8	Very high	88.5	Confident	13 Å²	13	52.1 Å²	52.1	5%	0.051	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-46.2	177.2	173.9	-108.3	0	0	0	111.3	Y148 S152 M153 I156 F237 Q238 L243 T244 L245	Y148-Y241 HydrophobicContact CE1-CE2 4.15Å; S152-Y241 PolarHBondContact OG-OH 2.94Å; M153-Y241 VanDerWaalsContact CG-OH 3.25Å; M153-Y241 WeakPolarHBondContact CG-OH 3.4Å; M153-Y241 HydrophobicContact SD-CE1 3.57Å; M153-Y241 VanDerWaalsContact SD-CE1 3.57Å; M153-Y241 PolarHBondContact SD-OH 3.44Å; I156-Y241 HydrophobicContact CD1-CD1 4.19Å; I156-Y241 HydrophobicContact CD1-CD2 3.66Å; I156-Y241 HydrophobicContact CD1-CE1 4.15Å; I156-Y241 HydrophobicContact CD1-CE2 3.62Å; I156-Y241 HydrophobicContact CD1-CG 3.96Å; F237-Y241 PolarHBondContact O-N 3.46Å; Q238-Y241 PolarHBondContact O-N 3.37Å; Y241-L243 VanDerWaalsContact C-N 3.28Å; Y241-L243 PolarHBondContact O-N 3.22Å; Y241-T244 WeakPolarHBondContact O-CB 3.16Å; Y241-T244 PolarHBondContact O-N 2.81Å; Y241-T244 PolarHBondContact O-OG1 2.9Å; Y241-L245 HydrophobicContact CD1-CD1 4.34Å; Y241-L245 HydrophobicContact CE1-CD1 3.58Å; Y241-L245 HydrophobicContact CE1-CG 4.22Å; Y241-L245 HydrophobicContact CE2-CG 4.43Å; Y241-L245 PolarHBondContact O-N 2.91Å
242	M	89.9	Confident	88.6	Confident	13 Å²	13	52.9 Å²	52.9	6%	0.064	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-36.7	179.1	-159.3	63.5	68.3	0	0	112.2	F213 T216 I217 Q238 S239 T244 L245 V246	F213-M242 HydrophobicContact CB-CG 4.06Å; F213-M242 HydrophobicContact CB-SD 3.93Å; F213-M242 HydrophobicContact CD1-CG 4.48Å; F213-M242 HydrophobicContact CD1-SD 3.28Å; F213-M242 WeakPolarHBondContact CD1-SD 3.26Å; F213-M242 HydrophobicContact CE1-SD 4.05Å; F213-M242 HydrophobicContact CG-SD 3.9Å; T216-M242 HydrophobicContact CG2-CE 3.63Å; I217-M242 HydrophobicContact CD1-CB 4.03Å; I217-M242 HydrophobicContact CD1-CG 3.8Å; I217-M242 HydrophobicContact CG1-CB 3.67Å; I217-M242 HydrophobicContact CG1-CG 3.48Å; I217-M242 VanDerWaalsContact CG1-CG 3.48Å; Q238-M242 WeakPolarHBondContact O-CB 3.35Å; Q238-M242 PolarHBondContact O-N 3.47Å; S239-M242 PolarHBondContact O-N 2.85Å; M242-T244 VanDerWaalsContact C-N 3.33Å; M242-T244 PolarHBondContact O-N 2.61Å; M242-L245 PolarHBondContact O-N 3.3Å; M242-L245 HydrophobicContact SD-CD1 4.25Å; M242-V246 WeakPolarHBondContact O-CG2 3.2Å; M242-V246 PolarHBondContact O-N 3.33Å
243	L	90.8	Very high	88.6	Confident	96 Å²	96	48.5 Å²	48.5	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-60.6	-41.1	173.2	-178.6	63	0	0	0	111.9	S239 S240 Y241 L245 V246 I247	S239-L243 WeakPolarHBondContact O-CB 3.42Å; S239-L243 PolarHBondContact O-N 3.07Å; S240-L243 WeakPolarHBondContact O-CB 3.33Å; S240-L243 PolarHBondContact O-N 3.49Å; Y241-L243 VanDerWaalsContact C-N 3.28Å; Y241-L243 PolarHBondContact O-N 3.22Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.96Å; L243-V246 PolarHBondContact O-N 2.76Å; L243-I247 HydrophobicContact CD1-CD1 4.39Å; L243-I247 HydrophobicContact CG-CD1 4.11Å; L243-I247 WeakPolarHBondContact O-CG1 3.38Å; L243-I247 PolarHBondContact O-N 2.53Å
244	T	91.9	Very high	88.9	Confident	49 Å²	49	48.4 Å²	48.4	30%	0.301	26%	0.255	S	S	.	.	H	α-helix	trans	-59.9	-42.6	175.1	71.5	0	0	0	0	111.8	Y148 S240 Y241 M242 I247 L248	Y148-T244 PolarHBondContact OH-OG1 2.84Å; S240-T244 WeakPolarHBondContact O-CG2 3.04Å; S240-T244 PolarHBondContact O-N 3.47Å; Y241-T244 WeakPolarHBondContact O-CB 3.16Å; Y241-T244 PolarHBondContact O-N 2.81Å; Y241-T244 PolarHBondContact O-OG1 2.9Å; M242-T244 VanDerWaalsContact C-N 3.33Å; M242-T244 PolarHBondContact O-N 2.61Å; T244-I247 PolarHBondContact O-N 2.69Å; T244-L248 WeakPolarHBondContact O-CG 3.47Å; T244-L248 PolarHBondContact O-N 3.48Å
245	L	90	Very high	88.8	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-42.3	177.1	-69.2	-179.1	0	0	0	111.9	L145 Y148 H149 F213 Y241 M242 L243 I247 L248 F249	L145-L245 HydrophobicContact CD1-CD2 4.36Å; Y148-L245 HydrophobicContact CD1-CD2 4.23Å; Y148-L245 HydrophobicContact CE1-CD2 4.03Å; H149-L245 HydrophobicContact CB-CD2 4.31Å; F213-L245 HydrophobicContact CE1-CD1 4.07Å; F213-L245 HydrophobicContact CE2-CB 4.39Å; F213-L245 HydrophobicContact CZ-CB 4.35Å; F213-L245 HydrophobicContact CZ-CD1 4.34Å; Y241-L245 HydrophobicContact CD1-CD1 4.34Å; Y241-L245 HydrophobicContact CE1-CD1 3.58Å; Y241-L245 HydrophobicContact CE1-CG 4.22Å; Y241-L245 HydrophobicContact CE2-CG 4.43Å; Y241-L245 PolarHBondContact O-N 2.91Å; M242-L245 PolarHBondContact O-N 3.3Å; M242-L245 HydrophobicContact SD-CD1 4.25Å; L243-L245 VanDerWaalsContact C-N 3.32Å; L243-L245 PolarHBondContact O-N 2.96Å; L245-I247 VanDerWaalsContact C-N 3.33Å; L245-I247 PolarHBondContact O-N 3.5Å; L245-L248 PolarHBondContact O-N 2.85Å; L245-F249 WeakPolarHBondContact O-CB 3.47Å; L245-F249 WeakPolarHBondContact O-CD2 3.37Å; L245-F249 PolarHBondContact O-N 2.99Å
246	V	90.9	Very high	88.7	Confident	18 Å²	18	53.9 Å²	53.9	11%	0.109	28%	0.281	C	S	.	.	H	α-helix	trans	-56.9	-48	174.9	169.7	0	0	0	0	110.7	F213 I217 M242 L243 L248 F249 L250	F213-V246 HydrophobicContact CB-CG2 3.52Å; F213-V246 HydrophobicContact CD2-CG2 4.35Å; F213-V246 HydrophobicContact CG-CG2 4.3Å; I217-V246 HydrophobicContact CD1-CG2 3.95Å; M242-V246 WeakPolarHBondContact O-CG2 3.2Å; M242-V246 PolarHBondContact O-N 3.33Å; L243-V246 PolarHBondContact O-N 2.76Å; V246-L248 PolarHBondContact O-N 3.38Å; V246-F249 PolarHBondContact O-N 2.87Å; V246-L250 HydrophobicContact CG1-CD1 3.66Å; V246-L250 HydrophobicContact CG1-CG 4.2Å; V246-L250 VanDerWaalsContact O-CB 3.27Å; V246-L250 WeakPolarHBondContact O-CB 3.4Å; V246-L250 VanDerWaalsContact O-CG 3.23Å; V246-L250 WeakPolarHBondContact O-CG 3.44Å; V246-L250 PolarHBondContact O-N 2.02Å
247	I	92.3	Very high	88.5	Confident	101 Å²	101	53.2 Å²	53.2	52%	0.518	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-47.2	179.1	-67.9	165	0	0	0	110.8	L243 T244 L245 L250 N251	L243-I247 HydrophobicContact CD1-CD1 4.39Å; L243-I247 HydrophobicContact CG-CD1 4.11Å; L243-I247 WeakPolarHBondContact O-CG1 3.38Å; L243-I247 PolarHBondContact O-N 2.53Å; T244-I247 PolarHBondContact O-N 2.69Å; L245-I247 VanDerWaalsContact C-N 3.33Å; L245-I247 PolarHBondContact O-N 3.5Å; I247-L250 PolarHBondContact O-N 3.45Å; I247-N251 WeakPolarHBondContact O-CB 3.49Å; I247-N251 PolarHBondContact O-N 3.25Å
248	L	89.8	Confident	88.1	Confident	36 Å²	36	57 Å²	57	19%	0.188	29%	0.285	C	S	.	.	H	α-helix	trans	-66.7	-40.9	-179	-68.8	171.9	0	0	0	112.4	F144 L145 Y148 T244 L245 V246 N251 F252	F144-L248 HydrophobicContact CD1-CD2 4.1Å; F144-L248 HydrophobicContact CE1-CD1 4.23Å; F144-L248 HydrophobicContact CE1-CD2 4.06Å; L145-L248 HydrophobicContact CB-CB 4.45Å; L145-L248 HydrophobicContact CD1-CB 3.51Å; L145-L248 HydrophobicContact CD1-CD1 4.01Å; L145-L248 HydrophobicContact CD1-CG 4.4Å; L145-L248 HydrophobicContact CG-CB 4.37Å; Y148-L248 HydrophobicContact CD1-CD1 3.56Å; Y148-L248 HydrophobicContact CE1-CD1 3.8Å; Y148-L248 HydrophobicContact CG-CD1 4.35Å; T244-L248 WeakPolarHBondContact O-CG 3.47Å; T244-L248 PolarHBondContact O-N 3.48Å; L245-L248 PolarHBondContact O-N 2.85Å; V246-L248 PolarHBondContact O-N 3.38Å; L248-N251 PolarHBondContact O-N 3.42Å; L248-F252 PolarHBondContact O-N 3.3Å
249	F	86.9	Confident	87.2	Confident	22 Å²	22	62 Å²	62	10%	0.096	31%	0.306	C	S	.	.	H	α-helix	trans	-70.7	-37.5	176.9	-93.6	-99.1	0	0	0	112.7	L145 Q209 L210 F213 L245 V246 N251 F252 Y253	L145-F249 HydrophobicContact CD1-CD2 3.62Å; L145-F249 HydrophobicContact CD1-CE2 3.62Å; L145-F249 HydrophobicContact CD2-CD1 4.47Å; L145-F249 HydrophobicContact CD2-CD2 3.75Å; L145-F249 HydrophobicContact CD2-CE2 3.84Å; L145-F249 HydrophobicContact CD2-CG 4.1Å; L145-F249 HydrophobicContact CD2-CZ 4.24Å; L145-F249 HydrophobicContact CG-CD2 4.26Å; L145-F249 HydrophobicContact CG-CE2 4.12Å; Q209-F249 HydrophobicContact CB-CD1 4.43Å; Q209-F249 HydrophobicContact CB-CE1 4.12Å; Q209-F249 HydrophobicContact CG-CE1 4.48Å; L210-F249 HydrophobicContact CD2-CB 3.65Å; L210-F249 HydrophobicContact CG-CB 4.38Å; F213-F249 HydrophobicContact CD2-CD2 4.49Å; F213-F249 HydrophobicContact CE2-CB 4.23Å; F213-F249 HydrophobicContact CE2-CD1 4.1Å; F213-F249 AromaticContact CE2-CD2 3.45Å; F213-F249 HydrophobicContact CE2-CD2 3.45Å; F213-F249 VanDerWaalsContact CE2-CD2 3.45Å; F213-F249 HydrophobicContact CE2-CE1 4.31Å; F213-F249 AromaticContact CE2-CE2 3.67Å; F213-F249 HydrophobicContact CE2-CE2 3.67Å; F213-F249 AromaticContact CE2-CG 3.67Å; F213-F249 HydrophobicContact CE2-CG 3.67Å; F213-F249 HydrophobicContact CE2-CZ 4.1Å; F213-F249 AromaticContact CZ-CD2 3.96Å; F213-F249 HydrophobicContact CZ-CD2 3.96Å; F213-F249 AromaticContact CZ-CE2 3.71Å; F213-F249 HydrophobicContact CZ-CE2 3.71Å; F213-F249 HydrophobicContact CZ-CZ 4.09Å; L245-F249 WeakPolarHBondContact O-CB 3.47Å; L245-F249 WeakPolarHBondContact O-CD2 3.37Å; L245-F249 PolarHBondContact O-N 2.99Å; V246-F249 PolarHBondContact O-N 2.87Å; F249-N251 VanDerWaalsContact C-N 3.33Å; F249-F252 PolarHBondContact O-N 3.23Å; F249-Y253 VanDerWaalsContact O-CB 3.3Å; F249-Y253 WeakPolarHBondContact O-CB 3.3Å; F249-Y253 PolarHBondContact O-N 2.76Å
250	L	89.2	Confident	85.3	Confident	81 Å²	81	70.2 Å²	70.2	42%	0.424	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-43.7	172.7	-77.1	173.4	0	0	0	110.7	L210 V246 I247 Y253 V254	L210-L250 HydrophobicContact CD1-CD2 4.05Å; L210-L250 HydrophobicContact CD2-CD2 3.98Å; L210-L250 HydrophobicContact CD2-CG 3.94Å; V246-L250 HydrophobicContact CG1-CD1 3.66Å; V246-L250 HydrophobicContact CG1-CG 4.2Å; V246-L250 VanDerWaalsContact O-CB 3.27Å; V246-L250 WeakPolarHBondContact O-CB 3.4Å; V246-L250 VanDerWaalsContact O-CG 3.23Å; V246-L250 WeakPolarHBondContact O-CG 3.44Å; V246-L250 PolarHBondContact O-N 2.02Å; I247-L250 PolarHBondContact O-N 3.45Å; L250-Y253 PolarHBondContact O-N 3.39Å; L250-V254 WeakPolarHBondContact O-CB 3.04Å; L250-V254 VanDerWaalsContact O-CG2 3.29Å; L250-V254 WeakPolarHBondContact O-CG2 2.99Å; L250-V254 PolarHBondContact O-N 3.45Å
251	N	90.4	Very high	83.3	Confident	83 Å²	83	72.6 Å²	72.6	44%	0.444	35%	0.354	S	S	.	.	H	α-helix	trans	-59	-48.4	174.7	-173.7	28.2	0	0	0	111.2	I247 L248 F249 Y253 V254 Q255	I247-N251 WeakPolarHBondContact O-CB 3.49Å; I247-N251 PolarHBondContact O-N 3.25Å; L248-N251 PolarHBondContact O-N 3.42Å; F249-N251 VanDerWaalsContact C-N 3.33Å; N251-Y253 PolarHBondContact O-N 3.03Å; N251-V254 PolarHBondContact O-N 3.39Å; N251-Q255 VanDerWaalsContact CG-NE2 3.3Å; N251-Q255 PolarHBondContact ND2-NE2 3.06Å; N251-Q255 WeakPolarHBondContact O-CB 3.46Å; N251-Q255 VanDerWaalsContact O-CG 3.27Å; N251-Q255 WeakPolarHBondContact O-CG 3.22Å; N251-Q255 PolarHBondContact O-N 3.49Å; N251-Q255 PolarHBondContact OD1-NE2 3.48Å
252	F	86.8	Confident	80.7	Confident	68 Å²	68	80.4 Å²	80.4	30%	0.298	39%	0.393	S	S	.	.	H	α-helix	trans	-57.7	-45.4	174.4	171.1	-99.1	0	0	0	112.4	L145 T206 L248 F249 Q255 T256 Y257	L145-F252 HydrophobicContact CD2-CB 4.13Å; T206-F252 HydrophobicContact CG2-CD1 4.18Å; T206-F252 HydrophobicContact CG2-CE1 4.14Å; L248-F252 PolarHBondContact O-N 3.3Å; F249-F252 PolarHBondContact O-N 3.23Å; F252-Q255 PolarHBondContact O-N 3.23Å; F252-T256 WeakPolarHBondContact CE2-OG1 3.33Å; F252-T256 HydrophobicContact CZ-CG2 4.39Å; F252-T256 VanDerWaalsContact O-CB 3.25Å; F252-T256 WeakPolarHBondContact O-CB 3.38Å; F252-T256 PolarHBondContact O-N 3.05Å; F252-T256 PolarHBondContact O-OG1 3.16Å; F252-Y257 HydrophobicContact CE1-CE2 4.45Å
253	Y	85.8	Confident	78.2	Confident	36 Å²	36	89.3 Å²	89.3	14%	0.141	43%	0.431	C	S	.	.	H	α-helix	trans	-64.1	-45.4	-179	-179.5	-91.4	0	0	0	111.8	K203 T206 Q207 L210 F249 L250 N251 T256 Y257	K203-Y253 WeakPolarHBondContact CE-OH 3.3Å; K203-Y253 HydrophobicContact CG-CE2 4.29Å; T206-Y253 HydrophobicContact CG2-CD2 3.91Å; Q207-Y253 HydrophobicContact CG-CE2 3.91Å; Q207-Y253 PolarHBondContact NE2-OH 2.94Å; Q207-Y253 VanDerWaalsContact NE2-OH 3.13Å; L210-Y253 HydrophobicContact CD1-CD2 4.41Å; L210-Y253 HydrophobicContact CD1-CG 4.32Å; F249-Y253 VanDerWaalsContact O-CB 3.3Å; F249-Y253 WeakPolarHBondContact O-CB 3.3Å; F249-Y253 PolarHBondContact O-N 2.76Å; L250-Y253 PolarHBondContact O-N 3.39Å; N251-Y253 PolarHBondContact O-N 3.03Å; Y253-T256 PolarHBondContact O-N 3.04Å; Y253-Y257 AromaticContact CD2-CD2 3.44Å; Y253-Y257 HydrophobicContact CD2-CD2 3.44Å; Y253-Y257 VanDerWaalsContact CD2-CD2 3.44Å; Y253-Y257 AromaticContact CD2-CE2 3.95Å; Y253-Y257 HydrophobicContact CD2-CE2 3.95Å; Y253-Y257 HydrophobicContact CD2-CG 4.38Å; Y253-Y257 AromaticContact CE2-CD2 3.74Å; Y253-Y257 HydrophobicContact CE2-CD2 3.74Å; Y253-Y257 HydrophobicContact CE2-CE2 4.35Å; Y253-Y257 HydrophobicContact CE2-CG 4.3Å; Y253-Y257 HydrophobicContact CG-CD2 4.03Å; Y253-Y257 WeakPolarHBondContact O-CB 3.35Å; Y253-Y257 PolarHBondContact O-N 2.89Å
254	V	88.1	Confident	75.6	Confident	51 Å²	51	93.4 Å²	93.4	31%	0.309	45%	0.445	S	S	.	.	I	π-helix	trans	-62.6	-45.9	177.8	170.8	0	0	0	0	110.7	L250 N251 R258 K259	L250-V254 WeakPolarHBondContact O-CB 3.04Å; L250-V254 VanDerWaalsContact O-CG2 3.29Å; L250-V254 WeakPolarHBondContact O-CG2 2.99Å; L250-V254 PolarHBondContact O-N 3.45Å; N251-V254 PolarHBondContact O-N 3.39Å; V254-R258 HydrophobicContact CG1-CB 4.43Å; V254-R258 WeakPolarHBondContact O-CB 3.34Å; V254-R258 PolarHBondContact O-N 3.33Å; V254-R258 VanDerWaalsContact O-N 3.09Å; V254-K259 PolarHBondContact O-N 2.55Å
255	Q	85.3	Confident	73.1	Confident	93 Å²	93	99 Å²	99	44%	0.435	47%	0.473	S	S	.	.	I	π-helix	trans	-65.4	-38	179.2	-70.7	-174.7	40.4	0	0	112.9	N251 F252	N251-Q255 VanDerWaalsContact CG-NE2 3.3Å; N251-Q255 PolarHBondContact ND2-NE2 3.06Å; N251-Q255 WeakPolarHBondContact O-CB 3.46Å; N251-Q255 VanDerWaalsContact O-CG 3.27Å; N251-Q255 WeakPolarHBondContact O-CG 3.22Å; N251-Q255 PolarHBondContact O-N 3.49Å; N251-Q255 PolarHBondContact OD1-NE2 3.48Å; F252-Q255 PolarHBondContact O-N 3.23Å
256	T	82.8	Confident	70.5	Confident	66 Å²	66	107.2 Å²	107.2	41%	0.405	51%	0.514	S	S	.	.	I	π-helix	trans	-84.1	-37.3	-174.6	-55.9	0	0	0	0	113	F252 Y253	F252-T256 WeakPolarHBondContact CE2-OG1 3.33Å; F252-T256 HydrophobicContact CZ-CG2 4.39Å; F252-T256 VanDerWaalsContact O-CB 3.25Å; F252-T256 WeakPolarHBondContact O-CB 3.38Å; F252-T256 PolarHBondContact O-N 3.05Å; F252-T256 PolarHBondContact O-OG1 3.16Å; Y253-T256 PolarHBondContact O-N 3.04Å
257	Y	83	Confident	67.9	Low	66 Å²	66	115.3 Å²	115.3	26%	0.259	55%	0.55	S	S	.	*	I	π-helix	trans	-118.6	-21.4	-167.9	-58.4	-71.5	0	0	0	115.2	K203 T206 F252 Y253	K203-Y257 HydrophobicContact CB-CD1 4.43Å; K203-Y257 HydrophobicContact CB-CE1 4.08Å; K203-Y257 HydrophobicContact CD-CD1 4.49Å; K203-Y257 HydrophobicContact CG-CD1 4.22Å; K203-Y257 HydrophobicContact CG-CE1 4.29Å; K203-Y257 HydrophobicContact CG-CG 4.46Å; T206-Y257 HydrophobicContact CG2-CE2 4.29Å; F252-Y257 HydrophobicContact CE1-CE2 4.45Å; Y253-Y257 AromaticContact CD2-CD2 3.44Å; Y253-Y257 HydrophobicContact CD2-CD2 3.44Å; Y253-Y257 VanDerWaalsContact CD2-CD2 3.44Å; Y253-Y257 AromaticContact CD2-CE2 3.95Å; Y253-Y257 HydrophobicContact CD2-CE2 3.95Å; Y253-Y257 HydrophobicContact CD2-CG 4.38Å; Y253-Y257 AromaticContact CE2-CD2 3.74Å; Y253-Y257 HydrophobicContact CE2-CD2 3.74Å; Y253-Y257 HydrophobicContact CE2-CE2 4.35Å; Y253-Y257 HydrophobicContact CE2-CG 4.3Å; Y253-Y257 HydrophobicContact CG-CD2 4.03Å; Y253-Y257 WeakPolarHBondContact O-CB 3.35Å; Y253-Y257 PolarHBondContact O-N 2.89Å
258	R	78.8	Confident	65.1	Low	185 Å²	185	119.7 Å²	119.7	70%	0.698	57%	0.568	S	S	*	*	I	π-helix	trans	-104	-33	-178.5	-75.2	-177.6	71.2	-179.6	2.7	114	V254 K260	V254-R258 HydrophobicContact CG1-CB 4.43Å; V254-R258 WeakPolarHBondContact O-CB 3.34Å; V254-R258 PolarHBondContact O-N 3.33Å; V254-R258 VanDerWaalsContact O-N 3.09Å; R258-K260 PolarHBondContact O-N 3.32Å
259	K	70.1	Confident	62.2	Low	146 Å²	146	123.5 Å²	123.5	64%	0.635	60%	0.595	S	S	*	*			trans	-70.4	99.7	173.8	-71.9	-170.6	178.5	-176.6	0	109.3	V254	V254-K259 PolarHBondContact O-N 2.55Å
260	K	48.8	Very low	59.6	Low	189 Å²	189	128.6 Å²	128.6	82%	0.822	63%	0.631	S	S	*	*			trans	-57.2	142.8	162.1	-75.7	-179.1	176.8	178.9	0	108	R258 M262	R258-K260 PolarHBondContact O-N 3.32Å; K260-M262 PolarHBondContact O-N 2.94Å; K260-M262 VanDerWaalsContact O-N 3.14Å
261	P	47.2	Very low	57	Low	111 Å²	111	130 Å²	130	72%	0.721	65%	0.653	S	S	*	*			trans	-56.4	125.3	164.6	24.5	-30.1	0	0	0	107.1	K263	P261-K263 PolarHBondContact O-N 2.94Å
262	M	35.8	Very low	54.3	Low	176 Å²	176	129.2 Å²	129.2	87%	0.867	67%	0.665	S	S	*	*			trans	-51.8	115.2	169.8	-116.7	166.9	74.6	0	0	106.5	K260 K264	K260-M262 PolarHBondContact O-N 2.94Å; K260-M262 VanDerWaalsContact O-N 3.14Å; M262-K264 VanDerWaalsContact C-N 3.28Å; M262-K264 PolarHBondContact O-N 3.22Å
263	K	37.5	Very low	51.4	Low	201 Å²	201	135.9 Å²	135.9	87%	0.874	69%	0.694	S	S	*	*			trans	-57.4	103.2	159.9	-85.4	-175.4	171.1	-172.1	0	104.9	P261 D265	P261-K263 PolarHBondContact O-N 2.94Å; K263-D265 PolarHBondContact O-N 3.2Å
264	K	36	Very low	48.7	Very low	182 Å²	182	143.6 Å²	143.6	79%	0.791	73%	0.731	S	S	*	*			trans	-63.8	117.5	155	-96.6	-177.2	170.4	-178.1	0	104.4	M262 M266	M262-K264 VanDerWaalsContact C-N 3.28Å; M262-K264 PolarHBondContact O-N 3.22Å; K264-M266 VanDerWaalsContact C-N 3.33Å; K264-M266 PolarHBondContact O-N 3.24Å
265	D	39.4	Very low	45.8	Very low	166 Å²	166	147.9 Å²	147.9	89%	0.888	76%	0.758	S	S	*	*			trans	-52.1	106	160.4	-97.3	-25.6	0	0	0	107	K263	K263-D265 PolarHBondContact O-N 3.2Å
266	M	36.5	Very low	43.1	Very low	175 Å²	175	152.4 Å²	152.4	86%	0.862	78%	0.776	S	S	*	*			trans	-92.9	106.6	166.5	-106.4	171.1	147.7	0	0	104.9	K264 E268	K264-M266 VanDerWaalsContact C-N 3.33Å; K264-M266 PolarHBondContact O-N 3.24Å; M266-E268 PolarHBondContact O-N 3.4Å
267	Q	35.8	Very low	40.5	Very low	188 Å²	188	156.4 Å²	156.4	88%	0.879	80%	0.795	S	S	*	*			trans	-51.4	125.5	154.4	-81.2	172.4	-27	0	0	107.8	P269	Q267-P269 WeakPolarHBondContact O-CD 3.39Å
268	E	32.6	Very low	37.9	Very low	192 Å²	192	157 Å²	157	90%	0.897	82%	0.82	S	S	*	*			trans	-63.9	141.2	175.9	-73.9	-177	144	0	0	111.7	M266	M266-E268 PolarHBondContact O-N 3.4Å
269	P	30.3	Very low	35.5	Very low	116 Å²	116	158.2 Å²	158.2	75%	0.753	83%	0.831	S	S	*	*			trans	-123.8	166.9	135.7	5.9	16.8	0	0	0	112	Q267	Q267-P269 WeakPolarHBondContact O-CD 3.39Å
270	P	31.8	Very low	33.4	Very low	130 Å²	130	156.6 Å²	156.6	84%	0.844	84%	0.838	S	S	*	*			trans	-83.7	167	-140.3	32.6	-36.2	0	0	0	115.9
271	A	34.7	Very low	32.5	Very low	109 Å²	109	156.4 Å²	156.4	90%	0.901	84%	0.838	S	S	*	*			trans	-46.8	141.9	-173.8	0	0	0	0	0	116.7
272	G	33.1	Very low	31.6	Very low	67 Å²	67	154.6 Å²	154.6	69%	0.691	83%	0.832	S	S	*	*			trans	136.7	91.9	155.5	0	0	0	0	0	114.5
273	K	26.4	Very low	31.4	Very low	208 Å²	208	155.6 Å²	155.6	90%	0.904	83%	0.827	S	S	*	*			trans	157	138.1	134.2	-83.1	166.9	-173.4	-176	0	111.4
274	E	28.6	Very low	31.2	Very low	198 Å²	198	154.9 Å²	154.9	93%	0.925	82%	0.824	S	S	*	*			trans	-52.1	137.8	-170.2	-59.2	174.9	139	0	0	114.8
275	V	27.1	Very low	30.8	Very low	142 Å²	142	152 Å²	152	86%	0.861	83%	0.828	S	S	*	*			trans	-109.3	106.5	174.4	179.7	0	0	0	0	109.6
276	K	28.8	Very low	30.4	Very low	188 Å²	188	148.6 Å²	148.6	82%	0.817	82%	0.822	S	S	*	*			trans	-92.7	139.8	162.3	-90.9	-179.6	177.5	171.9	0	110.3
277	N	28.1	Very low	30	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	81%	0.814	S	S	*	*			trans	80.6	97.4	161.2	-57.9	-13.9	0	0	0	117.2	F279	N277-F279 PolarHBondContact O-N 3.39Å
278	G	28.4	Very low	29.6	Very low	77 Å²	77	142.9 Å²	142.9	79%	0.794	81%	0.813	S	S	*	*			trans	-69.4	118.4	170	0	0	0	0	0	112.7
279	F	28.7	Very low	29.4	Very low	211 Å²	211	137.3 Å²	137.3	93%	0.925	81%	0.807	S	S	*	*			trans	-147.9	125.5	146.3	-104.5	-85	0	0	0	107.2	N277 K281	N277-F279 PolarHBondContact O-N 3.39Å; F279-K281 PolarHBondContact O-N 3.37Å
280	S	26.6	Very low	29.3	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	81%	0.811	S	S	*	*			trans	-63.1	115.8	-174.7	178.4	0	0	0	0	111.6	A282	S280-A282 PolarHBondContact O-N 2.89Å; S280-A282 VanDerWaalsContact O-N 3.14Å
281	K	28.7	Very low	29.1	Very low	186 Å²	186	140.8 Å²	140.8	81%	0.809	81%	0.813	S	S	*	*			trans	-83.4	37.4	179.5	-151.7	-180	-173.2	-178.9	0	112.4	F279	F279-K281 PolarHBondContact O-N 3.37Å
282	A	29.2	Very low	28.9	Very low	73 Å²	73	141.9 Å²	141.9	60%	0.603	80%	0.804	S	S	*	*			trans	-101.1	14.7	-169.9	0	0	0	0	0	115.6	S280	S280-A282 PolarHBondContact O-N 2.89Å; S280-A282 VanDerWaalsContact O-N 3.14Å
283	Y	30.8	Very low	28.7	Very low	197 Å²	197	148.3 Å²	148.3	77%	0.773	81%	0.813	S	S	*	*	S	Bend	trans	-119.9	3.4	-179.9	-125.6	-92.9	0	0	0	115.2	S285	Y283-S285 PolarHBondContact O-N 3.44Å
284	F	33	Very low	28.9	Very low	185 Å²	185	147 Å²	147	81%	0.811	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-4.2	-174.4	-97.4	-81.9	0	0	0	115.5
285	S	28.9	Very low	29	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	9.6	-169.6	-140.4	0	0	0	0	116.2	Y283	Y283-S285 PolarHBondContact O-N 3.44Å
286	A	30.2	Very low	29.2	Very low	94 Å²	94	148.2 Å²	148.2	78%	0.777	82%	0.82	S	S	*	*	S	Bend	trans	-108.6	10.4	-179.1	0	0	0	0	0	114.5
287	A	28.9	Very low	29.2	Very low	84 Å²	84	146.3 Å²	146.3	69%	0.694	82%	0.82	S	S	*	*	S	Bend	trans	-113.5	-0.9	-173.6	0	0	0	0	0	115.8
288	N	27.8	Very low	29.3	Very low	159 Å²	159	146.1 Å²	146.1	85%	0.85	82%	0.821	S	S	*	*	S	Bend	trans	-114.3	108.6	173.1	-75.4	-11.3	0	0	0	109.6
289	G	27.2	Very low	29.3	Very low	74 Å²	74	149.9 Å²	149.9	76%	0.763	82%	0.823	S	S	*	*			trans	-54.7	151.9	175.9	0	0	0	0	0	112.6	M291	G289-M291 PolarHBondContact O-N 3.18Å; G289-M291 VanDerWaalsContact O-N 3.17Å
290	V	29.3	Very low	29.3	Very low	138 Å²	138	146.3 Å²	146.3	84%	0.836	82%	0.817	S	S	*	*			trans	-45.7	113.6	166.8	177.1	0	0	0	0	110.2	N292	V290-N292 HydrophobicContact CG1-CB 4.24Å
291	M	27	Very low	29.5	Very low	181 Å²	181	148.4 Å²	148.4	89%	0.892	82%	0.819	S	S	*	*			trans	-123.7	89.5	145.4	-86.9	-169.2	65.5	0	0	107.6	G289	G289-M291 PolarHBondContact O-N 3.18Å; G289-M291 VanDerWaalsContact O-N 3.17Å
292	N	29.8	Very low	29.6	Very low	132 Å²	132	145.9 Å²	145.9	71%	0.706	82%	0.82	S	S	*	*			trans	-81.2	111	164.4	-150	1.9	0	0	0	106.6	V290	V290-N292 HydrophobicContact CG1-CB 4.24Å
293	K	29.8	Very low	29.6	Very low	202 Å²	202	151.1 Å²	151.1	88%	0.878	84%	0.835	S	S	*	*			trans	-133.9	106.1	150.7	-93.3	-168.6	176	-176.7	0	107.6
294	K	31.1	Very low	29.5	Very low	181 Å²	181	147.6 Å²	147.6	79%	0.787	84%	0.84	S	S	*	*			trans	-66.1	150.8	166.7	-81.9	179.7	168.8	-178.4	0	110.4
295	A	29.6	Very low	29.2	Very low	98 Å²	98	144.5 Å²	144.5	81%	0.81	84%	0.842	S	S	*	*			trans	47.4	123.9	140.3	0	0	0	0	0	116.8
296	Q	30.9	Very low	29.2	Very low	268 Å²	268	146.5 Å²	146.5	100%	1.252	84%	0.841	S	S	*	*				-163	0	63.3	-159.6	168.7	-4.3	0	0	110.1

Retrieved 296 of 296 residues in 249.5 ms (Link to these results)

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