A0A3B3UT14_9TELE Loading...

Squalene synthase

Catalyzes the condensation of 2 farnesyl pyrophosphate (FPP) moieties to form squalene. Proceeds in two distinct steps. In the first half-reaction, two molecules of FPP react to form the stable presqualene diphosphate intermediate (PSQPP), with concomitant release of a proton and a molecule of inorganic diphosphate. In the second half-reaction, PSQPP undergoes heterolysis, isomerization, and reduction with NADPH or NADH to form squalene. It is the first committed enzyme of the sterol biosynthesis pathway.

AlphaFold DB , UniProt , Accession A0A3B3UT14, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 417 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	51.6	Low	60.2	Low	184 Å²	184	85.5 Å²	85.5	91%	0.906	46%	0.455	S	S	*	.				0	-55	0	-105	178.2	176.2	0	0	112.7	I3 L4 K5	M1-I3 PolarHBondContact O-N 3.44Å; M1-L4 WeakPolarHBondContact O-CB 3.32Å; M1-L4 PolarHBondContact O-N 3.28Å; M1-K5 PolarHBondContact O-N 3.4Å
2	D	49.2	Very low	61.6	Low	66 Å²	66	79.5 Å²	79.5	35%	0.353	42%	0.422	S	S	.	.	H	α-helix	trans	-61	-41.6	-176.9	-62	-24	0	0	0	114.4	L4 K5 S6 K318	D2-L4 VanDerWaalsContact C-N 3.3Å; D2-L4 PolarHBondContact O-N 2.99Å; D2-K5 PolarHBondContact O-N 2.62Å; D2-S6 PolarHBondContact O-N 3.45Å; D2-K318 HydrophobicContact CB-CD 4.2Å; D2-K318 WeakPolarHBondContact OD2-CD 3.35Å; D2-K318 IonicContact OD2-NZ 3.39Å; D2-K318 PolarHBondContact OD2-NZ 3.06Å
3	I	56.7	Low	62	Low	85 Å²	85	77.4 Å²	77.4	44%	0.436	41%	0.41	S	S	.	.	H	α-helix	trans	-63.7	-37.5	177.6	-62.3	172.1	0	0	0	111.1	M1 K5 S6 L7	M1-I3 PolarHBondContact O-N 3.44Å; I3-K5 VanDerWaalsContact C-N 3.35Å; I3-K5 PolarHBondContact O-N 3.09Å; I3-S6 CarbonylContact O-C 3.6Å; I3-S6 PolarHBondContact O-N 3.4Å; I3-L7 PolarHBondContact O-N 3.05Å
4	L	51.4	Low	62.6	Low	119 Å²	119	79.1 Å²	79.1	62%	0.623	41%	0.413	S	S	*	.	H	α-helix	trans	-65.5	-38.2	178.1	-66.1	170.5	0	0	0	111.5	M1 D2 S6 L7	M1-L4 WeakPolarHBondContact O-CB 3.32Å; M1-L4 PolarHBondContact O-N 3.28Å; D2-L4 VanDerWaalsContact C-N 3.3Å; D2-L4 PolarHBondContact O-N 2.99Å; L4-S6 PolarHBondContact O-N 2.97Å; L4-L7 HydrophobicContact CB-CD1 4.38Å; L4-L7 HydrophobicContact CD2-CD1 3.66Å; L4-L7 WeakPolarHBondContact O-CB 3.42Å; L4-L7 WeakPolarHBondContact O-CG 3.31Å; L4-L7 PolarHBondContact O-N 3.23Å
5	K	59.8	Low	63.2	Low	147 Å²	147	75.3 Å²	75.3	64%	0.639	39%	0.393	S	S	*	.	H	α-helix	trans	-69.5	-17.6	176.2	-68.6	-175.9	177.9	-176.7	0	113.5	M1 D2 I3 R317	M1-K5 PolarHBondContact O-N 3.4Å; D2-K5 PolarHBondContact O-N 2.62Å; I3-K5 VanDerWaalsContact C-N 3.35Å; I3-K5 PolarHBondContact O-N 3.09Å; K5-R317 WeakPolarHBondContact O-CD 3.29Å
6	S	56.1	Low	63.6	Low	1 Å²	1	71.3 Å²	71.3	1%	0.007	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	9	177.4	-65.9	0	0	0	0	113.1	D2 I3 L4 G8 H9 E12 I13	D2-S6 PolarHBondContact O-N 3.45Å; I3-S6 CarbonylContact O-C 3.6Å; I3-S6 PolarHBondContact O-N 3.4Å; L4-S6 PolarHBondContact O-N 2.97Å; S6-G8 PolarHBondContact O-N 3.02Å; S6-H9 CarbonylContact O-C 3.51Å; S6-H9 WeakPolarHBondContact O-CA 3.3Å; S6-H9 PolarHBondContact O-N 2.71Å; S6-E12 PolarHBondContact OG-OE2 3.48Å; S6-I13 WeakPolarHBondContact O-CD1 3.31Å; S6-I13 WeakPolarHBondContact O-CG1 3.45Å
7	L	58	Low	63.7	Low	108 Å²	108	74.7 Å²	74.7	57%	0.565	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.4	179.7	-79.5	172	0	0	0	113.9	I3 L4 H9 I13	I3-L7 PolarHBondContact O-N 3.05Å; L4-L7 HydrophobicContact CB-CD1 4.38Å; L4-L7 HydrophobicContact CD2-CD1 3.66Å; L4-L7 WeakPolarHBondContact O-CB 3.42Å; L4-L7 WeakPolarHBondContact O-CG 3.31Å; L4-L7 PolarHBondContact O-N 3.23Å; L7-H9 VanDerWaalsContact C-N 3.28Å; L7-H9 PolarHBondContact O-N 3.41Å; L7-I13 HydrophobicContact CD2-CD1 4.37Å
8	G	64.4	Low	63.9	Low	61 Å²	61	75.3 Å²	75.3	63%	0.629	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.8	173.8	0	0	0	0	0	114.8	S6	S6-G8 PolarHBondContact O-N 3.02Å
9	H	71.8	Confident	64.2	Low	67 Å²	67	75.1 Å²	75.1	31%	0.31	38%	0.379	S	S	.	.			trans	-131.2	79.2	-176.1	-58.5	-71.6	0	0	0	110.4	S6 L7 E11 E12 I13 R317	S6-H9 CarbonylContact O-C 3.51Å; S6-H9 WeakPolarHBondContact O-CA 3.3Å; S6-H9 PolarHBondContact O-N 2.71Å; L7-H9 VanDerWaalsContact C-N 3.28Å; L7-H9 PolarHBondContact O-N 3.41Å; H9-E11 PolarHBondContact O-N 3.29Å; H9-E11 VanDerWaalsContact O-N 3.11Å; H9-E12 HydrophobicContact CB-CB 3.85Å; H9-E12 VanDerWaalsContact CB-CD 3.5Å; H9-E12 HydrophobicContact CB-CG 3.66Å; H9-E12 IonicContact CD2-OE1 2.73Å; H9-E12 IonicContact CG-OE1 2.95Å; H9-E12 WeakPolarHBondContact O-CB 3.39Å; H9-E12 PolarHBondContact O-N 3.48Å; H9-I13 PolarHBondContact O-N 2.7Å; H9-R317 PolarHBondContact NE2-NH2 3.31Å
10	P	72.6	Confident	64.3	Low	30 Å²	30	79.1 Å²	79.1	20%	0.195	39%	0.394	C	S	.	.	H	α-helix	trans	-52	-35.4	-177.4	-27.9	34.5	0	0	0	114.5	I13 F14 Y388 A391	P10-I13 PolarHBondContact O-N 3.38Å; P10-F14 PolarHBondContact O-N 3.43Å; P10-F14 VanDerWaalsContact O-N 3.09Å; P10-Y388 VanDerWaalsContact CD-CE1 3.44Å; P10-Y388 HydrophobicContact CG-CD1 3.99Å; P10-Y388 HydrophobicContact CG-CE1 3.8Å; P10-A391 HydrophobicContact CG-CB 4.42Å
11	E	70.3	Confident	64.3	Low	72 Å²	72	81.9 Å²	81.9	34%	0.336	41%	0.408	S	S	.	.	H	α-helix	trans	-67.1	-38.5	177	-57.8	-171.5	151.4	0	0	112.7	H9 I13 F14 N15 S385 M387 Y388	H9-E11 PolarHBondContact O-N 3.29Å; H9-E11 VanDerWaalsContact O-N 3.11Å; E11-I13 VanDerWaalsContact C-N 3.32Å; E11-I13 PolarHBondContact O-N 3.35Å; E11-F14 PolarHBondContact O-N 2.9Å; E11-N15 WeakPolarHBondContact O-CB 3.42Å; E11-N15 PolarHBondContact O-N 3Å; E11-N15 PolarHBondContact O-ND2 2.72Å; E11-S385 WeakPolarHBondContact OE1-CB 3.5Å; E11-S385 PolarHBondContact OE1-OG 3.21Å; E11-M387 HydrophobicContact CB-CE 3.99Å; E11-M387 HydrophobicContact CG-CE 3.66Å; E11-Y388 HydrophobicContact CG-CD2 4.37Å; E11-Y388 HydrophobicContact CG-CE2 3.75Å
12	E	77.8	Confident	64.7	Low	14 Å²	14	75.4 Å²	75.4	7%	0.065	39%	0.388	C	S	.	.	H	α-helix	trans	-63.5	-38.7	174.4	-71.1	-175.9	-160	0	0	111.3	S6 H9 N15 L16 R317 Q320	S6-E12 PolarHBondContact OG-OE2 3.48Å; H9-E12 HydrophobicContact CB-CB 3.85Å; H9-E12 VanDerWaalsContact CB-CD 3.5Å; H9-E12 HydrophobicContact CB-CG 3.66Å; H9-E12 IonicContact CD2-OE1 2.73Å; H9-E12 IonicContact CG-OE1 2.95Å; H9-E12 WeakPolarHBondContact O-CB 3.39Å; H9-E12 PolarHBondContact O-N 3.48Å; E12-N15 PolarHBondContact O-N 3.38Å; E12-L16 WeakPolarHBondContact O-CB 3.34Å; E12-L16 WeakPolarHBondContact O-CG 3.3Å; E12-L16 PolarHBondContact O-N 2.94Å; E12-R317 IonicContact OE1-CZ 3.9Å; E12-R317 IonicContact OE1-NE 2.75Å; E12-R317 PolarHBondContact OE1-NE 2.89Å; E12-R317 VanDerWaalsContact OE1-NE 3.17Å; E12-R317 IonicContact OE1-NH2 3.81Å; E12-R317 PolarHBondContact OE1-NH2 3.49Å; E12-R317 IonicContact OE2-NE 3.14Å; E12-R317 PolarHBondContact OE2-NE 3.47Å; E12-Q320 PolarHBondContact OE2-N 3.25Å
13	I	66.9	Low	65.3	Low	52 Å²	52	73.7 Å²	73.7	27%	0.267	39%	0.386	S	S	.	.	H	α-helix	trans	-65.5	-45.8	177.7	-57.7	174.7	0	0	0	110.5	S6 L7 H9 P10 E11 L16 F17	S6-I13 WeakPolarHBondContact O-CD1 3.31Å; S6-I13 WeakPolarHBondContact O-CG1 3.45Å; L7-I13 HydrophobicContact CD2-CD1 4.37Å; H9-I13 PolarHBondContact O-N 2.7Å; P10-I13 PolarHBondContact O-N 3.38Å; E11-I13 VanDerWaalsContact C-N 3.32Å; E11-I13 PolarHBondContact O-N 3.35Å; I13-L16 PolarHBondContact O-N 3.09Å; I13-F17 WeakPolarHBondContact O-CB 3.43Å; I13-F17 PolarHBondContact O-N 2.87Å
14	F	69.5	Low	65.8	Low	101 Å²	101	70 Å²	70	44%	0.443	37%	0.368	S	S	.	.	H	α-helix	trans	-60.9	-44.8	176.5	178.6	-97.6	0	0	0	111.4	P10 E11 F17 K18 M387	P10-F14 PolarHBondContact O-N 3.43Å; P10-F14 VanDerWaalsContact O-N 3.09Å; E11-F14 PolarHBondContact O-N 2.9Å; F14-F17 WeakPolarHBondContact O-CB 3.34Å; F14-F17 PolarHBondContact O-N 3.36Å; F14-K18 HydrophobicContact CE1-CD 4.25Å; F14-K18 WeakPolarHBondContact O-CB 3.38Å; F14-K18 PolarHBondContact O-N 2.82Å; F14-M387 HydrophobicContact CB-CE 3.71Å; F14-M387 HydrophobicContact CB-SD 3.87Å; F14-M387 HydrophobicContact CD1-CE 4.05Å; F14-M387 HydrophobicContact CD1-SD 4.13Å; F14-M387 HydrophobicContact CD2-SD 3.97Å; F14-M387 HydrophobicContact CG-CE 3.93Å; F14-M387 HydrophobicContact CG-SD 3.71Å
15	N	72	Confident	66.8	Low	22 Å²	22	75.2 Å²	75.2	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-66.1	-39.1	177.8	-73.7	-21.7	0	0	0	112.1	E11 E12 F17 K18 F19 V322 T323 M326	E11-N15 WeakPolarHBondContact O-CB 3.42Å; E11-N15 PolarHBondContact O-N 3Å; E11-N15 PolarHBondContact O-ND2 2.72Å; E12-N15 PolarHBondContact O-N 3.38Å; N15-F17 VanDerWaalsContact C-N 3.32Å; N15-F17 PolarHBondContact O-N 3.04Å; N15-K18 PolarHBondContact O-N 2.99Å; N15-F19 VanDerWaalsContact O-CB 3.24Å; N15-F19 WeakPolarHBondContact O-CB 3.28Å; N15-F19 PolarHBondContact O-N 3.32Å; N15-V322 HydrophobicContact CB-CG1 4.2Å; N15-T323 WeakPolarHBondContact ND2-CG2 3.16Å; N15-T323 PolarHBondContact ND2-OG1 2.94Å; N15-M326 HydrophobicContact CB-SD 3.94Å
16	L	70.1	Confident	67.2	Low	12 Å²	12	68.8 Å²	68.8	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-41.9	171.8	-77.6	168.4	0	0	0	111.8	E12 I13 K20 K318 V322	E12-L16 WeakPolarHBondContact O-CB 3.34Å; E12-L16 WeakPolarHBondContact O-CG 3.3Å; E12-L16 PolarHBondContact O-N 2.94Å; I13-L16 PolarHBondContact O-N 3.09Å; L16-K20 WeakPolarHBondContact O-CB 3.32Å; L16-K20 WeakPolarHBondContact O-CG 3.38Å; L16-K20 PolarHBondContact O-N 3.43Å; L16-K318 HydrophobicContact CD2-CD 4.44Å; L16-K318 HydrophobicContact CD2-CG 4.14Å; L16-V322 HydrophobicContact CD2-CB 4.48Å; L16-V322 HydrophobicContact CD2-CG2 4.03Å
17	F	65.4	Low	68.1	Low	129 Å²	129	69 Å²	69	57%	0.566	36%	0.355	S	S	*	.	H	α-helix	trans	-65	-49.2	176.1	-175.9	-97.3	0	0	0	111	I13 F14 N15 F19 K20 M21	I13-F17 WeakPolarHBondContact O-CB 3.43Å; I13-F17 PolarHBondContact O-N 2.87Å; F14-F17 WeakPolarHBondContact O-CB 3.34Å; F14-F17 PolarHBondContact O-N 3.36Å; N15-F17 VanDerWaalsContact C-N 3.32Å; N15-F17 PolarHBondContact O-N 3.04Å; F17-F19 VanDerWaalsContact C-N 3.32Å; F17-F19 PolarHBondContact O-N 3.4Å; F17-K20 PolarHBondContact O-N 3.45Å; F17-M21 HydrophobicContact CD1-CG 4.13Å; F17-M21 HydrophobicContact CE1-CG 3.77Å; F17-M21 HydrophobicContact CE2-CG 4.4Å; F17-M21 HydrophobicContact CZ-CG 3.92Å; F17-M21 HydrophobicContact CZ-SD 4.14Å; F17-M21 VanDerWaalsContact O-CG 3.28Å; F17-M21 WeakPolarHBondContact O-CG 3.37Å; F17-M21 PolarHBondContact O-N 3.25Å
18	K	66.4	Low	69	Low	85 Å²	85	68.5 Å²	68.5	37%	0.37	35%	0.35	S	S	.	.	H	α-helix	trans	-59.5	-41.3	177.3	-177.4	168.8	168	-169.7	0	112.1	F14 N15 M21 G22 G23 M326	F14-K18 HydrophobicContact CE1-CD 4.25Å; F14-K18 WeakPolarHBondContact O-CB 3.38Å; F14-K18 PolarHBondContact O-N 2.82Å; N15-K18 PolarHBondContact O-N 2.99Å; K18-M21 CarbonylContact O-C 3.56Å; K18-M21 PolarHBondContact O-N 2.9Å; K18-G22 PolarHBondContact O-N 2.97Å; K18-G23 WeakPolarHBondContact CE-O 3.5Å; K18-G23 WeakPolarHBondContact O-CA 3.49Å; K18-G23 PolarHBondContact O-N 3.19Å; K18-M326 HydrophobicContact CD-CE 3.55Å; K18-M326 HydrophobicContact CG-CE 4.09Å
19	F	69.5	Low	69.6	Low	71 Å²	71	69.1 Å²	69.1	31%	0.311	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-46.3	175.3	-178.2	-93.1	0	0	0	111.9	N15 F17 M21 G22 C24 V27 V322 M325	N15-F19 VanDerWaalsContact O-CB 3.24Å; N15-F19 WeakPolarHBondContact O-CB 3.28Å; N15-F19 PolarHBondContact O-N 3.32Å; F17-F19 VanDerWaalsContact C-N 3.32Å; F17-F19 PolarHBondContact O-N 3.4Å; F19-M21 PolarHBondContact O-N 3.09Å; F19-G22 PolarHBondContact O-N 2.89Å; F19-C24 HydrophobicContact CD2-CB 3.73Å; F19-C24 HydrophobicContact CE2-CB 4.23Å; F19-V27 HydrophobicContact CE2-CG2 3.89Å; F19-V322 HydrophobicContact CB-CG1 3.56Å; F19-V322 HydrophobicContact CB-CG2 4.48Å; F19-V322 HydrophobicContact CD1-CG2 4.32Å; F19-V322 HydrophobicContact CD2-CG1 4.03Å; F19-V322 HydrophobicContact CD2-CG2 4.33Å; F19-V322 HydrophobicContact CG-CG1 3.91Å; F19-V322 HydrophobicContact CG-CG2 4.12Å; F19-M325 HydrophobicContact CE2-CE 4.19Å
20	K	66.3	Low	70.1	Confident	156 Å²	156	70.5 Å²	70.5	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-62	-29.9	175.5	-79.4	-173.8	173.8	-169.8	0	113.5	L16 F17 G22	L16-K20 WeakPolarHBondContact O-CB 3.32Å; L16-K20 WeakPolarHBondContact O-CG 3.38Å; L16-K20 PolarHBondContact O-N 3.43Å; F17-K20 PolarHBondContact O-N 3.45Å; K20-G22 PolarHBondContact O-N 2.89Å
21	M	64.8	Low	70.4	Confident	138 Å²	138	70.4 Å²	70.4	68%	0.68	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	11.1	176	-64.7	-68.7	-69.5	0	0	113.2	F17 K18 F19 G23	F17-M21 HydrophobicContact CD1-CG 4.13Å; F17-M21 HydrophobicContact CE1-CG 3.77Å; F17-M21 HydrophobicContact CE2-CG 4.4Å; F17-M21 HydrophobicContact CZ-CG 3.92Å; F17-M21 HydrophobicContact CZ-SD 4.14Å; F17-M21 VanDerWaalsContact O-CG 3.28Å; F17-M21 WeakPolarHBondContact O-CG 3.37Å; F17-M21 PolarHBondContact O-N 3.25Å; K18-M21 CarbonylContact O-C 3.56Å; K18-M21 PolarHBondContact O-N 2.9Å; F19-M21 PolarHBondContact O-N 3.09Å; M21-G23 VanDerWaalsContact C-N 3.32Å; M21-G23 PolarHBondContact O-N 2.71Å
22	G	60.7	Low	71	Confident	48 Å²	48	70.9 Å²	70.9	50%	0.495	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	12.8	179.6	0	0	0	0	0	114.7	K18 F19 K20 C24	K18-G22 PolarHBondContact O-N 2.97Å; F19-G22 PolarHBondContact O-N 2.89Å; K20-G22 PolarHBondContact O-N 2.89Å; G22-C24 VanDerWaalsContact C-N 3.29Å; G22-C24 PolarHBondContact O-N 3.41Å
23	G	60.5	Low	71.2	Confident	30 Å²	30	75.6 Å²	75.6	31%	0.309	37%	0.369	S	S	.	.			trans	-79.8	6.4	-172.5	0	0	0	0	0	116.3	K18 M21	K18-G23 WeakPolarHBondContact CE-O 3.5Å; K18-G23 WeakPolarHBondContact O-CA 3.49Å; K18-G23 PolarHBondContact O-N 3.19Å; M21-G23 VanDerWaalsContact C-N 3.32Å; M21-G23 PolarHBondContact O-N 2.71Å
24	C	68.4	Low	71.8	Confident	8 Å²	8	81.6 Å²	81.6	5%	0.054	40%	0.396	C	S	.	.			trans	-98.2	83.5	178.2	-167.2	0	0	0	0	111	F19 G22 A26 V27 M28 M326	F19-C24 HydrophobicContact CD2-CB 3.73Å; F19-C24 HydrophobicContact CE2-CB 4.23Å; G22-C24 VanDerWaalsContact C-N 3.29Å; G22-C24 PolarHBondContact O-N 3.41Å; C24-A26 PolarHBondContact O-N 3.38Å; C24-A26 VanDerWaalsContact O-N 3.12Å; C24-V27 HydrophobicContact CB-CG2 3.88Å; C24-V27 PolarHBondContact O-N 2.98Å; C24-V27 VanDerWaalsContact O-N 3.14Å; C24-M28 PolarHBondContact O-N 3.3Å; C24-M326 HydrophobicContact CB-CG 4.26Å; C24-M326 VanDerWaalsContact SG-CG 3.56Å
25	R	71.4	Confident	72.6	Confident	227 Å²	227	81.1 Å²	81.1	86%	0.857	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-55.4	-29.2	179.5	-69.4	-174.9	-179.2	177.9	-0.2	113.7	V27 M28	R25-V27 PolarHBondContact O-N 2.76Å; R25-M28 HydrophobicContact CB-SD 4.45Å; R25-M28 HydrophobicContact CG-SD 4.06Å
26	A	69.1	Low	73.6	Confident	12 Å²	12	80.8 Å²	80.8	10%	0.099	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-64.1	-25	-178.6	0	0	0	0	0	113.7	C24 N287 T329	C24-A26 PolarHBondContact O-N 3.38Å; C24-A26 VanDerWaalsContact O-N 3.12Å; A26-N287 WeakPolarHBondContact CA-ND2 3.26Å; A26-N287 PolarHBondContact O-ND2 3.16Å; A26-T329 HydrophobicContact CB-CG2 3.81Å
27	V	74.6	Confident	74.7	Confident	7 Å²	7	82.6 Å²	82.6	4%	0.042	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-129.6	21.2	-176.9	-54.9	0	0	0	0	112.2	F19 C24 R25 P29 A56 V57 I291 M325	F19-V27 HydrophobicContact CE2-CG2 3.89Å; C24-V27 HydrophobicContact CB-CG2 3.88Å; C24-V27 PolarHBondContact O-N 2.98Å; C24-V27 VanDerWaalsContact O-N 3.14Å; R25-V27 PolarHBondContact O-N 2.76Å; V27-P29 WeakPolarHBondContact O-CD 3.46Å; V27-A56 HydrophobicContact CB-CB 4.35Å; V27-V57 HydrophobicContact CG1-CG2 3.99Å; V27-I291 HydrophobicContact CG1-CD1 3.79Å; V27-M325 HydrophobicContact CB-CE 4.25Å; V27-M325 HydrophobicContact CG1-CE 3.69Å; V27-M325 HydrophobicContact CG2-CE 3.97Å
28	M	77.4	Confident	76.2	Confident	96 Å²	96	82 Å²	82	47%	0.473	42%	0.42	S	S	.	.			trans	-65.9	122.3	174.3	-87	-179.2	55	0	0	109.4	C24 R25 K30 A60	C24-M28 PolarHBondContact O-N 3.3Å; R25-M28 HydrophobicContact CB-SD 4.45Å; R25-M28 HydrophobicContact CG-SD 4.06Å; M28-K30 PolarHBondContact O-N 3.32Å; M28-A60 WeakPolarHBondContact O-CA 3.16Å; M28-A60 WeakPolarHBondContact O-CB 3.34Å
29	P	76.9	Confident	77.7	Confident	75 Å²	75	79.1 Å²	79.1	49%	0.487	41%	0.41	S	S	.	.			trans	-58	134.2	176.5	-24.8	35.1	0	0	0	110.9	V27 L31 Q59	V27-P29 WeakPolarHBondContact O-CD 3.46Å; P29-L31 HydrophobicContact CB-CD1 4.49Å; P29-L31 HydrophobicContact CB-CG 4.4Å; P29-Q59 HydrophobicContact CB-CB 4.03Å; P29-Q59 HydrophobicContact CG-CB 4.48Å
30	K	80.6	Confident	79	Confident	95 Å²	95	76.5 Å²	76.5	41%	0.413	40%	0.4	S	S	.	.			trans	-106.1	33.2	174.4	-67.6	176.9	-172.7	154.8	0	111.1	M28 Q59 A60 D62 R66	M28-K30 PolarHBondContact O-N 3.32Å; K30-Q59 PolarHBondContact N-O 3.49Å; K30-A60 WeakPolarHBondContact CD-O 3.5Å; K30-A60 WeakPolarHBondContact CE-O 3.4Å; K30-A60 PolarHBondContact NZ-O 2.75Å; K30-D62 IonicContact NZ-OD1 3.84Å; K30-D62 PolarHBondContact NZ-OD1 3.14Å; K30-R66 PolarHBondContact O-NH1 3.33Å; K30-R66 PolarHBondContact O-NH2 2.94Å
31	L	80.3	Confident	80.5	Confident	28 Å²	28	73 Å²	73	15%	0.147	38%	0.382	C	S	.	.			trans	-81	130.8	-178	-62.1	173.9	0	0	0	110.2	P29 Y33 M36 Y44 Q59	P29-L31 HydrophobicContact CB-CD1 4.49Å; P29-L31 HydrophobicContact CB-CG 4.4Å; L31-Y33 HydrophobicContact CB-CD2 4.13Å; L31-Y33 HydrophobicContact CB-CE2 3.86Å; L31-Y33 HydrophobicContact CD1-CE1 4.36Å; L31-Y33 HydrophobicContact CD1-CE2 3.78Å; L31-Y33 VanDerWaalsContact CD1-OH 3.26Å; L31-Y33 WeakPolarHBondContact CD1-OH 3.29Å; L31-M36 HydrophobicContact CB-CE 3.95Å; L31-M36 HydrophobicContact CD2-CE 3.62Å; L31-M36 HydrophobicContact CG-CE 4.38Å; L31-Y44 HydrophobicContact CD1-CD1 4.34Å; L31-Y44 HydrophobicContact CD2-CD1 4.03Å; L31-Y44 HydrophobicContact CD2-CD2 4.21Å; L31-Y44 HydrophobicContact CD2-CE1 3.63Å; L31-Y44 HydrophobicContact CD2-CE2 3.8Å; L31-Y44 HydrophobicContact CD2-CG 4.32Å; L31-Q59 HydrophobicContact CD1-CB 4.28Å; L31-Q59 HydrophobicContact CD1-CG 3.82Å; L31-Q59 HydrophobicContact CD2-CG 4.32Å; L31-Q59 HydrophobicContact CG-CB 4.28Å; L31-Q59 HydrophobicContact CG-CG 4.23Å
32	D	83.4	Confident	82.1	Confident	83 Å²	83	68.6 Å²	68.6	44%	0.444	36%	0.363	S	S	.	.			trans	-105.4	94.4	163.6	175.4	16.9	0	0	0	107.9	E34 S35 M36	D32-E34 VanDerWaalsContact C-N 3.25Å; D32-E34 PolarHBondContact O-N 3.48Å; D32-E34 PolarHBondContact OD1-N 3Å; D32-S35 PolarHBondContact O-OG 3.03Å; D32-S35 WeakPolarHBondContact OD2-CB 3.24Å; D32-S35 PolarHBondContact OD2-OG 3.14Å; D32-M36 VanDerWaalsContact O-CE 3.32Å; D32-M36 WeakPolarHBondContact O-CE 3.35Å; D32-M36 WeakPolarHBondContact O-CG 3.47Å
33	Y	80.4	Confident	83.8	Confident	112 Å²	112	66.3 Å²	66.3	44%	0.439	34%	0.339	S	S	.	.	S	Bend	trans	-65.7	-30	-176	-78.5	-83.1	0	0	0	112.3	L31 S35 M36 R41	L31-Y33 HydrophobicContact CB-CD2 4.13Å; L31-Y33 HydrophobicContact CB-CE2 3.86Å; L31-Y33 HydrophobicContact CD1-CE1 4.36Å; L31-Y33 HydrophobicContact CD1-CE2 3.78Å; L31-Y33 VanDerWaalsContact CD1-OH 3.26Å; L31-Y33 WeakPolarHBondContact CD1-OH 3.29Å; Y33-S35 VanDerWaalsContact C-N 3.3Å; Y33-S35 PolarHBondContact O-N 3.3Å; Y33-M36 PolarHBondContact O-N 3.05Å; Y33-R41 HydrophobicContact CD1-CG 4.22Å; Y33-R41 PolarHBondContact O-NE 3.36Å; Y33-R41 PolarHBondContact O-NH2 3.44Å
34	E	80.9	Confident	85.5	Confident	179 Å²	179	65 Å²	65	84%	0.836	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.4	-174.3	-66.5	-167.3	170.7	0	0	112.2	D32	D32-E34 VanDerWaalsContact C-N 3.25Å; D32-E34 PolarHBondContact O-N 3.48Å; D32-E34 PolarHBondContact OD1-N 3Å
35	S	86.1	Confident	86.8	Confident	90 Å²	90	68 Å²	68	63%	0.629	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.3	177.8	55.5	0	0	0	0	114.9	D32 Y33	D32-S35 PolarHBondContact O-OG 3.03Å; D32-S35 WeakPolarHBondContact OD2-CB 3.24Å; D32-S35 PolarHBondContact OD2-OG 3.14Å; Y33-S35 VanDerWaalsContact C-N 3.3Å; Y33-S35 PolarHBondContact O-N 3.3Å
36	M	91.9	Very high	88	Confident	16 Å²	16	58.1 Å²	58.1	8%	0.079	31%	0.306	C	S	.	.	S	Bend	trans	-83.9	144.4	-178.6	-66.6	-178	-159.5	0	0	113.1	L31 D32 Y33 L40 R41 Y44	L31-M36 HydrophobicContact CB-CE 3.95Å; L31-M36 HydrophobicContact CD2-CE 3.62Å; L31-M36 HydrophobicContact CG-CE 4.38Å; D32-M36 VanDerWaalsContact O-CE 3.32Å; D32-M36 WeakPolarHBondContact O-CE 3.35Å; D32-M36 WeakPolarHBondContact O-CG 3.47Å; Y33-M36 PolarHBondContact O-N 3.05Å; M36-L40 HydrophobicContact CB-CB 4.46Å; M36-L40 HydrophobicContact CB-CD2 4.23Å; M36-L40 HydrophobicContact CB-CG 4.49Å; M36-L40 HydrophobicContact CG-CD2 3.91Å; M36-L40 HydrophobicContact CG-CG 4.37Å; M36-L40 HydrophobicContact SD-CD2 4.23Å; M36-L40 HydrophobicContact SD-CG 4.22Å; M36-R41 HydrophobicContact CB-CG 3.88Å; M36-R41 PolarHBondContact O-NE 2.89Å; M36-R41 PolarHBondContact O-NH2 3.38Å; M36-Y44 HydrophobicContact CE-CE2 4.19Å; M36-Y44 HydrophobicContact SD-CD2 3.85Å; M36-Y44 HydrophobicContact SD-CE2 3.78Å
37	S	94.8	Very high	89.2	Confident	50 Å²	50	57.6 Å²	57.6	35%	0.35	30%	0.301	S	S	.	.			trans	-61.1	156	164.6	61.5	0	0	0	0	110.9	S39 L40 R41 E131	S37-S39 VanDerWaalsContact C-N 3.3Å; S37-S39 PolarHBondContact O-N 3.23Å; S37-S39 PolarHBondContact OG-OG 3.24Å; S37-L40 PolarHBondContact O-N 3.41Å; S37-L40 WeakPolarHBondContact OG-CB 3.35Å; S37-L40 PolarHBondContact OG-N 3.29Å; S37-L40 VanDerWaalsContact OG-N 3.16Å; S37-R41 WeakPolarHBondContact O-CG 3.25Å; S37-R41 PolarHBondContact O-N 3.03Å; S37-E131 PolarHBondContact OG-OE1 2.95Å
38	D	96.6	Very high	89.9	Confident	116 Å²	116	60.4 Å²	60.4	62%	0.62	32%	0.317	S	S	*	.	H	α-helix	trans	-63.4	-37	177.2	-69.5	-31	0	0	0	111.9	L40 R41 T42	D38-L40 PolarHBondContact O-N 3.08Å; D38-R41 WeakPolarHBondContact O-CB 3.37Å; D38-R41 PolarHBondContact O-N 2.7Å; D38-R41 IonicContact OD1-CZ 3.9Å; D38-R41 IonicContact OD1-NH1 2.94Å; D38-R41 PolarHBondContact OD1-NH1 2.88Å; D38-T42 PolarHBondContact O-N 3.49Å; D38-T42 PolarHBondContact O-OG1 3.5Å; D38-T42 VanDerWaalsContact O-OG1 3.08Å
39	S	97.4	Very high	90.6	Very high	25 Å²	25	61.3 Å²	61.3	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-40.7	174.8	37.6	0	0	0	0	112.8	S37 T42 C43 E131	S37-S39 VanDerWaalsContact C-N 3.3Å; S37-S39 PolarHBondContact O-N 3.23Å; S37-S39 PolarHBondContact OG-OG 3.24Å; S39-T42 WeakPolarHBondContact O-CB 3.36Å; S39-T42 PolarHBondContact O-N 2.92Å; S39-C43 PolarHBondContact O-N 2.5Å; S39-C43 PolarHBondContact O-SG 3.28Å; S39-E131 VanDerWaalsContact CB-OE1 3.24Å; S39-E131 WeakPolarHBondContact CB-OE1 3.1Å; S39-E131 PolarHBondContact OG-OE1 3.29Å
40	L	97.4	Very high	91	Very high	16 Å²	16	58.6 Å²	58.6	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-69	-37.9	175.6	-175.3	57.2	0	0	0	112.1	M36 S37 D38 T42 C43 Y44 E131	M36-L40 HydrophobicContact CB-CB 4.46Å; M36-L40 HydrophobicContact CB-CD2 4.23Å; M36-L40 HydrophobicContact CB-CG 4.49Å; M36-L40 HydrophobicContact CG-CD2 3.91Å; M36-L40 HydrophobicContact CG-CG 4.37Å; M36-L40 HydrophobicContact SD-CD2 4.23Å; M36-L40 HydrophobicContact SD-CG 4.22Å; S37-L40 PolarHBondContact O-N 3.41Å; S37-L40 WeakPolarHBondContact OG-CB 3.35Å; S37-L40 PolarHBondContact OG-N 3.29Å; S37-L40 VanDerWaalsContact OG-N 3.16Å; D38-L40 PolarHBondContact O-N 3.08Å; L40-T42 VanDerWaalsContact C-N 3.32Å; L40-T42 PolarHBondContact O-N 3.01Å; L40-C43 WeakPolarHBondContact O-CB 3.43Å; L40-C43 PolarHBondContact O-N 2.51Å; L40-Y44 HydrophobicContact CD1-CD2 4.36Å; L40-Y44 HydrophobicContact CD1-CE2 3.92Å; L40-Y44 HydrophobicContact CG-CD2 4.29Å; L40-Y44 HydrophobicContact CG-CE2 4.01Å; L40-Y44 VanDerWaalsContact O-CD2 3.29Å; L40-Y44 WeakPolarHBondContact O-CD2 3.32Å; L40-Y44 PolarHBondContact O-N 3.08Å; L40-E131 HydrophobicContact CB-CG 4.18Å; L40-E131 HydrophobicContact CD1-CG 4.41Å; L40-E131 PolarHBondContact N-OE1 3.43Å
41	R	96.9	Very high	90.8	Very high	82 Å²	82	54.6 Å²	54.6	31%	0.309	29%	0.286	S	S	.	.	H	α-helix	trans	-60.5	-43.8	172.3	-68.1	176.4	-175.3	156.4	-1	111.1	Y33 M36 S37 D38 C43 Y44 V45	Y33-R41 HydrophobicContact CD1-CG 4.22Å; Y33-R41 PolarHBondContact O-NE 3.36Å; Y33-R41 PolarHBondContact O-NH2 3.44Å; M36-R41 HydrophobicContact CB-CG 3.88Å; M36-R41 PolarHBondContact O-NE 2.89Å; M36-R41 PolarHBondContact O-NH2 3.38Å; S37-R41 WeakPolarHBondContact O-CG 3.25Å; S37-R41 PolarHBondContact O-N 3.03Å; D38-R41 WeakPolarHBondContact O-CB 3.37Å; D38-R41 PolarHBondContact O-N 2.7Å; D38-R41 IonicContact OD1-CZ 3.9Å; D38-R41 IonicContact OD1-NH1 2.94Å; D38-R41 PolarHBondContact OD1-NH1 2.88Å; R41-C43 VanDerWaalsContact C-N 3.34Å; R41-C43 PolarHBondContact O-N 3.41Å; R41-Y44 PolarHBondContact O-N 2.88Å; R41-Y44 VanDerWaalsContact O-N 3.14Å; R41-V45 PolarHBondContact O-N 2.66Å
42	T	97.8	Very high	90.6	Very high	46 Å²	46	62.4 Å²	62.4	28%	0.282	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-42.6	174.6	-62.3	0	0	0	0	111.5	D38 S39 L40 Y44 V45 Y46 T127	D38-T42 PolarHBondContact O-N 3.49Å; D38-T42 PolarHBondContact O-OG1 3.5Å; D38-T42 VanDerWaalsContact O-OG1 3.08Å; S39-T42 WeakPolarHBondContact O-CB 3.36Å; S39-T42 PolarHBondContact O-N 2.92Å; L40-T42 VanDerWaalsContact C-N 3.32Å; L40-T42 PolarHBondContact O-N 3.01Å; T42-Y44 VanDerWaalsContact C-N 3.32Å; T42-Y44 PolarHBondContact O-N 3.33Å; T42-V45 WeakPolarHBondContact O-CA 3.32Å; T42-V45 WeakPolarHBondContact O-CB 3.39Å; T42-V45 PolarHBondContact O-N 3.37Å; T42-Y46 HydrophobicContact CG2-CD2 4.16Å; T42-Y46 HydrophobicContact CG2-CE1 4.09Å; T42-Y46 HydrophobicContact CG2-CE2 3.49Å; T42-Y46 VanDerWaalsContact CG2-CE2 3.49Å; T42-Y46 VanDerWaalsContact CG2-CZ 3.44Å; T42-Y46 PolarHBondContact O-N 2.85Å; T42-T127 HydrophobicContact CG2-CG2 3.99Å
43	C	98	Very high	90	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-57.2	-43.2	173.1	-69.4	0	0	0	0	112	S39 L40 R41 V45 Y46 L47 I71 L74	S39-C43 PolarHBondContact O-N 2.5Å; S39-C43 PolarHBondContact O-SG 3.28Å; L40-C43 WeakPolarHBondContact O-CB 3.43Å; L40-C43 PolarHBondContact O-N 2.51Å; R41-C43 VanDerWaalsContact C-N 3.34Å; R41-C43 PolarHBondContact O-N 3.41Å; C43-V45 VanDerWaalsContact C-N 3.31Å; C43-V45 PolarHBondContact O-N 3.09Å; C43-Y46 PolarHBondContact O-N 2.91Å; C43-L47 WeakPolarHBondContact O-CB 3.34Å; C43-L47 PolarHBondContact O-N 2.81Å; C43-I71 HydrophobicContact CB-CD1 3.95Å; C43-L74 HydrophobicContact CB-CD1 3.62Å; C43-L74 WeakPolarHBondContact O-CD1 3.36Å
44	Y	95.5	Very high	89.8	Confident	1 Å²	1	59.4 Å²	59.4	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-31.3	174.6	-80.7	-68.8	0	0	0	113.4	L31 M36 L40 R41 T42 L47 N48 Q59 R66 H67 C70	L31-Y44 HydrophobicContact CD1-CD1 4.34Å; L31-Y44 HydrophobicContact CD2-CD1 4.03Å; L31-Y44 HydrophobicContact CD2-CD2 4.21Å; L31-Y44 HydrophobicContact CD2-CE1 3.63Å; L31-Y44 HydrophobicContact CD2-CE2 3.8Å; L31-Y44 HydrophobicContact CD2-CG 4.32Å; M36-Y44 HydrophobicContact CE-CE2 4.19Å; M36-Y44 HydrophobicContact SD-CD2 3.85Å; M36-Y44 HydrophobicContact SD-CE2 3.78Å; L40-Y44 HydrophobicContact CD1-CD2 4.36Å; L40-Y44 HydrophobicContact CD1-CE2 3.92Å; L40-Y44 HydrophobicContact CG-CD2 4.29Å; L40-Y44 HydrophobicContact CG-CE2 4.01Å; L40-Y44 VanDerWaalsContact O-CD2 3.29Å; L40-Y44 WeakPolarHBondContact O-CD2 3.32Å; L40-Y44 PolarHBondContact O-N 3.08Å; R41-Y44 PolarHBondContact O-N 2.88Å; R41-Y44 VanDerWaalsContact O-N 3.14Å; T42-Y44 VanDerWaalsContact C-N 3.32Å; T42-Y44 PolarHBondContact O-N 3.33Å; Y44-L47 HydrophobicContact CD1-CD2 3.93Å; Y44-L47 HydrophobicContact CE1-CD2 4.11Å; Y44-L47 PolarHBondContact O-N 3.28Å; Y44-N48 PolarHBondContact O-N 3.12Å; Y44-N48 PolarHBondContact O-ND2 3.29Å; Y44-Q59 HydrophobicContact CD1-CG 4.01Å; Y44-Q59 HydrophobicContact CE1-CG 4.03Å; Y44-R66 WeakPolarHBondContact OH-CG 3.36Å; Y44-R66 PolarHBondContact OH-O 2.96Å; Y44-H67 AromaticContact CE2-CE1 3.85Å; Y44-H67 AromaticContact CE2-ND1 3.56Å; Y44-H67 AromaticContact CZ-ND1 3.64Å; Y44-H67 PolarHBondContact OH-CE1 2.75Å; Y44-H67 PolarHBondContact OH-ND1 3.45Å; Y44-C70 HydrophobicContact CE1-CB 3.93Å
45	V	95.6	Very high	90	Very high	73 Å²	73	50.9 Å²	50.9	44%	0.442	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-49.4	171.3	172.3	0	0	0	0	110.1	R41 T42 C43 L47 N48 Q49	R41-V45 PolarHBondContact O-N 2.66Å; T42-V45 WeakPolarHBondContact O-CA 3.32Å; T42-V45 WeakPolarHBondContact O-CB 3.39Å; T42-V45 PolarHBondContact O-N 3.37Å; C43-V45 VanDerWaalsContact C-N 3.31Å; C43-V45 PolarHBondContact O-N 3.09Å; V45-L47 VanDerWaalsContact C-N 3.3Å; V45-L47 PolarHBondContact O-N 3.14Å; V45-N48 PolarHBondContact O-N 3.25Å; V45-N48 VanDerWaalsContact O-N 3.14Å; V45-Q49 HydrophobicContact CG1-CG 4.46Å; V45-Q49 WeakPolarHBondContact O-CG 3.29Å; V45-Q49 PolarHBondContact O-N 2.88Å
46	Y	96.9	Very high	89.9	Confident	19 Å²	19	47.7 Å²	47.7	8%	0.075	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-39.4	176.4	-62	-25.8	0	0	0	112.4	T42 C43 N48 Q49 T50 Q120 D124 I128	T42-Y46 HydrophobicContact CG2-CD2 4.16Å; T42-Y46 HydrophobicContact CG2-CE1 4.09Å; T42-Y46 HydrophobicContact CG2-CE2 3.49Å; T42-Y46 VanDerWaalsContact CG2-CE2 3.49Å; T42-Y46 VanDerWaalsContact CG2-CZ 3.44Å; T42-Y46 PolarHBondContact O-N 2.85Å; C43-Y46 PolarHBondContact O-N 2.91Å; Y46-N48 PolarHBondContact O-N 3.4Å; Y46-Q49 PolarHBondContact O-N 3.05Å; Y46-T50 WeakPolarHBondContact O-CB 3.46Å; Y46-T50 WeakPolarHBondContact O-CG2 3.42Å; Y46-T50 PolarHBondContact O-N 2.83Å; Y46-T50 PolarHBondContact O-OG1 3.37Å; Y46-Q120 HydrophobicContact CD1-CG 4.01Å; Y46-Q120 HydrophobicContact CE1-CG 3.41Å; Y46-Q120 VanDerWaalsContact CE1-CG 3.41Å; Y46-Q120 PolarHBondContact OH-NE2 3.22Å; Y46-D124 HydrophobicContact CE2-CB 4.11Å; Y46-D124 VanDerWaalsContact CE2-OD2 3.29Å; Y46-D124 WeakPolarHBondContact CE2-OD2 3.4Å; Y46-D124 VanDerWaalsContact CZ-OD2 3.28Å; Y46-D124 WeakPolarHBondContact OH-CB 3.48Å; Y46-D124 PolarHBondContact OH-OD2 3.48Å; Y46-I128 HydrophobicContact CD2-CD1 4.3Å; Y46-I128 HydrophobicContact CD2-CG1 4.33Å
47	L	93.9	Very high	89.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-46.6	175	177.6	66.8	0	0	0	111.3	C43 Y44 V45 Q49 S51 A55 I58 Q59 C70 Y73	C43-L47 WeakPolarHBondContact O-CB 3.34Å; C43-L47 PolarHBondContact O-N 2.81Å; Y44-L47 HydrophobicContact CD1-CD2 3.93Å; Y44-L47 HydrophobicContact CE1-CD2 4.11Å; Y44-L47 PolarHBondContact O-N 3.28Å; V45-L47 VanDerWaalsContact C-N 3.3Å; V45-L47 PolarHBondContact O-N 3.14Å; L47-Q49 VanDerWaalsContact C-N 3.34Å; L47-Q49 PolarHBondContact O-N 3.42Å; L47-S51 WeakPolarHBondContact O-CB 3.4Å; L47-S51 PolarHBondContact O-N 3.35Å; L47-A55 HydrophobicContact CD2-CB 4.33Å; L47-A55 HydrophobicContact CG-CB 3.93Å; L47-I58 HydrophobicContact CD1-CD1 3.63Å; L47-I58 HydrophobicContact CD2-CB 4.05Å; L47-I58 HydrophobicContact CD2-CD1 4.33Å; L47-I58 HydrophobicContact CD2-CG2 3.73Å; L47-Q59 HydrophobicContact CD2-CG 4.45Å; L47-C70 HydrophobicContact CD2-CB 4.34Å; L47-Y73 HydrophobicContact CD1-CD1 3.4Å; L47-Y73 HydrophobicContact CD1-CE1 3.84Å; L47-Y73 HydrophobicContact CD1-CG 3.89Å
48	N	89.8	Confident	89.3	Confident	67 Å²	67	44.8 Å²	44.8	36%	0.358	23%	0.228	S	C	.	.	H	α-helix	trans	-65.8	-36.8	179.5	-77.1	-67.6	0	0	0	112.4	Y44 V45 Y46 A55 Q59	Y44-N48 PolarHBondContact O-N 3.12Å; Y44-N48 PolarHBondContact O-ND2 3.29Å; V45-N48 PolarHBondContact O-N 3.25Å; V45-N48 VanDerWaalsContact O-N 3.14Å; Y46-N48 PolarHBondContact O-N 3.4Å; N48-A55 WeakPolarHBondContact OD1-CB 3.37Å; N48-Q59 PolarHBondContact ND2-NE2 2.95Å; N48-Q59 PolarHBondContact OD1-NE2 3.48Å
49	Q	90.9	Very high	89.1	Confident	115 Å²	115	39.7 Å²	39.7	54%	0.537	20%	0.2	S	C	.	.	H	α-helix	trans	-67	-43.3	178.9	-72.1	172.2	-9.9	0	0	112.2	V45 Y46 L47	V45-Q49 HydrophobicContact CG1-CG 4.46Å; V45-Q49 WeakPolarHBondContact O-CG 3.29Å; V45-Q49 PolarHBondContact O-N 2.88Å; Y46-Q49 PolarHBondContact O-N 3.05Å; L47-Q49 VanDerWaalsContact C-N 3.34Å; L47-Q49 PolarHBondContact O-N 3.42Å
50	T	86.6	Confident	88.8	Confident	18 Å²	18	38.7 Å²	38.7	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-91.8	-31.6	-171.6	56.9	0	0	0	0	113.4	Y46 Y73 R77 D118 V121	Y46-T50 WeakPolarHBondContact O-CB 3.46Å; Y46-T50 WeakPolarHBondContact O-CG2 3.42Å; Y46-T50 PolarHBondContact O-N 2.83Å; Y46-T50 PolarHBondContact O-OG1 3.37Å; T50-Y73 PolarHBondContact O-OH 3.28Å; T50-Y73 WeakPolarHBondContact OG1-CE1 3.35Å; T50-R77 HydrophobicContact CG2-CG 4.16Å; T50-D118 HydrophobicContact CG2-CB 4.18Å; T50-V121 HydrophobicContact CG2-CG1 4.2Å
51	S	75.9	Confident	88.6	Confident	11 Å²	11	38 Å²	38	8%	0.077	19%	0.19	C	C	.	.	H	α-helix	trans	-101	-16	-169.3	-159.3	0	0	0	0	114.3	L47 S53 F54 A55 Y73	L47-S51 WeakPolarHBondContact O-CB 3.4Å; L47-S51 PolarHBondContact O-N 3.35Å; S51-S53 PolarHBondContact O-N 2.81Å; S51-F54 PolarHBondContact O-N 3.4Å; S51-F54 VanDerWaalsContact OG-CB 3.31Å; S51-F54 WeakPolarHBondContact OG-CB 3.36Å; S51-A55 PolarHBondContact OG-N 2.82Å; S51-Y73 WeakPolarHBondContact CA-OH 3.47Å; S51-Y73 WeakPolarHBondContact CB-OH 3.42Å; S51-Y73 PolarHBondContact OG-OH 2.92Å
52	R	75.8	Confident	88.5	Confident	191 Å²	191	36.2 Å²	36.2	72%	0.721	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	-109.4	-179.3	-66.9	-178	-95	-178.6	-8.7	112.4	F54 A55	R52-F54 VanDerWaalsContact C-N 3.28Å; R52-F54 PolarHBondContact O-N 3.47Å; R52-A55 WeakPolarHBondContact O-CB 3.31Å; R52-A55 PolarHBondContact O-N 3.02Å
53	S	70.1	Confident	88.2	Confident	75 Å²	75	36.5 Å²	36.5	52%	0.524	20%	0.199	S	C	.	.	H	α-helix	trans	-67.1	-26.9	-176.8	46.5	0	0	0	0	113.6	S51 A55	S51-S53 PolarHBondContact O-N 2.81Å; S53-A55 VanDerWaalsContact C-N 3.34Å
54	F	78.1	Confident	88	Confident	58 Å²	58	42.7 Å²	42.7	25%	0.254	23%	0.228	S	C	.	.	H	α-helix	trans	-78.4	-22	-178.5	-167.6	-112.6	0	0	0	112.1	S51 R52 A56 V57 I58 Y73 F288 P292	S51-F54 PolarHBondContact O-N 3.4Å; S51-F54 VanDerWaalsContact OG-CB 3.31Å; S51-F54 WeakPolarHBondContact OG-CB 3.36Å; R52-F54 VanDerWaalsContact C-N 3.28Å; R52-F54 PolarHBondContact O-N 3.47Å; F54-A56 VanDerWaalsContact C-N 3.32Å; F54-A56 PolarHBondContact O-N 3.41Å; F54-V57 PolarHBondContact O-N 3.09Å; F54-V57 VanDerWaalsContact O-N 3.16Å; F54-I58 HydrophobicContact CD1-CD1 3.64Å; F54-I58 HydrophobicContact CD1-CG1 4.23Å; F54-I58 HydrophobicContact CE1-CD1 3.76Å; F54-I58 HydrophobicContact CE1-CG1 4.16Å; F54-I58 PolarHBondContact O-N 3.28Å; F54-Y73 HydrophobicContact CD1-CD2 4.33Å; F54-Y73 HydrophobicContact CD1-CE2 4.24Å; F54-Y73 HydrophobicContact CE1-CD2 4.39Å; F54-F288 AromaticContact CE1-CE2 3.87Å; F54-F288 HydrophobicContact CE1-CE2 3.87Å; F54-F288 HydrophobicContact CE1-CZ 4.1Å; F54-F288 HydrophobicContact CE2-CD2 4.37Å; F54-F288 AromaticContact CE2-CE2 3.87Å; F54-F288 HydrophobicContact CE2-CE2 3.87Å; F54-F288 HydrophobicContact CE2-CZ 4.31Å; F54-F288 HydrophobicContact CZ-CD2 4.23Å; F54-F288 HydrophobicContact CZ-CE1 4.46Å; F54-F288 AromaticContact CZ-CE2 3.32Å; F54-F288 HydrophobicContact CZ-CE2 3.32Å; F54-F288 AromaticContact CZ-CZ 3.48Å; F54-F288 HydrophobicContact CZ-CZ 3.48Å; F54-F288 VanDerWaalsContact CZ-CZ 3.48Å; F54-P292 HydrophobicContact CD2-CG 4.1Å; F54-P292 HydrophobicContact CE2-CG 3.51Å; F54-P292 HydrophobicContact CZ-CG 4.49Å
55	A	83.9	Confident	88	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.7	-43.1	171.2	0	0	0	0	0	112.5	L47 N48 S51 R52 S53 V57 I58 Q59	L47-A55 HydrophobicContact CD2-CB 4.33Å; L47-A55 HydrophobicContact CG-CB 3.93Å; N48-A55 WeakPolarHBondContact OD1-CB 3.37Å; S51-A55 PolarHBondContact OG-N 2.82Å; R52-A55 WeakPolarHBondContact O-CB 3.31Å; R52-A55 PolarHBondContact O-N 3.02Å; S53-A55 VanDerWaalsContact C-N 3.34Å; A55-V57 VanDerWaalsContact C-N 3.29Å; A55-V57 PolarHBondContact O-N 3.22Å; A55-I58 PolarHBondContact O-N 3.04Å; A55-Q59 WeakPolarHBondContact O-CB 3.49Å; A55-Q59 WeakPolarHBondContact O-CG 3.43Å; A55-Q59 PolarHBondContact O-N 3.36Å; A55-Q59 PolarHBondContact O-NE2 3.31Å
56	A	83.6	Confident	88.1	Confident	23 Å²	23	40.2 Å²	40.2	19%	0.19	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-36.8	179.5	0	0	0	0	0	112.2	V27 F54 Q59 A60	V27-A56 HydrophobicContact CB-CB 4.35Å; F54-A56 VanDerWaalsContact C-N 3.32Å; F54-A56 PolarHBondContact O-N 3.41Å; A56-Q59 PolarHBondContact O-N 2.91Å; A56-A60 PolarHBondContact O-N 3.46Å
57	V	85.7	Confident	88.1	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.024	22%	0.216	C	C	.	.	H	α-helix	trans	-71.6	-41.1	179.4	-164.9	0	0	0	0	110.7	V27 F54 A55 A60 F288 I291 M325	V27-V57 HydrophobicContact CG1-CG2 3.99Å; F54-V57 PolarHBondContact O-N 3.09Å; F54-V57 VanDerWaalsContact O-N 3.16Å; A55-V57 VanDerWaalsContact C-N 3.29Å; A55-V57 PolarHBondContact O-N 3.22Å; V57-A60 PolarHBondContact O-N 3.21Å; V57-F288 VanDerWaalsContact CG1-CA 3.46Å; V57-F288 HydrophobicContact CG1-CB 4.04Å; V57-F288 HydrophobicContact CG1-CD2 4Å; V57-F288 HydrophobicContact CG1-CG 4.46Å; V57-I291 HydrophobicContact CG1-CD1 4.23Å; V57-I291 HydrophobicContact CG2-CD1 4.36Å; V57-I291 HydrophobicContact CG2-CG2 4.44Å; V57-M325 HydrophobicContact CG2-CE 4.35Å
58	I	89.2	Confident	88.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-49.2	172.8	-69.5	165.5	0	0	0	110	L47 F54 A55 A60 L61 R66 V69 C70 Y73 F288	L47-I58 HydrophobicContact CD1-CD1 3.63Å; L47-I58 HydrophobicContact CD2-CB 4.05Å; L47-I58 HydrophobicContact CD2-CD1 4.33Å; L47-I58 HydrophobicContact CD2-CG2 3.73Å; F54-I58 HydrophobicContact CD1-CD1 3.64Å; F54-I58 HydrophobicContact CD1-CG1 4.23Å; F54-I58 HydrophobicContact CE1-CD1 3.76Å; F54-I58 HydrophobicContact CE1-CG1 4.16Å; F54-I58 PolarHBondContact O-N 3.28Å; A55-I58 PolarHBondContact O-N 3.04Å; I58-A60 PolarHBondContact O-N 3.01Å; I58-L61 VanDerWaalsContact O-CB 3.3Å; I58-L61 WeakPolarHBondContact O-CB 3.33Å; I58-L61 WeakPolarHBondContact O-CG 3.24Å; I58-L61 PolarHBondContact O-N 3.46Å; I58-R66 WeakPolarHBondContact O-CG 3.47Å; I58-V69 HydrophobicContact CD1-CG1 4.43Å; I58-V69 HydrophobicContact CG1-CG1 4.01Å; I58-V69 HydrophobicContact CG2-CG1 4.15Å; I58-C70 HydrophobicContact CG2-CB 4.28Å; I58-Y73 HydrophobicContact CD1-CD2 4.27Å; I58-Y73 HydrophobicContact CD1-CG 4.25Å; I58-F288 HydrophobicContact CD1-CE2 4.48Å; I58-F288 HydrophobicContact CG1-CD2 4.2Å; I58-F288 HydrophobicContact CG1-CE2 3.57Å
59	Q	92.1	Very high	88.7	Confident	9 Å²	9	38 Å²	38	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-16.3	-177.3	-69.8	168.8	34.8	0	0	114.3	P29 K30 L31 Y44 L47 N48 A55 A56 R66	P29-Q59 HydrophobicContact CB-CB 4.03Å; P29-Q59 HydrophobicContact CG-CB 4.48Å; K30-Q59 PolarHBondContact N-O 3.49Å; L31-Q59 HydrophobicContact CD1-CB 4.28Å; L31-Q59 HydrophobicContact CD1-CG 3.82Å; L31-Q59 HydrophobicContact CD2-CG 4.32Å; L31-Q59 HydrophobicContact CG-CB 4.28Å; L31-Q59 HydrophobicContact CG-CG 4.23Å; Y44-Q59 HydrophobicContact CD1-CG 4.01Å; Y44-Q59 HydrophobicContact CE1-CG 4.03Å; L47-Q59 HydrophobicContact CD2-CG 4.45Å; N48-Q59 PolarHBondContact ND2-NE2 2.95Å; N48-Q59 PolarHBondContact OD1-NE2 3.48Å; A55-Q59 WeakPolarHBondContact O-CB 3.49Å; A55-Q59 WeakPolarHBondContact O-CG 3.43Å; A55-Q59 PolarHBondContact O-N 3.36Å; A55-Q59 PolarHBondContact O-NE2 3.31Å; A56-Q59 PolarHBondContact O-N 2.91Å; Q59-R66 WeakPolarHBondContact O-CD 3.18Å
60	A	91.1	Very high	89	Confident	5 Å²	5	32.6 Å²	32.6	4%	0.041	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-7.2	177.5	0	0	0	0	0	114	M28 K30 A56 V57 I58 S284	M28-A60 WeakPolarHBondContact O-CA 3.16Å; M28-A60 WeakPolarHBondContact O-CB 3.34Å; K30-A60 WeakPolarHBondContact CD-O 3.5Å; K30-A60 WeakPolarHBondContact CE-O 3.4Å; K30-A60 PolarHBondContact NZ-O 2.75Å; A56-A60 PolarHBondContact O-N 3.46Å; V57-A60 PolarHBondContact O-N 3.21Å; I58-A60 PolarHBondContact O-N 3.01Å; A60-S284 WeakPolarHBondContact O-CB 3.41Å
61	L	93.9	Very high	89.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.			trans	-61	145.4	175.9	-72	169.8	0	0	0	111.7	I58 L65 R66 V69 V285 F288	I58-L61 VanDerWaalsContact O-CB 3.3Å; I58-L61 WeakPolarHBondContact O-CB 3.33Å; I58-L61 WeakPolarHBondContact O-CG 3.24Å; I58-L61 PolarHBondContact O-N 3.46Å; L61-L65 HydrophobicContact CD1-CG 4.46Å; L61-L65 HydrophobicContact CD2-CD2 4.09Å; L61-R66 HydrophobicContact CB-CB 3.83Å; L61-R66 HydrophobicContact CB-CG 4.29Å; L61-R66 PolarHBondContact O-NH1 3.3Å; L61-V69 HydrophobicContact CD1-CB 3.78Å; L61-V69 HydrophobicContact CD1-CG1 3.88Å; L61-V69 HydrophobicContact CD1-CG2 3.8Å; L61-V285 HydrophobicContact CD2-CG2 4.41Å; L61-F288 HydrophobicContact CD1-CD2 4.09Å; L61-F288 HydrophobicContact CD1-CE2 4.43Å; L61-F288 HydrophobicContact CD1-CG 4.36Å; L61-F288 HydrophobicContact CD2-CB 3.77Å; L61-F288 HydrophobicContact CD2-CD2 4.48Å; L61-F288 HydrophobicContact CD2-CG 4.08Å; L61-F288 HydrophobicContact CG-CB 4.46Å; L61-F288 HydrophobicContact CG-CD2 4.4Å; L61-F288 HydrophobicContact CG-CG 4.49Å
62	D	93.9	Very high	90.7	Very high	45 Å²	45	31.3 Å²	31.3	24%	0.241	17%	0.166	C	C	.	.			trans	-75.8	144.2	-179.7	-72.2	-35	0	0	0	112.6	K30 L65 L192 N282 S284	K30-D62 IonicContact NZ-OD1 3.84Å; K30-D62 PolarHBondContact NZ-OD1 3.14Å; D62-L65 WeakPolarHBondContact O-CB 3.33Å; D62-L192 HydrophobicContact CB-CD1 4.02Å; D62-L192 HydrophobicContact CB-CD2 4.46Å; D62-N282 PolarHBondContact OD2-ND2 3.05Å; D62-N282 PolarHBondContact OD2-OD1 3.37Å; D62-S284 PolarHBondContact N-OG 3.14Å; D62-S284 VanDerWaalsContact N-OG 3.09Å; D62-S284 PolarHBondContact OD2-OG 3.46Å
63	G	92.5	Very high	91.8	Very high	53 Å²	53	23.9 Å²	23.9	55%	0.546	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	-146.4	169.6	0	0	0	0	0	114.7	L65	G63-L65 VanDerWaalsContact C-N 3.26Å; G63-L65 PolarHBondContact O-N 2.86Å
64	E	93.3	Very high	93.1	Very high	130 Å²	130	20.3 Å²	20.3	61%	0.607	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-20.9	-178.2	-62	-173.7	160.2	0	0	113.2	R66 H67 A68 Y139	E64-R66 PolarHBondContact O-N 3.35Å; E64-R66 VanDerWaalsContact O-N 3.12Å; E64-H67 PolarHBondContact O-N 3.31Å; E64-A68 PolarHBondContact O-N 3.41Å; E64-A68 VanDerWaalsContact O-N 3.16Å; E64-Y139 HydrophobicContact CB-CE2 4.46Å
65	L	96.3	Very high	94.1	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-54.5	-36.1	178	176.6	65.3	0	0	0	111.1	L61 D62 G63 H67 A68 V69 L186 F187 L192 V285	L61-L65 HydrophobicContact CD1-CG 4.46Å; L61-L65 HydrophobicContact CD2-CD2 4.09Å; D62-L65 WeakPolarHBondContact O-CB 3.33Å; G63-L65 VanDerWaalsContact C-N 3.26Å; G63-L65 PolarHBondContact O-N 2.86Å; L65-H67 VanDerWaalsContact C-N 3.31Å; L65-H67 PolarHBondContact O-N 3.1Å; L65-A68 PolarHBondContact O-N 3.02Å; L65-V69 HydrophobicContact CD1-CG2 3.77Å; L65-V69 HydrophobicContact CG-CG2 4.06Å; L65-V69 WeakPolarHBondContact O-CB 3.12Å; L65-V69 WeakPolarHBondContact O-CG2 3.43Å; L65-V69 PolarHBondContact O-N 3.25Å; L65-L186 HydrophobicContact CD1-CB 3.92Å; L65-F187 HydrophobicContact CD1-CD1 3.87Å; L65-F187 HydrophobicContact CD1-CE1 4.36Å; L65-F187 HydrophobicContact CD2-CD1 3.61Å; L65-F187 HydrophobicContact CD2-CE1 4.07Å; L65-F187 HydrophobicContact CG-CD1 4.32Å; L65-L192 HydrophobicContact CB-CD1 4.02Å; L65-L192 HydrophobicContact CD2-CD1 3.68Å; L65-L192 HydrophobicContact CG-CD1 4.49Å; L65-V285 HydrophobicContact CD2-CG2 3.73Å
66	R	96.2	Very high	94.7	Very high	21 Å²	21	18 Å²	18	8%	0.079	10%	0.103	C	C	.	.	H	α-helix	trans	-58.7	-40.4	177.1	-175.9	-179.4	55	-124	6.7	113.1	K30 Y44 I58 Q59 L61 E64 C70	K30-R66 PolarHBondContact O-NH1 3.33Å; K30-R66 PolarHBondContact O-NH2 2.94Å; Y44-R66 WeakPolarHBondContact OH-CG 3.36Å; Y44-R66 PolarHBondContact OH-O 2.96Å; I58-R66 WeakPolarHBondContact O-CG 3.47Å; Q59-R66 WeakPolarHBondContact O-CD 3.18Å; L61-R66 HydrophobicContact CB-CB 3.83Å; L61-R66 HydrophobicContact CB-CG 4.29Å; L61-R66 PolarHBondContact O-NH1 3.3Å; E64-R66 PolarHBondContact O-N 3.35Å; E64-R66 VanDerWaalsContact O-N 3.12Å; R66-C70 VanDerWaalsContact O-CB 3.28Å; R66-C70 WeakPolarHBondContact O-CB 3.38Å; R66-C70 PolarHBondContact O-N 3.5Å
67	H	96.8	Very high	95.4	Very high	38 Å²	38	19.5 Å²	19.5	18%	0.176	10%	0.104	C	C	.	.	H	α-helix	trans	-71.6	-46.1	178.4	-61.1	-52.1	0	0	0	109.9	Y44 E64 L65 V69 C70 I71 L135	Y44-H67 AromaticContact CE2-CE1 3.85Å; Y44-H67 AromaticContact CE2-ND1 3.56Å; Y44-H67 AromaticContact CZ-ND1 3.64Å; Y44-H67 PolarHBondContact OH-CE1 2.75Å; Y44-H67 PolarHBondContact OH-ND1 3.45Å; E64-H67 PolarHBondContact O-N 3.31Å; L65-H67 VanDerWaalsContact C-N 3.31Å; L65-H67 PolarHBondContact O-N 3.1Å; H67-V69 VanDerWaalsContact C-N 3.35Å; H67-V69 PolarHBondContact O-N 3.11Å; H67-C70 WeakPolarHBondContact O-CB 3.49Å; H67-C70 PolarHBondContact O-N 2.94Å; H67-I71 WeakPolarHBondContact O-CG1 3.29Å; H67-I71 PolarHBondContact O-N 3.5Å; H67-L135 HydrophobicContact CB-CD2 4.35Å
68	A	98.3	Very high	96	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56.6	-46.1	176.3	0	0	0	0	0	112.4	E64 L65 I71 F72 L135 Y139	E64-A68 PolarHBondContact O-N 3.41Å; E64-A68 VanDerWaalsContact O-N 3.16Å; L65-A68 PolarHBondContact O-N 3.02Å; A68-I71 PolarHBondContact O-N 2.96Å; A68-F72 VanDerWaalsContact O-CB 3.25Å; A68-F72 WeakPolarHBondContact O-CB 3.39Å; A68-F72 PolarHBondContact O-N 3.02Å; A68-L135 HydrophobicContact CB-CD1 4.44Å; A68-L135 HydrophobicContact CB-CD2 4.4Å; A68-Y139 HydrophobicContact CB-CD1 4.12Å; A68-Y139 HydrophobicContact CB-CD2 3.87Å; A68-Y139 HydrophobicContact CB-CE1 4.5Å; A68-Y139 HydrophobicContact CB-CE2 4.3Å; A68-Y139 HydrophobicContact CB-CG 3.78Å
69	V	98.3	Very high	96.5	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.012	10%	0.103	C	C	.	.	H	α-helix	trans	-70	-36.1	178.6	175	0	0	0	0	112.2	I58 L61 L65 H67 F72 Y73 L183 L186 F187 F288	I58-V69 HydrophobicContact CD1-CG1 4.43Å; I58-V69 HydrophobicContact CG1-CG1 4.01Å; I58-V69 HydrophobicContact CG2-CG1 4.15Å; L61-V69 HydrophobicContact CD1-CB 3.78Å; L61-V69 HydrophobicContact CD1-CG1 3.88Å; L61-V69 HydrophobicContact CD1-CG2 3.8Å; L65-V69 HydrophobicContact CD1-CG2 3.77Å; L65-V69 HydrophobicContact CG-CG2 4.06Å; L65-V69 WeakPolarHBondContact O-CB 3.12Å; L65-V69 WeakPolarHBondContact O-CG2 3.43Å; L65-V69 PolarHBondContact O-N 3.25Å; H67-V69 VanDerWaalsContact C-N 3.35Å; H67-V69 PolarHBondContact O-N 3.11Å; V69-F72 PolarHBondContact O-N 3.28Å; V69-Y73 WeakPolarHBondContact O-CB 3.5Å; V69-Y73 PolarHBondContact O-N 3.22Å; V69-L183 HydrophobicContact CG1-CD2 3.92Å; V69-L183 HydrophobicContact CG2-CD2 3.95Å; V69-L186 HydrophobicContact CG2-CD1 4.24Å; V69-F187 HydrophobicContact CG2-CE1 4.47Å; V69-F288 HydrophobicContact CG1-CE2 4.03Å; V69-F288 HydrophobicContact CG1-CZ 3.92Å
70	C	97.9	Very high	96.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.5	-50.3	173.4	179.3	0	0	0	0	111.1	Y44 L47 I58 R66 H67 Y73 L74	Y44-C70 HydrophobicContact CE1-CB 3.93Å; L47-C70 HydrophobicContact CD2-CB 4.34Å; I58-C70 HydrophobicContact CG2-CB 4.28Å; R66-C70 VanDerWaalsContact O-CB 3.28Å; R66-C70 WeakPolarHBondContact O-CB 3.38Å; R66-C70 PolarHBondContact O-N 3.5Å; H67-C70 WeakPolarHBondContact O-CB 3.49Å; H67-C70 PolarHBondContact O-N 2.94Å; C70-Y73 PolarHBondContact O-N 3.11Å; C70-L74 WeakPolarHBondContact O-CG 3.32Å; C70-L74 PolarHBondContact O-N 2.89Å; C70-L74 VanDerWaalsContact O-N 3.08Å
71	I	98.8	Very high	96.9	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-67.8	-41.8	179.8	-61.5	-52.6	0	0	0	111.1	C43 H67 A68 Y73 L74 V75 E131 F132 L135	C43-I71 HydrophobicContact CB-CD1 3.95Å; H67-I71 WeakPolarHBondContact O-CG1 3.29Å; H67-I71 PolarHBondContact O-N 3.5Å; A68-I71 PolarHBondContact O-N 2.96Å; I71-Y73 VanDerWaalsContact C-N 3.3Å; I71-Y73 PolarHBondContact O-N 3.45Å; I71-L74 PolarHBondContact O-N 3.46Å; I71-L74 VanDerWaalsContact O-N 3.15Å; I71-V75 HydrophobicContact CG2-CG2 4.22Å; I71-V75 WeakPolarHBondContact O-CG2 3.37Å; I71-V75 PolarHBondContact O-N 3.34Å; I71-E131 HydrophobicContact CD1-CB 3.52Å; I71-E131 HydrophobicContact CD1-CG 4.48Å; I71-E131 HydrophobicContact CG1-CB 4.12Å; I71-F132 HydrophobicContact CG2-CB 3.67Å; I71-F132 HydrophobicContact CG2-CD2 4.49Å; I71-L135 HydrophobicContact CB-CD1 4.1Å; I71-L135 HydrophobicContact CG1-CD1 4.44Å; I71-L135 HydrophobicContact CG2-CD1 4.16Å
72	F	98.7	Very high	97	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.009	11%	0.108	C	C	.	.	H	α-helix	trans	-56	-46.9	175	-175.2	-143.3	0	0	0	111.4	A68 V69 L74 V75 L76 I143 I146 V179 L183 L186	A68-F72 VanDerWaalsContact O-CB 3.25Å; A68-F72 WeakPolarHBondContact O-CB 3.39Å; A68-F72 PolarHBondContact O-N 3.02Å; V69-F72 PolarHBondContact O-N 3.28Å; F72-L74 PolarHBondContact O-N 3.11Å; F72-V75 PolarHBondContact O-N 2.86Å; F72-L76 HydrophobicContact CD2-CD1 4.04Å; F72-L76 HydrophobicContact CD2-CG 4Å; F72-L76 HydrophobicContact CE1-CD1 4.14Å; F72-L76 HydrophobicContact CE2-CD1 3.54Å; F72-L76 HydrophobicContact CE2-CD2 4.02Å; F72-L76 HydrophobicContact CE2-CG 3.78Å; F72-L76 HydrophobicContact CZ-CD1 3.6Å; F72-L76 HydrophobicContact CZ-CG 4.36Å; F72-L76 WeakPolarHBondContact O-CG 3.4Å; F72-L76 PolarHBondContact O-N 3.41Å; F72-I143 HydrophobicContact CB-CD1 3.94Å; F72-I143 HydrophobicContact CB-CG1 3.85Å; F72-I143 HydrophobicContact CD2-CB 4.15Å; F72-I143 HydrophobicContact CD2-CG1 3.7Å; F72-I143 HydrophobicContact CD2-CG2 4.03Å; F72-I143 HydrophobicContact CG-CG1 3.97Å; F72-I146 HydrophobicContact CE2-CB 4.04Å; F72-I146 HydrophobicContact CE2-CG2 3.83Å; F72-I146 HydrophobicContact CZ-CB 4.12Å; F72-I146 HydrophobicContact CZ-CG1 4.42Å; F72-I146 HydrophobicContact CZ-CG2 3.7Å; F72-V179 HydrophobicContact CE1-CG1 4.22Å; F72-L183 HydrophobicContact CD1-CD2 4.05Å; F72-L183 HydrophobicContact CD1-CG 4.27Å; F72-L183 HydrophobicContact CE1-CD2 4.31Å; F72-L183 HydrophobicContact CE1-CG 4.02Å; F72-L186 HydrophobicContact CB-CD1 4.12Å; F72-L186 HydrophobicContact CD1-CD1 3.74Å; F72-L186 HydrophobicContact CE1-CD1 4.43Å; F72-L186 HydrophobicContact CG-CD1 4.1Å
73	Y	98.3	Very high	97	Very high	35 Å²	35	19.2 Å²	19.2	14%	0.137	10%	0.101	C	C	.	.	H	α-helix	trans	-59.4	-44.4	176.3	177	-85.2	0	0	0	112.5	L47 T50 S51 F54 I58 V69 C70 I71 L76 R77	L47-Y73 HydrophobicContact CD1-CD1 3.4Å; L47-Y73 HydrophobicContact CD1-CE1 3.84Å; L47-Y73 HydrophobicContact CD1-CG 3.89Å; T50-Y73 PolarHBondContact O-OH 3.28Å; T50-Y73 WeakPolarHBondContact OG1-CE1 3.35Å; S51-Y73 WeakPolarHBondContact CA-OH 3.47Å; S51-Y73 WeakPolarHBondContact CB-OH 3.42Å; S51-Y73 PolarHBondContact OG-OH 2.92Å; F54-Y73 HydrophobicContact CD1-CD2 4.33Å; F54-Y73 HydrophobicContact CD1-CE2 4.24Å; F54-Y73 HydrophobicContact CE1-CD2 4.39Å; I58-Y73 HydrophobicContact CD1-CD2 4.27Å; I58-Y73 HydrophobicContact CD1-CG 4.25Å; V69-Y73 WeakPolarHBondContact O-CB 3.5Å; V69-Y73 PolarHBondContact O-N 3.22Å; C70-Y73 PolarHBondContact O-N 3.11Å; I71-Y73 VanDerWaalsContact C-N 3.3Å; I71-Y73 PolarHBondContact O-N 3.45Å; Y73-L76 PolarHBondContact O-N 3.18Å; Y73-R77 HydrophobicContact CE1-CB 4.26Å; Y73-R77 WeakPolarHBondContact O-CB 3.49Å; Y73-R77 PolarHBondContact O-N 3.14Å; Y73-R77 PolarHBondContact OH-NE 2.9Å; Y73-R77 PolarHBondContact OH-NH2 3.42Å
74	L	98.6	Very high	97	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-69.5	-38.5	-178.3	-69	173.1	0	0	0	112.7	C43 C70 I71 F72 L76 R77 A78 V121 I128	C43-L74 HydrophobicContact CB-CD1 3.62Å; C43-L74 WeakPolarHBondContact O-CD1 3.36Å; C70-L74 WeakPolarHBondContact O-CG 3.32Å; C70-L74 PolarHBondContact O-N 2.89Å; C70-L74 VanDerWaalsContact O-N 3.08Å; I71-L74 PolarHBondContact O-N 3.46Å; I71-L74 VanDerWaalsContact O-N 3.15Å; F72-L74 PolarHBondContact O-N 3.11Å; L74-L76 VanDerWaalsContact C-N 3.34Å; L74-R77 PolarHBondContact O-N 2.75Å; L74-A78 WeakPolarHBondContact O-CB 3.36Å; L74-A78 PolarHBondContact O-N 2.86Å; L74-V121 HydrophobicContact CD2-CG1 4.23Å; L74-I128 HydrophobicContact CB-CD1 4.12Å; L74-I128 HydrophobicContact CB-CG1 4.34Å; L74-I128 HydrophobicContact CB-CG2 3.92Å; L74-I128 HydrophobicContact CD1-CG1 4.27Å
75	V	98.8	Very high	97	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-59.2	-47.6	173.1	167.1	0	0	0	0	110.3	I71 F72 A78 L79 F100 L104 I128 I143 C147	I71-V75 HydrophobicContact CG2-CG2 4.22Å; I71-V75 WeakPolarHBondContact O-CG2 3.37Å; I71-V75 PolarHBondContact O-N 3.34Å; F72-V75 PolarHBondContact O-N 2.86Å; V75-A78 PolarHBondContact O-N 3.26Å; V75-L79 PolarHBondContact O-N 2.88Å; V75-F100 HydrophobicContact CG1-CE1 4.5Å; V75-L104 HydrophobicContact CB-CD2 4.3Å; V75-L104 HydrophobicContact CG1-CD1 4.46Å; V75-L104 HydrophobicContact CG1-CD2 3.78Å; V75-L104 HydrophobicContact CG2-CD2 3.49Å; V75-L104 VanDerWaalsContact CG2-CD2 3.49Å; V75-I128 HydrophobicContact CG2-CG2 4.06Å; V75-I143 HydrophobicContact CB-CG2 4.4Å; V75-I143 HydrophobicContact CG1-CG2 4.22Å; V75-I143 HydrophobicContact CG2-CG2 4.33Å; V75-C147 HydrophobicContact CG1-CB 4.27Å
76	L	97.6	Very high	96.7	Very high	10 Å²	10	18.7 Å²	18.7	5%	0.052	9%	0.088	C	C	.	.	H	α-helix	trans	-69.1	-36.2	178.4	-64	-172.1	0	0	0	112.5	F72 Y73 L74 A78 L79 D80 M150 V179	F72-L76 HydrophobicContact CD2-CD1 4.04Å; F72-L76 HydrophobicContact CD2-CG 4Å; F72-L76 HydrophobicContact CE1-CD1 4.14Å; F72-L76 HydrophobicContact CE2-CD1 3.54Å; F72-L76 HydrophobicContact CE2-CD2 4.02Å; F72-L76 HydrophobicContact CE2-CG 3.78Å; F72-L76 HydrophobicContact CZ-CD1 3.6Å; F72-L76 HydrophobicContact CZ-CG 4.36Å; F72-L76 WeakPolarHBondContact O-CG 3.4Å; F72-L76 PolarHBondContact O-N 3.41Å; Y73-L76 PolarHBondContact O-N 3.18Å; L74-L76 VanDerWaalsContact C-N 3.34Å; L76-A78 VanDerWaalsContact C-N 3.29Å; L76-A78 PolarHBondContact O-N 3.17Å; L76-L79 HydrophobicContact CD2-CD2 4.42Å; L76-L79 WeakPolarHBondContact O-CB 3.27Å; L76-L79 PolarHBondContact O-N 2.62Å; L76-D80 WeakPolarHBondContact O-CB 3.48Å; L76-D80 PolarHBondContact O-N 3.47Å; L76-M150 HydrophobicContact CD1-CE 4.33Å; L76-M150 HydrophobicContact CD1-SD 3.87Å; L76-M150 HydrophobicContact CD2-CE 4.09Å; L76-M150 HydrophobicContact CD2-SD 3.42Å; L76-M150 WeakPolarHBondContact CD2-SD 3.33Å; L76-M150 HydrophobicContact CG-SD 4.25Å; L76-V179 HydrophobicContact CD1-CB 4.28Å; L76-V179 HydrophobicContact CD1-CG1 3.91Å; L76-V179 HydrophobicContact CD1-CG2 3.61Å
77	R	98	Very high	96.6	Very high	53 Å²	53	21.6 Å²	21.6	20%	0.2	11%	0.108	C	C	.	.	H	α-helix	trans	-61.2	-40.2	173.3	-179.7	55.2	57.8	-157	-5.9	111.4	T50 Y73 L74 D80 T81 V121	T50-R77 HydrophobicContact CG2-CG 4.16Å; Y73-R77 HydrophobicContact CE1-CB 4.26Å; Y73-R77 WeakPolarHBondContact O-CB 3.49Å; Y73-R77 PolarHBondContact O-N 3.14Å; Y73-R77 PolarHBondContact OH-NE 2.9Å; Y73-R77 PolarHBondContact OH-NH2 3.42Å; L74-R77 PolarHBondContact O-N 2.75Å; R77-D80 IonicContact NH1-OD2 2.62Å; R77-T81 WeakPolarHBondContact O-CB 3.15Å; R77-T81 PolarHBondContact O-N 2.78Å; R77-T81 PolarHBondContact O-OG1 3.38Å; R77-V121 HydrophobicContact CG-CG1 4.48Å; R77-V121 HydrophobicContact CG-CG2 4.08Å
78	A	98.3	Very high	96.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67	-41.8	176.3	0	0	0	0	0	111.3	L74 V75 L76 T81 V82 F100 V121 L122 F125	L74-A78 WeakPolarHBondContact O-CB 3.36Å; L74-A78 PolarHBondContact O-N 2.86Å; V75-A78 PolarHBondContact O-N 3.26Å; L76-A78 VanDerWaalsContact C-N 3.29Å; L76-A78 PolarHBondContact O-N 3.17Å; A78-T81 WeakPolarHBondContact O-CB 3.3Å; A78-T81 PolarHBondContact O-N 3.41Å; A78-V82 PolarHBondContact O-N 3.34Å; A78-F100 HydrophobicContact CB-CE1 4.29Å; A78-F100 HydrophobicContact CB-CZ 3.65Å; A78-V121 HydrophobicContact CB-CB 4.29Å; A78-V121 HydrophobicContact CB-CG2 3.73Å; A78-L122 HydrophobicContact CB-CD2 3.91Å; A78-L122 HydrophobicContact CB-CG 4.4Å; A78-F125 HydrophobicContact CB-CD2 3.8Å; A78-F125 HydrophobicContact CB-CE2 3.74Å
79	L	98	Very high	96.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.7	-50.1	173.3	-177	68.1	0	0	0	112.1	V75 L76 T81 V82 E83 L97 F100 M150 M154	V75-L79 PolarHBondContact O-N 2.88Å; L76-L79 HydrophobicContact CD2-CD2 4.42Å; L76-L79 WeakPolarHBondContact O-CB 3.27Å; L76-L79 PolarHBondContact O-N 2.62Å; L79-T81 VanDerWaalsContact C-N 3.27Å; L79-T81 PolarHBondContact O-N 2.92Å; L79-V82 WeakPolarHBondContact O-CB 3.2Å; L79-V82 PolarHBondContact O-N 2.94Å; L79-V82 VanDerWaalsContact O-N 3.09Å; L79-E83 PolarHBondContact O-N 3.26Å; L79-E83 VanDerWaalsContact O-N 3.09Å; L79-L97 HydrophobicContact CD1-CD2 3.56Å; L79-L97 HydrophobicContact CG-CD2 4.36Å; L79-F100 HydrophobicContact CB-CD1 4.28Å; L79-F100 HydrophobicContact CB-CE1 4.26Å; L79-F100 HydrophobicContact CD1-CB 3.65Å; L79-F100 HydrophobicContact CD1-CD1 4.09Å; L79-F100 HydrophobicContact CD1-CD2 3.98Å; L79-F100 HydrophobicContact CD1-CG 3.63Å; L79-M150 HydrophobicContact CD2-CB 3.69Å; L79-M154 HydrophobicContact CD1-SD 4.33Å; L79-M154 HydrophobicContact CD2-CE 4.13Å; L79-M154 HydrophobicContact CD2-SD 3.75Å; L79-M154 HydrophobicContact CG-CE 4.26Å; L79-M154 HydrophobicContact CG-SD 3.69Å
80	D	96	Very high	96.1	Very high	33 Å²	33	27.2 Å²	27.2	18%	0.176	14%	0.142	C	C	.	.	H	α-helix	trans	-57.6	-40.3	175.7	-73.3	2.6	0	0	0	111.1	L76 R77 V82 E83 D84 M154	L76-D80 WeakPolarHBondContact O-CB 3.48Å; L76-D80 PolarHBondContact O-N 3.47Å; R77-D80 IonicContact NH1-OD2 2.62Å; D80-V82 PolarHBondContact O-N 3.44Å; D80-E83 WeakPolarHBondContact O-CB 3.19Å; D80-E83 PolarHBondContact O-N 3.45Å; D80-E83 VanDerWaalsContact O-N 3.07Å; D80-D84 WeakPolarHBondContact O-CB 3.43Å; D80-D84 PolarHBondContact O-N 3.09Å; D80-M154 VanDerWaalsContact OD1-CE 3.23Å; D80-M154 WeakPolarHBondContact OD1-CE 3.38Å
81	T	96.2	Very high	96	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-33.4	179.3	-55.5	0	0	0	0	111.3	R77 A78 L79 D85 E116 L122	R77-T81 WeakPolarHBondContact O-CB 3.15Å; R77-T81 PolarHBondContact O-N 2.78Å; R77-T81 PolarHBondContact O-OG1 3.38Å; A78-T81 WeakPolarHBondContact O-CB 3.3Å; A78-T81 PolarHBondContact O-N 3.41Å; L79-T81 VanDerWaalsContact C-N 3.27Å; L79-T81 PolarHBondContact O-N 2.92Å; T81-D85 WeakPolarHBondContact O-CB 3.38Å; T81-D85 PolarHBondContact O-N 3.11Å; T81-E116 HydrophobicContact CG2-CB 3.59Å; T81-E116 HydrophobicContact CG2-CG 4.13Å; T81-L122 HydrophobicContact CG2-CD1 3.5Å; T81-L122 HydrophobicContact CG2-CG 4.33Å
82	V	96.8	Very high	95.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-72	-40.5	172.4	174.9	0	0	0	0	111.5	A78 L79 D80 I88 K93 M96 L97 F100 L122	A78-V82 PolarHBondContact O-N 3.34Å; L79-V82 WeakPolarHBondContact O-CB 3.2Å; L79-V82 PolarHBondContact O-N 2.94Å; L79-V82 VanDerWaalsContact O-N 3.09Å; D80-V82 PolarHBondContact O-N 3.44Å; V82-I88 HydrophobicContact CG1-CD1 4.42Å; V82-K93 HydrophobicContact CG1-CG 4.07Å; V82-K93 WeakPolarHBondContact O-CD 3.44Å; V82-K93 WeakPolarHBondContact O-CE 3.2Å; V82-M96 HydrophobicContact CB-SD 4.24Å; V82-M96 HydrophobicContact CG1-CB 4.34Å; V82-M96 HydrophobicContact CG1-CG 4.11Å; V82-M96 HydrophobicContact CG1-SD 3.53Å; V82-M96 VanDerWaalsContact CG1-SD 3.53Å; V82-M96 HydrophobicContact CG2-SD 3.57Å; V82-M96 VanDerWaalsContact CG2-SD 3.57Å; V82-L97 HydrophobicContact CB-CD2 4.03Å; V82-L97 HydrophobicContact CG1-CD2 3.73Å; V82-L97 HydrophobicContact CG1-CG 4.11Å; V82-F100 HydrophobicContact CG2-CE2 4.05Å; V82-L122 HydrophobicContact CG2-CD1 3.85Å; V82-L122 HydrophobicContact CG2-CD2 3.74Å; V82-L122 HydrophobicContact CG2-CG 4.47Å
83	E	94.4	Very high	95.8	Very high	19 Å²	19	37.9 Å²	37.9	9%	0.089	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-52.2	178.4	-172.1	-166.5	-162.8	0	0	111.2	L79 D80 D85 K93 L97 M154	L79-E83 PolarHBondContact O-N 3.26Å; L79-E83 VanDerWaalsContact O-N 3.09Å; D80-E83 WeakPolarHBondContact O-CB 3.19Å; D80-E83 PolarHBondContact O-N 3.45Å; D80-E83 VanDerWaalsContact O-N 3.07Å; E83-D85 VanDerWaalsContact C-N 3.33Å; E83-D85 PolarHBondContact O-N 2.96Å; E83-K93 PolarHBondContact O-NZ 3.4Å; E83-L97 HydrophobicContact CB-CD2 4.42Å; E83-M154 HydrophobicContact CB-SD 4.26Å; E83-M154 HydrophobicContact CG-CB 4.22Å; E83-M154 HydrophobicContact CG-CG 4.27Å; E83-M154 HydrophobicContact CG-SD 4.47Å; E83-M154 WeakPolarHBondContact OE2-CE 3.27Å
84	D	92.1	Very high	95.8	Very high	42 Å²	42	37.4 Å²	37.4	23%	0.225	19%	0.191	C	C	.	.	H	α-helix	trans	-69.4	-25.8	-173.5	-84.5	-32.2	0	0	0	113.4	D80 M86 R228	D80-D84 WeakPolarHBondContact O-CB 3.43Å; D80-D84 PolarHBondContact O-N 3.09Å; D84-M86 PolarHBondContact O-N 3.04Å; D84-R228 IonicContact OD1-NH1 3.71Å; D84-R228 PolarHBondContact OD1-NH1 2.81Å; D84-R228 IonicContact OD2-NH1 3.33Å
85	D	92.9	Very high	95.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.			trans	-71.9	94.9	-174.7	-166.4	-32.6	0	0	0	112.2	T81 E83 T87 I88 K93 S114 H115 E116	T81-D85 WeakPolarHBondContact O-CB 3.38Å; T81-D85 PolarHBondContact O-N 3.11Å; E83-D85 VanDerWaalsContact C-N 3.33Å; E83-D85 PolarHBondContact O-N 2.96Å; D85-T87 PolarHBondContact O-N 3.17Å; D85-T87 WeakPolarHBondContact OD1-CA 3.4Å; D85-T87 VanDerWaalsContact OD1-CB 3.28Å; D85-T87 WeakPolarHBondContact OD1-CB 3.49Å; D85-T87 PolarHBondContact OD1-N 3.5Å; D85-T87 PolarHBondContact OD1-OG1 3.26Å; D85-I88 HydrophobicContact CB-CD1 3.7Å; D85-I88 HydrophobicContact CB-CG1 3.87Å; D85-I88 PolarHBondContact O-N 2.84Å; D85-K93 WeakPolarHBondContact O-CE 3.23Å; D85-K93 PolarHBondContact O-NZ 3.16Å; D85-S114 WeakPolarHBondContact OD2-CA 3.05Å; D85-S114 WeakPolarHBondContact OD2-CB 3.36Å; D85-S114 PolarHBondContact OD2-OG 3.2Å; D85-H115 PolarHBondContact OD2-N 2.85Å; D85-E116 HydrophobicContact CB-CG 3.67Å
86	M	90.6	Very high	95.7	Very high	132 Å²	132	40.8 Å²	40.8	65%	0.65	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-6.9	-179.4	-62.1	-61.1	-77.9	0	0	113.8	D84	D84-M86 PolarHBondContact O-N 3.04Å
87	T	92.8	Very high	95.7	Very high	81 Å²	81	40.3 Å²	40.3	50%	0.497	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-18.1	177.1	77.2	0	0	0	0	113	D85 P89 H115	D85-T87 PolarHBondContact O-N 3.17Å; D85-T87 WeakPolarHBondContact OD1-CA 3.4Å; D85-T87 VanDerWaalsContact OD1-CB 3.28Å; D85-T87 WeakPolarHBondContact OD1-CB 3.49Å; D85-T87 PolarHBondContact OD1-N 3.5Å; D85-T87 PolarHBondContact OD1-OG1 3.26Å; T87-P89 WeakPolarHBondContact O-CD 3.3Å; T87-H115 HydrophobicContact CG2-CB 4.29Å
88	I	94.8	Very high	95.8	Very high	10 Å²	10	40.2 Å²	40.2	5%	0.051	21%	0.213	C	C	.	.	S	Bend	trans	-78.6	119.3	176.9	-53.9	175.2	0	0	0	109.3	V82 D85 K92 K93 F111	V82-I88 HydrophobicContact CG1-CD1 4.42Å; D85-I88 HydrophobicContact CB-CD1 3.7Å; D85-I88 HydrophobicContact CB-CG1 3.87Å; D85-I88 PolarHBondContact O-N 2.84Å; I88-K92 HydrophobicContact CG2-CB 4.16Å; I88-K92 HydrophobicContact CG2-CD 4.37Å; I88-K92 HydrophobicContact CG2-CG 4.3Å; I88-K93 HydrophobicContact CG2-CB 3.9Å; I88-F111 HydrophobicContact CD1-CE1 3.54Å; I88-F111 HydrophobicContact CD1-CZ 3.89Å; I88-F111 HydrophobicContact CG1-CE1 4.17Å; I88-F111 HydrophobicContact CG1-CZ 4.17Å
89	P	94.9	Very high	95.7	Very high	63 Å²	63	43.7 Å²	43.7	41%	0.409	23%	0.232	S	C	.	.			trans	-60.9	145.8	177.4	-22.8	34.2	0	0	0	112.6	T87 E91 K92 K93	T87-P89 WeakPolarHBondContact O-CD 3.3Å; P89-E91 VanDerWaalsContact C-N 3.26Å; P89-E91 HydrophobicContact CB-CG 4.18Å; P89-E91 WeakPolarHBondContact CB-OE1 3.42Å; P89-E91 VanDerWaalsContact CB-OE2 3.25Å; P89-E91 WeakPolarHBondContact CB-OE2 3.47Å; P89-E91 PolarHBondContact O-N 2.96Å; P89-K92 PolarHBondContact O-N 3.32Å; P89-K93 PolarHBondContact O-N 3.35Å
90	L	94.8	Very high	95.8	Very high	86 Å²	86	43.7 Å²	43.7	45%	0.45	23%	0.232	S	C	.	.	H	α-helix	trans	-59.5	-35.9	-175.6	-70.2	-179.7	0	0	0	112.6	K92 K93 V94 L158	L90-K92 PolarHBondContact O-N 3.03Å; L90-K92 VanDerWaalsContact O-N 3.14Å; L90-K93 PolarHBondContact O-N 3.33Å; L90-V94 WeakPolarHBondContact O-CB 3.43Å; L90-V94 WeakPolarHBondContact O-CG2 3.45Å; L90-V94 PolarHBondContact O-N 3.29Å; L90-L158 HydrophobicContact CD2-CB 4.06Å; L90-L158 HydrophobicContact CD2-CD1 4.15Å; L90-L158 HydrophobicContact CD2-CD2 4.47Å; L90-L158 HydrophobicContact CD2-CG 4.48Å
91	E	95.8	Very high	95.9	Very high	151 Å²	151	43.5 Å²	43.5	71%	0.706	23%	0.23	S	C	*	.	H	α-helix	trans	-60.4	-22.8	176.5	63.8	-88.6	-158.1	0	0	113.5	P89 P95	P89-E91 VanDerWaalsContact C-N 3.26Å; P89-E91 HydrophobicContact CB-CG 4.18Å; P89-E91 WeakPolarHBondContact CB-OE1 3.42Å; P89-E91 VanDerWaalsContact CB-OE2 3.25Å; P89-E91 WeakPolarHBondContact CB-OE2 3.47Å; P89-E91 PolarHBondContact O-N 2.96Å; E91-P95 VanDerWaalsContact O-CD 3.29Å; E91-P95 WeakPolarHBondContact O-CD 3.36Å; E91-P95 WeakPolarHBondContact O-CG 3.47Å
92	K	96.4	Very high	96	Very high	71 Å²	71	45.3 Å²	45.3	31%	0.309	24%	0.241	S	C	.	.	H	α-helix	trans	-98.7	-41.5	174.8	-171.5	174.6	-174.5	170.8	0	111.5	I88 P89 L90 M96 F111 E113	I88-K92 HydrophobicContact CG2-CB 4.16Å; I88-K92 HydrophobicContact CG2-CD 4.37Å; I88-K92 HydrophobicContact CG2-CG 4.3Å; P89-K92 PolarHBondContact O-N 3.32Å; L90-K92 PolarHBondContact O-N 3.03Å; L90-K92 VanDerWaalsContact O-N 3.14Å; K92-M96 HydrophobicContact CG-CE 4.12Å; K92-M96 VanDerWaalsContact O-CB 3.31Å; K92-M96 WeakPolarHBondContact O-CB 3.19Å; K92-M96 PolarHBondContact O-N 3.49Å; K92-F111 HydrophobicContact CD-CE2 4.5Å; K92-E113 IonicContact NZ-OE1 2.68Å; K92-E113 PolarHBondContact NZ-OE1 2.97Å; K92-E113 IonicContact NZ-OE2 3.2Å; K92-E113 PolarHBondContact NZ-OE2 3.47Å
93	K	96.8	Very high	96.1	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-48.1	-177.3	-169.5	-179.9	-71	-165.1	0	112	V82 E83 D85 I88 P89 L90 M96 L97 L158	V82-K93 HydrophobicContact CG1-CG 4.07Å; V82-K93 WeakPolarHBondContact O-CD 3.44Å; V82-K93 WeakPolarHBondContact O-CE 3.2Å; E83-K93 PolarHBondContact O-NZ 3.4Å; D85-K93 WeakPolarHBondContact O-CE 3.23Å; D85-K93 PolarHBondContact O-NZ 3.16Å; I88-K93 HydrophobicContact CG2-CB 3.9Å; P89-K93 PolarHBondContact O-N 3.35Å; L90-K93 PolarHBondContact O-N 3.33Å; K93-M96 WeakPolarHBondContact O-CB 3.35Å; K93-M96 PolarHBondContact O-N 3.06Å; K93-M96 VanDerWaalsContact O-N 3.16Å; K93-L97 HydrophobicContact CG-CD1 4.04Å; K93-L97 HydrophobicContact CG-CG 4.28Å; K93-L97 WeakPolarHBondContact O-CG 3.36Å; K93-L97 PolarHBondContact O-N 3.05Å; K93-L158 HydrophobicContact CB-CD1 4.48Å; K93-L158 HydrophobicContact CD-CD1 3.43Å; K93-L158 VanDerWaalsContact CD-CD1 3.43Å; K93-L158 HydrophobicContact CD-CD2 4.01Å; K93-L158 HydrophobicContact CD-CG 4.39Å; K93-L158 HydrophobicContact CG-CD1 3.78Å
94	V	97.2	Very high	96.3	Very high	26 Å²	26	46 Å²	46	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-48.5	-175.9	169.1	0	0	0	0	112.3	L90 M96 N98 A155 L158	L90-V94 WeakPolarHBondContact O-CB 3.43Å; L90-V94 WeakPolarHBondContact O-CG2 3.45Å; L90-V94 PolarHBondContact O-N 3.29Å; V94-M96 VanDerWaalsContact C-N 3.32Å; V94-M96 PolarHBondContact O-N 2.92Å; V94-N98 PolarHBondContact O-N 2.86Å; V94-N98 VanDerWaalsContact O-N 3.15Å; V94-N98 PolarHBondContact O-ND2 3.31Å; V94-A155 HydrophobicContact CG1-CB 4.28Å; V94-L158 HydrophobicContact CG2-CD1 4.16Å
95	P	97.7	Very high	96.6	Very high	59 Å²	59	49 Å²	49	38%	0.383	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-36.7	173.7	-24.6	35.3	0	0	0	113.1	E91 N99	E91-P95 VanDerWaalsContact O-CD 3.29Å; E91-P95 WeakPolarHBondContact O-CD 3.36Å; E91-P95 WeakPolarHBondContact O-CG 3.47Å; P95-N99 WeakPolarHBondContact O-CB 3.41Å; P95-N99 PolarHBondContact O-N 3.16Å; P95-N99 PolarHBondContact O-ND2 3.22Å
96	M	98	Very high	96.9	Very high	11 Å²	11	53.1 Å²	53.1	5%	0.054	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-46.1	179.8	-168.8	-176.5	-60.4	0	0	111.6	V82 K92 K93 V94 N99 F100 Y103 W109 F111	V82-M96 HydrophobicContact CB-SD 4.24Å; V82-M96 HydrophobicContact CG1-CB 4.34Å; V82-M96 HydrophobicContact CG1-CG 4.11Å; V82-M96 HydrophobicContact CG1-SD 3.53Å; V82-M96 VanDerWaalsContact CG1-SD 3.53Å; V82-M96 HydrophobicContact CG2-SD 3.57Å; V82-M96 VanDerWaalsContact CG2-SD 3.57Å; K92-M96 HydrophobicContact CG-CE 4.12Å; K92-M96 VanDerWaalsContact O-CB 3.31Å; K92-M96 WeakPolarHBondContact O-CB 3.19Å; K92-M96 PolarHBondContact O-N 3.49Å; K93-M96 WeakPolarHBondContact O-CB 3.35Å; K93-M96 PolarHBondContact O-N 3.06Å; K93-M96 VanDerWaalsContact O-N 3.16Å; V94-M96 VanDerWaalsContact C-N 3.32Å; V94-M96 PolarHBondContact O-N 2.92Å; M96-N99 PolarHBondContact O-N 3.37Å; M96-F100 WeakPolarHBondContact O-CA 3.28Å; M96-F100 WeakPolarHBondContact O-CB 3.33Å; M96-F100 PolarHBondContact O-N 2.95Å; M96-Y103 HydrophobicContact CG-CE2 3.88Å; M96-W109 HydrophobicContact CG-CZ2 4.2Å; M96-W109 HydrophobicContact SD-CZ2 4.24Å; M96-F111 HydrophobicContact CE-CD2 3.64Å; M96-F111 HydrophobicContact CE-CE2 3.61Å; M96-F111 HydrophobicContact CE-CG 4.17Å; M96-F111 HydrophobicContact CE-CZ 4.04Å; M96-F111 HydrophobicContact SD-CD2 4.44Å; M96-F111 HydrophobicContact SD-CG 4.4Å
97	L	98.3	Very high	97.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-48.8	176.7	-68.2	176.6	0	0	0	111.8	L79 V82 E83 K93 N99 F100 G151 M154 A155 L158	L79-L97 HydrophobicContact CD1-CD2 3.56Å; L79-L97 HydrophobicContact CG-CD2 4.36Å; V82-L97 HydrophobicContact CB-CD2 4.03Å; V82-L97 HydrophobicContact CG1-CD2 3.73Å; V82-L97 HydrophobicContact CG1-CG 4.11Å; E83-L97 HydrophobicContact CB-CD2 4.42Å; K93-L97 HydrophobicContact CG-CD1 4.04Å; K93-L97 HydrophobicContact CG-CG 4.28Å; K93-L97 WeakPolarHBondContact O-CG 3.36Å; K93-L97 PolarHBondContact O-N 3.05Å; L97-N99 VanDerWaalsContact C-N 3.26Å; L97-N99 PolarHBondContact O-N 3.36Å; L97-F100 PolarHBondContact O-N 3.12Å; L97-G151 WeakPolarHBondContact O-CA 3.41Å; L97-M154 HydrophobicContact CD1-CB 3.99Å; L97-M154 HydrophobicContact CD2-SD 4.43Å; L97-A155 HydrophobicContact CB-CB 4.45Å; L97-L158 HydrophobicContact CD1-CD1 3.49Å; L97-L158 VanDerWaalsContact CD1-CD1 3.49Å; L97-L158 HydrophobicContact CD1-CG 4.43Å
98	N	98.3	Very high	97.4	Very high	52 Å²	52	56.4 Å²	56.4	28%	0.278	28%	0.279	S	S	.	.	H	α-helix	trans	-59.8	-36.4	179.8	-78.9	-56.9	0	0	0	112.8	V94 H101	V94-N98 PolarHBondContact O-N 2.86Å; V94-N98 VanDerWaalsContact O-N 3.15Å; V94-N98 PolarHBondContact O-ND2 3.31Å; N98-H101 PolarHBondContact O-CE1 3.19Å; N98-H101 PolarHBondContact O-ND1 3.5Å
99	N	98.2	Very high	97.6	Very high	72 Å²	72	57.6 Å²	57.6	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-98.9	3.8	-177	-63.4	-66.7	0	0	0	113.8	P95 M96 L97 H101 T102	P95-N99 WeakPolarHBondContact O-CB 3.41Å; P95-N99 PolarHBondContact O-N 3.16Å; P95-N99 PolarHBondContact O-ND2 3.22Å; M96-N99 PolarHBondContact O-N 3.37Å; L97-N99 VanDerWaalsContact C-N 3.26Å; L97-N99 PolarHBondContact O-N 3.36Å; N99-H101 VanDerWaalsContact C-N 3.26Å; N99-H101 PolarHBondContact O-N 3.42Å; N99-T102 WeakPolarHBondContact O-CB 3.3Å; N99-T102 PolarHBondContact O-N 2.72Å; N99-T102 PolarHBondContact O-OG1 3.31Å
100	F	98.8	Very high	97.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-39.7	-171.1	-160.4	-85.2	0	0	0	112.9	V75 A78 L79 V82 M96 L97 T102 Y103 W109 L122 F125 C147	V75-F100 HydrophobicContact CG1-CE1 4.5Å; A78-F100 HydrophobicContact CB-CE1 4.29Å; A78-F100 HydrophobicContact CB-CZ 3.65Å; L79-F100 HydrophobicContact CB-CD1 4.28Å; L79-F100 HydrophobicContact CB-CE1 4.26Å; L79-F100 HydrophobicContact CD1-CB 3.65Å; L79-F100 HydrophobicContact CD1-CD1 4.09Å; L79-F100 HydrophobicContact CD1-CD2 3.98Å; L79-F100 HydrophobicContact CD1-CG 3.63Å; V82-F100 HydrophobicContact CG2-CE2 4.05Å; M96-F100 WeakPolarHBondContact O-CA 3.28Å; M96-F100 WeakPolarHBondContact O-CB 3.33Å; M96-F100 PolarHBondContact O-N 2.95Å; L97-F100 PolarHBondContact O-N 3.12Å; F100-T102 PolarHBondContact O-N 3.34Å; F100-T102 VanDerWaalsContact O-N 3.14Å; F100-Y103 VanDerWaalsContact CA-CD2 3.5Å; F100-Y103 HydrophobicContact CB-CD2 4.35Å; F100-Y103 AromaticContact CD2-CD2 3.97Å; F100-Y103 HydrophobicContact CD2-CD2 3.97Å; F100-Y103 HydrophobicContact CD2-CE2 4.3Å; F100-Y103 HydrophobicContact CG-CD2 4.16Å; F100-Y103 WeakPolarHBondContact O-CB 3.46Å; F100-Y103 PolarHBondContact O-N 3.19Å; F100-W109 HydrophobicContact CD2-CH2 4.2Å; F100-W109 AromaticContact CE2-CH2 3.58Å; F100-W109 HydrophobicContact CE2-CH2 3.58Å; F100-W109 HydrophobicContact CE2-CZ2 4.5Å; F100-W109 HydrophobicContact CE2-CZ3 4.01Å; F100-W109 HydrophobicContact CZ-CH2 4.19Å; F100-W109 HydrophobicContact CZ-CZ3 4.15Å; F100-L122 HydrophobicContact CE2-CD2 4.03Å; F100-L122 HydrophobicContact CZ-CD2 4.21Å; F100-F125 AromaticContact CE1-CE2 3.62Å; F100-F125 HydrophobicContact CE1-CE2 3.62Å; F100-F125 AromaticContact CE1-CZ 3.58Å; F100-F125 HydrophobicContact CE1-CZ 3.58Å; F100-F125 HydrophobicContact CZ-CD2 4.25Å; F100-F125 AromaticContact CZ-CE2 3.62Å; F100-F125 HydrophobicContact CZ-CE2 3.62Å; F100-F125 AromaticContact CZ-CZ 3.9Å; F100-F125 HydrophobicContact CZ-CZ 3.9Å; F100-C147 VanDerWaalsContact CD1-SG 3.57Å
101	H	98.8	Very high	97.9	Very high	30 Å²	30	53.8 Å²	53.8	14%	0.139	26%	0.263	C	S	.	.	H	α-helix	trans	-57.6	-27.6	175.7	72.5	-77.9	0	0	0	113.6	N98 N99 Y103 L104 C147 Q148	N98-H101 PolarHBondContact O-CE1 3.19Å; N98-H101 PolarHBondContact O-ND1 3.5Å; N99-H101 VanDerWaalsContact C-N 3.26Å; N99-H101 PolarHBondContact O-N 3.42Å; H101-Y103 VanDerWaalsContact C-N 3.34Å; H101-L104 WeakPolarHBondContact O-CB 3.49Å; H101-L104 WeakPolarHBondContact O-CG 3.49Å; H101-C147 HydrophobicContact CB-CB 4.17Å; H101-Q148 HydrophobicContact CB-CB 3.88Å
102	T	98.8	Very high	98	Very high	43 Å²	43	51.2 Å²	51.2	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-73.8	-27.9	176.9	74.1	0	0	0	0	112.1	N99 F100 L104 Y105 Q106	N99-T102 WeakPolarHBondContact O-CB 3.3Å; N99-T102 PolarHBondContact O-N 2.72Å; N99-T102 PolarHBondContact O-OG1 3.31Å; F100-T102 PolarHBondContact O-N 3.34Å; F100-T102 VanDerWaalsContact O-N 3.14Å; T102-L104 PolarHBondContact O-N 3.26Å; T102-Y105 PolarHBondContact O-N 3.36Å; T102-Y105 VanDerWaalsContact O-N 3.12Å; T102-Q106 PolarHBondContact OG1-NE2 3.37Å
103	Y	98.6	Very high	98	Very high	32 Å²	32	53.1 Å²	53.1	13%	0.125	27%	0.268	C	S	.	.	H	α-helix	trans	-68.6	-21.3	179.6	-53.4	-34.4	0	0	0	112.2	M96 F100 H101 Y105 Q106 W109	M96-Y103 HydrophobicContact CG-CE2 3.88Å; F100-Y103 VanDerWaalsContact CA-CD2 3.5Å; F100-Y103 HydrophobicContact CB-CD2 4.35Å; F100-Y103 AromaticContact CD2-CD2 3.97Å; F100-Y103 HydrophobicContact CD2-CD2 3.97Å; F100-Y103 HydrophobicContact CD2-CE2 4.3Å; F100-Y103 HydrophobicContact CG-CD2 4.16Å; F100-Y103 WeakPolarHBondContact O-CB 3.46Å; F100-Y103 PolarHBondContact O-N 3.19Å; H101-Y103 VanDerWaalsContact C-N 3.34Å; Y103-Y105 PolarHBondContact O-N 3.35Å; Y103-Y105 VanDerWaalsContact O-N 3.11Å; Y103-Q106 PolarHBondContact O-N 3.26Å; Y103-W109 AromaticContact CD1-CD1 3.4Å; Y103-W109 HydrophobicContact CD1-CD2 4.02Å; Y103-W109 AromaticContact CD1-CE2 3.89Å; Y103-W109 AromaticContact CD1-CG 3.75Å; Y103-W109 HydrophobicContact CD1-CG 3.75Å; Y103-W109 AromaticContact CD1-NE1 3.48Å; Y103-W109 AromaticContact CD2-CD2 3.65Å; Y103-W109 HydrophobicContact CD2-CD2 3.65Å; Y103-W109 AromaticContact CD2-CE2 3.21Å; Y103-W109 HydrophobicContact CD2-CE3 4.07Å; Y103-W109 HydrophobicContact CD2-CG 4.27Å; Y103-W109 AromaticContact CD2-CH2 3.73Å; Y103-W109 HydrophobicContact CD2-CH2 3.73Å; Y103-W109 AromaticContact CD2-CZ2 3.27Å; Y103-W109 HydrophobicContact CD2-CZ2 3.27Å; Y103-W109 HydrophobicContact CD2-CZ3 4.1Å; Y103-W109 AromaticContact CD2-NE1 3.6Å; Y103-W109 AromaticContact CE1-CD1 3.69Å; Y103-W109 HydrophobicContact CE1-CG 4.45Å; Y103-W109 AromaticContact CE1-NE1 3.46Å; Y103-W109 HydrophobicContact CE2-CD2 4.37Å; Y103-W109 AromaticContact CE2-CE2 3.49Å; Y103-W109 VanDerWaalsContact CE2-CE2 3.49Å; Y103-W109 HydrophobicContact CE2-CH2 4.2Å; Y103-W109 AromaticContact CE2-CZ2 3.4Å; Y103-W109 HydrophobicContact CE2-CZ2 3.4Å; Y103-W109 VanDerWaalsContact CE2-CZ2 3.4Å; Y103-W109 AromaticContact CE2-NE1 3.59Å; Y103-W109 AromaticContact CG-CD1 3.71Å; Y103-W109 AromaticContact CG-CD2 3.47Å; Y103-W109 HydrophobicContact CG-CD2 3.47Å; Y103-W109 VanDerWaalsContact CG-CD2 3.47Å; Y103-W109 AromaticContact CG-CE2 3.46Å; Y103-W109 VanDerWaalsContact CG-CE2 3.46Å; Y103-W109 HydrophobicContact CG-CE3 4.04Å; Y103-W109 AromaticContact CG-CG 3.67Å; Y103-W109 HydrophobicContact CG-CG 3.67Å; Y103-W109 HydrophobicContact CG-CZ2 4.02Å; Y103-W109 AromaticContact CG-NE1 3.58Å; Y103-W109 AromaticContact CZ-CE2 3.94Å; Y103-W109 AromaticContact CZ-NE1 3.51Å
104	L	98.6	Very high	97.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-26.2	171	-61.5	174.1	0	0	0	113	V75 H101 T102 F125 F132 R133 I143 C144 C147	V75-L104 HydrophobicContact CB-CD2 4.3Å; V75-L104 HydrophobicContact CG1-CD1 4.46Å; V75-L104 HydrophobicContact CG1-CD2 3.78Å; V75-L104 HydrophobicContact CG2-CD2 3.49Å; V75-L104 VanDerWaalsContact CG2-CD2 3.49Å; H101-L104 WeakPolarHBondContact O-CB 3.49Å; H101-L104 WeakPolarHBondContact O-CG 3.49Å; T102-L104 PolarHBondContact O-N 3.26Å; L104-F125 HydrophobicContact CD2-CE1 4.28Å; L104-F125 HydrophobicContact CD2-CZ 3.75Å; L104-F132 HydrophobicContact CB-CD1 3.72Å; L104-F132 HydrophobicContact CB-CE1 3.55Å; L104-F132 HydrophobicContact CB-CG 4.36Å; L104-F132 HydrophobicContact CB-CZ 4.02Å; L104-F132 HydrophobicContact CD1-CD2 4.45Å; L104-F132 HydrophobicContact CD1-CE1 4.32Å; L104-F132 HydrophobicContact CD1-CE2 3.98Å; L104-F132 HydrophobicContact CD1-CZ 3.92Å; L104-F132 HydrophobicContact CD2-CD1 4.42Å; L104-F132 HydrophobicContact CD2-CD2 4.4Å; L104-F132 HydrophobicContact CD2-CG 4.24Å; L104-F132 HydrophobicContact CG-CE1 4.42Å; L104-F132 HydrophobicContact CG-CZ 4.5Å; L104-R133 PolarHBondContact O-NH1 2.77Å; L104-I143 HydrophobicContact CD1-CG2 4.39Å; L104-C144 HydrophobicContact CD1-CB 4.31Å; L104-C147 HydrophobicContact CD1-CB 4.48Å
105	Y	98.6	Very high	97.8	Very high	107 Å²	107	58.5 Å²	58.5	42%	0.42	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	0.9	179.5	-60.7	-81.6	0	0	0	113.5	T102 Y103 F132	T102-Y105 PolarHBondContact O-N 3.36Å; T102-Y105 VanDerWaalsContact O-N 3.12Å; Y103-Y105 PolarHBondContact O-N 3.35Å; Y103-Y105 VanDerWaalsContact O-N 3.11Å; Y105-F132 HydrophobicContact CD1-CE1 4.37Å; Y105-F132 AromaticContact CE1-CE1 3.86Å; Y105-F132 HydrophobicContact CE1-CE1 3.86Å; Y105-F132 HydrophobicContact CE1-CZ 4.42Å; Y105-F132 HydrophobicContact CE2-CE1 4.1Å; Y105-F132 HydrophobicContact CE2-CZ 4.25Å; Y105-F132 AromaticContact CZ-CE1 3.71Å; Y105-F132 AromaticContact CZ-CZ 3.88Å
106	Q	98.2	Very high	97.6	Very high	85 Å²	85	58.4 Å²	58.4	40%	0.397	29%	0.286	S	S	.	.			trans	-101.7	104.8	178.1	-65.1	177.9	29.7	0	0	109	T102 Y103 E108 W109	T102-Q106 PolarHBondContact OG1-NE2 3.37Å; Y103-Q106 PolarHBondContact O-N 3.26Å; Q106-E108 VanDerWaalsContact C-N 3.26Å; Q106-E108 PolarHBondContact O-N 3.36Å; Q106-W109 HydrophobicContact CB-CB 3.79Å; Q106-W109 PolarHBondContact O-N 3.04Å
107	E	96.8	Very high	97.3	Very high	124 Å²	124	64.8 Å²	64.8	58%	0.579	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-36.7	-168.2	-53.5	-169.3	161.1	0	0	113.7	P126	E107-P126 WeakPolarHBondContact O-CB 3.43Å
108	E	97.6	Very high	97.1	Very high	158 Å²	158	66 Å²	66	74%	0.738	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	2.7	-174.7	-57.8	-58.8	145.6	0	0	113.4	Q106 C110	Q106-E108 VanDerWaalsContact C-N 3.26Å; Q106-E108 PolarHBondContact O-N 3.36Å; E108-C110 PolarHBondContact O-N 3.43Å
109	W	98.5	Very high	97.1	Very high	36 Å²	36	68.6 Å²	68.6	14%	0.136	33%	0.326	C	S	.	.			trans	-69.2	126	-177.5	-173.9	93.5	0	0	0	110.5	M96 F100 Y103 Q106 F111 L122 F125 P126	M96-W109 HydrophobicContact CG-CZ2 4.2Å; M96-W109 HydrophobicContact SD-CZ2 4.24Å; F100-W109 HydrophobicContact CD2-CH2 4.2Å; F100-W109 AromaticContact CE2-CH2 3.58Å; F100-W109 HydrophobicContact CE2-CH2 3.58Å; F100-W109 HydrophobicContact CE2-CZ2 4.5Å; F100-W109 HydrophobicContact CE2-CZ3 4.01Å; F100-W109 HydrophobicContact CZ-CH2 4.19Å; F100-W109 HydrophobicContact CZ-CZ3 4.15Å; Y103-W109 AromaticContact CD1-CD1 3.4Å; Y103-W109 HydrophobicContact CD1-CD2 4.02Å; Y103-W109 AromaticContact CD1-CE2 3.89Å; Y103-W109 AromaticContact CD1-CG 3.75Å; Y103-W109 HydrophobicContact CD1-CG 3.75Å; Y103-W109 AromaticContact CD1-NE1 3.48Å; Y103-W109 AromaticContact CD2-CD2 3.65Å; Y103-W109 HydrophobicContact CD2-CD2 3.65Å; Y103-W109 AromaticContact CD2-CE2 3.21Å; Y103-W109 HydrophobicContact CD2-CE3 4.07Å; Y103-W109 HydrophobicContact CD2-CG 4.27Å; Y103-W109 AromaticContact CD2-CH2 3.73Å; Y103-W109 HydrophobicContact CD2-CH2 3.73Å; Y103-W109 AromaticContact CD2-CZ2 3.27Å; Y103-W109 HydrophobicContact CD2-CZ2 3.27Å; Y103-W109 HydrophobicContact CD2-CZ3 4.1Å; Y103-W109 AromaticContact CD2-NE1 3.6Å; Y103-W109 AromaticContact CE1-CD1 3.69Å; Y103-W109 HydrophobicContact CE1-CG 4.45Å; Y103-W109 AromaticContact CE1-NE1 3.46Å; Y103-W109 HydrophobicContact CE2-CD2 4.37Å; Y103-W109 AromaticContact CE2-CE2 3.49Å; Y103-W109 VanDerWaalsContact CE2-CE2 3.49Å; Y103-W109 HydrophobicContact CE2-CH2 4.2Å; Y103-W109 AromaticContact CE2-CZ2 3.4Å; Y103-W109 HydrophobicContact CE2-CZ2 3.4Å; Y103-W109 VanDerWaalsContact CE2-CZ2 3.4Å; Y103-W109 AromaticContact CE2-NE1 3.59Å; Y103-W109 AromaticContact CG-CD1 3.71Å; Y103-W109 AromaticContact CG-CD2 3.47Å; Y103-W109 HydrophobicContact CG-CD2 3.47Å; Y103-W109 VanDerWaalsContact CG-CD2 3.47Å; Y103-W109 AromaticContact CG-CE2 3.46Å; Y103-W109 VanDerWaalsContact CG-CE2 3.46Å; Y103-W109 HydrophobicContact CG-CE3 4.04Å; Y103-W109 AromaticContact CG-CG 3.67Å; Y103-W109 HydrophobicContact CG-CG 3.67Å; Y103-W109 HydrophobicContact CG-CZ2 4.02Å; Y103-W109 AromaticContact CG-NE1 3.58Å; Y103-W109 AromaticContact CZ-CE2 3.94Å; Y103-W109 AromaticContact CZ-NE1 3.51Å; Q106-W109 HydrophobicContact CB-CB 3.79Å; Q106-W109 PolarHBondContact O-N 3.04Å; W109-F111 HydrophobicContact CH2-CB 4.1Å; W109-F111 HydrophobicContact CZ2-CB 4.22Å; W109-L122 HydrophobicContact CH2-CD2 4.02Å; W109-L122 HydrophobicContact CZ3-CD2 4.27Å; W109-F125 HydrophobicContact CE3-CB 4.01Å; W109-F125 AromaticContact CE3-CD1 3.4Å; W109-F125 HydrophobicContact CE3-CD1 3.4Å; W109-F125 VanDerWaalsContact CE3-CD1 3.4Å; W109-F125 AromaticContact CE3-CE1 3.96Å; W109-F125 HydrophobicContact CE3-CE1 3.96Å; W109-F125 AromaticContact CE3-CG 3.78Å; W109-F125 HydrophobicContact CE3-CG 3.78Å; W109-F125 HydrophobicContact CZ3-CB 3.98Å; W109-F125 AromaticContact CZ3-CD1 3.72Å; W109-F125 HydrophobicContact CZ3-CD1 3.72Å; W109-F125 HydrophobicContact CZ3-CD2 4.17Å; W109-F125 HydrophobicContact CZ3-CE1 4.16Å; W109-F125 AromaticContact CZ3-CG 3.68Å; W109-F125 HydrophobicContact CZ3-CG 3.68Å; W109-P126 VanDerWaalsContact O-CD 3.27Å; W109-P126 WeakPolarHBondContact O-CD 3.49Å; W109-P126 WeakPolarHBondContact O-CG 3.5Å
110	C	98.3	Very high	97.1	Very high	56 Å²	56	68.9 Å²	68.9	38%	0.378	32%	0.324	S	S	.	.			trans	-146.4	166.2	172.8	61.4	0	0	0	0	109.5	E108 L122 E123 P126	E108-C110 PolarHBondContact O-N 3.43Å; C110-L122 WeakPolarHBondContact CA-O 3.38Å; C110-L122 WeakPolarHBondContact CB-O 3.35Å; C110-E123 WeakPolarHBondContact CB-O 3.44Å; C110-P126 HydrophobicContact CB-CG 4.19Å
111	F	98.3	Very high	97	Very high	12 Å²	12	68.9 Å²	68.9	5%	0.053	33%	0.325	C	S	.	.			trans	-137.8	116	175.1	-176.5	-104.1	0	0	0	111.4	I88 K92 M96 W109 E113 L122 E123	I88-F111 HydrophobicContact CD1-CE1 3.54Å; I88-F111 HydrophobicContact CD1-CZ 3.89Å; I88-F111 HydrophobicContact CG1-CE1 4.17Å; I88-F111 HydrophobicContact CG1-CZ 4.17Å; K92-F111 HydrophobicContact CD-CE2 4.5Å; M96-F111 HydrophobicContact CE-CD2 3.64Å; M96-F111 HydrophobicContact CE-CE2 3.61Å; M96-F111 HydrophobicContact CE-CG 4.17Å; M96-F111 HydrophobicContact CE-CZ 4.04Å; M96-F111 HydrophobicContact SD-CD2 4.44Å; M96-F111 HydrophobicContact SD-CG 4.4Å; W109-F111 HydrophobicContact CH2-CB 4.1Å; W109-F111 HydrophobicContact CZ2-CB 4.22Å; F111-E113 HydrophobicContact CE1-CB 4.13Å; F111-E113 HydrophobicContact CE2-CB 3.87Å; F111-E113 HydrophobicContact CE2-CG 4.32Å; F111-E113 HydrophobicContact CZ-CB 3.58Å; F111-E113 HydrophobicContact CZ-CG 4.48Å; F111-L122 HydrophobicContact CB-CB 4.18Å; F111-L122 HydrophobicContact CD1-CD1 4.07Å; F111-L122 PolarHBondContact N-O 2.91Å; F111-L122 CarbonylContact O-C 3.49Å; F111-L122 WeakPolarHBondContact O-CB 3.33Å; F111-E123 PolarHBondContact O-N 3.37Å
112	T	97.4	Very high	97	Very high	97 Å²	97	67.5 Å²	67.5	60%	0.595	32%	0.318	S	S	*	.			trans	-110.2	2.7	-170.2	55.4	0	0	0	0	114.3	E123	T112-E123 HydrophobicContact CG2-CG 4.24Å
113	E	96.6	Very high	97	Very high	111 Å²	111	68.6 Å²	68.6	52%	0.519	32%	0.32	S	S	.	.			trans	-96.2	2	-178.4	-60.7	165.7	-124.2	0	0	112.7	K92 F111 H115	K92-E113 IonicContact NZ-OE1 2.68Å; K92-E113 PolarHBondContact NZ-OE1 2.97Å; K92-E113 IonicContact NZ-OE2 3.2Å; K92-E113 PolarHBondContact NZ-OE2 3.47Å; F111-E113 HydrophobicContact CE1-CB 4.13Å; F111-E113 HydrophobicContact CE2-CB 3.87Å; F111-E113 HydrophobicContact CE2-CG 4.32Å; F111-E113 HydrophobicContact CZ-CB 3.58Å; F111-E113 HydrophobicContact CZ-CG 4.48Å; E113-H115 PolarHBondContact O-CD2 3.37Å
114	S	95.5	Very high	97	Very high	3 Å²	3	68.8 Å²	68.8	2%	0.021	32%	0.323	C	S	.	.			trans	-73.7	139.4	179.1	-179.7	0	0	0	0	111.5	D85 E116 R119	D85-S114 WeakPolarHBondContact OD2-CA 3.05Å; D85-S114 WeakPolarHBondContact OD2-CB 3.36Å; D85-S114 PolarHBondContact OD2-OG 3.2Å; S114-E116 PolarHBondContact OG-N 2.85Å; S114-R119 WeakPolarHBondContact O-CD 3.48Å
115	H	93.2	Very high	97	Very high	141 Å²	141	68.8 Å²	68.8	65%	0.653	32%	0.323	S	S	*	.			trans	-101.3	-0.5	176.5	-70.9	-169.4	0	0	0	112.7	D85 T87 E113	D85-H115 PolarHBondContact OD2-N 2.85Å; T87-H115 HydrophobicContact CG2-CB 4.29Å; E113-H115 PolarHBondContact O-CD2 3.37Å
116	E	93.6	Very high	97	Very high	56 Å²	56	65.1 Å²	65.1	26%	0.262	31%	0.313	S	S	.	.	S	Bend	trans	-66.9	157.7	-179.7	-77.1	-57.8	116.4	0	0	112.9	T81 D85 S114 D118 R119	T81-E116 HydrophobicContact CG2-CB 3.59Å; T81-E116 HydrophobicContact CG2-CG 4.13Å; D85-E116 HydrophobicContact CB-CG 3.67Å; S114-E116 PolarHBondContact OG-N 2.85Å; E116-D118 PolarHBondContact O-N 3.12Å; E116-R119 WeakPolarHBondContact O-CB 3.46Å; E116-R119 WeakPolarHBondContact O-CG 3.4Å; E116-R119 PolarHBondContact O-N 3.21Å; E116-R119 PolarHBondContact O-NH1 3.03Å
117	K	93.1	Very high	97.1	Very high	146 Å²	146	62.4 Å²	62.4	64%	0.635	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.4	-179.5	73.9	-168.2	178	-140.2	0	112.8
118	D	94.1	Very high	97.1	Very high	26 Å²	26	56.5 Å²	56.5	14%	0.139	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	10.4	-173.3	-66.2	-36.6	0	0	0	112.3	T50 E116 Q120 V121	T50-D118 HydrophobicContact CG2-CB 4.18Å; E116-D118 PolarHBondContact O-N 3.12Å; D118-Q120 PolarHBondContact O-N 3.49Å; D118-V121 WeakPolarHBondContact O-CG2 3.24Å; D118-V121 PolarHBondContact O-N 2.69Å
119	R	97.1	Very high	97.2	Very high	106 Å²	106	49 Å²	49	40%	0.4	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-21.2	-177.4	67.7	-179	-175.2	-78.8	-4.8	115.8	S114 E116 V121 L122 E123	S114-R119 WeakPolarHBondContact O-CD 3.48Å; E116-R119 WeakPolarHBondContact O-CB 3.46Å; E116-R119 WeakPolarHBondContact O-CG 3.4Å; E116-R119 PolarHBondContact O-N 3.21Å; E116-R119 PolarHBondContact O-NH1 3.03Å; R119-V121 PolarHBondContact O-N 3.08Å; R119-V121 VanDerWaalsContact O-N 3.16Å; R119-L122 WeakPolarHBondContact O-CA 3.4Å; R119-L122 WeakPolarHBondContact O-CB 3.39Å; R119-L122 PolarHBondContact O-N 3.44Å; R119-E123 WeakPolarHBondContact CD-OE1 3.42Å; R119-E123 WeakPolarHBondContact CG-OE1 3.38Å; R119-E123 IonicContact NE-OE1 3.17Å; R119-E123 PolarHBondContact NE-OE1 2.93Å; R119-E123 VanDerWaalsContact NE-OE1 3.14Å; R119-E123 WeakPolarHBondContact O-CG 3.39Å; R119-E123 PolarHBondContact O-N 3.39Å
120	Q	98.1	Very high	97.2	Very high	77 Å²	77	50.5 Å²	50.5	36%	0.36	25%	0.25	S	C	.	.	H	α-helix	trans	-53	-34.8	174.5	-176.1	64.2	40.2	0	0	112.5	Y46 D118 L122 E123 D124	Y46-Q120 HydrophobicContact CD1-CG 4.01Å; Y46-Q120 HydrophobicContact CE1-CG 3.41Å; Y46-Q120 VanDerWaalsContact CE1-CG 3.41Å; Y46-Q120 PolarHBondContact OH-NE2 3.22Å; D118-Q120 PolarHBondContact O-N 3.49Å; Q120-L122 PolarHBondContact O-N 2.92Å; Q120-E123 PolarHBondContact O-N 3.15Å; Q120-D124 PolarHBondContact O-N 3.39Å
121	V	98.1	Very high	97.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-71.5	-16.7	177.8	-57.7	0	0	0	0	113.2	T50 L74 R77 A78 D118 R119 F125 I128	T50-V121 HydrophobicContact CG2-CG1 4.2Å; L74-V121 HydrophobicContact CD2-CG1 4.23Å; R77-V121 HydrophobicContact CG-CG1 4.48Å; R77-V121 HydrophobicContact CG-CG2 4.08Å; A78-V121 HydrophobicContact CB-CB 4.29Å; A78-V121 HydrophobicContact CB-CG2 3.73Å; D118-V121 WeakPolarHBondContact O-CG2 3.24Å; D118-V121 PolarHBondContact O-N 2.69Å; R119-V121 PolarHBondContact O-N 3.08Å; R119-V121 VanDerWaalsContact O-N 3.16Å; V121-F125 WeakPolarHBondContact O-CB 3.02Å; V121-F125 WeakPolarHBondContact O-CD2 3.4Å; V121-I128 HydrophobicContact CB-CD1 3.79Å; V121-I128 HydrophobicContact CG1-CD1 4.24Å; V121-I128 WeakPolarHBondContact O-CD1 3.4Å
122	L	98.6	Very high	97.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-92	-41.3	172.5	-71.1	171.4	0	0	0	111.5	A78 T81 V82 F100 W109 C110 F111 R119 Q120 F125	A78-L122 HydrophobicContact CB-CD2 3.91Å; A78-L122 HydrophobicContact CB-CG 4.4Å; T81-L122 HydrophobicContact CG2-CD1 3.5Å; T81-L122 HydrophobicContact CG2-CG 4.33Å; V82-L122 HydrophobicContact CG2-CD1 3.85Å; V82-L122 HydrophobicContact CG2-CD2 3.74Å; V82-L122 HydrophobicContact CG2-CG 4.47Å; F100-L122 HydrophobicContact CE2-CD2 4.03Å; F100-L122 HydrophobicContact CZ-CD2 4.21Å; W109-L122 HydrophobicContact CH2-CD2 4.02Å; W109-L122 HydrophobicContact CZ3-CD2 4.27Å; C110-L122 WeakPolarHBondContact CA-O 3.38Å; C110-L122 WeakPolarHBondContact CB-O 3.35Å; F111-L122 HydrophobicContact CB-CB 4.18Å; F111-L122 HydrophobicContact CD1-CD1 4.07Å; F111-L122 PolarHBondContact N-O 2.91Å; F111-L122 CarbonylContact O-C 3.49Å; F111-L122 WeakPolarHBondContact O-CB 3.33Å; R119-L122 WeakPolarHBondContact O-CA 3.4Å; R119-L122 WeakPolarHBondContact O-CB 3.39Å; R119-L122 PolarHBondContact O-N 3.44Å; Q120-L122 PolarHBondContact O-N 2.92Å; L122-F125 WeakPolarHBondContact O-CB 3.34Å; L122-F125 PolarHBondContact O-N 3.11Å
123	E	98.5	Very high	97.3	Very high	66 Å²	66	45.5 Å²	45.5	31%	0.308	21%	0.212	S	C	.	.	H	α-helix	trans	-63	-42	178	-68.3	177.8	-165.8	0	0	111.6	C110 F111 T112 R119 Q120	C110-E123 WeakPolarHBondContact CB-O 3.44Å; F111-E123 PolarHBondContact O-N 3.37Å; T112-E123 HydrophobicContact CG2-CG 4.24Å; R119-E123 WeakPolarHBondContact CD-OE1 3.42Å; R119-E123 WeakPolarHBondContact CG-OE1 3.38Å; R119-E123 IonicContact NE-OE1 3.17Å; R119-E123 PolarHBondContact NE-OE1 2.93Å; R119-E123 VanDerWaalsContact NE-OE1 3.14Å; R119-E123 WeakPolarHBondContact O-CG 3.39Å; R119-E123 PolarHBondContact O-N 3.39Å; Q120-E123 PolarHBondContact O-N 3.15Å
124	D	98.6	Very high	97.4	Very high	36 Å²	36	45 Å²	45	19%	0.193	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	34.8	176.8	-170.4	30.6	0	0	0	112.3	Y46 Q120 P126 T127	Y46-D124 HydrophobicContact CE2-CB 4.11Å; Y46-D124 VanDerWaalsContact CE2-OD2 3.29Å; Y46-D124 WeakPolarHBondContact CE2-OD2 3.4Å; Y46-D124 VanDerWaalsContact CZ-OD2 3.28Å; Y46-D124 WeakPolarHBondContact OH-CB 3.48Å; Y46-D124 PolarHBondContact OH-OD2 3.48Å; Q120-D124 PolarHBondContact O-N 3.39Å; D124-P126 VanDerWaalsContact C-N 3.26Å; D124-T127 VanDerWaalsContact CG-OG1 3.22Å; D124-T127 PolarHBondContact O-N 3.01Å; D124-T127 WeakPolarHBondContact OD1-CB 3.48Å; D124-T127 PolarHBondContact OD1-OG1 3.03Å; D124-T127 WeakPolarHBondContact OD2-CB 3.42Å; D124-T127 PolarHBondContact OD2-OG1 2.93Å; D124-T127 VanDerWaalsContact OD2-OG1 3.08Å
125	F	98.8	Very high	97.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-29	171.6	-162	-96.3	0	0	0	114.3	A78 F100 L104 W109 V121 L122 T127 I128 S129	A78-F125 HydrophobicContact CB-CD2 3.8Å; A78-F125 HydrophobicContact CB-CE2 3.74Å; F100-F125 AromaticContact CE1-CE2 3.62Å; F100-F125 HydrophobicContact CE1-CE2 3.62Å; F100-F125 AromaticContact CE1-CZ 3.58Å; F100-F125 HydrophobicContact CE1-CZ 3.58Å; F100-F125 HydrophobicContact CZ-CD2 4.25Å; F100-F125 AromaticContact CZ-CE2 3.62Å; F100-F125 HydrophobicContact CZ-CE2 3.62Å; F100-F125 AromaticContact CZ-CZ 3.9Å; F100-F125 HydrophobicContact CZ-CZ 3.9Å; L104-F125 HydrophobicContact CD2-CE1 4.28Å; L104-F125 HydrophobicContact CD2-CZ 3.75Å; W109-F125 HydrophobicContact CE3-CB 4.01Å; W109-F125 AromaticContact CE3-CD1 3.4Å; W109-F125 HydrophobicContact CE3-CD1 3.4Å; W109-F125 VanDerWaalsContact CE3-CD1 3.4Å; W109-F125 AromaticContact CE3-CE1 3.96Å; W109-F125 HydrophobicContact CE3-CE1 3.96Å; W109-F125 AromaticContact CE3-CG 3.78Å; W109-F125 HydrophobicContact CE3-CG 3.78Å; W109-F125 HydrophobicContact CZ3-CB 3.98Å; W109-F125 AromaticContact CZ3-CD1 3.72Å; W109-F125 HydrophobicContact CZ3-CD1 3.72Å; W109-F125 HydrophobicContact CZ3-CD2 4.17Å; W109-F125 HydrophobicContact CZ3-CE1 4.16Å; W109-F125 AromaticContact CZ3-CG 3.68Å; W109-F125 HydrophobicContact CZ3-CG 3.68Å; V121-F125 WeakPolarHBondContact O-CB 3.02Å; V121-F125 WeakPolarHBondContact O-CD2 3.4Å; L122-F125 WeakPolarHBondContact O-CB 3.34Å; L122-F125 PolarHBondContact O-N 3.11Å; F125-T127 VanDerWaalsContact C-N 3.26Å; F125-T127 PolarHBondContact O-N 3.11Å; F125-I128 HydrophobicContact CD2-CD1 4.44Å; F125-I128 PolarHBondContact O-N 3.31Å; F125-I128 VanDerWaalsContact O-N 3.11Å; F125-S129 WeakPolarHBondContact O-CB 3.36Å; F125-S129 PolarHBondContact O-N 3.35Å; F125-S129 PolarHBondContact O-OG 2.82Å
126	P	98.8	Very high	97.8	Very high	31 Å²	31	41 Å²	41	20%	0.201	20%	0.202	C	C	.	.	H	α-helix	trans	-52.3	-41.8	171.7	-33.4	40.9	0	0	0	113.3	E107 W109 C110 D124 S129 L130	E107-P126 WeakPolarHBondContact O-CB 3.43Å; W109-P126 VanDerWaalsContact O-CD 3.27Å; W109-P126 WeakPolarHBondContact O-CD 3.49Å; W109-P126 WeakPolarHBondContact O-CG 3.5Å; C110-P126 HydrophobicContact CB-CG 4.19Å; D124-P126 VanDerWaalsContact C-N 3.26Å; P126-S129 PolarHBondContact O-N 3.35Å; P126-S129 PolarHBondContact O-OG 2.88Å; P126-S129 VanDerWaalsContact O-OG 3.11Å; P126-L130 WeakPolarHBondContact O-CB 3.35Å; P126-L130 PolarHBondContact O-N 2.92Å
127	T	98.8	Very high	98	Very high	27 Å²	27	43 Å²	43	17%	0.166	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-42.7	176.9	-65.9	0	0	0	0	112.2	T42 D124 F125 E131	T42-T127 HydrophobicContact CG2-CG2 3.99Å; D124-T127 VanDerWaalsContact CG-OG1 3.22Å; D124-T127 PolarHBondContact O-N 3.01Å; D124-T127 WeakPolarHBondContact OD1-CB 3.48Å; D124-T127 PolarHBondContact OD1-OG1 3.03Å; D124-T127 WeakPolarHBondContact OD2-CB 3.42Å; D124-T127 PolarHBondContact OD2-OG1 2.93Å; D124-T127 VanDerWaalsContact OD2-OG1 3.08Å; F125-T127 VanDerWaalsContact C-N 3.26Å; F125-T127 PolarHBondContact O-N 3.11Å; T127-E131 PolarHBondContact O-N 3.16Å
128	I	98.8	Very high	98.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68	-44.7	179	-62.7	164.5	0	0	0	110.6	Y46 L74 V75 V121 F125 L130 E131 F132	Y46-I128 HydrophobicContact CD2-CD1 4.3Å; Y46-I128 HydrophobicContact CD2-CG1 4.33Å; L74-I128 HydrophobicContact CB-CD1 4.12Å; L74-I128 HydrophobicContact CB-CG1 4.34Å; L74-I128 HydrophobicContact CB-CG2 3.92Å; L74-I128 HydrophobicContact CD1-CG1 4.27Å; V75-I128 HydrophobicContact CG2-CG2 4.06Å; V121-I128 HydrophobicContact CB-CD1 3.79Å; V121-I128 HydrophobicContact CG1-CD1 4.24Å; V121-I128 WeakPolarHBondContact O-CD1 3.4Å; F125-I128 HydrophobicContact CD2-CD1 4.44Å; F125-I128 PolarHBondContact O-N 3.31Å; F125-I128 VanDerWaalsContact O-N 3.11Å; I128-L130 VanDerWaalsContact C-N 3.33Å; I128-L130 PolarHBondContact O-N 2.85Å; I128-E131 PolarHBondContact O-N 2.95Å; I128-F132 PolarHBondContact O-N 2.63Å
129	S	98.7	Very high	98.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68	-33.4	-179.1	76.9	0	0	0	0	112	F125 P126 F132 R133	F125-S129 WeakPolarHBondContact O-CB 3.36Å; F125-S129 PolarHBondContact O-N 3.35Å; F125-S129 PolarHBondContact O-OG 2.82Å; P126-S129 PolarHBondContact O-N 3.35Å; P126-S129 PolarHBondContact O-OG 2.88Å; P126-S129 VanDerWaalsContact O-OG 3.11Å; S129-F132 WeakPolarHBondContact O-CB 3.46Å; S129-F132 PolarHBondContact O-N 3Å; S129-R133 VanDerWaalsContact CB-NH1 3.27Å; S129-R133 WeakPolarHBondContact O-CG 3.49Å; S129-R133 PolarHBondContact O-N 3.38Å; S129-R133 PolarHBondContact O-NH1 3.06Å; S129-R133 VanDerWaalsContact O-NH1 3.11Å; S129-R133 PolarHBondContact OG-NH1 2.76Å
130	L	98.8	Very high	98.5	Very high	69 Å²	69	37 Å²	37	36%	0.361	19%	0.187	S	C	.	.	H	α-helix	trans	-58.4	-51.3	171.2	174.3	62.5	0	0	0	111	P126 I128 F132 R133 N134	P126-L130 WeakPolarHBondContact O-CB 3.35Å; P126-L130 PolarHBondContact O-N 2.92Å; I128-L130 VanDerWaalsContact C-N 3.33Å; I128-L130 PolarHBondContact O-N 2.85Å; L130-F132 VanDerWaalsContact C-N 3.33Å; L130-F132 PolarHBondContact O-N 3.4Å; L130-R133 PolarHBondContact O-N 2.88Å; L130-R133 VanDerWaalsContact O-N 3.1Å; L130-N134 PolarHBondContact O-N 2.83Å; L130-N134 PolarHBondContact O-ND2 3Å
131	E	98.7	Very high	98.5	Very high	12 Å²	12	37 Å²	37	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-68.8	-31.7	179.5	-68.4	-57.8	155.3	0	0	112.7	S37 S39 L40 I71 T127 I128 N134 L135	S37-E131 PolarHBondContact OG-OE1 2.95Å; S39-E131 VanDerWaalsContact CB-OE1 3.24Å; S39-E131 WeakPolarHBondContact CB-OE1 3.1Å; S39-E131 PolarHBondContact OG-OE1 3.29Å; L40-E131 HydrophobicContact CB-CG 4.18Å; L40-E131 HydrophobicContact CD1-CG 4.41Å; L40-E131 PolarHBondContact N-OE1 3.43Å; I71-E131 HydrophobicContact CD1-CB 3.52Å; I71-E131 HydrophobicContact CD1-CG 4.48Å; I71-E131 HydrophobicContact CG1-CB 4.12Å; T127-E131 PolarHBondContact O-N 3.16Å; I128-E131 PolarHBondContact O-N 2.95Å; E131-N134 PolarHBondContact O-N 3.27Å; E131-N134 PolarHBondContact OE2-ND2 2.65Å; E131-L135 WeakPolarHBondContact O-CG 3.42Å; E131-L135 PolarHBondContact O-N 3.17Å
132	F	98.8	Very high	98.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.9	-48.2	166.6	164.9	-92.7	0	0	0	111.7	I71 L104 Y105 I128 S129 L130 N134 L135 R140 I143 C144	I71-F132 HydrophobicContact CG2-CB 3.67Å; I71-F132 HydrophobicContact CG2-CD2 4.49Å; L104-F132 HydrophobicContact CB-CD1 3.72Å; L104-F132 HydrophobicContact CB-CE1 3.55Å; L104-F132 HydrophobicContact CB-CG 4.36Å; L104-F132 HydrophobicContact CB-CZ 4.02Å; L104-F132 HydrophobicContact CD1-CD2 4.45Å; L104-F132 HydrophobicContact CD1-CE1 4.32Å; L104-F132 HydrophobicContact CD1-CE2 3.98Å; L104-F132 HydrophobicContact CD1-CZ 3.92Å; L104-F132 HydrophobicContact CD2-CD1 4.42Å; L104-F132 HydrophobicContact CD2-CD2 4.4Å; L104-F132 HydrophobicContact CD2-CG 4.24Å; L104-F132 HydrophobicContact CG-CE1 4.42Å; L104-F132 HydrophobicContact CG-CZ 4.5Å; Y105-F132 HydrophobicContact CD1-CE1 4.37Å; Y105-F132 AromaticContact CE1-CE1 3.86Å; Y105-F132 HydrophobicContact CE1-CE1 3.86Å; Y105-F132 HydrophobicContact CE1-CZ 4.42Å; Y105-F132 HydrophobicContact CE2-CE1 4.1Å; Y105-F132 HydrophobicContact CE2-CZ 4.25Å; Y105-F132 AromaticContact CZ-CE1 3.71Å; Y105-F132 AromaticContact CZ-CZ 3.88Å; I128-F132 PolarHBondContact O-N 2.63Å; S129-F132 WeakPolarHBondContact O-CB 3.46Å; S129-F132 PolarHBondContact O-N 3Å; L130-F132 VanDerWaalsContact C-N 3.33Å; L130-F132 PolarHBondContact O-N 3.4Å; F132-N134 PolarHBondContact O-N 3.35Å; F132-L135 WeakPolarHBondContact O-CB 2.92Å; F132-L135 PolarHBondContact O-N 2.88Å; F132-L135 VanDerWaalsContact O-N 3.12Å; F132-R140 HydrophobicContact CD2-CG 4.43Å; F132-R140 HydrophobicContact CE1-CB 4.43Å; F132-R140 HydrophobicContact CE1-CG 4.33Å; F132-R140 HydrophobicContact CE2-CB 3.89Å; F132-R140 HydrophobicContact CE2-CG 4.02Å; F132-R140 HydrophobicContact CZ-CB 3.7Å; F132-R140 HydrophobicContact CZ-CG 3.97Å; F132-R140 VanDerWaalsContact O-CD 3.24Å; F132-R140 WeakPolarHBondContact O-CD 3.39Å; F132-R140 VanDerWaalsContact O-CG 3.31Å; F132-R140 WeakPolarHBondContact O-CG 3.39Å; F132-I143 HydrophobicContact CD2-CB 4.26Å; F132-I143 HydrophobicContact CD2-CD1 4.28Å; F132-I143 HydrophobicContact CD2-CG2 3.83Å; F132-I143 HydrophobicContact CE2-CB 3.86Å; F132-I143 HydrophobicContact CE2-CG2 3.71Å; F132-C144 HydrophobicContact CZ-CB 4.41Å
133	R	98.6	Very high	98.6	Very high	47 Å²	47	37.3 Å²	37.3	18%	0.177	19%	0.191	C	C	.	.	H	α-helix	trans	-65.6	-23.3	178.8	-70.4	-172.5	-60.9	-78	0.5	112.4	L104 S129 L130 R140	L104-R133 PolarHBondContact O-NH1 2.77Å; S129-R133 VanDerWaalsContact CB-NH1 3.27Å; S129-R133 WeakPolarHBondContact O-CG 3.49Å; S129-R133 PolarHBondContact O-N 3.38Å; S129-R133 PolarHBondContact O-NH1 3.06Å; S129-R133 VanDerWaalsContact O-NH1 3.11Å; S129-R133 PolarHBondContact OG-NH1 2.76Å; L130-R133 PolarHBondContact O-N 2.88Å; L130-R133 VanDerWaalsContact O-N 3.1Å; R133-R140 PolarHBondContact O-NH1 3.09Å
134	N	98.3	Very high	98.6	Very high	101 Å²	101	35 Å²	35	54%	0.54	18%	0.182	S	C	.	.	H	α-helix	trans	-77.2	-17.1	174.6	-66.6	-22.3	0	0	0	114.1	L130 E131 F132	L130-N134 PolarHBondContact O-N 2.83Å; L130-N134 PolarHBondContact O-ND2 3Å; E131-N134 PolarHBondContact O-N 3.27Å; E131-N134 PolarHBondContact OE2-ND2 2.65Å; F132-N134 PolarHBondContact O-N 3.35Å
135	L	98.4	Very high	98.6	Very high	19 Å²	19	35.7 Å²	35.7	10%	0.099	19%	0.186	C	C	.	.	S	Bend	trans	-67.3	157.2	178.9	-63	175.9	0	0	0	112.4	H67 A68 I71 E131 F132 R140 I143	H67-L135 HydrophobicContact CB-CD2 4.35Å; A68-L135 HydrophobicContact CB-CD1 4.44Å; A68-L135 HydrophobicContact CB-CD2 4.4Å; I71-L135 HydrophobicContact CB-CD1 4.1Å; I71-L135 HydrophobicContact CG1-CD1 4.44Å; I71-L135 HydrophobicContact CG2-CD1 4.16Å; E131-L135 WeakPolarHBondContact O-CG 3.42Å; E131-L135 PolarHBondContact O-N 3.17Å; F132-L135 WeakPolarHBondContact O-CB 2.92Å; F132-L135 PolarHBondContact O-N 2.88Å; F132-L135 VanDerWaalsContact O-N 3.12Å; L135-R140 HydrophobicContact CB-CG 3.97Å; L135-R140 PolarHBondContact O-NH1 3.35Å; L135-I143 HydrophobicContact CD1-CD1 3.67Å
136	A	98.3	Very high	98.6	Very high	42 Å²	42	35.7 Å²	35.7	35%	0.347	19%	0.186	S	C	.	.			trans	-56.6	146.5	169.3	0	0	0	0	0	111.6	E138 Y139 R140	A136-E138 VanDerWaalsContact C-N 3.26Å; A136-E138 HydrophobicContact CB-CG 4.2Å; A136-E138 PolarHBondContact O-N 2.69Å; A136-Y139 HydrophobicContact CB-CD2 3.87Å; A136-Y139 HydrophobicContact CB-CE2 4.16Å; A136-Y139 PolarHBondContact O-N 2.84Å; A136-R140 PolarHBondContact O-N 3.08Å; A136-R140 VanDerWaalsContact O-N 3.12Å
137	Q	98.4	Very high	98.6	Very high	97 Å²	97	34.2 Å²	34.2	45%	0.453	18%	0.176	S	C	.	.	H	α-helix	trans	-52.4	-43.5	-175.5	-177.4	68.9	39.5	0	0	112.5	Y139 R140 D141	Q137-Y139 VanDerWaalsContact C-N 3.28Å; Q137-Y139 PolarHBondContact O-N 3.33Å; Q137-R140 PolarHBondContact O-N 2.95Å; Q137-R140 VanDerWaalsContact O-N 3.1Å; Q137-D141 PolarHBondContact NE2-OD1 3.03Å; Q137-D141 VanDerWaalsContact O-CG 3.24Å; Q137-D141 PolarHBondContact O-N 3.04Å
138	E	97.8	Very high	98.6	Very high	89 Å²	89	36.8 Å²	36.8	42%	0.416	19%	0.187	S	C	.	.	H	α-helix	trans	-59.8	-34	180	59.2	-170.7	-155.3	0	0	113.6	A136 V142 A189	A136-E138 VanDerWaalsContact C-N 3.26Å; A136-E138 HydrophobicContact CB-CG 4.2Å; A136-E138 PolarHBondContact O-N 2.69Å; E138-V142 WeakPolarHBondContact O-CG2 3.19Å; E138-A189 HydrophobicContact CB-CB 4.4Å; E138-A189 HydrophobicContact CG-CB 4.27Å
139	Y	98.6	Very high	98.6	Very high	9 Å²	9	40.9 Å²	40.9	4%	0.035	20%	0.202	C	C	.	.	H	α-helix	trans	-76.5	-40.5	174	-57.9	-42.2	0	0	0	111.5	E64 A68 A136 Q137 D141 V142 I143 L186 A189 S190	E64-Y139 HydrophobicContact CB-CE2 4.46Å; A68-Y139 HydrophobicContact CB-CD1 4.12Å; A68-Y139 HydrophobicContact CB-CD2 3.87Å; A68-Y139 HydrophobicContact CB-CE1 4.5Å; A68-Y139 HydrophobicContact CB-CE2 4.3Å; A68-Y139 HydrophobicContact CB-CG 3.78Å; A136-Y139 HydrophobicContact CB-CD2 3.87Å; A136-Y139 HydrophobicContact CB-CE2 4.16Å; A136-Y139 PolarHBondContact O-N 2.84Å; Q137-Y139 VanDerWaalsContact C-N 3.28Å; Q137-Y139 PolarHBondContact O-N 3.33Å; Y139-D141 VanDerWaalsContact C-N 3.32Å; Y139-D141 PolarHBondContact O-N 3.39Å; Y139-V142 PolarHBondContact O-N 2.81Å; Y139-I143 WeakPolarHBondContact O-CG1 3.49Å; Y139-I143 PolarHBondContact O-N 3.41Å; Y139-L186 HydrophobicContact CD1-CD2 3.56Å; Y139-L186 HydrophobicContact CE1-CD2 4.5Å; Y139-L186 HydrophobicContact CG-CD2 4.16Å; Y139-A189 HydrophobicContact CD1-CB 4.17Å; Y139-A189 HydrophobicContact CE1-CB 3.93Å; Y139-S190 VanDerWaalsContact OH-CA 3.23Å; Y139-S190 WeakPolarHBondContact OH-CA 3.49Å; Y139-S190 WeakPolarHBondContact OH-CB 3.43Å
140	R	98.8	Very high	98.6	Very high	54 Å²	54	41 Å²	41	20%	0.204	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-43.2	177.5	-65.9	-167.2	-59.5	-123.5	-1.8	111.7	F132 R133 L135 A136 Q137 V142 I143 C144	F132-R140 HydrophobicContact CD2-CG 4.43Å; F132-R140 HydrophobicContact CE1-CB 4.43Å; F132-R140 HydrophobicContact CE1-CG 4.33Å; F132-R140 HydrophobicContact CE2-CB 3.89Å; F132-R140 HydrophobicContact CE2-CG 4.02Å; F132-R140 HydrophobicContact CZ-CB 3.7Å; F132-R140 HydrophobicContact CZ-CG 3.97Å; F132-R140 VanDerWaalsContact O-CD 3.24Å; F132-R140 WeakPolarHBondContact O-CD 3.39Å; F132-R140 VanDerWaalsContact O-CG 3.31Å; F132-R140 WeakPolarHBondContact O-CG 3.39Å; R133-R140 PolarHBondContact O-NH1 3.09Å; L135-R140 HydrophobicContact CB-CG 3.97Å; L135-R140 PolarHBondContact O-NH1 3.35Å; A136-R140 PolarHBondContact O-N 3.08Å; A136-R140 VanDerWaalsContact O-N 3.12Å; Q137-R140 PolarHBondContact O-N 2.95Å; Q137-R140 VanDerWaalsContact O-N 3.1Å; R140-V142 VanDerWaalsContact C-N 3.35Å; R140-V142 PolarHBondContact O-N 3.31Å; R140-I143 PolarHBondContact O-N 2.96Å; R140-C144 WeakPolarHBondContact O-CB 3.4Å; R140-C144 PolarHBondContact O-N 3.35Å
141	D	98.8	Very high	98.6	Very high	77 Å²	77	37.7 Å²	37.7	41%	0.412	19%	0.185	S	C	.	.	H	α-helix	trans	-61.3	-43	179.2	-68.7	-19.3	0	0	0	111.7	Q137 Y139 D145	Q137-D141 PolarHBondContact NE2-OD1 3.03Å; Q137-D141 VanDerWaalsContact O-CG 3.24Å; Q137-D141 PolarHBondContact O-N 3.04Å; Y139-D141 VanDerWaalsContact C-N 3.32Å; Y139-D141 PolarHBondContact O-N 3.39Å; D141-D145 VanDerWaalsContact O-CB 3.29Å; D141-D145 WeakPolarHBondContact O-CB 3.4Å; D141-D145 PolarHBondContact O-N 3.4Å
142	V	98.8	Very high	98.5	Very high	7 Å²	7	40.3 Å²	40.3	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-65.7	-50.4	177.5	174.6	0	0	0	0	111.1	E138 Y139 R140 C144 D145 I146 G182 R185 L186	E138-V142 WeakPolarHBondContact O-CG2 3.19Å; Y139-V142 PolarHBondContact O-N 2.81Å; R140-V142 VanDerWaalsContact C-N 3.35Å; R140-V142 PolarHBondContact O-N 3.31Å; V142-C144 VanDerWaalsContact C-N 3.33Å; V142-C144 PolarHBondContact O-N 3.21Å; V142-D145 PolarHBondContact O-N 2.95Å; V142-I146 HydrophobicContact CG1-CG1 4.41Å; V142-I146 WeakPolarHBondContact O-CB 3.43Å; V142-I146 VanDerWaalsContact O-CG1 3.3Å; V142-I146 WeakPolarHBondContact O-CG1 3.4Å; V142-I146 PolarHBondContact O-N 3.49Å; V142-G182 WeakPolarHBondContact CG1-O 3.45Å; V142-R185 HydrophobicContact CG1-CB 3.84Å; V142-R185 HydrophobicContact CG2-CB 3.79Å; V142-L186 HydrophobicContact CB-CD2 3.88Å; V142-L186 HydrophobicContact CB-CG 4.5Å; V142-L186 HydrophobicContact CG1-CD2 3.9Å; V142-L186 HydrophobicContact CG1-CG 3.97Å; V142-L186 HydrophobicContact CG2-CD2 4.41Å
143	I	98.8	Very high	98.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-43.5	-177.6	-67.6	168.7	0	0	0	110.5	F72 V75 L104 F132 L135 Y139 R140 C147 L186	F72-I143 HydrophobicContact CB-CD1 3.94Å; F72-I143 HydrophobicContact CB-CG1 3.85Å; F72-I143 HydrophobicContact CD2-CB 4.15Å; F72-I143 HydrophobicContact CD2-CG1 3.7Å; F72-I143 HydrophobicContact CD2-CG2 4.03Å; F72-I143 HydrophobicContact CG-CG1 3.97Å; V75-I143 HydrophobicContact CB-CG2 4.4Å; V75-I143 HydrophobicContact CG1-CG2 4.22Å; V75-I143 HydrophobicContact CG2-CG2 4.33Å; L104-I143 HydrophobicContact CD1-CG2 4.39Å; F132-I143 HydrophobicContact CD2-CB 4.26Å; F132-I143 HydrophobicContact CD2-CD1 4.28Å; F132-I143 HydrophobicContact CD2-CG2 3.83Å; F132-I143 HydrophobicContact CE2-CB 3.86Å; F132-I143 HydrophobicContact CE2-CG2 3.71Å; L135-I143 HydrophobicContact CD1-CD1 3.67Å; Y139-I143 WeakPolarHBondContact O-CG1 3.49Å; Y139-I143 PolarHBondContact O-N 3.41Å; R140-I143 PolarHBondContact O-N 2.96Å; I143-C147 WeakPolarHBondContact O-CB 3.44Å; I143-C147 PolarHBondContact O-N 2.68Å; I143-L186 HydrophobicContact CG1-CD2 4.48Å
144	C	98.8	Very high	98.4	Very high	19 Å²	19	38 Å²	38	13%	0.128	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-47.7	179	-174.1	0	0	0	0	112.2	L104 F132 R140 V142 I146 C147 Q148	L104-C144 HydrophobicContact CD1-CB 4.31Å; F132-C144 HydrophobicContact CZ-CB 4.41Å; R140-C144 WeakPolarHBondContact O-CB 3.4Å; R140-C144 PolarHBondContact O-N 3.35Å; V142-C144 VanDerWaalsContact C-N 3.33Å; V142-C144 PolarHBondContact O-N 3.21Å; C144-I146 PolarHBondContact O-N 3.43Å; C144-C147 PolarHBondContact O-N 3.45Å; C144-Q148 WeakPolarHBondContact O-CB 3.38Å; C144-Q148 PolarHBondContact O-N 3.45Å
145	D	98.8	Very high	98.3	Very high	49 Å²	49	33.5 Å²	33.5	26%	0.262	17%	0.17	S	C	.	.	H	α-helix	trans	-59.4	-46.9	177.8	172.2	68.8	0	0	0	111.6	D141 V142 Q148 R149 R185	D141-D145 VanDerWaalsContact O-CB 3.29Å; D141-D145 WeakPolarHBondContact O-CB 3.4Å; D141-D145 PolarHBondContact O-N 3.4Å; V142-D145 PolarHBondContact O-N 2.95Å; D145-Q148 PolarHBondContact O-N 3.12Å; D145-R149 VanDerWaalsContact O-CG 3.31Å; D145-R149 WeakPolarHBondContact O-CG 3.17Å; D145-R149 PolarHBondContact O-N 3.45Å; D145-R149 IonicContact OD2-NH1 2.61Å; D145-R149 PolarHBondContact OD2-NH1 3.45Å; D145-R185 IonicContact OD2-CZ 3.12Å; D145-R185 IonicContact OD2-NH1 2.75Å; D145-R185 PolarHBondContact OD2-NH1 2.63Å
146	I	98.7	Very high	98.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.7	-46.9	179.2	-64.4	-60.2	0	0	0	110.7	F72 V142 C144 Q148 R149 M150 L178 I181	F72-I146 HydrophobicContact CE2-CB 4.04Å; F72-I146 HydrophobicContact CE2-CG2 3.83Å; F72-I146 HydrophobicContact CZ-CB 4.12Å; F72-I146 HydrophobicContact CZ-CG1 4.42Å; F72-I146 HydrophobicContact CZ-CG2 3.7Å; V142-I146 HydrophobicContact CG1-CG1 4.41Å; V142-I146 WeakPolarHBondContact O-CB 3.43Å; V142-I146 VanDerWaalsContact O-CG1 3.3Å; V142-I146 WeakPolarHBondContact O-CG1 3.4Å; V142-I146 PolarHBondContact O-N 3.49Å; C144-I146 PolarHBondContact O-N 3.43Å; I146-Q148 VanDerWaalsContact C-N 3.26Å; I146-Q148 PolarHBondContact O-N 2.9Å; I146-R149 PolarHBondContact O-N 3.09Å; I146-M150 HydrophobicContact CG2-CG 3.92Å; I146-M150 HydrophobicContact CG2-SD 3.6Å; I146-M150 WeakPolarHBondContact O-CB 3.21Å; I146-M150 WeakPolarHBondContact O-CG 3.29Å; I146-M150 PolarHBondContact O-N 3.06Å; I146-L178 HydrophobicContact CD1-CB 4.41Å; I146-L178 HydrophobicContact CD1-CD2 4.25Å; I146-L178 WeakPolarHBondContact CD1-O 3.13Å; I146-L178 HydrophobicContact CG2-CB 4.08Å; I146-I181 HydrophobicContact CD1-CG2 4.27Å
147	C	98.7	Very high	97.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.5	-41.2	177.7	-175	0	0	0	0	112.2	V75 F100 H101 L104 I143 C144 G151	V75-C147 HydrophobicContact CG1-CB 4.27Å; F100-C147 VanDerWaalsContact CD1-SG 3.57Å; H101-C147 HydrophobicContact CB-CB 4.17Å; L104-C147 HydrophobicContact CD1-CB 4.48Å; I143-C147 WeakPolarHBondContact O-CB 3.44Å; I143-C147 PolarHBondContact O-N 2.68Å; C144-C147 PolarHBondContact O-N 3.45Å; C147-G151 PolarHBondContact O-N 3.37Å
148	Q	98.8	Very high	97.5	Very high	82 Å²	82	32.3 Å²	32.3	38%	0.383	16%	0.157	S	C	.	.	H	α-helix	trans	-62.7	-51.7	176.9	-177.7	-179.5	16.6	0	0	111.3	H101 C144 D145 I146 M150 G151 V152	H101-Q148 HydrophobicContact CB-CB 3.88Å; C144-Q148 WeakPolarHBondContact O-CB 3.38Å; C144-Q148 PolarHBondContact O-N 3.45Å; D145-Q148 PolarHBondContact O-N 3.12Å; I146-Q148 VanDerWaalsContact C-N 3.26Å; I146-Q148 PolarHBondContact O-N 2.9Å; Q148-M150 VanDerWaalsContact C-N 3.34Å; Q148-M150 PolarHBondContact O-N 3.43Å; Q148-G151 PolarHBondContact O-N 2.83Å; Q148-V152 WeakPolarHBondContact O-CG2 3.42Å; Q148-V152 PolarHBondContact O-N 3.16Å
149	R	98.8	Very high	96.9	Very high	86 Å²	86	35.3 Å²	35.3	33%	0.325	17%	0.171	S	C	.	.	H	α-helix	trans	-64.8	-38	-177.5	-68.7	167.2	61.4	-172	2	112.1	D145 I146 G153 L178	D145-R149 VanDerWaalsContact O-CG 3.31Å; D145-R149 WeakPolarHBondContact O-CG 3.17Å; D145-R149 PolarHBondContact O-N 3.45Å; D145-R149 IonicContact OD2-NH1 2.61Å; D145-R149 PolarHBondContact OD2-NH1 3.45Å; I146-R149 PolarHBondContact O-N 3.09Å; R149-G153 PolarHBondContact O-N 2.93Å; R149-G153 VanDerWaalsContact O-N 3.1Å; R149-L178 HydrophobicContact CB-CD1 3.61Å; R149-L178 HydrophobicContact CB-CD2 4.41Å
150	M	98.5	Very high	96.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-63.6	-49.7	173.8	-68.7	-172.3	62.3	0	0	110.8	L76 L79 I146 Q148 V152 G153 M154 Y174 L178 V179	L76-M150 HydrophobicContact CD1-CE 4.33Å; L76-M150 HydrophobicContact CD1-SD 3.87Å; L76-M150 HydrophobicContact CD2-CE 4.09Å; L76-M150 HydrophobicContact CD2-SD 3.42Å; L76-M150 WeakPolarHBondContact CD2-SD 3.33Å; L76-M150 HydrophobicContact CG-SD 4.25Å; L79-M150 HydrophobicContact CD2-CB 3.69Å; I146-M150 HydrophobicContact CG2-CG 3.92Å; I146-M150 HydrophobicContact CG2-SD 3.6Å; I146-M150 WeakPolarHBondContact O-CB 3.21Å; I146-M150 WeakPolarHBondContact O-CG 3.29Å; I146-M150 PolarHBondContact O-N 3.06Å; Q148-M150 VanDerWaalsContact C-N 3.34Å; Q148-M150 PolarHBondContact O-N 3.43Å; M150-V152 VanDerWaalsContact C-N 3.35Å; M150-V152 PolarHBondContact O-N 3.4Å; M150-G153 PolarHBondContact O-N 2.76Å; M150-G153 VanDerWaalsContact O-N 3.1Å; M150-M154 HydrophobicContact CE-CE 3.82Å; M150-M154 WeakPolarHBondContact O-CB 3.33Å; M150-M154 VanDerWaalsContact O-CG 3.3Å; M150-M154 WeakPolarHBondContact O-CG 3.49Å; M150-M154 PolarHBondContact O-N 3.17Å; M150-Y174 VanDerWaalsContact CG-O 3.26Å; M150-Y174 WeakPolarHBondContact CG-O 3.49Å; M150-L178 HydrophobicContact CB-CD1 4.37Å; M150-L178 HydrophobicContact CG-CB 3.8Å; M150-L178 HydrophobicContact CG-CD1 3.59Å; M150-L178 HydrophobicContact CG-CG 4.35Å; M150-L178 HydrophobicContact SD-CB 4.28Å; M150-V179 HydrophobicContact CE-CG2 3.76Å; M150-V179 HydrophobicContact SD-CG2 3.8Å
151	G	98.2	Very high	95.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-41.7	-179.9	0	0	0	0	0	113.5	L97 C147 Q148 A155	L97-G151 WeakPolarHBondContact O-CA 3.41Å; C147-G151 PolarHBondContact O-N 3.37Å; Q148-G151 PolarHBondContact O-N 2.83Å; G151-A155 WeakPolarHBondContact O-CB 3.37Å; G151-A155 PolarHBondContact O-N 3.45Å
152	V	98	Very high	95.6	Very high	67 Å²	67	40.9 Å²	40.9	41%	0.406	19%	0.194	S	C	.	.	H	α-helix	trans	-62.3	-45.5	173.7	172.1	0	0	0	0	111.2	Q148 M150 A155 E156	Q148-V152 WeakPolarHBondContact O-CG2 3.42Å; Q148-V152 PolarHBondContact O-N 3.16Å; M150-V152 VanDerWaalsContact C-N 3.35Å; M150-V152 PolarHBondContact O-N 3.4Å; V152-A155 PolarHBondContact O-N 2.9Å; V152-E156 PolarHBondContact O-N 3.37Å
153	G	97.3	Very high	95.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.5	-42.2	-179.9	0	0	0	0	0	113.9	R149 M150 E156 F157 Y174	R149-G153 PolarHBondContact O-N 2.93Å; R149-G153 VanDerWaalsContact O-N 3.1Å; M150-G153 PolarHBondContact O-N 2.76Å; M150-G153 VanDerWaalsContact O-N 3.1Å; G153-E156 WeakPolarHBondContact O-CB 3.13Å; G153-E156 PolarHBondContact O-N 2.94Å; G153-F157 WeakPolarHBondContact O-CD2 3.26Å; G153-F157 PolarHBondContact O-N 3.11Å; G153-Y174 VanDerWaalsContact CA-CE2 3.47Å; G153-Y174 VanDerWaalsContact CA-CG 3.43Å
154	M	96.4	Very high	95.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-45.6	174.3	-70.4	165.9	166.8	0	0	110.5	L79 D80 E83 L97 M150 E156 F157 L158 V175	L79-M154 HydrophobicContact CD1-SD 4.33Å; L79-M154 HydrophobicContact CD2-CE 4.13Å; L79-M154 HydrophobicContact CD2-SD 3.75Å; L79-M154 HydrophobicContact CG-CE 4.26Å; L79-M154 HydrophobicContact CG-SD 3.69Å; D80-M154 VanDerWaalsContact OD1-CE 3.23Å; D80-M154 WeakPolarHBondContact OD1-CE 3.38Å; E83-M154 HydrophobicContact CB-SD 4.26Å; E83-M154 HydrophobicContact CG-CB 4.22Å; E83-M154 HydrophobicContact CG-CG 4.27Å; E83-M154 HydrophobicContact CG-SD 4.47Å; E83-M154 WeakPolarHBondContact OE2-CE 3.27Å; L97-M154 HydrophobicContact CD1-CB 3.99Å; L97-M154 HydrophobicContact CD2-SD 4.43Å; M150-M154 HydrophobicContact CE-CE 3.82Å; M150-M154 WeakPolarHBondContact O-CB 3.33Å; M150-M154 VanDerWaalsContact O-CG 3.3Å; M150-M154 WeakPolarHBondContact O-CG 3.49Å; M150-M154 PolarHBondContact O-N 3.17Å; M154-E156 VanDerWaalsContact C-N 3.3Å; M154-E156 PolarHBondContact O-N 3.41Å; M154-F157 CarbonylContact O-C 3.38Å; M154-F157 PolarHBondContact O-N 3.49Å; M154-F157 VanDerWaalsContact O-N 3.08Å; M154-L158 WeakPolarHBondContact O-CG 3.37Å; M154-L158 PolarHBondContact O-N 2.98Å; M154-V175 HydrophobicContact CE-CB 4.41Å; M154-V175 HydrophobicContact CE-CG1 3.98Å; M154-V175 HydrophobicContact CG-CG1 4.02Å
155	A	96.4	Very high	95.5	Very high	6 Å²	6	44 Å²	44	5%	0.05	22%	0.217	C	C	.	.	H	α-helix	trans	-58.6	-40	175.9	0	0	0	0	0	112.7	V94 L97 G151 V152 F157 L158	V94-A155 HydrophobicContact CG1-CB 4.28Å; L97-A155 HydrophobicContact CB-CB 4.45Å; G151-A155 WeakPolarHBondContact O-CB 3.37Å; G151-A155 PolarHBondContact O-N 3.45Å; V152-A155 PolarHBondContact O-N 2.9Å; A155-F157 VanDerWaalsContact C-N 3.29Å; A155-F157 PolarHBondContact O-N 3.45Å; A155-L158 PolarHBondContact O-N 2.94Å
156	E	95.1	Very high	95.4	Very high	69 Å²	69	49.7 Å²	49.7	32%	0.322	24%	0.24	S	C	.	.	H	α-helix	trans	-58.1	-39.9	174.9	-169	-168.8	148.1	0	0	112.2	V152 G153 M154 K160 Y174	V152-E156 PolarHBondContact O-N 3.37Å; G153-E156 WeakPolarHBondContact O-CB 3.13Å; G153-E156 PolarHBondContact O-N 2.94Å; M154-E156 VanDerWaalsContact C-N 3.3Å; M154-E156 PolarHBondContact O-N 3.41Å; E156-K160 WeakPolarHBondContact O-CG 3.38Å; E156-K160 WeakPolarHBondContact OE1-CE 3.46Å; E156-K160 IonicContact OE1-NZ 3.64Å; E156-K160 PolarHBondContact OE1-NZ 3.28Å; E156-Y174 WeakPolarHBondContact OE2-CE2 3.46Å; E156-Y174 PolarHBondContact OE2-OH 2.63Å
157	F	94.3	Very high	95.4	Very high	20 Å²	20	52.4 Å²	52.4	9%	0.088	25%	0.253	C	S	.	.	H	α-helix	trans	-88.3	-4.9	-178.3	-80.8	-86.9	0	0	0	114.8	G153 M154 A155 E159 K160 V162 E167 L170 Y171 Y174	G153-F157 WeakPolarHBondContact O-CD2 3.26Å; G153-F157 PolarHBondContact O-N 3.11Å; M154-F157 CarbonylContact O-C 3.38Å; M154-F157 PolarHBondContact O-N 3.49Å; M154-F157 VanDerWaalsContact O-N 3.08Å; A155-F157 VanDerWaalsContact C-N 3.29Å; A155-F157 PolarHBondContact O-N 3.45Å; F157-E159 VanDerWaalsContact C-N 3.34Å; F157-K160 HydrophobicContact CD1-CG 4.18Å; F157-K160 VanDerWaalsContact CE1-CE 3.46Å; F157-V162 HydrophobicContact CD1-CG2 4.1Å; F157-V162 HydrophobicContact CE1-CG2 4.06Å; F157-E167 HydrophobicContact CE1-CB 4.38Å; F157-E167 HydrophobicContact CZ-CB 4.45Å; F157-E167 WeakPolarHBondContact CZ-O 3.34Å; F157-L170 HydrophobicContact CE2-CB 4.45Å; F157-L170 HydrophobicContact CE2-CD2 4.2Å; F157-L170 HydrophobicContact CE2-CG 4.02Å; F157-L170 HydrophobicContact CZ-CB 4.22Å; F157-L170 HydrophobicContact CZ-CD2 4.24Å; F157-L170 HydrophobicContact CZ-CG 4.21Å; F157-Y171 HydrophobicContact CB-CD2 3.9Å; F157-Y171 HydrophobicContact CB-CE2 4.33Å; F157-Y171 HydrophobicContact CD1-CD2 4.02Å; F157-Y171 HydrophobicContact CD1-CG 4.42Å; F157-Y171 HydrophobicContact CD2-CD2 4.03Å; F157-Y171 AromaticContact CG-CD2 3.72Å; F157-Y171 HydrophobicContact CG-CD2 3.72Å; F157-Y171 HydrophobicContact CG-CG 4.48Å; F157-Y174 AromaticContact CD2-CD2 3.87Å; F157-Y174 HydrophobicContact CD2-CD2 3.87Å; F157-Y174 HydrophobicContact CD2-CE2 4.11Å; F157-Y174 AromaticContact CE2-CD2 3.69Å; F157-Y174 HydrophobicContact CE2-CD2 3.69Å; F157-Y174 AromaticContact CE2-CE2 3.75Å; F157-Y174 HydrophobicContact CE2-CE2 3.75Å
158	L	90.2	Very high	95.4	Very high	43 Å²	43	52.4 Å²	52.4	23%	0.225	25%	0.253	C	S	.	.	H	α-helix	trans	-73.4	-29	165.7	-70.9	176.5	0	0	0	112.3	L90 K93 V94 L97 M154 A155	L90-L158 HydrophobicContact CD2-CB 4.06Å; L90-L158 HydrophobicContact CD2-CD1 4.15Å; L90-L158 HydrophobicContact CD2-CD2 4.47Å; L90-L158 HydrophobicContact CD2-CG 4.48Å; K93-L158 HydrophobicContact CB-CD1 4.48Å; K93-L158 HydrophobicContact CD-CD1 3.43Å; K93-L158 VanDerWaalsContact CD-CD1 3.43Å; K93-L158 HydrophobicContact CD-CD2 4.01Å; K93-L158 HydrophobicContact CD-CG 4.39Å; K93-L158 HydrophobicContact CG-CD1 3.78Å; V94-L158 HydrophobicContact CG2-CD1 4.16Å; L97-L158 HydrophobicContact CD1-CD1 3.49Å; L97-L158 VanDerWaalsContact CD1-CD1 3.49Å; L97-L158 HydrophobicContact CD1-CG 4.43Å; M154-L158 WeakPolarHBondContact O-CG 3.37Å; M154-L158 PolarHBondContact O-N 2.98Å; A155-L158 PolarHBondContact O-N 2.94Å
159	E	84.3	Confident	95.4	Very high	152 Å²	152	50.6 Å²	50.6	71%	0.71	25%	0.246	S	C	*	.	S	Bend	trans	-92.5	-8.4	-177.1	-62.1	-173.8	157.7	0	0	113.2	F157	F157-E159 VanDerWaalsContact C-N 3.34Å
160	K	87.9	Confident	95.3	Very high	64 Å²	64	49.3 Å²	49.3	28%	0.278	25%	0.245	S	C	.	.	S	Bend	trans	-143.3	150.1	-178.7	76.3	-173.8	-175.4	173.2	0	112.9	E156 F157 E167	E156-K160 WeakPolarHBondContact O-CG 3.38Å; E156-K160 WeakPolarHBondContact OE1-CE 3.46Å; E156-K160 IonicContact OE1-NZ 3.64Å; E156-K160 PolarHBondContact OE1-NZ 3.28Å; F157-K160 HydrophobicContact CD1-CG 4.18Å; F157-K160 VanDerWaalsContact CE1-CE 3.46Å; K160-E167 IonicContact NZ-OE1 3.75Å
161	K	87.9	Confident	95.3	Very high	182 Å²	182	49.8 Å²	49.8	79%	0.791	25%	0.247	S	C	*	.			trans	-84.9	154.1	172	-62.8	-170.8	176.8	-168.8	0	111.1	G163	K161-G163 PolarHBondContact O-N 2.95Å
162	V	93.9	Very high	95.3	Very high	11 Å²	11	49.8 Å²	49.8	7%	0.067	25%	0.247	C	C	.	.			trans	-68.6	102.4	173.3	-174.2	0	0	0	0	110	F157 E167 W168 Y171 P232 K233	F157-V162 HydrophobicContact CD1-CG2 4.1Å; F157-V162 HydrophobicContact CE1-CG2 4.06Å; V162-E167 HydrophobicContact CG1-CB 4.32Å; V162-W168 HydrophobicContact CG1-CB 3.66Å; V162-W168 HydrophobicContact CG1-CG 4.24Å; V162-Y171 HydrophobicContact CG2-CG 4.42Å; V162-P232 HydrophobicContact CG1-CB 4.04Å; V162-K233 PolarHBondContact O-N 3.01Å; V162-K233 VanDerWaalsContact O-N 3.13Å
163	G	96.1	Very high	95.4	Very high	25 Å²	25	48.6 Å²	48.6	26%	0.258	24%	0.236	S	C	.	.			trans	-85.5	-61.9	-177	0	0	0	0	0	112.7	K161 E167 K233 E234	K161-G163 PolarHBondContact O-N 2.95Å; G163-E167 WeakPolarHBondContact CA-OE2 3.33Å; G163-E167 PolarHBondContact N-OE2 3.29Å; G163-K233 CarbonylContact O-C 3.54Å; G163-K233 WeakPolarHBondContact O-CA 3.5Å; G163-K233 WeakPolarHBondContact O-CB 3.47Å; G163-K233 PolarHBondContact O-N 2.78Å; G163-K233 VanDerWaalsContact O-N 3.07Å; G163-E234 PolarHBondContact O-N 3.41Å
164	S	98.1	Very high	95.4	Very high	32 Å²	32	50.5 Å²	50.5	22%	0.224	24%	0.244	C	C	.	.	S	Bend	trans	-99.4	164.4	-174.9	63	0	0	0	0	113.8	K166 E167 W168 E234	S164-K166 PolarHBondContact O-N 3.4Å; S164-E167 PolarHBondContact N-OE2 3.19Å; S164-E167 PolarHBondContact O-N 3.33Å; S164-E167 VanDerWaalsContact O-N 3.16Å; S164-E167 WeakPolarHBondContact OG-CG 3.32Å; S164-E167 PolarHBondContact OG-N 3.43Å; S164-E167 VanDerWaalsContact OG-N 3.07Å; S164-E167 PolarHBondContact OG-OE2 2.92Å; S164-W168 PolarHBondContact O-N 2.9Å; S164-E234 WeakPolarHBondContact CA-OE2 3.49Å; S164-E234 VanDerWaalsContact CB-OE2 3.26Å; S164-E234 WeakPolarHBondContact CB-OE2 3.31Å
165	M	98	Very high	95.3	Very high	34 Å²	34	51.1 Å²	51.1	17%	0.167	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-34.5	170.2	-66.1	-61.1	-66.2	0	0	111.7	W168 D169 P232 E234 A235 L262 D265	M165-W168 HydrophobicContact CE-CE3 3.79Å; M165-W168 HydrophobicContact CE-CZ3 3.95Å; M165-W168 WeakPolarHBondContact O-CB 3.25Å; M165-W168 PolarHBondContact O-N 2.85Å; M165-W168 HydrophobicContact SD-CE3 4.39Å; M165-D169 PolarHBondContact O-N 2.9Å; M165-P232 HydrophobicContact SD-CB 4.1Å; M165-P232 HydrophobicContact SD-CG 3.39Å; M165-P232 WeakPolarHBondContact SD-CG 3.38Å; M165-E234 HydrophobicContact CG-CG 4.43Å; M165-E234 PolarHBondContact N-OE2 3.5Å; M165-A235 HydrophobicContact SD-CB 3.99Å; M165-L262 HydrophobicContact CE-CD2 4.31Å; M165-L262 HydrophobicContact SD-CD2 4.34Å; M165-D265 HydrophobicContact CE-CB 3.71Å
166	K	98.1	Very high	95.3	Very high	170 Å²	170	51.3 Å²	51.3	74%	0.739	25%	0.249	S	C	*	.	H	α-helix	trans	-68.3	-38.7	175.4	-174.4	-178.3	178.4	-175.9	0	112.2	S164 W168 D169 L170	S164-K166 PolarHBondContact O-N 3.4Å; K166-W168 VanDerWaalsContact C-N 3.28Å; K166-D169 WeakPolarHBondContact O-CB 3.31Å; K166-D169 PolarHBondContact O-N 3.4Å; K166-L170 PolarHBondContact O-N 3.1Å
167	E	98	Very high	95.4	Very high	57 Å²	57	48 Å²	48	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-68.2	-31.7	173	-75.5	173.4	135.6	0	0	111.7	F157 K160 V162 G163 S164 L170 Y171	F157-E167 HydrophobicContact CE1-CB 4.38Å; F157-E167 HydrophobicContact CZ-CB 4.45Å; F157-E167 WeakPolarHBondContact CZ-O 3.34Å; K160-E167 IonicContact NZ-OE1 3.75Å; V162-E167 HydrophobicContact CG1-CB 4.32Å; G163-E167 WeakPolarHBondContact CA-OE2 3.33Å; G163-E167 PolarHBondContact N-OE2 3.29Å; S164-E167 PolarHBondContact N-OE2 3.19Å; S164-E167 PolarHBondContact O-N 3.33Å; S164-E167 VanDerWaalsContact O-N 3.16Å; S164-E167 WeakPolarHBondContact OG-CG 3.32Å; S164-E167 PolarHBondContact OG-N 3.43Å; S164-E167 VanDerWaalsContact OG-N 3.07Å; S164-E167 PolarHBondContact OG-OE2 2.92Å; E167-L170 PolarHBondContact O-N 3.31Å; E167-Y171 WeakPolarHBondContact O-CB 3.2Å; E167-Y171 PolarHBondContact O-N 3.01Å
168	W	98.4	Very high	95.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-41.2	172.9	-168.6	42.6	0	0	0	111.9	V162 S164 M165 K166 L170 Y171 C172 K213 I216 I217 F230 P232 L262 D265	V162-W168 HydrophobicContact CG1-CB 3.66Å; V162-W168 HydrophobicContact CG1-CG 4.24Å; S164-W168 PolarHBondContact O-N 2.9Å; M165-W168 HydrophobicContact CE-CE3 3.79Å; M165-W168 HydrophobicContact CE-CZ3 3.95Å; M165-W168 WeakPolarHBondContact O-CB 3.25Å; M165-W168 PolarHBondContact O-N 2.85Å; M165-W168 HydrophobicContact SD-CE3 4.39Å; K166-W168 VanDerWaalsContact C-N 3.28Å; W168-L170 VanDerWaalsContact C-N 3.33Å; W168-Y171 PolarHBondContact O-N 2.71Å; W168-C172 WeakPolarHBondContact O-CB 3.33Å; W168-C172 PolarHBondContact O-N 3.21Å; W168-C172 PolarHBondContact O-SG 3.44Å; W168-K213 HydrophobicContact CD2-CD 4.5Å; W168-K213 HydrophobicContact CD2-CG 4.48Å; W168-K213 HydrophobicContact CE3-CD 4.1Å; W168-K213 HydrophobicContact CH2-CB 3.85Å; W168-K213 HydrophobicContact CH2-CD 3.7Å; W168-K213 HydrophobicContact CH2-CG 3.68Å; W168-K213 HydrophobicContact CZ2-CB 3.89Å; W168-K213 HydrophobicContact CZ2-CD 4.11Å; W168-K213 HydrophobicContact CZ2-CG 3.61Å; W168-K213 HydrophobicContact CZ3-CD 3.7Å; W168-K213 HydrophobicContact CZ3-CG 4.15Å; W168-I216 HydrophobicContact CZ2-CB 4.43Å; W168-I216 HydrophobicContact CZ2-CG2 4.03Å; W168-I217 HydrophobicContact CH2-CD1 4.25Å; W168-I217 HydrophobicContact CH2-CG1 4.34Å; W168-F230 PolarHBondContact NE1-O 3.46Å; W168-P232 HydrophobicContact CB-CB 4.06Å; W168-P232 HydrophobicContact CB-CG 4.05Å; W168-P232 HydrophobicContact CD2-CG 3.99Å; W168-P232 HydrophobicContact CE3-CG 3.98Å; W168-P232 HydrophobicContact CG-CB 4.45Å; W168-P232 HydrophobicContact CG-CG 4.03Å; W168-L262 HydrophobicContact CE3-CD2 4.38Å; W168-L262 HydrophobicContact CH2-CB 4.24Å; W168-L262 HydrophobicContact CH2-CD2 4.04Å; W168-L262 HydrophobicContact CZ3-CD2 3.79Å; W168-D265 HydrophobicContact CZ3-CB 4.44Å; W168-D265 WeakPolarHBondContact CZ3-OD2 3.26Å
169	D	98.6	Very high	96	Very high	44 Å²	44	46.8 Å²	46.8	24%	0.235	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-42.7	170.1	-74.7	-19.2	0	0	0	112.2	M165 K166 C172 H173 L209 K213 R268	M165-D169 PolarHBondContact O-N 2.9Å; K166-D169 WeakPolarHBondContact O-CB 3.31Å; K166-D169 PolarHBondContact O-N 3.4Å; D169-C172 PolarHBondContact O-N 3.12Å; D169-H173 WeakPolarHBondContact O-CB 3.39Å; D169-H173 PolarHBondContact O-N 3.4Å; D169-L209 HydrophobicContact CB-CD2 4.41Å; D169-K213 VanDerWaalsContact OD1-CE 3.28Å; D169-K213 WeakPolarHBondContact OD1-CE 3.38Å; D169-K213 IonicContact OD1-NZ 2.7Å; D169-K213 PolarHBondContact OD1-NZ 3.21Å; D169-R268 IonicContact OD1-CZ 3.95Å; D169-R268 IonicContact OD1-NH2 3.2Å; D169-R268 PolarHBondContact OD1-NH2 3.42Å; D169-R268 IonicContact OD2-CZ 2.99Å; D169-R268 IonicContact OD2-NH2 2.78Å; D169-R268 PolarHBondContact OD2-NH2 2.85Å
170	L	98.4	Very high	96.6	Very high	59 Å²	59	40 Å²	40	31%	0.309	20%	0.2	S	C	.	.	H	α-helix	trans	-67.3	-42.4	179.5	-177.5	62.7	0	0	0	111.9	F157 K166 E167 W168 H173 Y174	F157-L170 HydrophobicContact CE2-CB 4.45Å; F157-L170 HydrophobicContact CE2-CD2 4.2Å; F157-L170 HydrophobicContact CE2-CG 4.02Å; F157-L170 HydrophobicContact CZ-CB 4.22Å; F157-L170 HydrophobicContact CZ-CD2 4.24Å; F157-L170 HydrophobicContact CZ-CG 4.21Å; K166-L170 PolarHBondContact O-N 3.1Å; E167-L170 PolarHBondContact O-N 3.31Å; W168-L170 VanDerWaalsContact C-N 3.33Å; L170-H173 WeakPolarHBondContact O-CB 3.45Å; L170-H173 PolarHBondContact O-N 3.44Å; L170-Y174 HydrophobicContact CD1-CD2 4.42Å; L170-Y174 HydrophobicContact CD1-CE1 4.35Å; L170-Y174 HydrophobicContact CD1-CE2 3.85Å; L170-Y174 HydrophobicContact CD2-CE2 4.22Å; L170-Y174 HydrophobicContact CG-CD2 4.22Å; L170-Y174 HydrophobicContact CG-CE2 3.72Å; L170-Y174 VanDerWaalsContact O-CD2 3.31Å; L170-Y174 WeakPolarHBondContact O-CD2 3.47Å; L170-Y174 PolarHBondContact O-N 3.41Å
171	Y	97.9	Very high	97.1	Very high	11 Å²	11	37.3 Å²	37.3	4%	0.043	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-51.3	173	175.3	-106.7	0	0	0	110.4	F157 V162 E167 W168 H173 Y174 V175 I216 F230	F157-Y171 HydrophobicContact CB-CD2 3.9Å; F157-Y171 HydrophobicContact CB-CE2 4.33Å; F157-Y171 HydrophobicContact CD1-CD2 4.02Å; F157-Y171 HydrophobicContact CD1-CG 4.42Å; F157-Y171 HydrophobicContact CD2-CD2 4.03Å; F157-Y171 AromaticContact CG-CD2 3.72Å; F157-Y171 HydrophobicContact CG-CD2 3.72Å; F157-Y171 HydrophobicContact CG-CG 4.48Å; V162-Y171 HydrophobicContact CG2-CG 4.42Å; E167-Y171 WeakPolarHBondContact O-CB 3.2Å; E167-Y171 PolarHBondContact O-N 3.01Å; W168-Y171 PolarHBondContact O-N 2.71Å; Y171-H173 PolarHBondContact O-N 2.82Å; Y171-Y174 PolarHBondContact O-N 3.06Å; Y171-Y174 VanDerWaalsContact O-N 3.09Å; Y171-V175 HydrophobicContact CD1-CG2 4.36Å; Y171-V175 HydrophobicContact CD2-CG1 4.29Å; Y171-V175 HydrophobicContact CE1-CG2 3.92Å; Y171-V175 HydrophobicContact CE2-CG1 3.68Å; Y171-V175 HydrophobicContact CE2-CG2 4.48Å; Y171-V175 PolarHBondContact O-N 2.95Å; Y171-I216 HydrophobicContact CD1-CD1 4.3Å; Y171-I216 HydrophobicContact CE1-CD1 4.06Å; Y171-F230 HydrophobicContact CD1-CD1 4.47Å; Y171-F230 AromaticContact CE1-CD1 3.67Å; Y171-F230 HydrophobicContact CE1-CD1 3.67Å; Y171-F230 HydrophobicContact CE1-CE1 4.04Å; Y171-F230 HydrophobicContact CE1-CG 4.4Å; Y171-F230 HydrophobicContact CE2-CE1 4.45Å; Y171-F230 AromaticContact CZ-CD1 3.78Å; Y171-F230 AromaticContact CZ-CE1 3.67Å; Y171-F230 VanDerWaalsContact OH-CE1 3.23Å; Y171-F230 WeakPolarHBondContact OH-CE1 3.33Å
172	C	98.3	Very high	97.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-32	177.6	-66.1	0	0	0	0	112.4	W168 D169 A176 G177 L209 Q212	W168-C172 WeakPolarHBondContact O-CB 3.33Å; W168-C172 PolarHBondContact O-N 3.21Å; W168-C172 PolarHBondContact O-SG 3.44Å; D169-C172 PolarHBondContact O-N 3.12Å; C172-A176 PolarHBondContact O-N 3.24Å; C172-G177 PolarHBondContact O-N 2.93Å; C172-L209 HydrophobicContact CB-CD1 4.02Å; C172-L209 HydrophobicContact CB-CG 3.74Å; C172-Q212 HydrophobicContact CB-CB 4.37Å; C172-Q212 HydrophobicContact CB-CG 4.3Å
173	H	98.6	Very high	97.8	Very high	41 Å²	41	29.2 Å²	29.2	19%	0.19	15%	0.154	C	C	.	.	I	π-helix	trans	-59.7	-51.6	172.4	171.2	70.1	0	0	0	110	D169 L170 Y171 G177 L178 N205 L209	D169-H173 WeakPolarHBondContact O-CB 3.39Å; D169-H173 PolarHBondContact O-N 3.4Å; L170-H173 WeakPolarHBondContact O-CB 3.45Å; L170-H173 PolarHBondContact O-N 3.44Å; Y171-H173 PolarHBondContact O-N 2.82Å; H173-G177 CarbonylContact O-C 3.54Å; H173-G177 WeakPolarHBondContact O-CA 3.33Å; H173-G177 PolarHBondContact O-N 3.34Å; H173-G177 VanDerWaalsContact O-N 3.1Å; H173-L178 WeakPolarHBondContact O-CG 3.35Å; H173-L178 PolarHBondContact O-N 2.82Å; H173-N205 PolarHBondContact ND1-OD1 3.45Å; H173-L209 HydrophobicContact CB-CD1 4.42Å
174	Y	98.2	Very high	98	Very high	41 Å²	41	28.1 Å²	28.1	16%	0.161	14%	0.142	C	C	.	.	I	π-helix	trans	-62.2	-50.8	-179.8	-65.7	-46.5	0	0	0	112.2	M150 G153 E156 F157 L170 Y171 L178	M150-Y174 VanDerWaalsContact CG-O 3.26Å; M150-Y174 WeakPolarHBondContact CG-O 3.49Å; G153-Y174 VanDerWaalsContact CA-CE2 3.47Å; G153-Y174 VanDerWaalsContact CA-CG 3.43Å; E156-Y174 WeakPolarHBondContact OE2-CE2 3.46Å; E156-Y174 PolarHBondContact OE2-OH 2.63Å; F157-Y174 AromaticContact CD2-CD2 3.87Å; F157-Y174 HydrophobicContact CD2-CD2 3.87Å; F157-Y174 HydrophobicContact CD2-CE2 4.11Å; F157-Y174 AromaticContact CE2-CD2 3.69Å; F157-Y174 HydrophobicContact CE2-CD2 3.69Å; F157-Y174 AromaticContact CE2-CE2 3.75Å; F157-Y174 HydrophobicContact CE2-CE2 3.75Å; L170-Y174 HydrophobicContact CD1-CD2 4.42Å; L170-Y174 HydrophobicContact CD1-CE1 4.35Å; L170-Y174 HydrophobicContact CD1-CE2 3.85Å; L170-Y174 HydrophobicContact CD2-CE2 4.22Å; L170-Y174 HydrophobicContact CG-CD2 4.22Å; L170-Y174 HydrophobicContact CG-CE2 3.72Å; L170-Y174 VanDerWaalsContact O-CD2 3.31Å; L170-Y174 WeakPolarHBondContact O-CD2 3.47Å; L170-Y174 PolarHBondContact O-N 3.41Å; Y171-Y174 PolarHBondContact O-N 3.06Å; Y171-Y174 VanDerWaalsContact O-N 3.09Å; Y174-L178 HydrophobicContact CD1-CD1 4.16Å
175	V	95.3	Very high	98	Very high	13 Å²	13	30.1 Å²	30.1	8%	0.079	15%	0.145	C	C	.	.	I	π-helix	trans	-85.1	-15.8	-170.9	-55.1	0	0	0	0	114.8	M154 Y171 Q212	M154-V175 HydrophobicContact CE-CB 4.41Å; M154-V175 HydrophobicContact CE-CG1 3.98Å; M154-V175 HydrophobicContact CG-CG1 4.02Å; Y171-V175 HydrophobicContact CD1-CG2 4.36Å; Y171-V175 HydrophobicContact CD2-CG1 4.29Å; Y171-V175 HydrophobicContact CE1-CG2 3.92Å; Y171-V175 HydrophobicContact CE2-CG1 3.68Å; Y171-V175 HydrophobicContact CE2-CG2 4.48Å; Y171-V175 PolarHBondContact O-N 2.95Å; V175-Q212 HydrophobicContact CG2-CG 3.83Å
176	A	94.9	Very high	98	Very high	10 Å²	10	28.5 Å²	28.5	8%	0.083	14%	0.137	C	C	.	.	I	π-helix	trans	-143.2	-37	-176.7	0	0	0	0	0	115	C172 L178 V179 G180 G208 Q212	C172-A176 PolarHBondContact O-N 3.24Å; A176-L178 VanDerWaalsContact C-N 3.33Å; A176-L178 PolarHBondContact O-N 3.01Å; A176-V179 VanDerWaalsContact O-CB 3.31Å; A176-V179 WeakPolarHBondContact O-CB 3.38Å; A176-V179 PolarHBondContact O-N 3.41Å; A176-V179 VanDerWaalsContact O-N 3.09Å; A176-G180 PolarHBondContact O-N 3.32Å; A176-G208 WeakPolarHBondContact CB-O 3.29Å; A176-G208 WeakPolarHBondContact O-CA 3.49Å; A176-Q212 HydrophobicContact CB-CB 3.5Å; A176-Q212 HydrophobicContact CB-CG 3.97Å
177	G	97.5	Very high	98	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.102	C	C	.	.	I	π-helix	trans	-60.3	-43.1	176.6	0	0	0	0	0	112.3	C172 H173 V179 G180 I181 N205	C172-G177 PolarHBondContact O-N 2.93Å; H173-G177 CarbonylContact O-C 3.54Å; H173-G177 WeakPolarHBondContact O-CA 3.33Å; H173-G177 PolarHBondContact O-N 3.34Å; H173-G177 VanDerWaalsContact O-N 3.1Å; G177-V179 VanDerWaalsContact C-N 3.27Å; G177-V179 PolarHBondContact O-N 3.12Å; G177-G180 PolarHBondContact O-N 2.98Å; G177-I181 WeakPolarHBondContact O-CG1 3.34Å; G177-I181 PolarHBondContact O-N 3.35Å; G177-N205 VanDerWaalsContact CA-OD1 3.29Å; G177-N205 WeakPolarHBondContact CA-OD1 3.49Å
178	L	98.6	Very high	98	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.7	-33.8	172.8	-73.2	-178.7	0	0	0	112.5	I146 R149 M150 H173 Y174 A176 I181 G182	I146-L178 HydrophobicContact CD1-CB 4.41Å; I146-L178 HydrophobicContact CD1-CD2 4.25Å; I146-L178 WeakPolarHBondContact CD1-O 3.13Å; I146-L178 HydrophobicContact CG2-CB 4.08Å; R149-L178 HydrophobicContact CB-CD1 3.61Å; R149-L178 HydrophobicContact CB-CD2 4.41Å; M150-L178 HydrophobicContact CB-CD1 4.37Å; M150-L178 HydrophobicContact CG-CB 3.8Å; M150-L178 HydrophobicContact CG-CD1 3.59Å; M150-L178 HydrophobicContact CG-CG 4.35Å; M150-L178 HydrophobicContact SD-CB 4.28Å; H173-L178 WeakPolarHBondContact O-CG 3.35Å; H173-L178 PolarHBondContact O-N 2.82Å; Y174-L178 HydrophobicContact CD1-CD1 4.16Å; A176-L178 VanDerWaalsContact C-N 3.33Å; A176-L178 PolarHBondContact O-N 3.01Å; L178-I181 HydrophobicContact CD2-CD1 4.3Å; L178-I181 PolarHBondContact O-N 3.28Å; L178-G182 PolarHBondContact O-N 3.21Å
179	V	97.9	Very high	98	Very high	37 Å²	37	19.8 Å²	19.8	22%	0.224	10%	0.104	C	C	.	.	H	α-helix	trans	-64.2	-44.9	173.9	-171.7	0	0	0	0	110.5	F72 L76 M150 A176 G177 I181 G182 L183	F72-V179 HydrophobicContact CE1-CG1 4.22Å; L76-V179 HydrophobicContact CD1-CB 4.28Å; L76-V179 HydrophobicContact CD1-CG1 3.91Å; L76-V179 HydrophobicContact CD1-CG2 3.61Å; M150-V179 HydrophobicContact CE-CG2 3.76Å; M150-V179 HydrophobicContact SD-CG2 3.8Å; A176-V179 VanDerWaalsContact O-CB 3.31Å; A176-V179 WeakPolarHBondContact O-CB 3.38Å; A176-V179 PolarHBondContact O-N 3.41Å; A176-V179 VanDerWaalsContact O-N 3.09Å; G177-V179 VanDerWaalsContact C-N 3.27Å; G177-V179 PolarHBondContact O-N 3.12Å; V179-I181 PolarHBondContact O-N 3.31Å; V179-G182 PolarHBondContact O-N 3.14Å; V179-L183 HydrophobicContact CG1-CD1 3.99Å; V179-L183 HydrophobicContact CG1-CG 4.47Å; V179-L183 WeakPolarHBondContact O-CB 3.45Å; V179-L183 VanDerWaalsContact O-CG 3.32Å; V179-L183 WeakPolarHBondContact O-CG 3.47Å; V179-L183 PolarHBondContact O-N 3.09Å
180	G	97.8	Very high	98	Very high	9 Å²	9	18.7 Å²	18.7	9%	0.093	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-43.9	173.7	0	0	0	0	0	112.8	A176 G177 S184	A176-G180 PolarHBondContact O-N 3.32Å; G177-G180 PolarHBondContact O-N 2.98Å; G180-S184 WeakPolarHBondContact O-CB 3.28Å; G180-S184 PolarHBondContact O-N 3.28Å; G180-S184 PolarHBondContact O-OG 2.56Å
181	I	98.8	Very high	97.9	Very high	7 Å²	7	24 Å²	24	4%	0.036	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-45.7	175.6	-67.5	163.7	0	0	0	111.3	I146 G177 L178 V179 S184 R185 T201 A204 N205	I146-I181 HydrophobicContact CD1-CG2 4.27Å; G177-I181 WeakPolarHBondContact O-CG1 3.34Å; G177-I181 PolarHBondContact O-N 3.35Å; L178-I181 HydrophobicContact CD2-CD1 4.3Å; L178-I181 PolarHBondContact O-N 3.28Å; V179-I181 PolarHBondContact O-N 3.31Å; I181-S184 PolarHBondContact O-N 2.69Å; I181-R185 WeakPolarHBondContact O-CG 3.28Å; I181-R185 PolarHBondContact O-N 2.91Å; I181-T201 HydrophobicContact CD1-CG2 4.4Å; I181-T201 HydrophobicContact CG1-CG2 4.31Å; I181-T201 HydrophobicContact CG2-CG2 4.05Å; I181-A204 HydrophobicContact CG1-CB 3.95Å; I181-N205 HydrophobicContact CD1-CB 4.29Å
182	G	98.4	Very high	97.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.6	-51.8	177.8	0	0	0	0	0	112.2	V142 L178 V179 S184 R185 L186	V142-G182 WeakPolarHBondContact CG1-O 3.45Å; L178-G182 PolarHBondContact O-N 3.21Å; V179-G182 PolarHBondContact O-N 3.14Å; G182-S184 VanDerWaalsContact C-N 3.31Å; G182-S184 PolarHBondContact O-N 2.83Å; G182-R185 PolarHBondContact O-N 2.65Å; G182-R185 VanDerWaalsContact O-N 3.15Å; G182-L186 WeakPolarHBondContact O-CG 3.47Å; G182-L186 PolarHBondContact O-N 3.25Å
183	L	98.6	Very high	97.9	Very high	24 Å²	24	26.4 Å²	26.4	13%	0.126	14%	0.137	C	C	.	.	H	α-helix	trans	-56	-46.1	176	-74.9	165.8	0	0	0	111.7	V69 F72 V179 R185 L186 F187 F288	V69-L183 HydrophobicContact CG1-CD2 3.92Å; V69-L183 HydrophobicContact CG2-CD2 3.95Å; F72-L183 HydrophobicContact CD1-CD2 4.05Å; F72-L183 HydrophobicContact CD1-CG 4.27Å; F72-L183 HydrophobicContact CE1-CD2 4.31Å; F72-L183 HydrophobicContact CE1-CG 4.02Å; V179-L183 HydrophobicContact CG1-CD1 3.99Å; V179-L183 HydrophobicContact CG1-CG 4.47Å; V179-L183 WeakPolarHBondContact O-CB 3.45Å; V179-L183 VanDerWaalsContact O-CG 3.32Å; V179-L183 WeakPolarHBondContact O-CG 3.47Å; V179-L183 PolarHBondContact O-N 3.09Å; L183-R185 VanDerWaalsContact C-N 3.31Å; L183-R185 PolarHBondContact O-N 3.3Å; L183-L186 WeakPolarHBondContact O-CB 3.5Å; L183-L186 PolarHBondContact O-N 3.39Å; L183-L186 VanDerWaalsContact O-N 3.12Å; L183-F187 HydrophobicContact CB-CE1 4.35Å; L183-F187 HydrophobicContact CB-CE2 3.99Å; L183-F187 HydrophobicContact CB-CZ 3.73Å; L183-F187 HydrophobicContact CD2-CE1 4.35Å; L183-F187 HydrophobicContact CD2-CZ 4.22Å; L183-F187 HydrophobicContact CG-CZ 4.47Å; L183-F187 VanDerWaalsContact O-CD1 3.26Å; L183-F187 WeakPolarHBondContact O-CD1 3.27Å; L183-F187 VanDerWaalsContact O-CD2 3.27Å; L183-F187 WeakPolarHBondContact O-CD2 3.09Å; L183-F187 WeakPolarHBondContact O-CG 3.15Å; L183-F187 PolarHBondContact O-N 2.75Å; L183-F288 HydrophobicContact CD1-CE1 3.81Å; L183-F288 HydrophobicContact CD1-CZ 4.02Å; L183-F288 HydrophobicContact CD2-CE1 3.78Å; L183-F288 HydrophobicContact CD2-CZ 3.8Å; L183-F288 HydrophobicContact CG-CE1 4.3Å
184	S	98.6	Very high	97.8	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.007	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-41.3	178.2	-55.4	0	0	0	0	112.5	G180 I181 G182 F187 S188 V197 G198 A204 Y276	G180-S184 WeakPolarHBondContact O-CB 3.28Å; G180-S184 PolarHBondContact O-N 3.28Å; G180-S184 PolarHBondContact O-OG 2.56Å; I181-S184 PolarHBondContact O-N 2.69Å; G182-S184 VanDerWaalsContact C-N 3.31Å; G182-S184 PolarHBondContact O-N 2.83Å; S184-F187 PolarHBondContact O-N 3.38Å; S184-S188 PolarHBondContact O-N 3.1Å; S184-S188 VanDerWaalsContact O-N 3.13Å; S184-V197 WeakPolarHBondContact CB-O 3.5Å; S184-G198 WeakPolarHBondContact O-CA 3.49Å; S184-A204 WeakPolarHBondContact OG-CB 3.4Å; S184-Y276 WeakPolarHBondContact CB-OH 3.43Å; S184-Y276 WeakPolarHBondContact OG-CE2 3.37Å; S184-Y276 PolarHBondContact OG-OH 2.86Å
185	R	98.8	Very high	97.8	Very high	75 Å²	75	29.3 Å²	29.3	28%	0.283	16%	0.161	S	C	.	.	H	α-helix	trans	-66.6	-39.9	174.9	-72	170.3	66	-172.5	-0.3	111.9	V142 D145 I181 G182 L183 F187 S188 A189 G198	V142-R185 HydrophobicContact CG1-CB 3.84Å; V142-R185 HydrophobicContact CG2-CB 3.79Å; D145-R185 IonicContact OD2-CZ 3.12Å; D145-R185 IonicContact OD2-NH1 2.75Å; D145-R185 PolarHBondContact OD2-NH1 2.63Å; I181-R185 WeakPolarHBondContact O-CG 3.28Å; I181-R185 PolarHBondContact O-N 2.91Å; G182-R185 PolarHBondContact O-N 2.65Å; G182-R185 VanDerWaalsContact O-N 3.15Å; L183-R185 VanDerWaalsContact C-N 3.31Å; L183-R185 PolarHBondContact O-N 3.3Å; R185-F187 VanDerWaalsContact C-N 3.35Å; R185-S188 PolarHBondContact O-N 3.24Å; R185-A189 VanDerWaalsContact O-CB 3.24Å; R185-A189 WeakPolarHBondContact O-CB 3.43Å; R185-A189 PolarHBondContact O-N 3.42Å; R185-G198 WeakPolarHBondContact CG-O 3.13Å
186	L	98.5	Very high	97.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-40.6	174.2	-65.1	176.8	0	0	0	111.6	L65 V69 F72 Y139 V142 I143 G182 L183 A189 S190	L65-L186 HydrophobicContact CD1-CB 3.92Å; V69-L186 HydrophobicContact CG2-CD1 4.24Å; F72-L186 HydrophobicContact CB-CD1 4.12Å; F72-L186 HydrophobicContact CD1-CD1 3.74Å; F72-L186 HydrophobicContact CE1-CD1 4.43Å; F72-L186 HydrophobicContact CG-CD1 4.1Å; Y139-L186 HydrophobicContact CD1-CD2 3.56Å; Y139-L186 HydrophobicContact CE1-CD2 4.5Å; Y139-L186 HydrophobicContact CG-CD2 4.16Å; V142-L186 HydrophobicContact CB-CD2 3.88Å; V142-L186 HydrophobicContact CB-CG 4.5Å; V142-L186 HydrophobicContact CG1-CD2 3.9Å; V142-L186 HydrophobicContact CG1-CG 3.97Å; V142-L186 HydrophobicContact CG2-CD2 4.41Å; I143-L186 HydrophobicContact CG1-CD2 4.48Å; G182-L186 WeakPolarHBondContact O-CG 3.47Å; G182-L186 PolarHBondContact O-N 3.25Å; L183-L186 WeakPolarHBondContact O-CB 3.5Å; L183-L186 PolarHBondContact O-N 3.39Å; L183-L186 VanDerWaalsContact O-N 3.12Å; L186-A189 PolarHBondContact O-N 2.99Å; L186-S190 WeakPolarHBondContact O-CB 3.24Å; L186-S190 PolarHBondContact O-N 3.16Å; L186-S190 PolarHBondContact O-OG 3.05Å
187	F	98.4	Very high	97.9	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-62.2	-48.6	177.5	-54	-28.8	0	0	0	111.7	L65 V69 L183 S184 R185 S190 E193 V197 V285 F288 C289	L65-F187 HydrophobicContact CD1-CD1 3.87Å; L65-F187 HydrophobicContact CD1-CE1 4.36Å; L65-F187 HydrophobicContact CD2-CD1 3.61Å; L65-F187 HydrophobicContact CD2-CE1 4.07Å; L65-F187 HydrophobicContact CG-CD1 4.32Å; V69-F187 HydrophobicContact CG2-CE1 4.47Å; L183-F187 HydrophobicContact CB-CE1 4.35Å; L183-F187 HydrophobicContact CB-CE2 3.99Å; L183-F187 HydrophobicContact CB-CZ 3.73Å; L183-F187 HydrophobicContact CD2-CE1 4.35Å; L183-F187 HydrophobicContact CD2-CZ 4.22Å; L183-F187 HydrophobicContact CG-CZ 4.47Å; L183-F187 VanDerWaalsContact O-CD1 3.26Å; L183-F187 WeakPolarHBondContact O-CD1 3.27Å; L183-F187 VanDerWaalsContact O-CD2 3.27Å; L183-F187 WeakPolarHBondContact O-CD2 3.09Å; L183-F187 WeakPolarHBondContact O-CG 3.15Å; L183-F187 PolarHBondContact O-N 2.75Å; S184-F187 PolarHBondContact O-N 3.38Å; R185-F187 VanDerWaalsContact C-N 3.35Å; F187-S190 PolarHBondContact O-N 3.01Å; F187-S190 PolarHBondContact O-OG 2.82Å; F187-E193 HydrophobicContact CB-CB 4.07Å; F187-E193 HydrophobicContact CB-CG 3.87Å; F187-V197 HydrophobicContact CD2-CG1 4.47Å; F187-V285 HydrophobicContact CB-CG1 4.36Å; F187-V285 HydrophobicContact CD1-CG1 4.01Å; F187-V285 HydrophobicContact CD1-CG2 4.23Å; F187-V285 HydrophobicContact CD2-CG1 3.61Å; F187-V285 HydrophobicContact CE1-CG1 4.18Å; F187-V285 HydrophobicContact CE2-CG1 3.82Å; F187-V285 HydrophobicContact CG-CG1 3.73Å; F187-V285 HydrophobicContact CG-CG2 4.48Å; F187-V285 HydrophobicContact CZ-CG1 4.08Å; F187-F288 HydrophobicContact CE1-CD1 4.23Å; F187-F288 HydrophobicContact CE1-CE1 4.3Å; F187-F288 AromaticContact CZ-CD1 3.66Å; F187-F288 HydrophobicContact CZ-CD1 3.66Å; F187-F288 AromaticContact CZ-CE1 3.69Å; F187-F288 HydrophobicContact CZ-CE1 3.69Å; F187-C289 WeakPolarHBondContact CE2-SG 3.41Å
188	S	98	Very high	97.8	Very high	20 Å²	20	34 Å²	34	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-39.7	176.4	-65.8	0	0	0	0	112.6	S184 R185 S190 Q191 D194 G198	S184-S188 PolarHBondContact O-N 3.1Å; S184-S188 VanDerWaalsContact O-N 3.13Å; R185-S188 PolarHBondContact O-N 3.24Å; S188-S190 VanDerWaalsContact C-N 3.29Å; S188-S190 PolarHBondContact O-N 3.27Å; S188-Q191 PolarHBondContact O-N 2.79Å; S188-Q191 VanDerWaalsContact O-N 3.09Å; S188-D194 PolarHBondContact OG-O 3.13Å; S188-G198 WeakPolarHBondContact OG-CA 3.49Å; S188-G198 PolarHBondContact OG-N 2.92Å
189	A	97.8	Very high	97.7	Very high	22 Å²	22	42.5 Å²	42.5	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-40.4	176.3	0	0	0	0	0	111.4	E138 Y139 R185 L186 Q191	E138-A189 HydrophobicContact CB-CB 4.4Å; E138-A189 HydrophobicContact CG-CB 4.27Å; Y139-A189 HydrophobicContact CD1-CB 4.17Å; Y139-A189 HydrophobicContact CE1-CB 3.93Å; R185-A189 VanDerWaalsContact O-CB 3.24Å; R185-A189 WeakPolarHBondContact O-CB 3.43Å; R185-A189 PolarHBondContact O-N 3.42Å; L186-A189 PolarHBondContact O-N 2.99Å; A189-Q191 PolarHBondContact O-N 3.29Å
190	S	97.7	Very high	97.6	Very high	21 Å²	21	42.6 Å²	42.6	15%	0.147	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-6.6	176.5	75.7	0	0	0	0	115.1	Y139 L186 F187 S188 L192	Y139-S190 VanDerWaalsContact OH-CA 3.23Å; Y139-S190 WeakPolarHBondContact OH-CA 3.49Å; Y139-S190 WeakPolarHBondContact OH-CB 3.43Å; L186-S190 WeakPolarHBondContact O-CB 3.24Å; L186-S190 PolarHBondContact O-N 3.16Å; L186-S190 PolarHBondContact O-OG 3.05Å; F187-S190 PolarHBondContact O-N 3.01Å; F187-S190 PolarHBondContact O-OG 2.82Å; S188-S190 VanDerWaalsContact C-N 3.29Å; S188-S190 PolarHBondContact O-N 3.27Å; S190-L192 PolarHBondContact O-N 2.87Å; S190-L192 VanDerWaalsContact O-N 3.08Å; S190-L192 WeakPolarHBondContact OG-CB 3.35Å; S190-L192 WeakPolarHBondContact OG-CG 3.33Å; S190-L192 PolarHBondContact OG-N 2.89Å
191	Q	97.7	Very high	97.6	Very high	170 Å²	170	45.5 Å²	45.5	79%	0.794	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	10.9	-175.1	-50.1	176.9	16.3	0	0	114.3	S188 A189 E193	S188-Q191 PolarHBondContact O-N 2.79Å; S188-Q191 VanDerWaalsContact O-N 3.09Å; A189-Q191 PolarHBondContact O-N 3.29Å; Q191-E193 VanDerWaalsContact C-N 3.31Å
192	L	97.1	Very high	97.6	Very high	53 Å²	53	52.4 Å²	52.4	28%	0.277	26%	0.264	S	S	.	.	S	Bend	trans	-75.9	-22.5	171.9	-65.6	177.2	0	0	0	112.3	D62 L65 S190 N282 V285	D62-L192 HydrophobicContact CB-CD1 4.02Å; D62-L192 HydrophobicContact CB-CD2 4.46Å; L65-L192 HydrophobicContact CB-CD1 4.02Å; L65-L192 HydrophobicContact CD2-CD1 3.68Å; L65-L192 HydrophobicContact CG-CD1 4.49Å; S190-L192 PolarHBondContact O-N 2.87Å; S190-L192 VanDerWaalsContact O-N 3.08Å; S190-L192 WeakPolarHBondContact OG-CB 3.35Å; S190-L192 WeakPolarHBondContact OG-CG 3.33Å; S190-L192 PolarHBondContact OG-N 2.89Å; L192-N282 HydrophobicContact CB-CB 4.14Å; L192-V285 HydrophobicContact CB-CG2 4.42Å; L192-V285 HydrophobicContact CD1-CG2 4.42Å
193	E	98.3	Very high	97.6	Very high	9 Å²	9	53.1 Å²	53.1	4%	0.042	27%	0.268	C	S	.	.	S	Bend	trans	-130.1	156	178.9	-66.1	-60.5	167.8	0	0	112.1	F187 Q191 V197 L280 R281 N282 V285	F187-E193 HydrophobicContact CB-CB 4.07Å; F187-E193 HydrophobicContact CB-CG 3.87Å; Q191-E193 VanDerWaalsContact C-N 3.31Å; E193-V197 HydrophobicContact CB-CB 4.3Å; E193-V197 HydrophobicContact CB-CG2 4.16Å; E193-L280 HydrophobicContact CG-CD2 4.28Å; E193-L280 WeakPolarHBondContact OE2-CA 3.17Å; E193-R281 VanDerWaalsContact CD-N 3.34Å; E193-R281 PolarHBondContact OE1-N 3.1Å; E193-R281 PolarHBondContact OE2-N 2.98Å; E193-N282 WeakPolarHBondContact OE1-CB 3.39Å; E193-N282 PolarHBondContact OE1-N 3Å; E193-V285 HydrophobicContact CG-CB 4.39Å; E193-V285 HydrophobicContact CG-CG1 3.96Å; E193-V285 HydrophobicContact CG-CG2 4.38Å
194	D	97.4	Very high	97.5	Very high	63 Å²	63	52 Å²	52	34%	0.337	26%	0.262	S	S	.	.			trans	-59.3	146.5	177.5	-78	-50.3	0	0	0	111.4	S188 E196 V197 R281	S188-D194 PolarHBondContact OG-O 3.13Å; D194-E196 PolarHBondContact O-N 2.88Å; D194-V197 WeakPolarHBondContact O-CB 3.16Å; D194-V197 PolarHBondContact O-N 3.48Å; D194-R281 IonicContact OD2-CZ 2.65Å; D194-R281 IonicContact OD2-NE 3.47Å; D194-R281 PolarHBondContact OD2-NE 3.06Å; D194-R281 IonicContact OD2-NH2 2.65Å; D194-R281 PolarHBondContact OD2-NH2 2.76Å
195	P	97.5	Very high	97.5	Very high	81 Å²	81	53.5 Å²	53.5	53%	0.526	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.3	177.5	-26.1	34.6	0	0	0	115.1	V197 R199	P195-V197 VanDerWaalsContact C-N 3.35Å; P195-R199 VanDerWaalsContact O-CG 3.31Å; P195-R199 WeakPolarHBondContact O-CG 3.36Å; P195-R199 PolarHBondContact O-N 3.13Å; P195-R199 PolarHBondContact O-NE 3.39Å
196	E	96.3	Very high	97.5	Very high	102 Å²	102	50.3 Å²	50.3	48%	0.477	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.5	173.9	-172.2	176	167.4	0	0	112.2	D194 G198 R199 D200 R279	D194-E196 PolarHBondContact O-N 2.88Å; E196-G198 VanDerWaalsContact C-N 3.34Å; E196-G198 PolarHBondContact O-N 3.3Å; E196-R199 PolarHBondContact O-N 3.18Å; E196-R199 VanDerWaalsContact O-N 3.09Å; E196-D200 PolarHBondContact O-N 3.01Å; E196-R279 IonicContact OE1-CZ 3.21Å; E196-R279 IonicContact OE1-NH1 2.61Å
197	V	96.8	Very high	97.5	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.024	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-46.2	179.2	175.2	0	0	0	0	110.7	S184 F187 E193 D194 P195 R199 Y276 R279 L280	S184-V197 WeakPolarHBondContact CB-O 3.5Å; F187-V197 HydrophobicContact CD2-CG1 4.47Å; E193-V197 HydrophobicContact CB-CB 4.3Å; E193-V197 HydrophobicContact CB-CG2 4.16Å; D194-V197 WeakPolarHBondContact O-CB 3.16Å; D194-V197 PolarHBondContact O-N 3.48Å; P195-V197 VanDerWaalsContact C-N 3.35Å; V197-R199 VanDerWaalsContact C-N 3.33Å; V197-R199 PolarHBondContact O-N 3.45Å; V197-Y276 HydrophobicContact CG1-CE2 4.24Å; V197-R279 HydrophobicContact CG2-CB 4.35Å; V197-L280 HydrophobicContact CG1-CD2 4.04Å; V197-L280 HydrophobicContact CG2-CD2 4.32Å
198	G	95.5	Very high	97.5	Very high	15 Å²	15	51 Å²	51	16%	0.155	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.8	177.4	0	0	0	0	0	115.5	S184 R185 S188 E196	S184-G198 WeakPolarHBondContact O-CA 3.49Å; R185-G198 WeakPolarHBondContact CG-O 3.13Å; S188-G198 WeakPolarHBondContact OG-CA 3.49Å; S188-G198 PolarHBondContact OG-N 2.92Å; E196-G198 VanDerWaalsContact C-N 3.34Å; E196-G198 PolarHBondContact O-N 3.3Å
199	R	96.4	Very high	97.5	Very high	179 Å²	179	50.2 Å²	50.2	68%	0.675	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-33.5	179.8	-78	-177.2	-70.2	159.7	0.9	113.3	P195 E196 V197 T201	P195-R199 VanDerWaalsContact O-CG 3.31Å; P195-R199 WeakPolarHBondContact O-CG 3.36Å; P195-R199 PolarHBondContact O-N 3.13Å; P195-R199 PolarHBondContact O-NE 3.39Å; E196-R199 PolarHBondContact O-N 3.18Å; E196-R199 VanDerWaalsContact O-N 3.09Å; V197-R199 VanDerWaalsContact C-N 3.33Å; V197-R199 PolarHBondContact O-N 3.45Å; R199-T201 PolarHBondContact O-N 3.46Å
200	D	95.5	Very high	97.6	Very high	39 Å²	39	49.3 Å²	49.3	21%	0.209	25%	0.25	C	C	.	.			trans	-78	87.9	178.4	-169.2	-26.2	0	0	0	110.7	E196 E202 L203 A204 R279	E196-D200 PolarHBondContact O-N 3.01Å; D200-E202 VanDerWaalsContact C-N 3.29Å; D200-E202 PolarHBondContact O-N 2.9Å; D200-E202 PolarHBondContact OD1-N 3.34Å; D200-L203 PolarHBondContact OD1-N 3.13Å; D200-L203 VanDerWaalsContact OD1-N 3.11Å; D200-L203 WeakPolarHBondContact OD2-CD1 3.41Å; D200-A204 WeakPolarHBondContact O-CB 3.41Å; D200-A204 PolarHBondContact O-N 3.12Å; D200-R279 IonicContact OD2-CZ 2.65Å; D200-R279 IonicContact OD2-NH1 3.2Å; D200-R279 PolarHBondContact OD2-NH1 3.3Å; D200-R279 IonicContact OD2-NH2 3.42Å; D200-R279 PolarHBondContact OD2-NH2 3.45Å
201	T	97.7	Very high	97.6	Very high	69 Å²	69	50.5 Å²	50.5	42%	0.423	26%	0.255	S	S	.	.	H	α-helix	trans	-73.3	-21.2	-179.5	56.1	0	0	0	0	113.2	I181 R199 N205	I181-T201 HydrophobicContact CD1-CG2 4.4Å; I181-T201 HydrophobicContact CG1-CG2 4.31Å; I181-T201 HydrophobicContact CG2-CG2 4.05Å; R199-T201 PolarHBondContact O-N 3.46Å; T201-N205 WeakPolarHBondContact O-CB 3.48Å; T201-N205 PolarHBondContact O-N 3.15Å
202	E	98.2	Very high	97.6	Very high	152 Å²	152	44.5 Å²	44.5	71%	0.71	23%	0.226	S	C	*	.	H	α-helix	trans	-70.9	-52.1	-177.4	-67.5	-172.8	171.1	0	0	110.2	D200 A204 N205 S206	D200-E202 VanDerWaalsContact C-N 3.29Å; D200-E202 PolarHBondContact O-N 2.9Å; D200-E202 PolarHBondContact OD1-N 3.34Å; E202-A204 VanDerWaalsContact C-N 3.34Å; E202-A204 PolarHBondContact O-N 3.36Å; E202-N205 WeakPolarHBondContact O-CB 3.4Å; E202-N205 PolarHBondContact O-N 3.01Å; E202-S206 PolarHBondContact O-N 3.35Å; E202-S206 PolarHBondContact O-OG 3.01Å
203	L	97.9	Very high	97.6	Very high	16 Å²	16	42 Å²	42	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-41.4	176.8	-65	-170.8	0	0	0	111.9	D200 N205 S206 M207 D272 A275 Y276	D200-L203 PolarHBondContact OD1-N 3.13Å; D200-L203 VanDerWaalsContact OD1-N 3.11Å; D200-L203 WeakPolarHBondContact OD2-CD1 3.41Å; L203-N205 VanDerWaalsContact C-N 3.29Å; L203-N205 PolarHBondContact O-N 2.8Å; L203-S206 PolarHBondContact O-N 3.37Å; L203-M207 WeakPolarHBondContact O-CG 3.3Å; L203-M207 PolarHBondContact O-N 2.88Å; L203-D272 HydrophobicContact CD2-CB 3.6Å; L203-A275 HydrophobicContact CD1-CB 3.96Å; L203-A275 HydrophobicContact CD2-CB 4.15Å; L203-Y276 HydrophobicContact CB-CD2 3.93Å
204	A	98.1	Very high	97.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-37.5	176.7	0	0	0	0	0	112.2	I181 S184 D200 E202 M207 G208 Y276	I181-A204 HydrophobicContact CG1-CB 3.95Å; S184-A204 WeakPolarHBondContact OG-CB 3.4Å; D200-A204 WeakPolarHBondContact O-CB 3.41Å; D200-A204 PolarHBondContact O-N 3.12Å; E202-A204 VanDerWaalsContact C-N 3.34Å; E202-A204 PolarHBondContact O-N 3.36Å; A204-M207 WeakPolarHBondContact O-CB 3.32Å; A204-G208 PolarHBondContact O-N 2.92Å; A204-Y276 HydrophobicContact CB-CE2 4.03Å
205	N	98.6	Very high	97.6	Very high	31 Å²	31	41.2 Å²	41.2	17%	0.166	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-46.9	173.9	-178.3	69.4	0	0	0	111.2	H173 G177 I181 T201 E202 L203 M207 G208 L209	H173-N205 PolarHBondContact ND1-OD1 3.45Å; G177-N205 VanDerWaalsContact CA-OD1 3.29Å; G177-N205 WeakPolarHBondContact CA-OD1 3.49Å; I181-N205 HydrophobicContact CD1-CB 4.29Å; T201-N205 WeakPolarHBondContact O-CB 3.48Å; T201-N205 PolarHBondContact O-N 3.15Å; E202-N205 WeakPolarHBondContact O-CB 3.4Å; E202-N205 PolarHBondContact O-N 3.01Å; L203-N205 VanDerWaalsContact C-N 3.29Å; L203-N205 PolarHBondContact O-N 2.8Å; N205-M207 VanDerWaalsContact C-N 3.27Å; N205-M207 PolarHBondContact O-N 2.9Å; N205-G208 PolarHBondContact O-N 3.31Å; N205-L209 WeakPolarHBondContact ND2-CD1 2.97Å; N205-L209 WeakPolarHBondContact O-CD1 3.23Å; N205-L209 PolarHBondContact O-N 3.44Å; N205-L209 VanDerWaalsContact OD1-CD1 3.32Å; N205-L209 WeakPolarHBondContact OD1-CD1 3.42Å
206	S	98.7	Very high	97.6	Very high	8 Å²	8	37.6 Å²	37.6	6%	0.056	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-36.7	177.8	-66.5	0	0	0	0	112.7	E202 L203 G208 L209 F210 D272	E202-S206 PolarHBondContact O-N 3.35Å; E202-S206 PolarHBondContact O-OG 3.01Å; L203-S206 PolarHBondContact O-N 3.37Å; S206-G208 VanDerWaalsContact C-N 3.31Å; S206-G208 PolarHBondContact O-N 3.48Å; S206-L209 PolarHBondContact O-N 2.91Å; S206-F210 WeakPolarHBondContact O-CB 3.17Å; S206-F210 PolarHBondContact O-N 3.04Å; S206-D272 VanDerWaalsContact CB-CB 3.47Å; S206-D272 WeakPolarHBondContact CB-OD2 3.41Å; S206-D272 PolarHBondContact OG-OD2 3.39Å
207	M	98.6	Very high	97.7	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.059	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-42	172.6	-70.8	-75.3	-72	0	0	112.5	L203 A204 N205 L211 V273 Y276 L277 C289 Q293	L203-M207 WeakPolarHBondContact O-CG 3.3Å; L203-M207 PolarHBondContact O-N 2.88Å; A204-M207 WeakPolarHBondContact O-CB 3.32Å; N205-M207 VanDerWaalsContact C-N 3.27Å; N205-M207 PolarHBondContact O-N 2.9Å; M207-L211 WeakPolarHBondContact O-CG 3.49Å; M207-V273 HydrophobicContact SD-CB 3.99Å; M207-V273 HydrophobicContact SD-CG1 3.85Å; M207-V273 HydrophobicContact SD-CG2 3.82Å; M207-Y276 HydrophobicContact CE-CD1 3.64Å; M207-Y276 HydrophobicContact CE-CE1 3.97Å; M207-Y276 HydrophobicContact CE-CG 4.42Å; M207-Y276 HydrophobicContact CG-CD1 3.75Å; M207-Y276 HydrophobicContact CG-CD2 4.02Å; M207-Y276 HydrophobicContact CG-CE1 4.31Å; M207-Y276 HydrophobicContact CG-CG 3.59Å; M207-Y276 HydrophobicContact SD-CD1 3.75Å; M207-Y276 HydrophobicContact SD-CG 3.96Å; M207-L277 HydrophobicContact CE-CD2 3.85Å; M207-L277 HydrophobicContact CE-CG 4.25Å; M207-L277 HydrophobicContact SD-CG 4.43Å; M207-C289 HydrophobicContact CE-CB 3.95Å; M207-Q293 HydrophobicContact CE-CG 3.66Å; M207-Q293 PolarHBondContact O-NE2 3.44Å; M207-Q293 HydrophobicContact SD-CG 4.08Å
208	G	97.1	Very high	97.7	Very high	5 Å²	5	34.5 Å²	34.5	5%	0.052	17%	0.169	C	C	.	.	H	α-helix	trans	-74.1	-45.2	177.4	0	0	0	0	0	112.9	A176 A204 N205 S206 F210 L211 Q212	A176-G208 WeakPolarHBondContact CB-O 3.29Å; A176-G208 WeakPolarHBondContact O-CA 3.49Å; A204-G208 PolarHBondContact O-N 2.92Å; N205-G208 PolarHBondContact O-N 3.31Å; S206-G208 VanDerWaalsContact C-N 3.31Å; S206-G208 PolarHBondContact O-N 3.48Å; G208-F210 VanDerWaalsContact C-N 3.31Å; G208-F210 PolarHBondContact O-N 3.01Å; G208-L211 PolarHBondContact O-N 2.91Å; G208-Q212 PolarHBondContact O-N 3.44Å
209	L	98.8	Very high	97.8	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-59.2	-41	178.8	-93.5	62.6	0	0	0	111.9	D169 C172 H173 N205 S206 L211 Q212 K213 H269	D169-L209 HydrophobicContact CB-CD2 4.41Å; C172-L209 HydrophobicContact CB-CD1 4.02Å; C172-L209 HydrophobicContact CB-CG 3.74Å; H173-L209 HydrophobicContact CB-CD1 4.42Å; N205-L209 WeakPolarHBondContact ND2-CD1 2.97Å; N205-L209 WeakPolarHBondContact O-CD1 3.23Å; N205-L209 PolarHBondContact O-N 3.44Å; N205-L209 VanDerWaalsContact OD1-CD1 3.32Å; N205-L209 WeakPolarHBondContact OD1-CD1 3.42Å; S206-L209 PolarHBondContact O-N 2.91Å; L209-L211 PolarHBondContact O-N 3.4Å; L209-Q212 PolarHBondContact O-N 2.96Å; L209-K213 VanDerWaalsContact O-CB 3.31Å; L209-K213 WeakPolarHBondContact O-CB 3.5Å; L209-K213 VanDerWaalsContact O-CG 3.24Å; L209-K213 WeakPolarHBondContact O-CG 3.44Å; L209-K213 PolarHBondContact O-N 3.42Å; L209-H269 VanDerWaalsContact CD2-CE1 3.42Å; L209-H269 WeakPolarHBondContact CD2-CE1 3.3Å
210	F	98.9	Very high	97.8	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.009	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-46.1	178.3	-175.2	-115.4	0	0	0	112.3	S206 G208 T214 A266 H269 V270 V273 A296 I297 L300	S206-F210 WeakPolarHBondContact O-CB 3.17Å; S206-F210 PolarHBondContact O-N 3.04Å; G208-F210 VanDerWaalsContact C-N 3.31Å; G208-F210 PolarHBondContact O-N 3.01Å; F210-T214 WeakPolarHBondContact O-CB 3.44Å; F210-T214 PolarHBondContact O-N 2.66Å; F210-T214 VanDerWaalsContact O-N 3.14Å; F210-T214 PolarHBondContact O-OG1 2.99Å; F210-A266 WeakPolarHBondContact CD2-O 3.23Å; F210-H269 HydrophobicContact CB-CB 3.86Å; F210-H269 HydrophobicContact CD2-CB 4.17Å; F210-H269 HydrophobicContact CG-CB 4.4Å; F210-V270 HydrophobicContact CD2-CG2 4.06Å; F210-V270 HydrophobicContact CE2-CG2 3.42Å; F210-V270 VanDerWaalsContact CE2-CG2 3.42Å; F210-V270 HydrophobicContact CZ-CG2 3.68Å; F210-V273 HydrophobicContact CB-CG2 4.13Å; F210-V273 HydrophobicContact CD1-CG2 4.34Å; F210-V273 HydrophobicContact CG-CG2 4.31Å; F210-A296 HydrophobicContact CD1-CB 3.78Å; F210-A296 HydrophobicContact CE1-CB 3.42Å; F210-A296 VanDerWaalsContact CE1-CB 3.42Å; F210-A296 HydrophobicContact CZ-CB 4.19Å; F210-I297 HydrophobicContact CE1-CB 4.4Å; F210-I297 HydrophobicContact CZ-CB 4.02Å; F210-I297 HydrophobicContact CZ-CD1 4.07Å; F210-L300 HydrophobicContact CD2-CD1 4.37Å; F210-L300 HydrophobicContact CE2-CD1 3.42Å; F210-L300 VanDerWaalsContact CE2-CD1 3.42Å; F210-L300 HydrophobicContact CZ-CD1 3.8Å
211	L	97.8	Very high	97.7	Very high	47 Å²	47	26.8 Å²	26.8	25%	0.246	14%	0.137	C	C	.	.	H	α-helix	trans	-65.2	-47.5	178.3	-61.7	179.7	0	0	0	111.2	M207 G208 L209 T214 N215 P292 A296	M207-L211 WeakPolarHBondContact O-CG 3.49Å; G208-L211 PolarHBondContact O-N 2.91Å; L209-L211 PolarHBondContact O-N 3.4Å; L211-T214 WeakPolarHBondContact O-CB 3.38Å; L211-T214 PolarHBondContact O-N 3.49Å; L211-N215 VanDerWaalsContact O-CG 3.24Å; L211-N215 PolarHBondContact O-N 2.84Å; L211-N215 PolarHBondContact O-OD1 3.27Å; L211-P292 HydrophobicContact CD1-CB 3.93Å; L211-P292 HydrophobicContact CD2-CB 3.83Å; L211-P292 WeakPolarHBondContact CD2-O 3.37Å; L211-A296 HydrophobicContact CD2-CB 3.67Å
212	Q	97.9	Very high	97.4	Very high	43 Å²	43	27.4 Å²	27.4	20%	0.201	14%	0.135	C	C	.	.	H	α-helix	trans	-66.4	-44.8	-175.5	-169.6	60.4	19.3	0	0	112.4	C172 V175 A176 G208 L209 T214 N215 I216	C172-Q212 HydrophobicContact CB-CB 4.37Å; C172-Q212 HydrophobicContact CB-CG 4.3Å; V175-Q212 HydrophobicContact CG2-CG 3.83Å; A176-Q212 HydrophobicContact CB-CB 3.5Å; A176-Q212 HydrophobicContact CB-CG 3.97Å; G208-Q212 PolarHBondContact O-N 3.44Å; L209-Q212 PolarHBondContact O-N 2.96Å; Q212-T214 VanDerWaalsContact C-N 3.28Å; Q212-T214 PolarHBondContact O-N 2.98Å; Q212-N215 PolarHBondContact O-N 3.07Å; Q212-N215 VanDerWaalsContact O-N 3.17Å; Q212-I216 HydrophobicContact CG-CD1 3.91Å; Q212-I216 WeakPolarHBondContact O-CG1 3.42Å; Q212-I216 PolarHBondContact O-N 2.87Å
213	K	98.8	Very high	97.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.4	-39.8	176.2	-69.8	-173	173.7	-162	0	111.5	W168 D169 L209 N215 I216 I217 D265 A266	W168-K213 HydrophobicContact CD2-CD 4.5Å; W168-K213 HydrophobicContact CD2-CG 4.48Å; W168-K213 HydrophobicContact CE3-CD 4.1Å; W168-K213 HydrophobicContact CH2-CB 3.85Å; W168-K213 HydrophobicContact CH2-CD 3.7Å; W168-K213 HydrophobicContact CH2-CG 3.68Å; W168-K213 HydrophobicContact CZ2-CB 3.89Å; W168-K213 HydrophobicContact CZ2-CD 4.11Å; W168-K213 HydrophobicContact CZ2-CG 3.61Å; W168-K213 HydrophobicContact CZ3-CD 3.7Å; W168-K213 HydrophobicContact CZ3-CG 4.15Å; D169-K213 VanDerWaalsContact OD1-CE 3.28Å; D169-K213 WeakPolarHBondContact OD1-CE 3.38Å; D169-K213 IonicContact OD1-NZ 2.7Å; D169-K213 PolarHBondContact OD1-NZ 3.21Å; L209-K213 VanDerWaalsContact O-CB 3.31Å; L209-K213 WeakPolarHBondContact O-CB 3.5Å; L209-K213 VanDerWaalsContact O-CG 3.24Å; L209-K213 WeakPolarHBondContact O-CG 3.44Å; L209-K213 PolarHBondContact O-N 3.42Å; K213-N215 VanDerWaalsContact C-N 3.3Å; K213-N215 PolarHBondContact O-N 3.09Å; K213-I216 PolarHBondContact O-N 3.27Å; K213-I217 WeakPolarHBondContact O-CB 3.49Å; K213-I217 VanDerWaalsContact O-CD1 3.32Å; K213-I217 WeakPolarHBondContact O-CD1 3.22Å; K213-I217 WeakPolarHBondContact O-CG1 3.15Å; K213-I217 PolarHBondContact O-N 3.18Å; K213-D265 IonicContact NZ-OD1 3.44Å; K213-D265 IonicContact NZ-OD2 4Å; K213-D265 PolarHBondContact NZ-OD2 2.83Å; K213-A266 HydrophobicContact CB-CB 3.92Å; K213-A266 HydrophobicContact CD-CB 4.45Å
214	T	98.6	Very high	96.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60	-42.2	175.3	-60.7	0	0	0	0	111.8	F210 L211 Q212 R218 A296 T299 L300	F210-T214 WeakPolarHBondContact O-CB 3.44Å; F210-T214 PolarHBondContact O-N 2.66Å; F210-T214 VanDerWaalsContact O-N 3.14Å; F210-T214 PolarHBondContact O-OG1 2.99Å; L211-T214 WeakPolarHBondContact O-CB 3.38Å; L211-T214 PolarHBondContact O-N 3.49Å; Q212-T214 VanDerWaalsContact C-N 3.28Å; Q212-T214 PolarHBondContact O-N 2.98Å; T214-R218 WeakPolarHBondContact O-CB 3.34Å; T214-R218 PolarHBondContact O-N 2.65Å; T214-R218 VanDerWaalsContact O-N 3.12Å; T214-A296 HydrophobicContact CG2-CB 4.03Å; T214-T299 HydrophobicContact CG2-CG2 3.74Å; T214-L300 HydrophobicContact CG2-CD2 3.87Å; T214-L300 HydrophobicContact CG2-CG 3.88Å; T214-L300 WeakPolarHBondContact OG1-CG 3.36Å
215	N	96.1	Very high	96.3	Very high	57 Å²	57	28.3 Å²	28.3	31%	0.305	14%	0.141	S	C	.	.	H	α-helix	trans	-65.4	-53.4	176.8	-61.5	-14.7	0	0	0	111.1	L211 Q212 K213 I217 R218 D219	L211-N215 VanDerWaalsContact O-CG 3.24Å; L211-N215 PolarHBondContact O-N 2.84Å; L211-N215 PolarHBondContact O-OD1 3.27Å; Q212-N215 PolarHBondContact O-N 3.07Å; Q212-N215 VanDerWaalsContact O-N 3.17Å; K213-N215 VanDerWaalsContact C-N 3.3Å; K213-N215 PolarHBondContact O-N 3.09Å; N215-I217 PolarHBondContact O-N 3.27Å; N215-R218 VanDerWaalsContact CG-NH2 3.29Å; N215-R218 PolarHBondContact O-N 2.91Å; N215-R218 PolarHBondContact OD1-NH2 3.43Å; N215-D219 VanDerWaalsContact O-CB 3.32Å; N215-D219 WeakPolarHBondContact O-CB 3.48Å; N215-D219 VanDerWaalsContact O-CG 3.23Å; N215-D219 PolarHBondContact O-N 2.67Å
216	I	97.6	Very high	95.8	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-54.6	-39.2	178	-71.1	168.4	0	0	0	112.2	W168 Y171 Q212 K213 F230 W231	W168-I216 HydrophobicContact CZ2-CB 4.43Å; W168-I216 HydrophobicContact CZ2-CG2 4.03Å; Y171-I216 HydrophobicContact CD1-CD1 4.3Å; Y171-I216 HydrophobicContact CE1-CD1 4.06Å; Q212-I216 HydrophobicContact CG-CD1 3.91Å; Q212-I216 WeakPolarHBondContact O-CG1 3.42Å; Q212-I216 PolarHBondContact O-N 2.87Å; K213-I216 PolarHBondContact O-N 3.27Å; I216-F230 HydrophobicContact CB-CB 4.48Å; I216-F230 HydrophobicContact CD1-CB 4.04Å; I216-F230 HydrophobicContact CG1-CB 4.03Å; I216-F230 HydrophobicContact CG1-CG 4.44Å; I216-F230 HydrophobicContact CG2-CB 3.65Å; I216-W231 PolarHBondContact O-NE1 3.31Å
217	I	98.4	Very high	95.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-47.3	178	-72.7	163.5	0	0	0	111.1	W168 K213 N215 L259 L262 V263 A266 L300 C303 V309	W168-I217 HydrophobicContact CH2-CD1 4.25Å; W168-I217 HydrophobicContact CH2-CG1 4.34Å; K213-I217 WeakPolarHBondContact O-CB 3.49Å; K213-I217 VanDerWaalsContact O-CD1 3.32Å; K213-I217 WeakPolarHBondContact O-CD1 3.22Å; K213-I217 WeakPolarHBondContact O-CG1 3.15Å; K213-I217 PolarHBondContact O-N 3.18Å; N215-I217 PolarHBondContact O-N 3.27Å; I217-L259 HydrophobicContact CG2-CD1 3.4Å; I217-L259 VanDerWaalsContact CG2-CD1 3.4Å; I217-L262 HydrophobicContact CD1-CB 3.94Å; I217-L262 WeakPolarHBondContact CD1-O 3.44Å; I217-L262 HydrophobicContact CG1-CB 3.88Å; I217-V263 HydrophobicContact CD1-CG2 4.3Å; I217-V263 HydrophobicContact CG2-CG2 3.91Å; I217-A266 HydrophobicContact CD1-CB 3.92Å; I217-L300 HydrophobicContact CD1-CD2 4.09Å; I217-C303 HydrophobicContact CG2-CB 4.42Å; I217-V309 WeakPolarHBondContact O-CG1 3.32Å
218	R	97.7	Very high	94.7	Very high	41 Å²	41	36 Å²	36	16%	0.155	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-38.5	-177.3	175.2	-172.5	50.1	-129.8	-9.2	112	T214 N215 Y220 T299 V314	T214-R218 WeakPolarHBondContact O-CB 3.34Å; T214-R218 PolarHBondContact O-N 2.65Å; T214-R218 VanDerWaalsContact O-N 3.12Å; N215-R218 VanDerWaalsContact CG-NH2 3.29Å; N215-R218 PolarHBondContact O-N 2.91Å; N215-R218 PolarHBondContact OD1-NH2 3.43Å; R218-Y220 VanDerWaalsContact C-N 3.31Å; R218-Y220 PolarHBondContact O-N 2.92Å; R218-T299 HydrophobicContact CB-CG2 4.21Å; R218-T299 HydrophobicContact CG-CG2 4.3Å; R218-T299 VanDerWaalsContact NH1-CG2 3.29Å; R218-T299 PolarHBondContact NH1-OG1 2.68Å; R218-V314 WeakPolarHBondContact CD-O 3.25Å; R218-V314 HydrophobicContact CG-CB 4.42Å; R218-V314 VanDerWaalsContact CG-O 3.23Å; R218-V314 WeakPolarHBondContact CG-O 3.29Å
219	D	95.9	Very high	94.5	Very high	37 Å²	37	37.9 Å²	37.9	20%	0.198	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	10.9	-165.3	-56.1	-27.8	0	0	0	112.3	N215 L221 E222 D223	N215-D219 VanDerWaalsContact O-CB 3.32Å; N215-D219 WeakPolarHBondContact O-CB 3.48Å; N215-D219 VanDerWaalsContact O-CG 3.23Å; N215-D219 PolarHBondContact O-N 2.67Å; D219-L221 VanDerWaalsContact C-N 3.28Å; D219-L221 PolarHBondContact O-N 3.4Å; D219-E222 WeakPolarHBondContact O-CB 3.14Å; D219-E222 PolarHBondContact O-N 3.16Å; D219-D223 PolarHBondContact O-N 3.05Å
220	Y	96.3	Very high	94.3	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-39.7	-49.5	178.9	167.4	-89.6	0	0	0	114.5	R218 T224 W231 L243 L246 A247 F310	R218-Y220 VanDerWaalsContact C-N 3.31Å; R218-Y220 PolarHBondContact O-N 2.92Å; Y220-T224 HydrophobicContact CD2-CG2 4.33Å; Y220-T224 HydrophobicContact CE1-CG2 4.47Å; Y220-T224 HydrophobicContact CE2-CG2 3.93Å; Y220-T224 WeakPolarHBondContact O-CB 3.31Å; Y220-T224 WeakPolarHBondContact O-CG2 3.34Å; Y220-T224 PolarHBondContact O-N 3.2Å; Y220-T224 PolarHBondContact O-OG1 2.8Å; Y220-W231 AromaticContact CD2-CD2 4Å; Y220-W231 HydrophobicContact CD2-CD2 4Å; Y220-W231 AromaticContact CD2-CE2 3.84Å; Y220-W231 HydrophobicContact CD2-CE3 4.32Å; Y220-W231 HydrophobicContact CD2-CH2 4.4Å; Y220-W231 HydrophobicContact CD2-CZ2 4.06Å; Y220-W231 HydrophobicContact CG-CZ2 4.27Å; Y220-L243 HydrophobicContact CD2-CD1 4.31Å; Y220-L243 HydrophobicContact CE2-CD1 3.67Å; Y220-L243 HydrophobicContact CE2-CG 3.91Å; Y220-L243 PolarHBondContact OH-O 2.7Å; Y220-L246 HydrophobicContact CE2-CB 4.42Å; Y220-L246 HydrophobicContact CE2-CD1 4.34Å; Y220-A247 HydrophobicContact CE1-CB 4.24Å; Y220-A247 PolarHBondContact OH-N 3Å; Y220-F310 AromaticContact CD1-CD1 3.67Å; Y220-F310 HydrophobicContact CD1-CD1 3.67Å; Y220-F310 HydrophobicContact CD1-CE1 4.1Å; Y220-F310 AromaticContact CE1-CD1 3.55Å; Y220-F310 HydrophobicContact CE1-CD1 3.55Å; Y220-F310 HydrophobicContact CE1-CE1 4.12Å; Y220-F310 HydrophobicContact CG-CD1 4.37Å; Y220-F310 HydrophobicContact CG-CE1 4.36Å
221	L	93.3	Very high	94.2	Very high	32 Å²	32	39.5 Å²	39.5	17%	0.168	21%	0.211	C	C	.	.	H	α-helix	trans	-72.3	-37.4	-175.5	-173.8	63.6	0	0	0	112.3	D219 T224 Q225	D219-L221 VanDerWaalsContact C-N 3.28Å; D219-L221 PolarHBondContact O-N 3.4Å; L221-T224 WeakPolarHBondContact CA-OG1 3.25Å; L221-T224 PolarHBondContact O-OG1 2.91Å; L221-Q225 WeakPolarHBondContact O-CB 3.41Å; L221-Q225 WeakPolarHBondContact O-CG 3.35Å; L221-Q225 PolarHBondContact O-N 3.23Å; L221-Q225 VanDerWaalsContact O-N 3.14Å
222	E	91.6	Very high	94.2	Very high	82 Å²	82	37.2 Å²	37.2	38%	0.383	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-48.9	176.1	-173.8	171.7	145.5	0	0	109.4	D219 T224 Q225 E226	D219-E222 WeakPolarHBondContact O-CB 3.14Å; D219-E222 PolarHBondContact O-N 3.16Å; E222-T224 PolarHBondContact O-N 3.45Å; E222-Q225 PolarHBondContact O-N 2.81Å; E222-E226 WeakPolarHBondContact O-CG 3.42Å; E222-E226 PolarHBondContact O-N 3.06Å; E222-E226 VanDerWaalsContact O-N 3.11Å
223	D	91.8	Very high	94.2	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-49.4	178.9	-70.2	-32.3	0	0	0	111.7	D219 Q225 E226 G227 R228 F230	D219-D223 PolarHBondContact O-N 3.05Å; D223-Q225 VanDerWaalsContact C-N 3.33Å; D223-Q225 PolarHBondContact O-N 3.2Å; D223-E226 CarbonylContact O-C 3.33Å; D223-E226 PolarHBondContact O-N 3.24Å; D223-G227 PolarHBondContact O-N 2.96Å; D223-G227 VanDerWaalsContact O-N 3.14Å; D223-R228 CarbonylContact C-O 3.59Å; D223-R228 HydrophobicContact CB-CB 4.11Å; D223-R228 WeakPolarHBondContact O-CA 3.41Å; D223-R228 WeakPolarHBondContact O-CB 3.24Å; D223-R228 PolarHBondContact O-N 3.14Å; D223-R228 VanDerWaalsContact O-O 3.13Å; D223-R228 IonicContact OD1-CZ 3.17Å; D223-R228 IonicContact OD1-NE 3.98Å; D223-R228 IonicContact OD1-NH2 3.41Å; D223-R228 PolarHBondContact OD1-NH2 3.44Å; D223-F230 HydrophobicContact CB-CD2 4.35Å; D223-F230 HydrophobicContact CB-CE2 4.49Å; D223-F230 WeakPolarHBondContact OD2-CD2 3.37Å
224	T	90.6	Very high	94.2	Very high	28 Å²	28	45.6 Å²	45.6	17%	0.172	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-33.8	-178.8	47.2	0	0	0	0	113	Y220 L221 E222 E226 G227 L243	Y220-T224 HydrophobicContact CD2-CG2 4.33Å; Y220-T224 HydrophobicContact CE1-CG2 4.47Å; Y220-T224 HydrophobicContact CE2-CG2 3.93Å; Y220-T224 WeakPolarHBondContact O-CB 3.31Å; Y220-T224 WeakPolarHBondContact O-CG2 3.34Å; Y220-T224 PolarHBondContact O-N 3.2Å; Y220-T224 PolarHBondContact O-OG1 2.8Å; L221-T224 WeakPolarHBondContact CA-OG1 3.25Å; L221-T224 PolarHBondContact O-OG1 2.91Å; E222-T224 PolarHBondContact O-N 3.45Å; T224-E226 VanDerWaalsContact C-N 3.33Å; T224-G227 PolarHBondContact O-N 3.27Å; T224-L243 HydrophobicContact CG2-CD2 4.45Å; T224-L243 HydrophobicContact CG2-CG 4.47Å
225	Q	90.4	Very high	94.1	Very high	147 Å²	147	45.6 Å²	45.6	69%	0.687	24%	0.237	S	C	*	.	H	α-helix	trans	-68.6	-32.3	175.2	-75.9	174	5.1	0	0	112.7	L221 E222 D223 G227	L221-Q225 WeakPolarHBondContact O-CB 3.41Å; L221-Q225 WeakPolarHBondContact O-CG 3.35Å; L221-Q225 PolarHBondContact O-N 3.23Å; L221-Q225 VanDerWaalsContact O-N 3.14Å; E222-Q225 PolarHBondContact O-N 2.81Å; D223-Q225 VanDerWaalsContact C-N 3.33Å; D223-Q225 PolarHBondContact O-N 3.2Å; Q225-G227 VanDerWaalsContact C-N 3.27Å
226	E	86.6	Confident	94.2	Very high	107 Å²	107	44.6 Å²	44.6	50%	0.5	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	4	176.1	-66.4	177	170.9	0	0	112.9	E222 D223 T224 R228	E222-E226 WeakPolarHBondContact O-CG 3.42Å; E222-E226 PolarHBondContact O-N 3.06Å; E222-E226 VanDerWaalsContact O-N 3.11Å; D223-E226 CarbonylContact O-C 3.33Å; D223-E226 PolarHBondContact O-N 3.24Å; T224-E226 VanDerWaalsContact C-N 3.33Å; E226-R228 VanDerWaalsContact C-N 3.31Å; E226-R228 HydrophobicContact CB-CG 4.47Å; E226-R228 IonicContact OE2-CZ 3.61Å; E226-R228 IonicContact OE2-NE 2.55Å; E226-R228 PolarHBondContact OE2-NE 2.87Å; E226-R228 IonicContact OE2-NH2 2.76Å; E226-R228 PolarHBondContact OE2-NH2 3.07Å
227	G	86.8	Confident	94.2	Very high	61 Å²	61	47.3 Å²	47.3	63%	0.629	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.1	15.2	178.7	0	0	0	0	0	114.4	D223 T224 Q225	D223-G227 PolarHBondContact O-N 2.96Å; D223-G227 VanDerWaalsContact O-N 3.14Å; T224-G227 PolarHBondContact O-N 3.27Å; Q225-G227 VanDerWaalsContact C-N 3.27Å
228	R	88.6	Confident	94.1	Very high	46 Å²	46	53.4 Å²	53.4	17%	0.174	28%	0.276	C	S	.	.			trans	-92.6	147.7	176.1	-57.5	-172.8	-71	165	3.3	110.4	D84 D223 E226 F230	D84-R228 IonicContact OD1-NH1 3.71Å; D84-R228 PolarHBondContact OD1-NH1 2.81Å; D84-R228 IonicContact OD2-NH1 3.33Å; D223-R228 CarbonylContact C-O 3.59Å; D223-R228 HydrophobicContact CB-CB 4.11Å; D223-R228 WeakPolarHBondContact O-CA 3.41Å; D223-R228 WeakPolarHBondContact O-CB 3.24Å; D223-R228 PolarHBondContact O-N 3.14Å; D223-R228 VanDerWaalsContact O-O 3.13Å; D223-R228 IonicContact OD1-CZ 3.17Å; D223-R228 IonicContact OD1-NE 3.98Å; D223-R228 IonicContact OD1-NH2 3.41Å; D223-R228 PolarHBondContact OD1-NH2 3.44Å; E226-R228 VanDerWaalsContact C-N 3.31Å; E226-R228 HydrophobicContact CB-CG 4.47Å; E226-R228 IonicContact OE2-CZ 3.61Å; E226-R228 IonicContact OE2-NE 2.55Å; E226-R228 PolarHBondContact OE2-NE 2.87Å; E226-R228 IonicContact OE2-NH2 2.76Å; E226-R228 PolarHBondContact OE2-NH2 3.07Å; R228-F230 HydrophobicContact CB-CD2 4.49Å; R228-F230 HydrophobicContact CB-CE2 3.77Å; R228-F230 HydrophobicContact CB-CZ 4.04Å
229	A	91.4	Very high	93.9	Very high	43 Å²	43	53 Å²	53	36%	0.355	28%	0.276	S	S	.	.			trans	-147.3	96.4	-175.8	0	0	0	0	0	111.7	L243	A229-L243 HydrophobicContact CB-CD2 3.79Å
230	F	95.1	Very high	93.9	Very high	34 Å²	34	51.8 Å²	51.8	15%	0.149	27%	0.271	C	S	.	.			trans	-105.1	-15.1	-176	-57.2	-64.7	0	0	0	114.6	W168 Y171 I216 D223 R228	W168-F230 PolarHBondContact NE1-O 3.46Å; Y171-F230 HydrophobicContact CD1-CD1 4.47Å; Y171-F230 AromaticContact CE1-CD1 3.67Å; Y171-F230 HydrophobicContact CE1-CD1 3.67Å; Y171-F230 HydrophobicContact CE1-CE1 4.04Å; Y171-F230 HydrophobicContact CE1-CG 4.4Å; Y171-F230 HydrophobicContact CE2-CE1 4.45Å; Y171-F230 AromaticContact CZ-CD1 3.78Å; Y171-F230 AromaticContact CZ-CE1 3.67Å; Y171-F230 VanDerWaalsContact OH-CE1 3.23Å; Y171-F230 WeakPolarHBondContact OH-CE1 3.33Å; I216-F230 HydrophobicContact CB-CB 4.48Å; I216-F230 HydrophobicContact CD1-CB 4.04Å; I216-F230 HydrophobicContact CG1-CB 4.03Å; I216-F230 HydrophobicContact CG1-CG 4.44Å; I216-F230 HydrophobicContact CG2-CB 3.65Å; D223-F230 HydrophobicContact CB-CD2 4.35Å; D223-F230 HydrophobicContact CB-CE2 4.49Å; D223-F230 WeakPolarHBondContact OD2-CD2 3.37Å; R228-F230 HydrophobicContact CB-CD2 4.49Å; R228-F230 HydrophobicContact CB-CE2 3.77Å; R228-F230 HydrophobicContact CB-CZ 4.04Å
231	W	97.7	Very high	93.9	Very high	5 Å²	5	56.9 Å²	56.9	2%	0.019	31%	0.307	C	S	.	.	S	Bend	trans	-67.1	129.5	176.2	-75.9	30.4	0	0	0	109.7	I216 Y220 K233 W236 L243 L246 C258 L259 L262 F310	I216-W231 PolarHBondContact O-NE1 3.31Å; Y220-W231 AromaticContact CD2-CD2 4Å; Y220-W231 HydrophobicContact CD2-CD2 4Å; Y220-W231 AromaticContact CD2-CE2 3.84Å; Y220-W231 HydrophobicContact CD2-CE3 4.32Å; Y220-W231 HydrophobicContact CD2-CH2 4.4Å; Y220-W231 HydrophobicContact CD2-CZ2 4.06Å; Y220-W231 HydrophobicContact CG-CZ2 4.27Å; W231-K233 PolarHBondContact O-N 2.84Å; W231-W236 PolarHBondContact O-NE1 3.05Å; W231-W236 VanDerWaalsContact O-NE1 3.08Å; W231-L243 HydrophobicContact CB-CD1 3.68Å; W231-L243 HydrophobicContact CB-CD2 4.14Å; W231-L243 HydrophobicContact CD2-CD1 4.24Å; W231-L243 HydrophobicContact CE3-CD1 4.06Å; W231-L243 HydrophobicContact CG-CD1 4.12Å; W231-L246 HydrophobicContact CE3-CD1 3.95Å; W231-L246 HydrophobicContact CZ3-CD1 3.8Å; W231-C258 HydrophobicContact CZ3-CB 4.16Å; W231-C258 VanDerWaalsContact CZ3-SG 3.56Å; W231-L259 HydrophobicContact CH2-CB 4.14Å; W231-L259 HydrophobicContact CH2-CD1 4.12Å; W231-L259 HydrophobicContact CZ2-CD1 4.33Å; W231-L262 HydrophobicContact CB-CD1 4.22Å; W231-L262 HydrophobicContact CD2-CD1 3.15Å; W231-L262 HydrophobicContact CE3-CD1 3.25Å; W231-L262 HydrophobicContact CG-CD1 3.62Å; W231-L262 HydrophobicContact CH2-CD1 3.99Å; W231-L262 HydrophobicContact CZ2-CD1 3.92Å; W231-L262 HydrophobicContact CZ3-CD1 3.67Å; W231-F310 AromaticContact CH2-CE1 3.96Å; W231-F310 HydrophobicContact CH2-CE1 3.96Å; W231-F310 AromaticContact CH2-CZ 3.96Å; W231-F310 HydrophobicContact CH2-CZ 3.96Å; W231-F310 HydrophobicContact CZ3-CE1 4.31Å; W231-F310 HydrophobicContact CZ3-CZ 4.41Å
232	P	97.9	Very high	93.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.326	C	S	.	.			trans	-66.6	133.7	-174.8	21.1	-29	0	0	0	111.8	V162 M165 W168 E234 A235 W236 L262	V162-P232 HydrophobicContact CG1-CB 4.04Å; M165-P232 HydrophobicContact SD-CB 4.1Å; M165-P232 HydrophobicContact SD-CG 3.39Å; M165-P232 WeakPolarHBondContact SD-CG 3.38Å; W168-P232 HydrophobicContact CB-CB 4.06Å; W168-P232 HydrophobicContact CB-CG 4.05Å; W168-P232 HydrophobicContact CD2-CG 3.99Å; W168-P232 HydrophobicContact CE3-CG 3.98Å; W168-P232 HydrophobicContact CG-CB 4.45Å; W168-P232 HydrophobicContact CG-CG 4.03Å; P232-E234 PolarHBondContact O-N 2.86Å; P232-A235 HydrophobicContact CG-CB 3.96Å; P232-A235 WeakPolarHBondContact O-CB 3.28Å; P232-A235 PolarHBondContact O-N 3.46Å; P232-W236 VanDerWaalsContact C-CD1 3.41Å; P232-W236 PolarHBondContact O-N 3.19Å; P232-L262 HydrophobicContact CG-CD2 3.97Å
233	K	97.8	Very high	94.1	Very high	120 Å²	120	58.9 Å²	58.9	52%	0.522	31%	0.309	S	S	.	.	H	α-helix	trans	-53.6	-40.7	177.9	-177.6	175.4	178.4	-175.4	0	113.3	V162 G163 W231 A235 W236 S237	V162-K233 PolarHBondContact O-N 3.01Å; V162-K233 VanDerWaalsContact O-N 3.13Å; G163-K233 CarbonylContact O-C 3.54Å; G163-K233 WeakPolarHBondContact O-CA 3.5Å; G163-K233 WeakPolarHBondContact O-CB 3.47Å; G163-K233 PolarHBondContact O-N 2.78Å; G163-K233 VanDerWaalsContact O-N 3.07Å; W231-K233 PolarHBondContact O-N 2.84Å; K233-A235 PolarHBondContact O-N 2.84Å; K233-W236 VanDerWaalsContact CA-CE2 3.49Å; K233-W236 VanDerWaalsContact CA-NE1 3.26Å; K233-W236 HydrophobicContact CB-CZ2 3.81Å; K233-W236 HydrophobicContact CD-CH2 4.38Å; K233-W236 HydrophobicContact CD-CZ2 4.21Å; K233-W236 HydrophobicContact CG-CH2 3.92Å; K233-W236 HydrophobicContact CG-CZ2 3.59Å; K233-S237 WeakPolarHBondContact O-CB 3.41Å; K233-S237 PolarHBondContact O-N 2.98Å; K233-S237 PolarHBondContact O-OG 3.03Å
234	E	97.9	Very high	94.2	Very high	99 Å²	99	62 Å²	62	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-54.3	-35.3	175.9	-177.5	-178.6	174	0	0	112.5	G163 S164 M165 P232 Q238	G163-E234 PolarHBondContact O-N 3.41Å; S164-E234 WeakPolarHBondContact CA-OE2 3.49Å; S164-E234 VanDerWaalsContact CB-OE2 3.26Å; S164-E234 WeakPolarHBondContact CB-OE2 3.31Å; M165-E234 HydrophobicContact CG-CG 4.43Å; M165-E234 PolarHBondContact N-OE2 3.5Å; P232-E234 PolarHBondContact O-N 2.86Å; E234-Q238 PolarHBondContact O-NE2 2.87Å
235	A	97.4	Very high	94.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-79.7	-61.1	176.9	0	0	0	0	0	111.7	M165 P232 K233 S237 Q238 F239 L261 L262	M165-A235 HydrophobicContact SD-CB 3.99Å; P232-A235 HydrophobicContact CG-CB 3.96Å; P232-A235 WeakPolarHBondContact O-CB 3.28Å; P232-A235 PolarHBondContact O-N 3.46Å; K233-A235 PolarHBondContact O-N 2.84Å; A235-S237 VanDerWaalsContact C-N 3.33Å; A235-S237 PolarHBondContact O-N 3.05Å; A235-Q238 WeakPolarHBondContact O-CB 3.38Å; A235-Q238 PolarHBondContact O-N 3.39Å; A235-F239 VanDerWaalsContact O-CD2 3.3Å; A235-F239 WeakPolarHBondContact O-CD2 3.45Å; A235-L261 HydrophobicContact CB-CD2 3.83Å; A235-L262 HydrophobicContact CB-CD2 3.72Å; A235-L262 HydrophobicContact CB-CG 4.5Å
236	W	97	Very high	94.6	Very high	36 Å²	36	55.1 Å²	55.1	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-70.9	-26.7	-169.5	62.2	-106.7	0	0	0	113.6	W231 P232 K233 Q238 F239 A240 S241 L243 L246 C258	W231-W236 PolarHBondContact O-NE1 3.05Å; W231-W236 VanDerWaalsContact O-NE1 3.08Å; P232-W236 VanDerWaalsContact C-CD1 3.41Å; P232-W236 PolarHBondContact O-N 3.19Å; K233-W236 VanDerWaalsContact CA-CE2 3.49Å; K233-W236 VanDerWaalsContact CA-NE1 3.26Å; K233-W236 HydrophobicContact CB-CZ2 3.81Å; K233-W236 HydrophobicContact CD-CH2 4.38Å; K233-W236 HydrophobicContact CD-CZ2 4.21Å; K233-W236 HydrophobicContact CG-CH2 3.92Å; K233-W236 HydrophobicContact CG-CZ2 3.59Å; W236-Q238 PolarHBondContact O-N 3.34Å; W236-F239 PolarHBondContact O-N 3.27Å; W236-A240 PolarHBondContact O-N 3.01Å; W236-S241 WeakPolarHBondContact CZ3-O 3.34Å; W236-L243 HydrophobicContact CB-CD1 3.98Å; W236-L243 HydrophobicContact CD2-CB 4.12Å; W236-L243 HydrophobicContact CD2-CD1 4.41Å; W236-L243 HydrophobicContact CG-CB 4.37Å; W236-L243 HydrophobicContact CG-CD1 3.78Å; W236-L243 HydrophobicContact CZ2-CB 4.49Å; W236-L246 HydrophobicContact CB-CD1 4.17Å; W236-C258 VanDerWaalsContact CA-SG 3.58Å
237	S	97.4	Very high	94.9	Very high	60 Å²	60	52 Å²	52	42%	0.42	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.8	179.3	66.2	0	0	0	0	113.9	K233 A235 F239 A240	K233-S237 WeakPolarHBondContact O-CB 3.41Å; K233-S237 PolarHBondContact O-N 2.98Å; K233-S237 PolarHBondContact O-OG 3.03Å; A235-S237 VanDerWaalsContact C-N 3.33Å; A235-S237 PolarHBondContact O-N 3.05Å; S237-F239 VanDerWaalsContact C-N 3.26Å; S237-A240 WeakPolarHBondContact CA-O 3.29Å
238	Q	96.1	Very high	95.3	Very high	128 Å²	128	52.9 Å²	52.9	60%	0.598	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.4	170.2	-62.5	175.2	58.7	0	0	112.3	E234 A235 W236	E234-Q238 PolarHBondContact O-NE2 2.87Å; A235-Q238 WeakPolarHBondContact O-CB 3.38Å; A235-Q238 PolarHBondContact O-N 3.39Å; W236-Q238 PolarHBondContact O-N 3.34Å
239	F	95.4	Very high	95.5	Very high	34 Å²	34	55.4 Å²	55.4	15%	0.149	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-23.1	-168.5	-58.2	-73.1	0	0	0	113.4	A235 W236 S237 L246 S254 S257 C258 L261 P354	A235-F239 VanDerWaalsContact O-CD2 3.3Å; A235-F239 WeakPolarHBondContact O-CD2 3.45Å; W236-F239 PolarHBondContact O-N 3.27Å; S237-F239 VanDerWaalsContact C-N 3.26Å; F239-L246 HydrophobicContact CB-CD2 4.43Å; F239-S254 WeakPolarHBondContact O-CB 3.38Å; F239-S257 VanDerWaalsContact CE1-CB 3.42Å; F239-C258 HydrophobicContact CB-CB 4.15Å; F239-C258 HydrophobicContact CD2-CB 3.41Å; F239-C258 VanDerWaalsContact CD2-CB 3.41Å; F239-C258 HydrophobicContact CE2-CB 3.98Å; F239-C258 HydrophobicContact CG-CB 3.88Å; F239-L261 HydrophobicContact CE2-CD2 3.96Å; F239-P354 HydrophobicContact CE1-CG 4.06Å; F239-P354 HydrophobicContact CZ-CG 4.4Å
240	A	95.4	Very high	95.6	Very high	11 Å²	11	60.7 Å²	60.7	9%	0.091	31%	0.31	C	S	.	.			trans	-149.8	161.7	179.7	0	0	0	0	0	112.7	W236 S237 R242 D245 L246	W236-A240 PolarHBondContact O-N 3.01Å; S237-A240 WeakPolarHBondContact CA-O 3.29Å; A240-R242 WeakPolarHBondContact CB-O 3.39Å; A240-D245 HydrophobicContact CB-CB 4.11Å; A240-L246 HydrophobicContact CB-CD2 3.51Å; A240-L246 HydrophobicContact CB-CG 4.2Å
241	S	94.8	Very high	95.6	Very high	109 Å²	109	63 Å²	63	76%	0.762	32%	0.32	S	S	*	.	S	Bend	trans	-79.5	-31.5	177.8	-58.4	0	0	0	0	112.5	W236	W236-S241 WeakPolarHBondContact CZ3-O 3.34Å
242	R	94.6	Very high	95.5	Very high	150 Å²	150	65.1 Å²	65.1	57%	0.566	33%	0.332	S	S	*	.	S	Bend	trans	-131.8	154.8	172.4	-59	172.4	53.5	168.7	-4.7	110.2	A240 E244 D245	A240-R242 WeakPolarHBondContact CB-O 3.39Å; R242-E244 VanDerWaalsContact C-N 3.28Å; R242-E244 WeakPolarHBondContact CB-OE2 3.31Å; R242-E244 IonicContact CZ-OE2 3.22Å; R242-E244 VanDerWaalsContact CZ-OE2 3.22Å; R242-E244 IonicContact NE-OE2 2.85Å; R242-E244 PolarHBondContact NE-OE2 3.26Å; R242-E244 IonicContact NH2-OE2 2.75Å; R242-E244 PolarHBondContact NH2-OE2 2.98Å; R242-E244 PolarHBondContact O-N 3.02Å; R242-D245 WeakPolarHBondContact CB-OD2 3.42Å; R242-D245 PolarHBondContact N-OD2 3.28Å; R242-D245 WeakPolarHBondContact O-CB 3.28Å; R242-D245 PolarHBondContact O-N 2.87Å
243	L	94.9	Very high	95.3	Very high	6 Å²	6	73 Å²	73	3%	0.031	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-61.4	-39.7	177.9	179.1	60.6	0	0	0	111.7	Y220 T224 A229 W231 W236 D245 L246	Y220-L243 HydrophobicContact CD2-CD1 4.31Å; Y220-L243 HydrophobicContact CE2-CD1 3.67Å; Y220-L243 HydrophobicContact CE2-CG 3.91Å; Y220-L243 PolarHBondContact OH-O 2.7Å; T224-L243 HydrophobicContact CG2-CD2 4.45Å; T224-L243 HydrophobicContact CG2-CG 4.47Å; A229-L243 HydrophobicContact CB-CD2 3.79Å; W231-L243 HydrophobicContact CB-CD1 3.68Å; W231-L243 HydrophobicContact CB-CD2 4.14Å; W231-L243 HydrophobicContact CD2-CD1 4.24Å; W231-L243 HydrophobicContact CE3-CD1 4.06Å; W231-L243 HydrophobicContact CG-CD1 4.12Å; W236-L243 HydrophobicContact CB-CD1 3.98Å; W236-L243 HydrophobicContact CD2-CB 4.12Å; W236-L243 HydrophobicContact CD2-CD1 4.41Å; W236-L243 HydrophobicContact CG-CB 4.37Å; W236-L243 HydrophobicContact CG-CD1 3.78Å; W236-L243 HydrophobicContact CZ2-CB 4.49Å; L243-D245 PolarHBondContact O-N 3.5Å; L243-L246 HydrophobicContact CD1-CD1 3.98Å; L243-L246 WeakPolarHBondContact O-CG 3.47Å; L243-L246 PolarHBondContact O-N 3.27Å
244	E	94.3	Very high	95.2	Very high	79 Å²	79	69.3 Å²	69.3	37%	0.369	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-68.5	-20.3	-177.8	-49.5	80.7	-137.8	0	0	112.7	R242 L246 A247	R242-E244 VanDerWaalsContact C-N 3.28Å; R242-E244 WeakPolarHBondContact CB-OE2 3.31Å; R242-E244 IonicContact CZ-OE2 3.22Å; R242-E244 VanDerWaalsContact CZ-OE2 3.22Å; R242-E244 IonicContact NE-OE2 2.85Å; R242-E244 PolarHBondContact NE-OE2 3.26Å; R242-E244 IonicContact NH2-OE2 2.75Å; R242-E244 PolarHBondContact NH2-OE2 2.98Å; R242-E244 PolarHBondContact O-N 3.02Å; E244-L246 PolarHBondContact O-N 3.18Å; E244-A247 PolarHBondContact O-N 3.5Å
245	D	94.4	Very high	95.2	Very high	29 Å²	29	64.6 Å²	64.6	16%	0.155	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-67.3	-20.7	178.6	-62.4	-28.8	0	0	0	112	A240 R242 L243 A247 Q248 K251	A240-D245 HydrophobicContact CB-CB 4.11Å; R242-D245 WeakPolarHBondContact CB-OD2 3.42Å; R242-D245 PolarHBondContact N-OD2 3.28Å; R242-D245 WeakPolarHBondContact O-CB 3.28Å; R242-D245 PolarHBondContact O-N 2.87Å; L243-D245 PolarHBondContact O-N 3.5Å; D245-A247 PolarHBondContact O-N 3.43Å; D245-Q248 VanDerWaalsContact O-CB 3.31Å; D245-Q248 WeakPolarHBondContact O-CB 3.33Å; D245-Q248 WeakPolarHBondContact O-CG 3.5Å; D245-Q248 PolarHBondContact O-N 3.47Å; D245-Q248 VanDerWaalsContact O-N 3.08Å; D245-Q248 PolarHBondContact OD1-NE2 3.45Å; D245-Q248 VanDerWaalsContact OD1-NE2 3.12Å; D245-K251 WeakPolarHBondContact O-CB 3.42Å; D245-K251 WeakPolarHBondContact O-CG 3.39Å
246	L	95.1	Very high	95.2	Very high	1 Å²	1	65.7 Å²	65.7	1%	0.005	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-66.2	-18.7	178.2	-56.2	178.3	0	0	0	112.8	Y220 W231 W236 F239 A240 L243 E244 Q248 A255 C258 F310	Y220-L246 HydrophobicContact CE2-CB 4.42Å; Y220-L246 HydrophobicContact CE2-CD1 4.34Å; W231-L246 HydrophobicContact CE3-CD1 3.95Å; W231-L246 HydrophobicContact CZ3-CD1 3.8Å; W236-L246 HydrophobicContact CB-CD1 4.17Å; F239-L246 HydrophobicContact CB-CD2 4.43Å; A240-L246 HydrophobicContact CB-CD2 3.51Å; A240-L246 HydrophobicContact CB-CG 4.2Å; L243-L246 HydrophobicContact CD1-CD1 3.98Å; L243-L246 WeakPolarHBondContact O-CG 3.47Å; L243-L246 PolarHBondContact O-N 3.27Å; E244-L246 PolarHBondContact O-N 3.18Å; L246-Q248 VanDerWaalsContact C-N 3.29Å; L246-A255 HydrophobicContact CB-CB 3.91Å; L246-A255 HydrophobicContact CD2-CB 4.21Å; L246-A255 VanDerWaalsContact O-CB 3.3Å; L246-A255 WeakPolarHBondContact O-CB 3.38Å; L246-C258 HydrophobicContact CD1-CB 4.29Å; L246-F310 HydrophobicContact CB-CD1 4.2Å; L246-F310 HydrophobicContact CB-CE1 3.94Å
247	A	93.4	Very high	95.3	Very high	41 Å²	41	65.1 Å²	65.1	34%	0.339	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-78.3	-11.7	174.2	0	0	0	0	0	113.5	Y220 E244 D245	Y220-A247 HydrophobicContact CE1-CB 4.24Å; Y220-A247 PolarHBondContact OH-N 3Å; E244-A247 PolarHBondContact O-N 3.5Å; D245-A247 PolarHBondContact O-N 3.43Å
248	Q	94.2	Very high	95.3	Very high	79 Å²	79	62.2 Å²	62.2	37%	0.369	32%	0.322	S	S	.	.	S	Bend	trans	-73.5	132.6	-178.6	-65.2	173.2	15.5	0	0	110.8	D245 L246 E250 K251	D245-Q248 VanDerWaalsContact O-CB 3.31Å; D245-Q248 WeakPolarHBondContact O-CB 3.33Å; D245-Q248 WeakPolarHBondContact O-CG 3.5Å; D245-Q248 PolarHBondContact O-N 3.47Å; D245-Q248 VanDerWaalsContact O-N 3.08Å; D245-Q248 PolarHBondContact OD1-NE2 3.45Å; D245-Q248 VanDerWaalsContact OD1-NE2 3.12Å; L246-Q248 VanDerWaalsContact C-N 3.29Å; Q248-E250 PolarHBondContact O-N 3.4Å; Q248-E250 VanDerWaalsContact O-N 3.13Å; Q248-K251 HydrophobicContact CB-CB 4.39Å; Q248-K251 HydrophobicContact CB-CG 4.13Å; Q248-K251 PolarHBondContact O-N 2.97Å
249	P	92.6	Very high	95.4	Very high	99 Å²	99	56.1 Å²	56.1	64%	0.643	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-54.7	-34.3	-179.8	-27.4	35.5	0	0	0	114	K251 L252	P249-K251 PolarHBondContact O-N 3.09Å; P249-L252 WeakPolarHBondContact O-CB 3.43Å; P249-L252 PolarHBondContact O-N 3.03Å
250	E	94.7	Very high	95.6	Very high	154 Å²	154	54.6 Å²	54.6	72%	0.72	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-72.1	-14.1	-179.3	-52	74.7	-159.8	0	0	112.8	Q248	Q248-E250 PolarHBondContact O-N 3.4Å; Q248-E250 VanDerWaalsContact O-N 3.13Å
251	K	94.6	Very high	95.7	Very high	82 Å²	82	55.2 Å²	55.2	36%	0.357	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-102.9	6.7	179.8	-62.9	-61.9	-173.4	179.4	0	113.3	D245 Q248 P249 E253 S254 A255	D245-K251 WeakPolarHBondContact O-CB 3.42Å; D245-K251 WeakPolarHBondContact O-CG 3.39Å; Q248-K251 HydrophobicContact CB-CB 4.39Å; Q248-K251 HydrophobicContact CB-CG 4.13Å; Q248-K251 PolarHBondContact O-N 2.97Å; P249-K251 PolarHBondContact O-N 3.09Å; K251-E253 VanDerWaalsContact C-N 3.35Å; K251-E253 PolarHBondContact O-N 2.87Å; K251-S254 WeakPolarHBondContact O-CB 3.4Å; K251-S254 PolarHBondContact O-N 3.39Å; K251-S254 VanDerWaalsContact O-N 3.07Å; K251-A255 WeakPolarHBondContact O-CB 3.4Å; K251-A255 PolarHBondContact O-N 3.22Å
252	L	94.6	Very high	95.9	Very high	51 Å²	51	50 Å²	50	27%	0.267	25%	0.253	S	S	.	.	H	α-helix	trans	-54.5	-44.1	-170.6	-179.6	59.7	0	0	0	113.7	P249 S254 A255 L256 P307 F310	P249-L252 WeakPolarHBondContact O-CB 3.43Å; P249-L252 PolarHBondContact O-N 3.03Å; L252-S254 PolarHBondContact O-N 2.99Å; L252-A255 WeakPolarHBondContact O-CB 3.35Å; L252-A255 PolarHBondContact O-N 2.65Å; L252-L256 HydrophobicContact CD1-CD1 4.2Å; L252-L256 HydrophobicContact CD1-CD2 4.43Å; L252-L256 HydrophobicContact CD1-CG 4.03Å; L252-L256 HydrophobicContact CG-CD1 4.12Å; L252-L256 HydrophobicContact CG-CG 4.38Å; L252-L256 WeakPolarHBondContact O-CB 3.5Å; L252-L256 VanDerWaalsContact O-CG 3.26Å; L252-L256 WeakPolarHBondContact O-CG 3.47Å; L252-L256 PolarHBondContact O-N 3.38Å; L252-P307 HydrophobicContact CD1-CB 3.77Å; L252-P307 HydrophobicContact CD1-CG 4.19Å; L252-P307 HydrophobicContact CD2-CB 4.27Å; L252-P307 HydrophobicContact CD2-CG 4.28Å; L252-F310 HydrophobicContact CD1-CD2 4.47Å
253	E	95.1	Very high	96.1	Very high	166 Å²	166	42.9 Å²	42.9	78%	0.776	23%	0.226	S	C	*	.	H	α-helix	trans	-63.3	-42.8	178.9	-67	-171.2	164.3	0	0	112.6	K251 A255 L256 S257	K251-E253 VanDerWaalsContact C-N 3.35Å; K251-E253 PolarHBondContact O-N 2.87Å; E253-A255 VanDerWaalsContact C-N 3.35Å; E253-L256 PolarHBondContact O-N 3.37Å; E253-S257 PolarHBondContact O-N 3.47Å; E253-S257 PolarHBondContact O-OG 2.69Å
254	S	95.8	Very high	96.3	Very high	42 Å²	42	43.1 Å²	43.1	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-63.6	-41.2	174.1	-69.8	0	0	0	0	111.6	F239 K251 L252 S257 C258	F239-S254 WeakPolarHBondContact O-CB 3.38Å; K251-S254 WeakPolarHBondContact O-CB 3.4Å; K251-S254 PolarHBondContact O-N 3.39Å; K251-S254 VanDerWaalsContact O-N 3.07Å; L252-S254 PolarHBondContact O-N 2.99Å; S254-S257 PolarHBondContact O-N 3.38Å; S254-C258 PolarHBondContact O-N 2.83Å
255	A	97.2	Very high	96.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-46.1	177.2	0	0	0	0	0	111.8	L246 K251 L252 E253 S257 C258 L259 F310	L246-A255 HydrophobicContact CB-CB 3.91Å; L246-A255 HydrophobicContact CD2-CB 4.21Å; L246-A255 VanDerWaalsContact O-CB 3.3Å; L246-A255 WeakPolarHBondContact O-CB 3.38Å; K251-A255 WeakPolarHBondContact O-CB 3.4Å; K251-A255 PolarHBondContact O-N 3.22Å; L252-A255 WeakPolarHBondContact O-CB 3.35Å; L252-A255 PolarHBondContact O-N 2.65Å; E253-A255 VanDerWaalsContact C-N 3.35Å; A255-S257 VanDerWaalsContact C-N 3.33Å; A255-S257 PolarHBondContact O-N 2.83Å; A255-C258 PolarHBondContact O-N 2.93Å; A255-L259 WeakPolarHBondContact O-CB 3.5Å; A255-L259 PolarHBondContact O-N 3.06Å; A255-F310 HydrophobicContact CB-CD1 4.23Å; A255-F310 HydrophobicContact CB-CD2 3.94Å; A255-F310 HydrophobicContact CB-CE1 3.9Å; A255-F310 HydrophobicContact CB-CE2 3.57Å; A255-F310 HydrophobicContact CB-CG 4.26Å; A255-F310 HydrophobicContact CB-CZ 3.55Å; A255-F310 VanDerWaalsContact O-CZ 3.25Å; A255-F310 WeakPolarHBondContact O-CZ 3.35Å
256	L	97.7	Very high	96.7	Very high	23 Å²	23	39.3 Å²	39.3	12%	0.12	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-39.9	174.9	-68.6	174.8	0	0	0	112.2	L252 E253 C258 L259 N260 P307 F310	L252-L256 HydrophobicContact CD1-CD1 4.2Å; L252-L256 HydrophobicContact CD1-CD2 4.43Å; L252-L256 HydrophobicContact CD1-CG 4.03Å; L252-L256 HydrophobicContact CG-CD1 4.12Å; L252-L256 HydrophobicContact CG-CG 4.38Å; L252-L256 WeakPolarHBondContact O-CB 3.5Å; L252-L256 VanDerWaalsContact O-CG 3.26Å; L252-L256 WeakPolarHBondContact O-CG 3.47Å; L252-L256 PolarHBondContact O-N 3.38Å; E253-L256 PolarHBondContact O-N 3.37Å; L256-C258 PolarHBondContact O-N 3.42Å; L256-L259 HydrophobicContact CD2-CD2 4.32Å; L256-L259 WeakPolarHBondContact O-CB 3.49Å; L256-L259 PolarHBondContact O-N 2.82Å; L256-N260 WeakPolarHBondContact O-CB 3.31Å; L256-N260 PolarHBondContact O-N 3.1Å; L256-N260 PolarHBondContact O-ND2 3.25Å; L256-N260 PolarHBondContact O-OD1 3.36Å; L256-P307 HydrophobicContact CD1-CG 4.37Å; L256-P307 HydrophobicContact CD2-CG 4.28Å; L256-F310 HydrophobicContact CD2-CE2 4.37Å
257	S	98	Very high	96.9	Very high	23 Å²	23	39.2 Å²	39.2	16%	0.161	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-41.4	176	-59	0	0	0	0	112	F239 E253 S254 A255 N260 L261	F239-S257 VanDerWaalsContact CE1-CB 3.42Å; E253-S257 PolarHBondContact O-N 3.47Å; E253-S257 PolarHBondContact O-OG 2.69Å; S254-S257 PolarHBondContact O-N 3.38Å; A255-S257 VanDerWaalsContact C-N 3.33Å; A255-S257 PolarHBondContact O-N 2.83Å; S257-N260 PolarHBondContact O-N 2.92Å; S257-L261 PolarHBondContact O-N 2.97Å
258	C	98.4	Very high	97.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-43.3	174.8	-171.9	0	0	0	0	112	W231 W236 F239 L246 S254 A255 L256 N260 L261 L262	W231-C258 HydrophobicContact CZ3-CB 4.16Å; W231-C258 VanDerWaalsContact CZ3-SG 3.56Å; W236-C258 VanDerWaalsContact CA-SG 3.58Å; F239-C258 HydrophobicContact CB-CB 4.15Å; F239-C258 HydrophobicContact CD2-CB 3.41Å; F239-C258 VanDerWaalsContact CD2-CB 3.41Å; F239-C258 HydrophobicContact CE2-CB 3.98Å; F239-C258 HydrophobicContact CG-CB 3.88Å; L246-C258 HydrophobicContact CD1-CB 4.29Å; S254-C258 PolarHBondContact O-N 2.83Å; A255-C258 PolarHBondContact O-N 2.93Å; L256-C258 PolarHBondContact O-N 3.42Å; C258-N260 PolarHBondContact O-N 2.71Å; C258-L261 WeakPolarHBondContact O-CB 3.42Å; C258-L261 PolarHBondContact O-N 3.01Å; C258-L262 WeakPolarHBondContact O-CG 3.42Å; C258-L262 PolarHBondContact O-N 3.39Å; C258-L262 VanDerWaalsContact O-N 3.11Å
259	L	98.6	Very high	97.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-47.9	175	174.7	57.9	0	0	0	111.5	I217 W231 A255 L256 L261 L262 V263 C303 V309 F310	I217-L259 HydrophobicContact CG2-CD1 3.4Å; I217-L259 VanDerWaalsContact CG2-CD1 3.4Å; W231-L259 HydrophobicContact CH2-CB 4.14Å; W231-L259 HydrophobicContact CH2-CD1 4.12Å; W231-L259 HydrophobicContact CZ2-CD1 4.33Å; A255-L259 WeakPolarHBondContact O-CB 3.5Å; A255-L259 PolarHBondContact O-N 3.06Å; L256-L259 HydrophobicContact CD2-CD2 4.32Å; L256-L259 WeakPolarHBondContact O-CB 3.49Å; L256-L259 PolarHBondContact O-N 2.82Å; L259-L261 VanDerWaalsContact C-N 3.3Å; L259-L261 PolarHBondContact O-N 3.49Å; L259-L262 PolarHBondContact O-N 3.46Å; L259-V263 HydrophobicContact CD1-CG2 4.05Å; L259-V263 HydrophobicContact CG-CG2 4.48Å; L259-V263 WeakPolarHBondContact O-CG2 3.3Å; L259-V263 PolarHBondContact O-N 3.07Å; L259-C303 VanDerWaalsContact CD2-O 3.29Å; L259-C303 WeakPolarHBondContact CD2-O 3.37Å; L259-V309 HydrophobicContact CD1-CG1 4.24Å; L259-V309 HydrophobicContact CD1-CG2 4.37Å; L259-V309 HydrophobicContact CD2-CB 4.03Å; L259-V309 HydrophobicContact CD2-CG1 4.41Å; L259-V309 HydrophobicContact CD2-CG2 3.85Å; L259-F310 HydrophobicContact CB-CE2 4.25Å; L259-F310 HydrophobicContact CB-CZ 3.97Å; L259-F310 HydrophobicContact CD2-CE2 3.94Å; L259-F310 HydrophobicContact CD2-CZ 4.32Å
260	N	98.7	Very high	97.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-35.7	179.8	-66.7	-15.4	0	0	0	111.9	L256 S257 C258 T264 Y304 N305 D353	L256-N260 WeakPolarHBondContact O-CB 3.31Å; L256-N260 PolarHBondContact O-N 3.1Å; L256-N260 PolarHBondContact O-ND2 3.25Å; L256-N260 PolarHBondContact O-OD1 3.36Å; S257-N260 PolarHBondContact O-N 2.92Å; C258-N260 PolarHBondContact O-N 2.71Å; N260-T264 VanDerWaalsContact O-CB 3.24Å; N260-T264 WeakPolarHBondContact O-CB 3.4Å; N260-T264 PolarHBondContact O-N 2.98Å; N260-T264 PolarHBondContact O-OG1 3.4Å; N260-Y304 HydrophobicContact CB-CD2 4.48Å; N260-Y304 HydrophobicContact CB-CE2 3.84Å; N260-N305 WeakPolarHBondContact OD1-CA 3.33Å; N260-N305 PolarHBondContact OD1-N 3.37Å; N260-D353 WeakPolarHBondContact CB-OD2 3.45Å; N260-D353 PolarHBondContact ND2-OD2 3.47Å
261	L	98.7	Very high	97.8	Very high	24 Å²	24	26.8 Å²	26.8	13%	0.126	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-50.4	171.4	179.7	62.2	0	0	0	111.8	A235 F239 S257 C258 L259 T264 D265 T355	A235-L261 HydrophobicContact CB-CD2 3.83Å; F239-L261 HydrophobicContact CE2-CD2 3.96Å; S257-L261 PolarHBondContact O-N 2.97Å; C258-L261 WeakPolarHBondContact O-CB 3.42Å; C258-L261 PolarHBondContact O-N 3.01Å; L259-L261 VanDerWaalsContact C-N 3.3Å; L259-L261 PolarHBondContact O-N 3.49Å; L261-T264 WeakPolarHBondContact O-CB 3.46Å; L261-T264 PolarHBondContact O-N 3.18Å; L261-D265 PolarHBondContact O-N 2.7Å; L261-T355 HydrophobicContact CB-CG2 3.73Å; L261-T355 HydrophobicContact CD1-CG2 3.72Å; L261-T355 HydrophobicContact CG-CG2 4.29Å
262	L	98.8	Very high	98	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-70.4	-38.1	-177.2	-63.6	-179.5	0	0	0	112.4	M165 W168 I217 W231 P232 A235 C258 L259 T264 D265 A266	M165-L262 HydrophobicContact CE-CD2 4.31Å; M165-L262 HydrophobicContact SD-CD2 4.34Å; W168-L262 HydrophobicContact CE3-CD2 4.38Å; W168-L262 HydrophobicContact CH2-CB 4.24Å; W168-L262 HydrophobicContact CH2-CD2 4.04Å; W168-L262 HydrophobicContact CZ3-CD2 3.79Å; I217-L262 HydrophobicContact CD1-CB 3.94Å; I217-L262 WeakPolarHBondContact CD1-O 3.44Å; I217-L262 HydrophobicContact CG1-CB 3.88Å; W231-L262 HydrophobicContact CB-CD1 4.22Å; W231-L262 HydrophobicContact CD2-CD1 3.15Å; W231-L262 HydrophobicContact CE3-CD1 3.25Å; W231-L262 HydrophobicContact CG-CD1 3.62Å; W231-L262 HydrophobicContact CH2-CD1 3.99Å; W231-L262 HydrophobicContact CZ2-CD1 3.92Å; W231-L262 HydrophobicContact CZ3-CD1 3.67Å; P232-L262 HydrophobicContact CG-CD2 3.97Å; A235-L262 HydrophobicContact CB-CD2 3.72Å; A235-L262 HydrophobicContact CB-CG 4.5Å; C258-L262 WeakPolarHBondContact O-CG 3.42Å; C258-L262 PolarHBondContact O-N 3.39Å; C258-L262 VanDerWaalsContact O-N 3.11Å; L259-L262 PolarHBondContact O-N 3.46Å; L262-T264 VanDerWaalsContact C-N 3.33Å; L262-D265 PolarHBondContact O-N 3.44Å; L262-A266 PolarHBondContact O-N 3.36Å
263	V	98.8	Very high	98.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-44	172.4	174.8	0	0	0	0	110.3	I217 L259 D265 A266 L267 L300 Y304	I217-V263 HydrophobicContact CD1-CG2 4.3Å; I217-V263 HydrophobicContact CG2-CG2 3.91Å; L259-V263 HydrophobicContact CD1-CG2 4.05Å; L259-V263 HydrophobicContact CG-CG2 4.48Å; L259-V263 WeakPolarHBondContact O-CG2 3.3Å; L259-V263 PolarHBondContact O-N 3.07Å; V263-D265 VanDerWaalsContact C-N 3.3Å; V263-D265 PolarHBondContact O-N 3.09Å; V263-A266 PolarHBondContact O-N 2.81Å; V263-L267 HydrophobicContact CG1-CD1 4.3Å; V263-L267 HydrophobicContact CG1-CG 4.38Å; V263-L267 VanDerWaalsContact O-CG 3.32Å; V263-L267 WeakPolarHBondContact O-CG 3.22Å; V263-L267 PolarHBondContact O-N 3.35Å; V263-L300 HydrophobicContact CG1-CB 4.2Å; V263-L300 HydrophobicContact CG1-CD2 4.25Å; V263-L300 HydrophobicContact CG2-CD2 4.23Å; V263-Y304 HydrophobicContact CB-CD2 3.92Å; V263-Y304 HydrophobicContact CG1-CD2 3.65Å; V263-Y304 HydrophobicContact CG1-CG 4.44Å; V263-Y304 HydrophobicContact CG2-CD2 4.46Å
264	T	98.8	Very high	98.4	Very high	11 Å²	11	15.7 Å²	15.7	7%	0.067	8%	0.084	C	C	.	.	H	α-helix	trans	-59.7	-41.6	176.7	-61.7	0	0	0	0	111.6	N260 L261 L262 L267 K358 T359 I362	N260-T264 VanDerWaalsContact O-CB 3.24Å; N260-T264 WeakPolarHBondContact O-CB 3.4Å; N260-T264 PolarHBondContact O-N 2.98Å; N260-T264 PolarHBondContact O-OG1 3.4Å; L261-T264 WeakPolarHBondContact O-CB 3.46Å; L261-T264 PolarHBondContact O-N 3.18Å; L262-T264 VanDerWaalsContact C-N 3.33Å; T264-L267 PolarHBondContact O-N 3.43Å; T264-K358 HydrophobicContact CG2-CB 3.96Å; T264-T359 PolarHBondContact OG1-OG1 3.27Å; T264-I362 HydrophobicContact CG2-CG2 4.14Å
265	D	98.8	Very high	98.5	Very high	28 Å²	28	15.3 Å²	15.3	15%	0.15	8%	0.083	C	C	.	.	H	α-helix	trans	-66.1	-41.9	174.6	176.4	78.5	0	0	0	112.2	M165 W168 K213 L261 L262 V263 L267 R268	M165-D265 HydrophobicContact CE-CB 3.71Å; W168-D265 HydrophobicContact CZ3-CB 4.44Å; W168-D265 WeakPolarHBondContact CZ3-OD2 3.26Å; K213-D265 IonicContact NZ-OD1 3.44Å; K213-D265 IonicContact NZ-OD2 4Å; K213-D265 PolarHBondContact NZ-OD2 2.83Å; L261-D265 PolarHBondContact O-N 2.7Å; L262-D265 PolarHBondContact O-N 3.44Å; V263-D265 VanDerWaalsContact C-N 3.3Å; V263-D265 PolarHBondContact O-N 3.09Å; D265-L267 VanDerWaalsContact C-N 3.32Å; D265-L267 PolarHBondContact O-N 3.17Å; D265-R268 WeakPolarHBondContact O-CB 3.31Å; D265-R268 VanDerWaalsContact O-CD 3.23Å; D265-R268 WeakPolarHBondContact O-CD 3.42Å; D265-R268 WeakPolarHBondContact O-CG 3.41Å; D265-R268 PolarHBondContact O-N 3.29Å; D265-R268 WeakPolarHBondContact OD1-CD 3.4Å; D265-R268 IonicContact OD1-NE 3.8Å; D265-R268 PolarHBondContact OD1-NE 2.91Å
266	A	98.8	Very high	98.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-39.4	175.7	0	0	0	0	0	112.3	F210 K213 I217 L262 V263 R268 H269 L300	F210-A266 WeakPolarHBondContact CD2-O 3.23Å; K213-A266 HydrophobicContact CB-CB 3.92Å; K213-A266 HydrophobicContact CD-CB 4.45Å; I217-A266 HydrophobicContact CD1-CB 3.92Å; L262-A266 PolarHBondContact O-N 3.36Å; V263-A266 PolarHBondContact O-N 2.81Å; A266-R268 PolarHBondContact O-N 3.41Å; A266-R268 VanDerWaalsContact O-N 3.1Å; A266-H269 PolarHBondContact O-CD2 3.01Å; A266-H269 PolarHBondContact O-N 3.1Å; A266-L300 HydrophobicContact CB-CD1 3.94Å; A266-L300 HydrophobicContact CB-CD2 4.44Å
267	L	98.8	Very high	98.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59.7	-21.3	178.6	-73.2	174.2	0	0	0	113.7	V263 T264 D265 H269 V270 I297 L300 I345 I362 L363 I366	V263-L267 HydrophobicContact CG1-CD1 4.3Å; V263-L267 HydrophobicContact CG1-CG 4.38Å; V263-L267 VanDerWaalsContact O-CG 3.32Å; V263-L267 WeakPolarHBondContact O-CG 3.22Å; V263-L267 PolarHBondContact O-N 3.35Å; T264-L267 PolarHBondContact O-N 3.43Å; D265-L267 VanDerWaalsContact C-N 3.32Å; D265-L267 PolarHBondContact O-N 3.17Å; L267-H269 PolarHBondContact O-N 3.12Å; L267-H269 VanDerWaalsContact O-N 3.11Å; L267-V270 HydrophobicContact CD2-CG2 4.14Å; L267-V270 WeakPolarHBondContact O-CB 3.32Å; L267-V270 WeakPolarHBondContact O-CG2 3.3Å; L267-V270 PolarHBondContact O-N 2.99Å; L267-V270 VanDerWaalsContact O-N 3.08Å; L267-I297 HydrophobicContact CD2-CD1 3.43Å; L267-I297 VanDerWaalsContact CD2-CD1 3.43Å; L267-L300 HydrophobicContact CD2-CD1 4.17Å; L267-I345 HydrophobicContact CD1-CD1 4.19Å; L267-I345 HydrophobicContact CD1-CG2 4.49Å; L267-I345 HydrophobicContact CD2-CD1 4.09Å; L267-I362 HydrophobicContact CB-CG1 4.04Å; L267-I362 HydrophobicContact CB-CG2 4.08Å; L267-I362 HydrophobicContact CD1-CG2 4.31Å; L267-L363 HydrophobicContact CD1-CD2 4.05Å; L267-I366 HydrophobicContact CB-CD1 4.14Å; L267-I366 HydrophobicContact CD2-CD1 4.12Å
268	R	98.5	Very high	98.6	Very high	90 Å²	90	17 Å²	17	34%	0.34	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.8	178.5	87.8	-167.7	173.7	63	-1.2	113.8	D169 D265 A266 P271 I362	D169-R268 IonicContact OD1-CZ 3.95Å; D169-R268 IonicContact OD1-NH2 3.2Å; D169-R268 PolarHBondContact OD1-NH2 3.42Å; D169-R268 IonicContact OD2-CZ 2.99Å; D169-R268 IonicContact OD2-NH2 2.78Å; D169-R268 PolarHBondContact OD2-NH2 2.85Å; D265-R268 WeakPolarHBondContact O-CB 3.31Å; D265-R268 VanDerWaalsContact O-CD 3.23Å; D265-R268 WeakPolarHBondContact O-CD 3.42Å; D265-R268 WeakPolarHBondContact O-CG 3.41Å; D265-R268 PolarHBondContact O-N 3.29Å; D265-R268 WeakPolarHBondContact OD1-CD 3.4Å; D265-R268 IonicContact OD1-NE 3.8Å; D265-R268 PolarHBondContact OD1-NE 2.91Å; A266-R268 PolarHBondContact O-N 3.41Å; A266-R268 VanDerWaalsContact O-N 3.1Å; R268-P271 WeakPolarHBondContact O-CD 3.49Å; R268-I362 HydrophobicContact CB-CD1 4.45Å
269	H	98.8	Very high	98.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-16	179.2	-62.6	-65.3	0	0	0	113.5	L209 F210 A266 L267 D272 V273	L209-H269 VanDerWaalsContact CD2-CE1 3.42Å; L209-H269 WeakPolarHBondContact CD2-CE1 3.3Å; F210-H269 HydrophobicContact CB-CB 3.86Å; F210-H269 HydrophobicContact CD2-CB 4.17Å; F210-H269 HydrophobicContact CG-CB 4.4Å; A266-H269 PolarHBondContact O-CD2 3.01Å; A266-H269 PolarHBondContact O-N 3.1Å; L267-H269 PolarHBondContact O-N 3.12Å; L267-H269 VanDerWaalsContact O-N 3.11Å; H269-D272 WeakPolarHBondContact O-CB 3.44Å; H269-D272 PolarHBondContact O-N 3.28Å; H269-D272 VanDerWaalsContact O-N 3.13Å; H269-V273 WeakPolarHBondContact O-CG2 3.39Å; H269-V273 PolarHBondContact O-N 2.99Å
270	V	98.8	Very high	98.5	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.012	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-40.3	-175.2	175.7	0	0	0	0	113.2	F210 L267 D272 V273 I274 I297 I338 I366	F210-V270 HydrophobicContact CD2-CG2 4.06Å; F210-V270 HydrophobicContact CE2-CG2 3.42Å; F210-V270 VanDerWaalsContact CE2-CG2 3.42Å; F210-V270 HydrophobicContact CZ-CG2 3.68Å; L267-V270 HydrophobicContact CD2-CG2 4.14Å; L267-V270 WeakPolarHBondContact O-CB 3.32Å; L267-V270 WeakPolarHBondContact O-CG2 3.3Å; L267-V270 PolarHBondContact O-N 2.99Å; L267-V270 VanDerWaalsContact O-N 3.08Å; V270-D272 VanDerWaalsContact C-N 3.3Å; V270-D272 PolarHBondContact O-N 2.8Å; V270-V273 WeakPolarHBondContact O-CB 3.44Å; V270-V273 PolarHBondContact O-N 2.86Å; V270-I274 HydrophobicContact CG1-CD1 4.22Å; V270-I274 WeakPolarHBondContact O-CG1 3.38Å; V270-I274 PolarHBondContact O-N 3.19Å; V270-I297 HydrophobicContact CG2-CD1 4.16Å; V270-I338 HydrophobicContact CG1-CD1 4.37Å; V270-I338 HydrophobicContact CG1-CG2 3.62Å; V270-I366 HydrophobicContact CB-CD1 3.76Å; V270-I366 HydrophobicContact CB-CG1 3.87Å; V270-I366 HydrophobicContact CG1-CB 4.45Å; V270-I366 HydrophobicContact CG1-CD1 3.98Å; V270-I366 HydrophobicContact CG1-CG1 3.85Å; V270-I366 HydrophobicContact CG1-CG2 3.76Å; V270-I366 HydrophobicContact CG2-CD1 4.09Å
271	P	98.6	Very high	98.5	Very high	18 Å²	18	30.6 Å²	30.6	12%	0.117	15%	0.148	C	C	.	.	H	α-helix	trans	-56.6	-41.7	172.9	-28.7	38.6	0	0	0	113.4	R268 I274 A275 I362 V365 I366 K369	R268-P271 WeakPolarHBondContact O-CD 3.49Å; P271-I274 PolarHBondContact O-N 3.29Å; P271-A275 PolarHBondContact O-N 2.93Å; P271-I362 HydrophobicContact CG-CD1 4.38Å; P271-V365 HydrophobicContact CG-CG1 3.89Å; P271-I366 HydrophobicContact CG-CG1 4.34Å; P271-K369 HydrophobicContact CB-CG 4.26Å
272	D	98.7	Very high	98.4	Very high	55 Å²	55	30.8 Å²	30.8	29%	0.294	15%	0.149	S	C	.	.	H	α-helix	trans	-69.8	-37.6	177.9	-68.6	-7.6	0	0	0	111.4	L203 S206 H269 V270 I274 A275 Y276	L203-D272 HydrophobicContact CD2-CB 3.6Å; S206-D272 VanDerWaalsContact CB-CB 3.47Å; S206-D272 WeakPolarHBondContact CB-OD2 3.41Å; S206-D272 PolarHBondContact OG-OD2 3.39Å; H269-D272 WeakPolarHBondContact O-CB 3.44Å; H269-D272 PolarHBondContact O-N 3.28Å; H269-D272 VanDerWaalsContact O-N 3.13Å; V270-D272 VanDerWaalsContact C-N 3.3Å; V270-D272 PolarHBondContact O-N 2.8Å; D272-I274 VanDerWaalsContact C-N 3.34Å; D272-I274 PolarHBondContact O-N 3.27Å; D272-A275 PolarHBondContact O-N 3.24Å; D272-Y276 WeakPolarHBondContact O-CB 3.46Å; D272-Y276 PolarHBondContact O-N 3.05Å
273	V	98.7	Very high	98.3	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-58.4	-45.8	172.9	167.6	0	0	0	0	110.8	M207 F210 H269 V270 A275 Y276 L277 Q293	M207-V273 HydrophobicContact SD-CB 3.99Å; M207-V273 HydrophobicContact SD-CG1 3.85Å; M207-V273 HydrophobicContact SD-CG2 3.82Å; F210-V273 HydrophobicContact CB-CG2 4.13Å; F210-V273 HydrophobicContact CD1-CG2 4.34Å; F210-V273 HydrophobicContact CG-CG2 4.31Å; H269-V273 WeakPolarHBondContact O-CG2 3.39Å; H269-V273 PolarHBondContact O-N 2.99Å; V270-V273 WeakPolarHBondContact O-CB 3.44Å; V270-V273 PolarHBondContact O-N 2.86Å; V273-A275 VanDerWaalsContact C-N 3.34Å; V273-A275 PolarHBondContact O-N 3.09Å; V273-Y276 PolarHBondContact O-N 3.15Å; V273-L277 HydrophobicContact CG1-CD1 3.93Å; V273-L277 HydrophobicContact CG1-CG 4.46Å; V273-L277 WeakPolarHBondContact O-CB 3.47Å; V273-L277 VanDerWaalsContact O-CG 3.29Å; V273-L277 WeakPolarHBondContact O-CG 3.23Å; V273-L277 PolarHBondContact O-N 3.45Å; V273-Q293 HydrophobicContact CG1-CB 3.83Å; V273-Q293 HydrophobicContact CG1-CG 3.84Å; V273-Q293 VanDerWaalsContact CG2-OE1 3.29Å
274	I	98.4	Very high	98.2	Very high	10 Å²	10	36 Å²	36	5%	0.051	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-45.2	175.8	-66.4	166.9	0	0	0	110.2	V270 P271 D272 S278 M331 Q335 I338 K369 S370	V270-I274 HydrophobicContact CG1-CD1 4.22Å; V270-I274 WeakPolarHBondContact O-CG1 3.38Å; V270-I274 PolarHBondContact O-N 3.19Å; P271-I274 PolarHBondContact O-N 3.29Å; D272-I274 VanDerWaalsContact C-N 3.34Å; D272-I274 PolarHBondContact O-N 3.27Å; I274-S278 WeakPolarHBondContact O-CB 3.41Å; I274-S278 PolarHBondContact O-N 3.01Å; I274-M331 HydrophobicContact CG2-CE 3.98Å; I274-M331 WeakPolarHBondContact O-CE 3.36Å; I274-Q335 HydrophobicContact CG2-CG 4.33Å; I274-I338 HydrophobicContact CD1-CD1 4.24Å; I274-I338 HydrophobicContact CD1-CG2 4.37Å; I274-I338 HydrophobicContact CG1-CD1 3.74Å; I274-K369 HydrophobicContact CD1-CB 3.99Å; I274-S370 WeakPolarHBondContact CD1-OG 3.47Å
275	A	98.3	Very high	98.1	Very high	34 Å²	34	35.4 Å²	35.4	28%	0.281	17%	0.171	S	C	.	.	H	α-helix	trans	-62.1	-45.1	179.2	0	0	0	0	0	111.9	L203 P271 D272 V273 S278	L203-A275 HydrophobicContact CD1-CB 3.96Å; L203-A275 HydrophobicContact CD2-CB 4.15Å; P271-A275 PolarHBondContact O-N 2.93Å; D272-A275 PolarHBondContact O-N 3.24Å; V273-A275 VanDerWaalsContact C-N 3.34Å; V273-A275 PolarHBondContact O-N 3.09Å; A275-S278 PolarHBondContact O-N 2.81Å; A275-S278 PolarHBondContact O-OG 3.37Å
276	Y	98.6	Very high	98.1	Very high	9 Å²	9	34.6 Å²	34.6	4%	0.035	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-54.3	177.3	-175.6	-85.6	0	0	0	111.3	S184 V197 L203 A204 M207 D272 V273 S278 R279 L280 C289	S184-Y276 WeakPolarHBondContact CB-OH 3.43Å; S184-Y276 WeakPolarHBondContact OG-CE2 3.37Å; S184-Y276 PolarHBondContact OG-OH 2.86Å; V197-Y276 HydrophobicContact CG1-CE2 4.24Å; L203-Y276 HydrophobicContact CB-CD2 3.93Å; A204-Y276 HydrophobicContact CB-CE2 4.03Å; M207-Y276 HydrophobicContact CE-CD1 3.64Å; M207-Y276 HydrophobicContact CE-CE1 3.97Å; M207-Y276 HydrophobicContact CE-CG 4.42Å; M207-Y276 HydrophobicContact CG-CD1 3.75Å; M207-Y276 HydrophobicContact CG-CD2 4.02Å; M207-Y276 HydrophobicContact CG-CE1 4.31Å; M207-Y276 HydrophobicContact CG-CG 3.59Å; M207-Y276 HydrophobicContact SD-CD1 3.75Å; M207-Y276 HydrophobicContact SD-CG 3.96Å; D272-Y276 WeakPolarHBondContact O-CB 3.46Å; D272-Y276 PolarHBondContact O-N 3.05Å; V273-Y276 PolarHBondContact O-N 3.15Å; Y276-S278 PolarHBondContact O-N 3.1Å; Y276-R279 WeakPolarHBondContact O-CB 3.38Å; Y276-R279 PolarHBondContact O-N 3.03Å; Y276-L280 HydrophobicContact CD1-CD1 4.35Å; Y276-L280 HydrophobicContact CE1-CD1 4.01Å; Y276-L280 HydrophobicContact CE1-CD2 3.94Å; Y276-L280 HydrophobicContact CE1-CG 4.25Å; Y276-C289 HydrophobicContact CE1-CB 4.46Å
277	L	98.4	Very high	97.9	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-28.9	-177.7	-67.5	176.3	0	0	0	112.2	M207 V273 R279 L280 F286 C289 A290 M331 V334	M207-L277 HydrophobicContact CE-CD2 3.85Å; M207-L277 HydrophobicContact CE-CG 4.25Å; M207-L277 HydrophobicContact SD-CG 4.43Å; V273-L277 HydrophobicContact CG1-CD1 3.93Å; V273-L277 HydrophobicContact CG1-CG 4.46Å; V273-L277 WeakPolarHBondContact O-CB 3.47Å; V273-L277 VanDerWaalsContact O-CG 3.29Å; V273-L277 WeakPolarHBondContact O-CG 3.23Å; V273-L277 PolarHBondContact O-N 3.45Å; L277-R279 PolarHBondContact O-N 3.06Å; L277-L280 HydrophobicContact CD2-CD1 3.81Å; L277-L280 PolarHBondContact O-N 3.19Å; L277-F286 HydrophobicContact CB-CE2 4.26Å; L277-C289 HydrophobicContact CD2-CB 3.5Å; L277-A290 HydrophobicContact CD1-CB 4.17Å; L277-A290 HydrophobicContact CD2-CB 4.13Å; L277-M331 HydrophobicContact CB-CE 4.11Å; L277-M331 HydrophobicContact CB-SD 3.42Å; L277-M331 WeakPolarHBondContact CB-SD 3.45Å; L277-V334 HydrophobicContact CD1-CG1 3.9Å
278	S	97.6	Very high	97.8	Very high	73 Å²	73	35.3 Å²	35.3	51%	0.51	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.1	177.4	78.1	0	0	0	0	114.5	I274 A275 Y276	I274-S278 WeakPolarHBondContact O-CB 3.41Å; I274-S278 PolarHBondContact O-N 3.01Å; A275-S278 PolarHBondContact O-N 2.81Å; A275-S278 PolarHBondContact O-OG 3.37Å; Y276-S278 PolarHBondContact O-N 3.1Å
279	R	97.4	Very high	97.7	Very high	76 Å²	76	31.5 Å²	31.5	29%	0.287	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-16.7	-179.8	-63.8	178.1	-178.5	173	3.8	113.3	E196 V197 D200 Y276 L277	E196-R279 IonicContact OE1-CZ 3.21Å; E196-R279 IonicContact OE1-NH1 2.61Å; V197-R279 HydrophobicContact CG2-CB 4.35Å; D200-R279 IonicContact OD2-CZ 2.65Å; D200-R279 IonicContact OD2-NH1 3.2Å; D200-R279 PolarHBondContact OD2-NH1 3.3Å; D200-R279 IonicContact OD2-NH2 3.42Å; D200-R279 PolarHBondContact OD2-NH2 3.45Å; Y276-R279 WeakPolarHBondContact O-CB 3.38Å; Y276-R279 PolarHBondContact O-N 3.03Å; L277-R279 PolarHBondContact O-N 3.06Å
280	L	98.1	Very high	97.7	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.089	16%	0.156	C	C	.	.			trans	-74.9	132.4	-175.9	-57.3	179.3	0	0	0	110.9	E193 V197 Y276 L277 V285 F286 C289	E193-L280 HydrophobicContact CG-CD2 4.28Å; E193-L280 WeakPolarHBondContact OE2-CA 3.17Å; V197-L280 HydrophobicContact CG1-CD2 4.04Å; V197-L280 HydrophobicContact CG2-CD2 4.32Å; Y276-L280 HydrophobicContact CD1-CD1 4.35Å; Y276-L280 HydrophobicContact CE1-CD1 4.01Å; Y276-L280 HydrophobicContact CE1-CD2 3.94Å; Y276-L280 HydrophobicContact CE1-CG 4.25Å; L277-L280 HydrophobicContact CD2-CD1 3.81Å; L277-L280 PolarHBondContact O-N 3.19Å; L280-V285 HydrophobicContact CD1-CG1 4.34Å; L280-V285 HydrophobicContact CD2-CG1 4.07Å; L280-F286 HydrophobicContact CB-CB 4.43Å; L280-F286 HydrophobicContact CB-CD2 4.14Å; L280-F286 HydrophobicContact CD1-CD2 4.48Å; L280-C289 HydrophobicContact CD1-CB 3.6Å
281	R	97.2	Very high	97.5	Very high	192 Å²	192	31.5 Å²	31.5	73%	0.725	16%	0.156	S	C	*	.			trans	-110.6	-34.7	-177.2	-58.5	-170.4	-172.4	-136.1	8.8	112.8	E193 D194	E193-R281 VanDerWaalsContact CD-N 3.34Å; E193-R281 PolarHBondContact OE1-N 3.1Å; E193-R281 PolarHBondContact OE2-N 2.98Å; D194-R281 IonicContact OD2-CZ 2.65Å; D194-R281 IonicContact OD2-NE 3.47Å; D194-R281 PolarHBondContact OD2-NE 3.06Å; D194-R281 IonicContact OD2-NH2 2.65Å; D194-R281 PolarHBondContact OD2-NH2 2.76Å
282	N	97.7	Very high	97.3	Very high	28 Å²	28	31.7 Å²	31.7	15%	0.15	16%	0.157	C	C	.	.	S	Bend	trans	-77.1	128.7	179	178.4	-81	0	0	0	110	D62 L192 E193 S284 V285 F286	D62-N282 PolarHBondContact OD2-ND2 3.05Å; D62-N282 PolarHBondContact OD2-OD1 3.37Å; L192-N282 HydrophobicContact CB-CB 4.14Å; E193-N282 WeakPolarHBondContact OE1-CB 3.39Å; E193-N282 PolarHBondContact OE1-N 3Å; N282-S284 VanDerWaalsContact C-N 3.33Å; N282-S284 PolarHBondContact O-N 2.79Å; N282-S284 WeakPolarHBondContact OD1-CA 3.43Å; N282-S284 WeakPolarHBondContact OD1-CB 3.29Å; N282-S284 PolarHBondContact OD1-N 3.27Å; N282-S284 PolarHBondContact OD1-OG 3.05Å; N282-V285 HydrophobicContact CB-CB 4.12Å; N282-V285 HydrophobicContact CB-CG2 3.95Å; N282-V285 PolarHBondContact O-N 2.96Å; N282-V285 PolarHBondContact OD1-N 3.15Å; N282-F286 WeakPolarHBondContact O-CB 3.48Å; N282-F286 PolarHBondContact O-N 3.42Å
283	Q	96.6	Very high	97.3	Very high	102 Å²	102	29.3 Å²	29.3	48%	0.477	15%	0.145	S	C	.	.	H	α-helix	trans	-64.6	-35.7	-175.2	-172.7	63.4	69.7	0	0	113.2	N287 T329	Q283-N287 PolarHBondContact NE2-OD1 3.21Å; Q283-N287 WeakPolarHBondContact O-CB 3.46Å; Q283-N287 PolarHBondContact O-N 3.14Å; Q283-N287 PolarHBondContact O-ND2 3.39Å; Q283-N287 PolarHBondContact O-OD1 3.28Å; Q283-T329 PolarHBondContact NE2-O 3.25Å
284	S	95.9	Very high	97.3	Very high	7 Å²	7	29.2 Å²	29.2	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-71	-41	179.2	78.7	0	0	0	0	111.4	A60 D62 N282 N287 F288	A60-S284 WeakPolarHBondContact O-CB 3.41Å; D62-S284 PolarHBondContact N-OG 3.14Å; D62-S284 VanDerWaalsContact N-OG 3.09Å; D62-S284 PolarHBondContact OD2-OG 3.46Å; N282-S284 VanDerWaalsContact C-N 3.33Å; N282-S284 PolarHBondContact O-N 2.79Å; N282-S284 WeakPolarHBondContact OD1-CA 3.43Å; N282-S284 WeakPolarHBondContact OD1-CB 3.29Å; N282-S284 PolarHBondContact OD1-N 3.27Å; N282-S284 PolarHBondContact OD1-OG 3.05Å; S284-N287 PolarHBondContact O-N 2.87Å; S284-F288 VanDerWaalsContact O-CB 3.29Å; S284-F288 WeakPolarHBondContact O-CB 3.35Å; S284-F288 PolarHBondContact O-N 3.27Å
285	V	97.8	Very high	97.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-45.1	173.3	179.1	0	0	0	0	110.4	L61 L65 F187 L192 E193 L280 N282 N287 F288 C289	L61-V285 HydrophobicContact CD2-CG2 4.41Å; L65-V285 HydrophobicContact CD2-CG2 3.73Å; F187-V285 HydrophobicContact CB-CG1 4.36Å; F187-V285 HydrophobicContact CD1-CG1 4.01Å; F187-V285 HydrophobicContact CD1-CG2 4.23Å; F187-V285 HydrophobicContact CD2-CG1 3.61Å; F187-V285 HydrophobicContact CE1-CG1 4.18Å; F187-V285 HydrophobicContact CE2-CG1 3.82Å; F187-V285 HydrophobicContact CG-CG1 3.73Å; F187-V285 HydrophobicContact CG-CG2 4.48Å; F187-V285 HydrophobicContact CZ-CG1 4.08Å; L192-V285 HydrophobicContact CB-CG2 4.42Å; L192-V285 HydrophobicContact CD1-CG2 4.42Å; E193-V285 HydrophobicContact CG-CB 4.39Å; E193-V285 HydrophobicContact CG-CG1 3.96Å; E193-V285 HydrophobicContact CG-CG2 4.38Å; L280-V285 HydrophobicContact CD1-CG1 4.34Å; L280-V285 HydrophobicContact CD2-CG1 4.07Å; N282-V285 HydrophobicContact CB-CB 4.12Å; N282-V285 HydrophobicContact CB-CG2 3.95Å; N282-V285 PolarHBondContact O-N 2.96Å; N282-V285 PolarHBondContact OD1-N 3.15Å; V285-N287 PolarHBondContact O-N 2.92Å; V285-F288 WeakPolarHBondContact O-CB 3.23Å; V285-F288 PolarHBondContact O-N 3.42Å; V285-C289 PolarHBondContact O-N 3.19Å; V285-C289 PolarHBondContact O-SG 3.11Å
286	F	98.3	Very high	97.1	Very high	10 Å²	10	29.1 Å²	29.1	4%	0.044	14%	0.139	C	C	.	.	H	α-helix	trans	-55.5	-52.1	175.3	-176.3	-85.3	0	0	0	111.8	L277 L280 N282 F288 C289 A290 T329 N330 M331 V334	L277-F286 HydrophobicContact CB-CE2 4.26Å; L280-F286 HydrophobicContact CB-CB 4.43Å; L280-F286 HydrophobicContact CB-CD2 4.14Å; L280-F286 HydrophobicContact CD1-CD2 4.48Å; N282-F286 WeakPolarHBondContact O-CB 3.48Å; N282-F286 PolarHBondContact O-N 3.42Å; F286-F288 VanDerWaalsContact C-N 3.29Å; F286-F288 PolarHBondContact O-N 3.33Å; F286-C289 PolarHBondContact O-N 3.43Å; F286-A290 HydrophobicContact CD1-CB 4.1Å; F286-A290 HydrophobicContact CE1-CB 3.67Å; F286-A290 HydrophobicContact CZ-CB 4.03Å; F286-A290 WeakPolarHBondContact O-CB 3.44Å; F286-A290 PolarHBondContact O-N 2.86Å; F286-T329 VanDerWaalsContact CE1-C 3.47Å; F286-N330 VanDerWaalsContact CE1-N 3.32Å; F286-M331 HydrophobicContact CE2-CG 3.73Å; F286-M331 HydrophobicContact CE2-SD 3.5Å; F286-M331 WeakPolarHBondContact CE2-SD 3.23Å; F286-M331 HydrophobicContact CZ-CG 4.17Å; F286-M331 HydrophobicContact CZ-SD 3.85Å; F286-V334 HydrophobicContact CE1-CG2 4.01Å; F286-V334 HydrophobicContact CZ-CG2 3.78Å
287	N	95.1	Very high	97.1	Very high	10 Å²	10	28.8 Å²	28.8	5%	0.053	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-42.8	179.4	-65.6	-11.7	0	0	0	111	A26 Q283 S284 V285 C289 A290 I291	A26-N287 WeakPolarHBondContact CA-ND2 3.26Å; A26-N287 PolarHBondContact O-ND2 3.16Å; Q283-N287 PolarHBondContact NE2-OD1 3.21Å; Q283-N287 WeakPolarHBondContact O-CB 3.46Å; Q283-N287 PolarHBondContact O-N 3.14Å; Q283-N287 PolarHBondContact O-ND2 3.39Å; Q283-N287 PolarHBondContact O-OD1 3.28Å; S284-N287 PolarHBondContact O-N 2.87Å; V285-N287 PolarHBondContact O-N 2.92Å; N287-C289 VanDerWaalsContact C-N 3.34Å; N287-C289 PolarHBondContact O-N 3.11Å; N287-A290 PolarHBondContact O-N 3.3Å; N287-I291 HydrophobicContact CB-CD1 4.27Å; N287-I291 WeakPolarHBondContact O-CB 3.37Å; N287-I291 WeakPolarHBondContact O-CD1 3.39Å; N287-I291 WeakPolarHBondContact O-CG1 3.37Å; N287-I291 PolarHBondContact O-N 2.99Å; N287-I291 VanDerWaalsContact O-N 3.12Å
288	F	95.4	Very high	97.1	Very high	5 Å²	5	28.8 Å²	28.8	2%	0.022	14%	0.138	C	C	.	.	H	α-helix	trans	-58.2	-44.5	177.7	174.5	-91.2	0	0	0	112.9	F54 V57 I58 L61 V69 L183 F187 S284 V285 F286 P292	F54-F288 AromaticContact CE1-CE2 3.87Å; F54-F288 HydrophobicContact CE1-CE2 3.87Å; F54-F288 HydrophobicContact CE1-CZ 4.1Å; F54-F288 HydrophobicContact CE2-CD2 4.37Å; F54-F288 AromaticContact CE2-CE2 3.87Å; F54-F288 HydrophobicContact CE2-CE2 3.87Å; F54-F288 HydrophobicContact CE2-CZ 4.31Å; F54-F288 HydrophobicContact CZ-CD2 4.23Å; F54-F288 HydrophobicContact CZ-CE1 4.46Å; F54-F288 AromaticContact CZ-CE2 3.32Å; F54-F288 HydrophobicContact CZ-CE2 3.32Å; F54-F288 AromaticContact CZ-CZ 3.48Å; F54-F288 HydrophobicContact CZ-CZ 3.48Å; F54-F288 VanDerWaalsContact CZ-CZ 3.48Å; V57-F288 VanDerWaalsContact CG1-CA 3.46Å; V57-F288 HydrophobicContact CG1-CB 4.04Å; V57-F288 HydrophobicContact CG1-CD2 4Å; V57-F288 HydrophobicContact CG1-CG 4.46Å; I58-F288 HydrophobicContact CD1-CE2 4.48Å; I58-F288 HydrophobicContact CG1-CD2 4.2Å; I58-F288 HydrophobicContact CG1-CE2 3.57Å; L61-F288 HydrophobicContact CD1-CD2 4.09Å; L61-F288 HydrophobicContact CD1-CE2 4.43Å; L61-F288 HydrophobicContact CD1-CG 4.36Å; L61-F288 HydrophobicContact CD2-CB 3.77Å; L61-F288 HydrophobicContact CD2-CD2 4.48Å; L61-F288 HydrophobicContact CD2-CG 4.08Å; L61-F288 HydrophobicContact CG-CB 4.46Å; L61-F288 HydrophobicContact CG-CD2 4.4Å; L61-F288 HydrophobicContact CG-CG 4.49Å; V69-F288 HydrophobicContact CG1-CE2 4.03Å; V69-F288 HydrophobicContact CG1-CZ 3.92Å; L183-F288 HydrophobicContact CD1-CE1 3.81Å; L183-F288 HydrophobicContact CD1-CZ 4.02Å; L183-F288 HydrophobicContact CD2-CE1 3.78Å; L183-F288 HydrophobicContact CD2-CZ 3.8Å; L183-F288 HydrophobicContact CG-CE1 4.3Å; F187-F288 HydrophobicContact CE1-CD1 4.23Å; F187-F288 HydrophobicContact CE1-CE1 4.3Å; F187-F288 AromaticContact CZ-CD1 3.66Å; F187-F288 HydrophobicContact CZ-CD1 3.66Å; F187-F288 AromaticContact CZ-CE1 3.69Å; F187-F288 HydrophobicContact CZ-CE1 3.69Å; S284-F288 VanDerWaalsContact O-CB 3.29Å; S284-F288 WeakPolarHBondContact O-CB 3.35Å; S284-F288 PolarHBondContact O-N 3.27Å; V285-F288 WeakPolarHBondContact O-CB 3.23Å; V285-F288 PolarHBondContact O-N 3.42Å; F286-F288 VanDerWaalsContact C-N 3.29Å; F286-F288 PolarHBondContact O-N 3.33Å; F288-P292 WeakPolarHBondContact O-CD 3.35Å
289	C	97.7	Very high	97.1	Very high	10 Å²	10	25.5 Å²	25.5	7%	0.068	11%	0.114	C	C	.	.	H	α-helix	trans	-77.6	-41.1	178.5	-66.6	0	0	0	0	112.9	F187 M207 Y276 L277 L280 V285 F286 N287 Q293	F187-C289 WeakPolarHBondContact CE2-SG 3.41Å; M207-C289 HydrophobicContact CE-CB 3.95Å; Y276-C289 HydrophobicContact CE1-CB 4.46Å; L277-C289 HydrophobicContact CD2-CB 3.5Å; L280-C289 HydrophobicContact CD1-CB 3.6Å; V285-C289 PolarHBondContact O-N 3.19Å; V285-C289 PolarHBondContact O-SG 3.11Å; F286-C289 PolarHBondContact O-N 3.43Å; N287-C289 VanDerWaalsContact C-N 3.34Å; N287-C289 PolarHBondContact O-N 3.11Å; C289-Q293 WeakPolarHBondContact O-CG 3.33Å
290	A	97.9	Very high	97.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-74.7	-39.5	-171	0	0	0	0	0	113.4	L277 F286 N287 Q293 V294 V334	L277-A290 HydrophobicContact CD1-CB 4.17Å; L277-A290 HydrophobicContact CD2-CB 4.13Å; F286-A290 HydrophobicContact CD1-CB 4.1Å; F286-A290 HydrophobicContact CE1-CB 3.67Å; F286-A290 HydrophobicContact CZ-CB 4.03Å; F286-A290 WeakPolarHBondContact O-CB 3.44Å; F286-A290 PolarHBondContact O-N 2.86Å; N287-A290 PolarHBondContact O-N 3.3Å; A290-Q293 WeakPolarHBondContact O-CB 3.5Å; A290-Q293 PolarHBondContact O-N 2.67Å; A290-Q293 VanDerWaalsContact O-N 3.13Å; A290-V294 PolarHBondContact O-N 2.98Å; A290-V334 HydrophobicContact CB-CG2 3.84Å
291	I	94.8	Very high	97.2	Very high	4 Å²	4	21 Å²	21	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-57.8	-50.4	-174.4	-72.1	172.1	0	0	0	112.2	V27 V57 N287 Q293 V294 M295 M325 A328	V27-I291 HydrophobicContact CG1-CD1 3.79Å; V57-I291 HydrophobicContact CG1-CD1 4.23Å; V57-I291 HydrophobicContact CG2-CD1 4.36Å; V57-I291 HydrophobicContact CG2-CG2 4.44Å; N287-I291 HydrophobicContact CB-CD1 4.27Å; N287-I291 WeakPolarHBondContact O-CB 3.37Å; N287-I291 WeakPolarHBondContact O-CD1 3.39Å; N287-I291 WeakPolarHBondContact O-CG1 3.37Å; N287-I291 PolarHBondContact O-N 2.99Å; N287-I291 VanDerWaalsContact O-N 3.12Å; I291-Q293 VanDerWaalsContact C-N 3.27Å; I291-Q293 PolarHBondContact O-N 3.17Å; I291-V294 WeakPolarHBondContact O-CG2 3.35Å; I291-V294 PolarHBondContact O-N 3.34Å; I291-M295 HydrophobicContact CG2-CE 3.78Å; I291-M295 HydrophobicContact CG2-SD 4.43Å; I291-M295 WeakPolarHBondContact O-CG 3.41Å; I291-M295 PolarHBondContact O-N 3.05Å; I291-M295 VanDerWaalsContact O-N 3.13Å; I291-M325 HydrophobicContact CD1-CB 4.34Å; I291-M325 HydrophobicContact CD1-CG 4.47Å; I291-M325 HydrophobicContact CG2-CG 3.68Å; I291-A328 HydrophobicContact CG1-CB 4.38Å
292	P	95.4	Very high	97.2	Very high	21 Å²	21	13.7 Å²	13.7	14%	0.136	7%	0.073	C	C	.	.	H	α-helix	trans	-60	-37.1	176.4	-25.3	35.2	0	0	0	113.1	F54 L211 F288 M295 A296	F54-P292 HydrophobicContact CD2-CG 4.1Å; F54-P292 HydrophobicContact CE2-CG 3.51Å; F54-P292 HydrophobicContact CZ-CG 4.49Å; L211-P292 HydrophobicContact CD1-CB 3.93Å; L211-P292 HydrophobicContact CD2-CB 3.83Å; L211-P292 WeakPolarHBondContact CD2-O 3.37Å; F288-P292 WeakPolarHBondContact O-CD 3.35Å; P292-M295 PolarHBondContact O-N 2.85Å; P292-A296 WeakPolarHBondContact O-CB 3.37Å; P292-A296 PolarHBondContact O-N 3.03Å
293	Q	98.1	Very high	97.2	Very high	6 Å²	6	12.4 Å²	12.4	3%	0.028	7%	0.066	C	C	.	.	H	α-helix	trans	-69	-42.9	-176.3	-57.2	-66	-29.9	0	0	111.1	M207 V273 C289 A290 I291 M295 A296 I297	M207-Q293 HydrophobicContact CE-CG 3.66Å; M207-Q293 PolarHBondContact O-NE2 3.44Å; M207-Q293 HydrophobicContact SD-CG 4.08Å; V273-Q293 HydrophobicContact CG1-CB 3.83Å; V273-Q293 HydrophobicContact CG1-CG 3.84Å; V273-Q293 VanDerWaalsContact CG2-OE1 3.29Å; C289-Q293 WeakPolarHBondContact O-CG 3.33Å; A290-Q293 WeakPolarHBondContact O-CB 3.5Å; A290-Q293 PolarHBondContact O-N 2.67Å; A290-Q293 VanDerWaalsContact O-N 3.13Å; I291-Q293 VanDerWaalsContact C-N 3.27Å; I291-Q293 PolarHBondContact O-N 3.17Å; Q293-M295 VanDerWaalsContact C-N 3.31Å; Q293-M295 PolarHBondContact O-N 3.38Å; Q293-A296 PolarHBondContact O-N 3.11Å; Q293-I297 PolarHBondContact O-N 2.95Å
294	V	97.6	Very high	97.3	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-68.9	-30.2	175.1	-62.2	0	0	0	0	112.5	A290 I291 I297 A298 L324 A328 V334 I337	A290-V294 PolarHBondContact O-N 2.98Å; I291-V294 WeakPolarHBondContact O-CG2 3.35Å; I291-V294 PolarHBondContact O-N 3.34Å; V294-I297 WeakPolarHBondContact O-CG2 3.41Å; V294-A298 WeakPolarHBondContact O-CB 3.43Å; V294-A298 PolarHBondContact O-N 2.73Å; V294-L324 HydrophobicContact CG2-CB 4.02Å; V294-A328 HydrophobicContact CB-CB 4.43Å; V294-A328 HydrophobicContact CG1-CB 4Å; V294-A328 HydrophobicContact CG2-CB 3.63Å; V294-V334 HydrophobicContact CG1-CB 4.49Å; V294-V334 HydrophobicContact CG1-CG1 4.08Å; V294-V334 HydrophobicContact CG1-CG2 4.23Å; V294-I337 HydrophobicContact CB-CG2 3.91Å; V294-I337 HydrophobicContact CG1-CB 4.3Å; V294-I337 HydrophobicContact CG1-CD1 4.22Å; V294-I337 HydrophobicContact CG1-CG2 3.96Å
295	M	95.8	Very high	97.4	Very high	36 Å²	36	9.9 Å²	9.9	18%	0.177	6%	0.055	C	C	.	.	H	α-helix	trans	-69.7	-36.5	172.2	-71.8	-173.3	-177.5	0	0	111.8	I291 P292 Q293 T299 I316 A321 L324 M325	I291-M295 HydrophobicContact CG2-CE 3.78Å; I291-M295 HydrophobicContact CG2-SD 4.43Å; I291-M295 WeakPolarHBondContact O-CG 3.41Å; I291-M295 PolarHBondContact O-N 3.05Å; I291-M295 VanDerWaalsContact O-N 3.13Å; P292-M295 PolarHBondContact O-N 2.85Å; Q293-M295 VanDerWaalsContact C-N 3.31Å; Q293-M295 PolarHBondContact O-N 3.38Å; M295-T299 WeakPolarHBondContact O-CB 3.46Å; M295-T299 PolarHBondContact O-N 2.99Å; M295-T299 PolarHBondContact O-OG1 3.18Å; M295-I316 HydrophobicContact CB-CD1 4.23Å; M295-I316 HydrophobicContact CG-CD1 4.11Å; M295-A321 HydrophobicContact CE-CB 4.03Å; M295-L324 HydrophobicContact CG-CD1 4.49Å; M295-M325 HydrophobicContact CE-CG 3.3Å; M295-M325 HydrophobicContact CE-SD 3.68Å
296	A	97.3	Very high	97.4	Very high	6 Å²	6	11.7 Å²	11.7	5%	0.05	7%	0.065	C	C	.	.	H	α-helix	trans	-67.5	-46.6	177.8	0	0	0	0	0	111.7	F210 L211 T214 P292 Q293 A298 T299 L300	F210-A296 HydrophobicContact CD1-CB 3.78Å; F210-A296 HydrophobicContact CE1-CB 3.42Å; F210-A296 VanDerWaalsContact CE1-CB 3.42Å; F210-A296 HydrophobicContact CZ-CB 4.19Å; L211-A296 HydrophobicContact CD2-CB 3.67Å; T214-A296 HydrophobicContact CG2-CB 4.03Å; P292-A296 WeakPolarHBondContact O-CB 3.37Å; P292-A296 PolarHBondContact O-N 3.03Å; Q293-A296 PolarHBondContact O-N 3.11Å; A296-A298 VanDerWaalsContact C-N 3.33Å; A296-A298 PolarHBondContact O-N 3.2Å; A296-T299 CarbonylContact O-C 3.44Å; A296-T299 WeakPolarHBondContact O-CA 3.39Å; A296-T299 WeakPolarHBondContact O-CB 3.48Å; A296-T299 PolarHBondContact O-N 3.02Å; A296-T299 VanDerWaalsContact O-N 3.1Å; A296-L300 PolarHBondContact O-N 3.11Å
297	I	98.5	Very high	97.3	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-64.1	-37.1	176.2	-166.6	63	0	0	0	112.3	F210 L267 V270 Q293 V294 T299 L300 S301 I338 Y341 I345	F210-I297 HydrophobicContact CE1-CB 4.4Å; F210-I297 HydrophobicContact CZ-CB 4.02Å; F210-I297 HydrophobicContact CZ-CD1 4.07Å; L267-I297 HydrophobicContact CD2-CD1 3.43Å; L267-I297 VanDerWaalsContact CD2-CD1 3.43Å; V270-I297 HydrophobicContact CG2-CD1 4.16Å; Q293-I297 PolarHBondContact O-N 2.95Å; V294-I297 WeakPolarHBondContact O-CG2 3.41Å; I297-T299 VanDerWaalsContact C-N 3.33Å; I297-T299 PolarHBondContact O-N 3.47Å; I297-L300 PolarHBondContact O-N 3.01Å; I297-S301 PolarHBondContact O-N 3.23Å; I297-I338 HydrophobicContact CG2-CG1 4.29Å; I297-Y341 HydrophobicContact CG2-CD2 3.97Å; I297-Y341 HydrophobicContact CG2-CG 4.49Å; I297-I345 HydrophobicContact CD1-CD1 4.45Å
298	A	98.3	Very high	97.3	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63.4	-39.2	172.6	0	0	0	0	0	112.2	V294 A296 T302 I316 L324 Y341	V294-A298 WeakPolarHBondContact O-CB 3.43Å; V294-A298 PolarHBondContact O-N 2.73Å; A296-A298 VanDerWaalsContact C-N 3.33Å; A296-A298 PolarHBondContact O-N 3.2Å; A298-T302 PolarHBondContact O-N 3.5Å; A298-T302 PolarHBondContact O-OG1 3.32Å; A298-I316 HydrophobicContact CB-CG2 4.17Å; A298-L324 HydrophobicContact CB-CD1 3.75Å; A298-Y341 HydrophobicContact CB-CD1 4.19Å; A298-Y341 HydrophobicContact CB-CD2 3.99Å; A298-Y341 HydrophobicContact CB-CE1 3.78Å; A298-Y341 HydrophobicContact CB-CE2 3.54Å; A298-Y341 HydrophobicContact CB-CG 4.3Å; A298-Y341 VanDerWaalsContact CB-CZ 3.44Å
299	T	98.1	Very high	97.4	Very high	4 Å²	4	16.6 Å²	16.6	3%	0.025	9%	0.092	C	C	.	.	H	α-helix	trans	-64.6	-49.2	174.5	-61	0	0	0	0	110.7	T214 R218 M295 A296 I297 S301 T302 C303	T214-T299 HydrophobicContact CG2-CG2 3.74Å; R218-T299 HydrophobicContact CB-CG2 4.21Å; R218-T299 HydrophobicContact CG-CG2 4.3Å; R218-T299 VanDerWaalsContact NH1-CG2 3.29Å; R218-T299 PolarHBondContact NH1-OG1 2.68Å; M295-T299 WeakPolarHBondContact O-CB 3.46Å; M295-T299 PolarHBondContact O-N 2.99Å; M295-T299 PolarHBondContact O-OG1 3.18Å; A296-T299 CarbonylContact O-C 3.44Å; A296-T299 WeakPolarHBondContact O-CA 3.39Å; A296-T299 WeakPolarHBondContact O-CB 3.48Å; A296-T299 PolarHBondContact O-N 3.02Å; A296-T299 VanDerWaalsContact O-N 3.1Å; I297-T299 VanDerWaalsContact C-N 3.33Å; I297-T299 PolarHBondContact O-N 3.47Å; T299-S301 VanDerWaalsContact C-N 3.3Å; T299-S301 PolarHBondContact O-N 3.38Å; T299-T302 CarbonylContact O-C 3.6Å; T299-T302 WeakPolarHBondContact O-CA 3.44Å; T299-T302 WeakPolarHBondContact O-CB 3.44Å; T299-T302 PolarHBondContact O-N 3.32Å; T299-C303 PolarHBondContact O-N 2.96Å; T299-C303 PolarHBondContact O-SG 2.8Å
300	L	98.6	Very high	97.3	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.8	-40	178	-70.8	-176.3	0	0	0	111.7	F210 T214 I217 V263 A266 L267 A296 I297 T302 C303 Y304	F210-L300 HydrophobicContact CD2-CD1 4.37Å; F210-L300 HydrophobicContact CE2-CD1 3.42Å; F210-L300 VanDerWaalsContact CE2-CD1 3.42Å; F210-L300 HydrophobicContact CZ-CD1 3.8Å; T214-L300 HydrophobicContact CG2-CD2 3.87Å; T214-L300 HydrophobicContact CG2-CG 3.88Å; T214-L300 WeakPolarHBondContact OG1-CG 3.36Å; I217-L300 HydrophobicContact CD1-CD2 4.09Å; V263-L300 HydrophobicContact CG1-CB 4.2Å; V263-L300 HydrophobicContact CG1-CD2 4.25Å; V263-L300 HydrophobicContact CG2-CD2 4.23Å; A266-L300 HydrophobicContact CB-CD1 3.94Å; A266-L300 HydrophobicContact CB-CD2 4.44Å; L267-L300 HydrophobicContact CD2-CD1 4.17Å; A296-L300 PolarHBondContact O-N 3.11Å; I297-L300 PolarHBondContact O-N 3.01Å; L300-T302 VanDerWaalsContact C-N 3.27Å; L300-T302 PolarHBondContact O-N 3.08Å; L300-C303 PolarHBondContact O-N 3.02Å; L300-Y304 WeakPolarHBondContact O-CB 3.35Å; L300-Y304 PolarHBondContact O-N 3.43Å
301	S	98.5	Very high	97.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.2	-42	170.6	175.5	0	0	0	0	111.7	I297 T299 E344 K348	I297-S301 PolarHBondContact O-N 3.23Å; T299-S301 VanDerWaalsContact C-N 3.3Å; T299-S301 PolarHBondContact O-N 3.38Å; S301-E344 WeakPolarHBondContact OG-CB 3.42Å; S301-E344 PolarHBondContact OG-OE2 3.4Å; S301-K348 PolarHBondContact O-NZ 3.2Å
302	T	98.1	Very high	96.8	Very high	38 Å²	38	22.7 Å²	22.7	23%	0.233	13%	0.125	C	C	.	.	H	α-helix	trans	-69.8	-36	179.1	-51.3	0	0	0	0	112.3	A298 T299 L300 N306 V314	A298-T302 PolarHBondContact O-N 3.5Å; A298-T302 PolarHBondContact O-OG1 3.32Å; T299-T302 CarbonylContact O-C 3.6Å; T299-T302 WeakPolarHBondContact O-CA 3.44Å; T299-T302 WeakPolarHBondContact O-CB 3.44Å; T299-T302 PolarHBondContact O-N 3.32Å; L300-T302 VanDerWaalsContact C-N 3.27Å; L300-T302 PolarHBondContact O-N 3.08Å; T302-N306 VanDerWaalsContact O-CB 3.3Å; T302-N306 WeakPolarHBondContact O-CB 3.08Å; T302-N306 PolarHBondContact O-ND2 3.3Å; T302-V314 HydrophobicContact CG2-CG1 3.55Å
303	C	98.4	Very high	96.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-77.9	-33.4	179.1	-66.8	0	0	0	0	113	I217 L259 T299 L300 N305 N306 V309	I217-C303 HydrophobicContact CG2-CB 4.42Å; L259-C303 VanDerWaalsContact CD2-O 3.29Å; L259-C303 WeakPolarHBondContact CD2-O 3.37Å; T299-C303 PolarHBondContact O-N 2.96Å; T299-C303 PolarHBondContact O-SG 2.8Å; L300-C303 PolarHBondContact O-N 3.02Å; C303-N305 PolarHBondContact O-N 3.01Å; C303-N306 VanDerWaalsContact O-CB 3.25Å; C303-N306 WeakPolarHBondContact O-CB 3.44Å; C303-N306 PolarHBondContact O-N 3.08Å; C303-V309 HydrophobicContact CB-CG2 3.99Å
304	Y	98.5	Very high	96.1	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.008	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	125.1	-173.6	-171.9	-94.9	0	0	0	111.8	N260 V263 L300 N306 I345 K348 V349 T359	N260-Y304 HydrophobicContact CB-CD2 4.48Å; N260-Y304 HydrophobicContact CB-CE2 3.84Å; V263-Y304 HydrophobicContact CB-CD2 3.92Å; V263-Y304 HydrophobicContact CG1-CD2 3.65Å; V263-Y304 HydrophobicContact CG1-CG 4.44Å; V263-Y304 HydrophobicContact CG2-CD2 4.46Å; L300-Y304 WeakPolarHBondContact O-CB 3.35Å; L300-Y304 PolarHBondContact O-N 3.43Å; Y304-N306 PolarHBondContact O-N 3.04Å; Y304-I345 HydrophobicContact CD1-CG2 3.82Å; Y304-I345 HydrophobicContact CD2-CG2 3.93Å; Y304-I345 HydrophobicContact CE1-CG2 4.05Å; Y304-I345 HydrophobicContact CE2-CG2 4.16Å; Y304-I345 HydrophobicContact CG-CG2 3.75Å; Y304-K348 HydrophobicContact CD1-CB 3.75Å; Y304-K348 HydrophobicContact CE1-CB 4.05Å; Y304-V349 HydrophobicContact CE1-CG2 4.04Å; Y304-T359 HydrophobicContact CE2-CG2 3.93Å
305	N	97.7	Very high	95.7	Very high	55 Å²	55	33 Å²	33	29%	0.294	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	35.5	-176.8	-157.8	30.1	0	0	0	114.3	N260 C303 K348	N260-N305 WeakPolarHBondContact OD1-CA 3.33Å; N260-N305 PolarHBondContact OD1-N 3.37Å; C303-N305 PolarHBondContact O-N 3.01Å; N305-K348 PolarHBondContact ND2-O 2.75Å
306	N	97.4	Very high	95.5	Very high	37 Å²	37	32.6 Å²	32.6	20%	0.198	18%	0.175	C	C	.	.			trans	-112.6	113.6	-175.9	-172.5	-7.7	0	0	0	112.8	T302 C303 Y304 M308 V309	T302-N306 VanDerWaalsContact O-CB 3.3Å; T302-N306 WeakPolarHBondContact O-CB 3.08Å; T302-N306 PolarHBondContact O-ND2 3.3Å; C303-N306 VanDerWaalsContact O-CB 3.25Å; C303-N306 WeakPolarHBondContact O-CB 3.44Å; C303-N306 PolarHBondContact O-N 3.08Å; Y304-N306 PolarHBondContact O-N 3.04Å; N306-M308 PolarHBondContact O-N 3.22Å; N306-M308 VanDerWaalsContact O-N 3.09Å; N306-M308 VanDerWaalsContact OD1-CB 3.3Å; N306-M308 WeakPolarHBondContact OD1-CB 3.34Å; N306-M308 WeakPolarHBondContact OD1-CG 3.49Å; N306-M308 PolarHBondContact OD1-N 2.9Å; N306-V309 PolarHBondContact O-N 3.34Å
307	P	96.3	Very high	95.1	Very high	40 Å²	40	36.4 Å²	36.4	26%	0.26	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-26.3	176.9	-28.4	36.2	0	0	0	114.8	L252 L256 V309 F310	L252-P307 HydrophobicContact CD1-CB 3.77Å; L252-P307 HydrophobicContact CD1-CG 4.19Å; L252-P307 HydrophobicContact CD2-CB 4.27Å; L252-P307 HydrophobicContact CD2-CG 4.28Å; L256-P307 HydrophobicContact CD1-CG 4.37Å; L256-P307 HydrophobicContact CD2-CG 4.28Å; P307-V309 PolarHBondContact O-N 2.97Å; P307-V309 VanDerWaalsContact O-N 3.15Å; P307-F310 PolarHBondContact O-N 3.42Å
308	M	96.1	Very high	94.4	Very high	88 Å²	88	41.6 Å²	41.6	43%	0.433	21%	0.211	S	C	.	.	H	α-helix	trans	-64	-19.7	-176.1	-67.7	-57.8	-52.6	0	0	113.5	N306 F310 Q311 G312 V314	N306-M308 PolarHBondContact O-N 3.22Å; N306-M308 VanDerWaalsContact O-N 3.09Å; N306-M308 VanDerWaalsContact OD1-CB 3.3Å; N306-M308 WeakPolarHBondContact OD1-CB 3.34Å; N306-M308 WeakPolarHBondContact OD1-CG 3.49Å; N306-M308 PolarHBondContact OD1-N 2.9Å; M308-F310 PolarHBondContact O-N 3.45Å; M308-Q311 PolarHBondContact O-N 3.42Å; M308-G312 CarbonylContact O-C 3.56Å; M308-G312 PolarHBondContact O-N 3.25Å; M308-G312 VanDerWaalsContact O-O 3.04Å; M308-V314 VanDerWaalsContact C-CG2 3.49Å; M308-V314 HydrophobicContact CB-CG2 3.64Å
309	V	97	Very high	93.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-30.7	173.6	175.1	0	0	0	0	111.5	I217 L259 C303 N306 P307 V314	I217-V309 WeakPolarHBondContact O-CG1 3.32Å; L259-V309 HydrophobicContact CD1-CG1 4.24Å; L259-V309 HydrophobicContact CD1-CG2 4.37Å; L259-V309 HydrophobicContact CD2-CB 4.03Å; L259-V309 HydrophobicContact CD2-CG1 4.41Å; L259-V309 HydrophobicContact CD2-CG2 3.85Å; C303-V309 HydrophobicContact CB-CG2 3.99Å; N306-V309 PolarHBondContact O-N 3.34Å; P307-V309 PolarHBondContact O-N 2.97Å; P307-V309 VanDerWaalsContact O-N 3.15Å; V309-V314 HydrophobicContact CB-CG2 4.49Å; V309-V314 HydrophobicContact CG2-CG2 3.84Å
310	F	96	Very high	93.4	Very high	7 Å²	7	42.5 Å²	42.5	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-96.5	-12.3	-178.6	-56	-71.6	0	0	0	113.5	Y220 W231 L246 L252 A255 L256 L259 P307 M308	Y220-F310 AromaticContact CD1-CD1 3.67Å; Y220-F310 HydrophobicContact CD1-CD1 3.67Å; Y220-F310 HydrophobicContact CD1-CE1 4.1Å; Y220-F310 AromaticContact CE1-CD1 3.55Å; Y220-F310 HydrophobicContact CE1-CD1 3.55Å; Y220-F310 HydrophobicContact CE1-CE1 4.12Å; Y220-F310 HydrophobicContact CG-CD1 4.37Å; Y220-F310 HydrophobicContact CG-CE1 4.36Å; W231-F310 AromaticContact CH2-CE1 3.96Å; W231-F310 HydrophobicContact CH2-CE1 3.96Å; W231-F310 AromaticContact CH2-CZ 3.96Å; W231-F310 HydrophobicContact CH2-CZ 3.96Å; W231-F310 HydrophobicContact CZ3-CE1 4.31Å; W231-F310 HydrophobicContact CZ3-CZ 4.41Å; L246-F310 HydrophobicContact CB-CD1 4.2Å; L246-F310 HydrophobicContact CB-CE1 3.94Å; L252-F310 HydrophobicContact CD1-CD2 4.47Å; A255-F310 HydrophobicContact CB-CD1 4.23Å; A255-F310 HydrophobicContact CB-CD2 3.94Å; A255-F310 HydrophobicContact CB-CE1 3.9Å; A255-F310 HydrophobicContact CB-CE2 3.57Å; A255-F310 HydrophobicContact CB-CG 4.26Å; A255-F310 HydrophobicContact CB-CZ 3.55Å; A255-F310 VanDerWaalsContact O-CZ 3.25Å; A255-F310 WeakPolarHBondContact O-CZ 3.35Å; L256-F310 HydrophobicContact CD2-CE2 4.37Å; L259-F310 HydrophobicContact CB-CE2 4.25Å; L259-F310 HydrophobicContact CB-CZ 3.97Å; L259-F310 HydrophobicContact CD2-CE2 3.94Å; L259-F310 HydrophobicContact CD2-CZ 4.32Å; P307-F310 PolarHBondContact O-N 3.42Å; M308-F310 PolarHBondContact O-N 3.45Å
311	Q	92	Very high	92.9	Very high	115 Å²	115	43.3 Å²	43.3	54%	0.537	22%	0.222	S	C	.	.	H	α-helix	trans	-118.1	-14.5	-169.4	-61.4	175.6	9	0	0	113.4	M308	M308-Q311 PolarHBondContact O-N 3.42Å
312	G	88.8	Confident	92.3	Very high	20 Å²	20	43.6 Å²	43.6	21%	0.206	22%	0.224	C	C	.	.	S	Bend	trans	-177.4	-154.7	-178.5	0	0	0	0	0	113.3	M308	M308-G312 CarbonylContact O-C 3.56Å; M308-G312 PolarHBondContact O-N 3.25Å; M308-G312 VanDerWaalsContact O-O 3.04Å
313	V	87.1	Confident	91.9	Very high	106 Å²	106	42.8 Å²	42.8	64%	0.642	22%	0.218	S	C	*	.			trans	-96.7	112.2	-172.9	179.6	0	0	0	0	110.2	K315	V313-K315 HydrophobicContact CG1-CD 3.52Å; V313-K315 VanDerWaalsContact CG1-CE 3.47Å; V313-K315 HydrophobicContact CG1-CG 3.7Å
314	V	92.2	Very high	91.5	Very high	9 Å²	9	43 Å²	43	6%	0.055	22%	0.219	C	C	.	.			trans	-91	108.8	172.5	-179.6	0	0	0	0	109.2	R218 T302 M308 V309	R218-V314 WeakPolarHBondContact CD-O 3.25Å; R218-V314 HydrophobicContact CG-CB 4.42Å; R218-V314 VanDerWaalsContact CG-O 3.23Å; R218-V314 WeakPolarHBondContact CG-O 3.29Å; T302-V314 HydrophobicContact CG2-CG1 3.55Å; M308-V314 VanDerWaalsContact C-CG2 3.49Å; M308-V314 HydrophobicContact CB-CG2 3.64Å; V309-V314 HydrophobicContact CB-CG2 4.49Å; V309-V314 HydrophobicContact CG2-CG2 3.84Å
315	K	90	Very high	91	Very high	128 Å²	128	43.2 Å²	43.2	56%	0.557	22%	0.221	S	C	*	.			trans	-136.3	139.2	176.8	-75.1	177.2	-178.8	167.6	0	110.5	V313	V313-K315 HydrophobicContact CG1-CD 3.52Å; V313-K315 VanDerWaalsContact CG1-CE 3.47Å; V313-K315 HydrophobicContact CG1-CG 3.7Å
316	I	90.8	Very high	90.4	Very high	29 Å²	29	42.1 Å²	42.1	15%	0.149	21%	0.214	C	C	.	.			trans	-59.4	144.9	167.6	62.2	172.9	0	0	0	109.2	M295 A298 A321 L324	M295-I316 HydrophobicContact CB-CD1 4.23Å; M295-I316 HydrophobicContact CG-CD1 4.11Å; A298-I316 HydrophobicContact CB-CG2 4.17Å; I316-A321 HydrophobicContact CD1-CB 3.82Å; I316-A321 HydrophobicContact CG1-CB 4.31Å; I316-L324 HydrophobicContact CD1-CD1 4.39Å
317	R	89.9	Confident	90.1	Very high	86 Å²	86	44.8 Å²	44.8	33%	0.325	23%	0.225	S	C	.	.			trans	-66.2	148.3	179.1	-66.3	178.2	-60.7	-76.2	-4.5	109.5	K5 H9 E12 G319 Q320 A321	K5-R317 WeakPolarHBondContact O-CD 3.29Å; H9-R317 PolarHBondContact NE2-NH2 3.31Å; E12-R317 IonicContact OE1-CZ 3.9Å; E12-R317 IonicContact OE1-NE 2.75Å; E12-R317 PolarHBondContact OE1-NE 2.89Å; E12-R317 VanDerWaalsContact OE1-NE 3.17Å; E12-R317 IonicContact OE1-NH2 3.81Å; E12-R317 PolarHBondContact OE1-NH2 3.49Å; E12-R317 IonicContact OE2-NE 3.14Å; E12-R317 PolarHBondContact OE2-NE 3.47Å; R317-G319 PolarHBondContact O-N 2.67Å; R317-Q320 HydrophobicContact CB-CB 4.26Å; R317-Q320 WeakPolarHBondContact O-CB 3.33Å; R317-Q320 PolarHBondContact O-N 3.14Å; R317-Q320 VanDerWaalsContact O-N 3.11Å; R317-A321 PolarHBondContact O-N 2.91Å
318	K	83.6	Confident	90	Very high	109 Å²	109	42.9 Å²	42.9	47%	0.474	21%	0.213	S	C	.	.	H	α-helix	trans	-58.5	-37.6	178.2	-168.6	178.6	-175.8	169.3	0	112.7	D2 L16 A321 V322	D2-K318 HydrophobicContact CB-CD 4.2Å; D2-K318 WeakPolarHBondContact OD2-CD 3.35Å; D2-K318 IonicContact OD2-NZ 3.39Å; D2-K318 PolarHBondContact OD2-NZ 3.06Å; L16-K318 HydrophobicContact CD2-CD 4.44Å; L16-K318 HydrophobicContact CD2-CG 4.14Å; K318-A321 PolarHBondContact O-N 2.74Å; K318-V322 WeakPolarHBondContact O-CG2 3.14Å; K318-V322 PolarHBondContact O-N 3.26Å
319	G	85.4	Confident	89.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-39.5	176.4	0	0	0	0	0	113.3	R317 V322 T323	R317-G319 PolarHBondContact O-N 2.67Å; G319-V322 PolarHBondContact O-N 2.84Å; G319-T323 WeakPolarHBondContact O-CB 3.31Å; G319-T323 PolarHBondContact O-N 3.21Å; G319-T323 PolarHBondContact O-OG1 3.17Å
320	Q	89.5	Confident	89.8	Confident	23 Å²	23	44 Å²	44	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-47.1	170.9	-173.9	-178.2	8.4	0	0	111.1	E12 R317 V322 T323 L324 Y341	E12-Q320 PolarHBondContact OE2-N 3.25Å; R317-Q320 HydrophobicContact CB-CB 4.26Å; R317-Q320 WeakPolarHBondContact O-CB 3.33Å; R317-Q320 PolarHBondContact O-N 3.14Å; R317-Q320 VanDerWaalsContact O-N 3.11Å; Q320-V322 PolarHBondContact O-N 2.96Å; Q320-T323 WeakPolarHBondContact O-CB 3.24Å; Q320-T323 PolarHBondContact O-N 2.9Å; Q320-T323 VanDerWaalsContact O-N 3.16Å; Q320-L324 HydrophobicContact CG-CD1 4.39Å; Q320-L324 WeakPolarHBondContact O-CG 3.32Å; Q320-L324 PolarHBondContact O-N 3.41Å; Q320-Y341 PolarHBondContact NE2-OH 3.11Å
321	A	88.4	Confident	89.9	Confident	18 Å²	18	45.4 Å²	45.4	15%	0.149	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-45.8	177	0	0	0	0	0	112.2	M295 I316 R317 K318 T323 L324 M325	M295-A321 HydrophobicContact CE-CB 4.03Å; I316-A321 HydrophobicContact CD1-CB 3.82Å; I316-A321 HydrophobicContact CG1-CB 4.31Å; R317-A321 PolarHBondContact O-N 2.91Å; K318-A321 PolarHBondContact O-N 2.74Å; A321-T323 VanDerWaalsContact C-N 3.33Å; A321-T323 PolarHBondContact O-N 3.43Å; A321-L324 PolarHBondContact O-N 2.77Å; A321-M325 VanDerWaalsContact O-CG 3.27Å; A321-M325 WeakPolarHBondContact O-CG 3.39Å; A321-M325 PolarHBondContact O-N 3.29Å
322	V	85.6	Confident	90.1	Very high	6 Å²	6	47.5 Å²	47.5	4%	0.036	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-39.6	176.6	167.9	0	0	0	0	111.8	N15 L16 F19 K318 G319 Q320 M325 M326	N15-V322 HydrophobicContact CB-CG1 4.2Å; L16-V322 HydrophobicContact CD2-CB 4.48Å; L16-V322 HydrophobicContact CD2-CG2 4.03Å; F19-V322 HydrophobicContact CB-CG1 3.56Å; F19-V322 HydrophobicContact CB-CG2 4.48Å; F19-V322 HydrophobicContact CD1-CG2 4.32Å; F19-V322 HydrophobicContact CD2-CG1 4.03Å; F19-V322 HydrophobicContact CD2-CG2 4.33Å; F19-V322 HydrophobicContact CG-CG1 3.91Å; F19-V322 HydrophobicContact CG-CG2 4.12Å; K318-V322 WeakPolarHBondContact O-CG2 3.14Å; K318-V322 PolarHBondContact O-N 3.26Å; G319-V322 PolarHBondContact O-N 2.84Å; Q320-V322 PolarHBondContact O-N 2.96Å; V322-M325 PolarHBondContact O-N 3.06Å; V322-M326 HydrophobicContact CG1-SD 3.96Å; V322-M326 VanDerWaalsContact O-CG 3.3Å; V322-M326 WeakPolarHBondContact O-CG 3.35Å; V322-M326 PolarHBondContact O-N 3.26Å
323	T	88.4	Confident	90.4	Very high	20 Å²	20	47.6 Å²	47.6	12%	0.123	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-47.3	175.8	-57.8	0	0	0	0	110.5	N15 G319 Q320 A321 M325 M326 E327	N15-T323 WeakPolarHBondContact ND2-CG2 3.16Å; N15-T323 PolarHBondContact ND2-OG1 2.94Å; G319-T323 WeakPolarHBondContact O-CB 3.31Å; G319-T323 PolarHBondContact O-N 3.21Å; G319-T323 PolarHBondContact O-OG1 3.17Å; Q320-T323 WeakPolarHBondContact O-CB 3.24Å; Q320-T323 PolarHBondContact O-N 2.9Å; Q320-T323 VanDerWaalsContact O-N 3.16Å; A321-T323 VanDerWaalsContact C-N 3.33Å; A321-T323 PolarHBondContact O-N 3.43Å; T323-M325 VanDerWaalsContact C-N 3.34Å; T323-M325 PolarHBondContact O-N 2.93Å; T323-M326 PolarHBondContact O-N 3.04Å; T323-M326 VanDerWaalsContact O-N 3.09Å; T323-E327 HydrophobicContact CG2-CG 4.36Å; T323-E327 WeakPolarHBondContact CG2-OE1 3.44Å; T323-E327 WeakPolarHBondContact O-CG 3.4Å; T323-E327 PolarHBondContact O-N 3.06Å
324	L	91.1	Very high	90.9	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-42.1	176	-66.3	171.2	0	0	0	112.4	V294 M295 A298 I316 Q320 A321 M326 E327 A328 I337 Y341	V294-L324 HydrophobicContact CG2-CB 4.02Å; M295-L324 HydrophobicContact CG-CD1 4.49Å; A298-L324 HydrophobicContact CB-CD1 3.75Å; I316-L324 HydrophobicContact CD1-CD1 4.39Å; Q320-L324 HydrophobicContact CG-CD1 4.39Å; Q320-L324 WeakPolarHBondContact O-CG 3.32Å; Q320-L324 PolarHBondContact O-N 3.41Å; A321-L324 PolarHBondContact O-N 2.77Å; L324-M326 VanDerWaalsContact C-N 3.26Å; L324-M326 PolarHBondContact O-N 3.09Å; L324-E327 PolarHBondContact O-N 2.96Å; L324-A328 WeakPolarHBondContact O-CB 3.38Å; L324-A328 PolarHBondContact O-N 3.08Å; L324-I337 HydrophobicContact CD2-CD1 4.23Å; L324-I337 HydrophobicContact CD2-CG1 4.44Å; L324-I337 HydrophobicContact CD2-CG2 3.75Å; L324-Y341 HydrophobicContact CD1-CE2 4.45Å; L324-Y341 HydrophobicContact CD2-CE2 3.79Å
325	M	87.8	Confident	91.2	Very high	7 Å²	7	43.4 Å²	43.4	3%	0.034	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-36.5	175.4	-69.3	171	71.3	0	0	112.7	F19 V27 V57 I291 M295 A321 V322 T323	F19-M325 HydrophobicContact CE2-CE 4.19Å; V27-M325 HydrophobicContact CB-CE 4.25Å; V27-M325 HydrophobicContact CG1-CE 3.69Å; V27-M325 HydrophobicContact CG2-CE 3.97Å; V57-M325 HydrophobicContact CG2-CE 4.35Å; I291-M325 HydrophobicContact CD1-CB 4.34Å; I291-M325 HydrophobicContact CD1-CG 4.47Å; I291-M325 HydrophobicContact CG2-CG 3.68Å; M295-M325 HydrophobicContact CE-CG 3.3Å; M295-M325 HydrophobicContact CE-SD 3.68Å; A321-M325 VanDerWaalsContact O-CG 3.27Å; A321-M325 WeakPolarHBondContact O-CG 3.39Å; A321-M325 PolarHBondContact O-N 3.29Å; V322-M325 PolarHBondContact O-N 3.06Å; T323-M325 VanDerWaalsContact C-N 3.34Å; T323-M325 PolarHBondContact O-N 2.93Å
326	M	85.8	Confident	91.5	Very high	33 Å²	33	40 Å²	40	16%	0.163	20%	0.197	C	C	.	.	H	α-helix	trans	-78.1	-31	-179.7	-72.5	175.4	67.9	0	0	112.9	N15 K18 C24 V322 T323 L324	N15-M326 HydrophobicContact CB-SD 3.94Å; K18-M326 HydrophobicContact CD-CE 3.55Å; K18-M326 HydrophobicContact CG-CE 4.09Å; C24-M326 HydrophobicContact CB-CG 4.26Å; C24-M326 VanDerWaalsContact SG-CG 3.56Å; V322-M326 HydrophobicContact CG1-SD 3.96Å; V322-M326 VanDerWaalsContact O-CG 3.3Å; V322-M326 WeakPolarHBondContact O-CG 3.35Å; V322-M326 PolarHBondContact O-N 3.26Å; T323-M326 PolarHBondContact O-N 3.04Å; T323-M326 VanDerWaalsContact O-N 3.09Å; L324-M326 VanDerWaalsContact C-N 3.26Å; L324-M326 PolarHBondContact O-N 3.09Å
327	E	91.1	Very high	91.8	Very high	92 Å²	92	39 Å²	39	43%	0.43	19%	0.191	S	C	.	.	H	α-helix	trans	-88.4	-35.9	-175.9	-70.8	178.7	175.1	0	0	113.1	T323 L324 T329 A333 I337	T323-E327 HydrophobicContact CG2-CG 4.36Å; T323-E327 WeakPolarHBondContact CG2-OE1 3.44Å; T323-E327 WeakPolarHBondContact O-CG 3.4Å; T323-E327 PolarHBondContact O-N 3.06Å; L324-E327 PolarHBondContact O-N 2.96Å; E327-T329 PolarHBondContact O-N 3.38Å; E327-T329 PolarHBondContact O-OG1 2.94Å; E327-A333 WeakPolarHBondContact O-CB 3.33Å; E327-I337 HydrophobicContact CB-CD1 3.98Å
328	A	93.5	Very high	92.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.			trans	-75.1	60.2	-175.3	0	0	0	0	0	113.5	I291 V294 L324 V334 I337	I291-A328 HydrophobicContact CG1-CB 4.38Å; V294-A328 HydrophobicContact CB-CB 4.43Å; V294-A328 HydrophobicContact CG1-CB 4Å; V294-A328 HydrophobicContact CG2-CB 3.63Å; L324-A328 WeakPolarHBondContact O-CB 3.38Å; L324-A328 PolarHBondContact O-N 3.08Å; A328-V334 HydrophobicContact CB-CG2 4.13Å; A328-I337 HydrophobicContact CB-CD1 4.29Å
329	T	93.3	Very high	92.9	Very high	41 Å²	41	31.6 Å²	31.6	25%	0.252	17%	0.168	S	C	.	.	S	Bend	trans	-116.3	-3.5	-174.1	56	0	0	0	0	113.6	A26 Q283 F286 E327	A26-T329 HydrophobicContact CB-CG2 3.81Å; Q283-T329 PolarHBondContact NE2-O 3.25Å; F286-T329 VanDerWaalsContact CE1-C 3.47Å; E327-T329 PolarHBondContact O-N 3.38Å; E327-T329 PolarHBondContact O-OG1 2.94Å
330	N	96.1	Very high	93.4	Very high	72 Å²	72	36.5 Å²	36.5	39%	0.385	19%	0.191	S	C	.	.	S	Bend	trans	-156.5	162.2	172.3	61.5	81.6	0	0	0	110.4	F286 R332 A333 V334	F286-N330 VanDerWaalsContact CE1-N 3.32Å; N330-R332 VanDerWaalsContact C-N 3.33Å; N330-R332 PolarHBondContact O-N 3.26Å; N330-R332 WeakPolarHBondContact OD1-CB 3.31Å; N330-R332 PolarHBondContact OD1-N 3.37Å; N330-A333 PolarHBondContact O-N 3.06Å; N330-A333 VanDerWaalsContact O-N 3.16Å; N330-A333 PolarHBondContact OD1-N 3.34Å; N330-V334 WeakPolarHBondContact O-CG2 3.36Å; N330-V334 PolarHBondContact O-N 3.4Å
331	M	97.1	Very high	93.8	Very high	36 Å²	36	36 Å²	36	18%	0.177	19%	0.189	C	C	.	.	H	α-helix	trans	-58.9	-39.4	-175.9	-80.9	-54.2	-67.3	0	0	114.2	I274 L277 F286 A333 V334 Q335	I274-M331 HydrophobicContact CG2-CE 3.98Å; I274-M331 WeakPolarHBondContact O-CE 3.36Å; L277-M331 HydrophobicContact CB-CE 4.11Å; L277-M331 HydrophobicContact CB-SD 3.42Å; L277-M331 WeakPolarHBondContact CB-SD 3.45Å; F286-M331 HydrophobicContact CE2-CG 3.73Å; F286-M331 HydrophobicContact CE2-SD 3.5Å; F286-M331 WeakPolarHBondContact CE2-SD 3.23Å; F286-M331 HydrophobicContact CZ-CG 4.17Å; F286-M331 HydrophobicContact CZ-SD 3.85Å; M331-A333 VanDerWaalsContact C-N 3.32Å; M331-A333 PolarHBondContact O-N 3.05Å; M331-V334 PolarHBondContact O-N 2.67Å; M331-Q335 HydrophobicContact CE-CG 4.23Å; M331-Q335 WeakPolarHBondContact O-CB 3.36Å; M331-Q335 WeakPolarHBondContact O-CG 3.47Å; M331-Q335 PolarHBondContact O-N 3.29Å
332	R	96.3	Very high	94.3	Very high	158 Å²	158	35.4 Å²	35.4	60%	0.596	18%	0.184	S	C	*	.	H	α-helix	trans	-61.2	-43.9	178.4	174	178.6	-77.7	156.3	-6.2	111.1	N330 S336 L372	N330-R332 VanDerWaalsContact C-N 3.33Å; N330-R332 PolarHBondContact O-N 3.26Å; N330-R332 WeakPolarHBondContact OD1-CB 3.31Å; N330-R332 PolarHBondContact OD1-N 3.37Å; R332-S336 WeakPolarHBondContact O-CB 3.47Å; R332-S336 PolarHBondContact O-N 3.02Å; R332-L372 HydrophobicContact CB-CD2 4.16Å; R332-L372 HydrophobicContact CG-CD1 3.68Å; R332-L372 HydrophobicContact CG-CD2 4.01Å
333	A	95.8	Very high	94.9	Very high	22 Å²	22	38.8 Å²	38.8	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-45.3	176.6	0	0	0	0	0	111.5	E327 N330 M331 S336 I337	E327-A333 WeakPolarHBondContact O-CB 3.33Å; N330-A333 PolarHBondContact O-N 3.06Å; N330-A333 VanDerWaalsContact O-N 3.16Å; N330-A333 PolarHBondContact OD1-N 3.34Å; M331-A333 VanDerWaalsContact C-N 3.32Å; M331-A333 PolarHBondContact O-N 3.05Å; A333-S336 WeakPolarHBondContact O-CB 3.49Å; A333-S336 PolarHBondContact O-N 3.24Å; A333-I337 VanDerWaalsContact O-CG1 3.28Å; A333-I337 WeakPolarHBondContact O-CG1 3.36Å; A333-I337 PolarHBondContact O-N 3.28Å
334	V	97.5	Very high	95.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-48	177.6	171.3	0	0	0	0	111.8	L277 F286 A290 V294 A328 N330 M331 S336 I337 I338	L277-V334 HydrophobicContact CD1-CG1 3.9Å; F286-V334 HydrophobicContact CE1-CG2 4.01Å; F286-V334 HydrophobicContact CZ-CG2 3.78Å; A290-V334 HydrophobicContact CB-CG2 3.84Å; V294-V334 HydrophobicContact CG1-CB 4.49Å; V294-V334 HydrophobicContact CG1-CG1 4.08Å; V294-V334 HydrophobicContact CG1-CG2 4.23Å; A328-V334 HydrophobicContact CB-CG2 4.13Å; N330-V334 WeakPolarHBondContact O-CG2 3.36Å; N330-V334 PolarHBondContact O-N 3.4Å; M331-V334 PolarHBondContact O-N 2.67Å; V334-S336 VanDerWaalsContact C-N 3.31Å; V334-S336 PolarHBondContact O-N 3.33Å; V334-I337 PolarHBondContact O-N 3.26Å; V334-I338 HydrophobicContact CG1-CD1 3.75Å; V334-I338 HydrophobicContact CG1-CG1 4.38Å; V334-I338 WeakPolarHBondContact O-CG1 3.41Å; V334-I338 PolarHBondContact O-N 2.92Å
335	Q	97.6	Very high	95.7	Very high	28 Å²	28	40.3 Å²	40.3	13%	0.131	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-39.4	176.7	-73.7	175.5	-55.5	0	0	111.7	I274 M331 I338 A339 K369	I274-Q335 HydrophobicContact CG2-CG 4.33Å; M331-Q335 HydrophobicContact CE-CG 4.23Å; M331-Q335 WeakPolarHBondContact O-CB 3.36Å; M331-Q335 WeakPolarHBondContact O-CG 3.47Å; M331-Q335 PolarHBondContact O-N 3.29Å; Q335-I338 PolarHBondContact O-N 2.96Å; Q335-A339 VanDerWaalsContact O-CB 3.24Å; Q335-A339 WeakPolarHBondContact O-CB 3.28Å; Q335-A339 PolarHBondContact O-N 3.34Å; Q335-K369 PolarHBondContact NE2-O 3.06Å
336	S	97.1	Very high	96.2	Very high	57 Å²	57	42.7 Å²	42.7	40%	0.399	22%	0.217	S	C	.	.	H	α-helix	trans	-63.2	-41.3	174.7	-173.7	0	0	0	0	112.2	R332 A333 V334 Q340	R332-S336 WeakPolarHBondContact O-CB 3.47Å; R332-S336 PolarHBondContact O-N 3.02Å; A333-S336 WeakPolarHBondContact O-CB 3.49Å; A333-S336 PolarHBondContact O-N 3.24Å; V334-S336 VanDerWaalsContact C-N 3.31Å; V334-S336 PolarHBondContact O-N 3.33Å; S336-Q340 WeakPolarHBondContact O-CB 3.44Å; S336-Q340 PolarHBondContact O-N 2.92Å
337	I	97.4	Very high	96.7	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-47.3	177.5	-69.7	164.1	0	0	0	110.4	V294 L324 E327 A328 A333 V334 A339 Q340 Y341	V294-I337 HydrophobicContact CB-CG2 3.91Å; V294-I337 HydrophobicContact CG1-CB 4.3Å; V294-I337 HydrophobicContact CG1-CD1 4.22Å; V294-I337 HydrophobicContact CG1-CG2 3.96Å; L324-I337 HydrophobicContact CD2-CD1 4.23Å; L324-I337 HydrophobicContact CD2-CG1 4.44Å; L324-I337 HydrophobicContact CD2-CG2 3.75Å; E327-I337 HydrophobicContact CB-CD1 3.98Å; A328-I337 HydrophobicContact CB-CD1 4.29Å; A333-I337 VanDerWaalsContact O-CG1 3.28Å; A333-I337 WeakPolarHBondContact O-CG1 3.36Å; A333-I337 PolarHBondContact O-N 3.28Å; V334-I337 PolarHBondContact O-N 3.26Å; I337-A339 PolarHBondContact O-N 3.46Å; I337-Q340 PolarHBondContact O-N 3.37Å; I337-Y341 HydrophobicContact CG2-CD2 3.64Å; I337-Y341 HydrophobicContact CG2-CE2 3.6Å; I337-Y341 VanDerWaalsContact O-CD2 3.28Å; I337-Y341 WeakPolarHBondContact O-CD2 3.5Å; I337-Y341 PolarHBondContact O-N 2.91Å
338	I	98.2	Very high	97	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-49.9	176.8	-70.8	170.5	0	0	0	109.9	V270 I274 I297 V334 Q335 Q340 Y341 S342 I366	V270-I338 HydrophobicContact CG1-CD1 4.37Å; V270-I338 HydrophobicContact CG1-CG2 3.62Å; I274-I338 HydrophobicContact CD1-CD1 4.24Å; I274-I338 HydrophobicContact CD1-CG2 4.37Å; I274-I338 HydrophobicContact CG1-CD1 3.74Å; I297-I338 HydrophobicContact CG2-CG1 4.29Å; V334-I338 HydrophobicContact CG1-CD1 3.75Å; V334-I338 HydrophobicContact CG1-CG1 4.38Å; V334-I338 WeakPolarHBondContact O-CG1 3.41Å; V334-I338 PolarHBondContact O-N 2.92Å; Q335-I338 PolarHBondContact O-N 2.96Å; I338-Q340 VanDerWaalsContact C-N 3.31Å; I338-Q340 PolarHBondContact O-N 3.23Å; I338-Y341 PolarHBondContact O-N 2.93Å; I338-S342 WeakPolarHBondContact O-CB 3.42Å; I338-S342 PolarHBondContact O-N 3.13Å; I338-S342 PolarHBondContact O-OG 3.22Å; I338-S342 VanDerWaalsContact O-OG 3.05Å; I338-I366 HydrophobicContact CG2-CG2 3.47Å; I338-I366 VanDerWaalsContact CG2-CG2 3.47Å
339	A	97.3	Very high	97.2	Very high	37 Å²	37	48.7 Å²	48.7	31%	0.306	25%	0.245	S	C	.	.	H	α-helix	trans	-58.5	-41.4	178.4	0	0	0	0	0	112.4	Q335 I337 Q343	Q335-A339 VanDerWaalsContact O-CB 3.24Å; Q335-A339 WeakPolarHBondContact O-CB 3.28Å; Q335-A339 PolarHBondContact O-N 3.34Å; I337-A339 PolarHBondContact O-N 3.46Å; A339-Q343 WeakPolarHBondContact O-CB 3.32Å; A339-Q343 PolarHBondContact O-N 2.71Å
340	Q	97.1	Very high	97.2	Very high	103 Å²	103	48.7 Å²	48.7	48%	0.481	25%	0.246	S	C	.	.	H	α-helix	trans	-60.8	-53.4	176.1	-179.7	-172.9	-33.9	0	0	111.5	S336 I337 I338 S342 Q343 E344	S336-Q340 WeakPolarHBondContact O-CB 3.44Å; S336-Q340 PolarHBondContact O-N 2.92Å; I337-Q340 PolarHBondContact O-N 3.37Å; I338-Q340 VanDerWaalsContact C-N 3.31Å; I338-Q340 PolarHBondContact O-N 3.23Å; Q340-S342 VanDerWaalsContact C-N 3.33Å; Q340-S342 PolarHBondContact O-N 3.36Å; Q340-Q343 WeakPolarHBondContact O-CB 3.36Å; Q340-Q343 PolarHBondContact O-N 3.15Å; Q340-Q343 VanDerWaalsContact O-N 3.11Å; Q340-E344 PolarHBondContact NE2-OE1 3.3Å; Q340-E344 PolarHBondContact O-N 3.3Å
341	Y	98.3	Very high	97.1	Very high	13 Å²	13	52.2 Å²	52.2	5%	0.051	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-31.2	-178	-74	-62.5	0	0	0	112.6	I297 A298 Q320 L324 I337 I338 Q343 E344 I345	I297-Y341 HydrophobicContact CG2-CD2 3.97Å; I297-Y341 HydrophobicContact CG2-CG 4.49Å; A298-Y341 HydrophobicContact CB-CD1 4.19Å; A298-Y341 HydrophobicContact CB-CD2 3.99Å; A298-Y341 HydrophobicContact CB-CE1 3.78Å; A298-Y341 HydrophobicContact CB-CE2 3.54Å; A298-Y341 HydrophobicContact CB-CG 4.3Å; A298-Y341 VanDerWaalsContact CB-CZ 3.44Å; Q320-Y341 PolarHBondContact NE2-OH 3.11Å; L324-Y341 HydrophobicContact CD1-CE2 4.45Å; L324-Y341 HydrophobicContact CD2-CE2 3.79Å; I337-Y341 HydrophobicContact CG2-CD2 3.64Å; I337-Y341 HydrophobicContact CG2-CE2 3.6Å; I337-Y341 VanDerWaalsContact O-CD2 3.28Å; I337-Y341 WeakPolarHBondContact O-CD2 3.5Å; I337-Y341 PolarHBondContact O-N 2.91Å; I338-Y341 PolarHBondContact O-N 2.93Å; Y341-Q343 VanDerWaalsContact C-N 3.32Å; Y341-E344 VanDerWaalsContact CD1-OE2 3.28Å; Y341-E344 WeakPolarHBondContact CD1-OE2 3.36Å; Y341-E344 PolarHBondContact O-N 2.91Å; Y341-I345 WeakPolarHBondContact O-CG1 3.21Å; Y341-I345 PolarHBondContact O-N 3.1Å
342	S	97.8	Very high	96.8	Very high	6 Å²	6	56.7 Å²	56.7	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-38.8	169.3	-66.7	0	0	0	0	111.9	I338 Q340 I345 L346 I366	I338-S342 WeakPolarHBondContact O-CB 3.42Å; I338-S342 PolarHBondContact O-N 3.13Å; I338-S342 PolarHBondContact O-OG 3.22Å; I338-S342 VanDerWaalsContact O-OG 3.05Å; Q340-S342 VanDerWaalsContact C-N 3.33Å; Q340-S342 PolarHBondContact O-N 3.36Å; S342-I345 PolarHBondContact O-N 3.2Å; S342-L346 WeakPolarHBondContact O-CB 3.45Å; S342-L346 PolarHBondContact O-N 3.38Å; S342-I366 WeakPolarHBondContact OG-CG2 3.48Å
343	Q	97.8	Very high	96.7	Very high	77 Å²	77	49.8 Å²	49.8	36%	0.36	27%	0.269	S	S	.	.	H	α-helix	trans	-67.2	-36.7	174.5	-175.8	61.7	47.3	0	0	112.3	A339 Q340 Y341 L346 Q347	A339-Q343 WeakPolarHBondContact O-CB 3.32Å; A339-Q343 PolarHBondContact O-N 2.71Å; Q340-Q343 WeakPolarHBondContact O-CB 3.36Å; Q340-Q343 PolarHBondContact O-N 3.15Å; Q340-Q343 VanDerWaalsContact O-N 3.11Å; Y341-Q343 VanDerWaalsContact C-N 3.32Å; Q343-L346 WeakPolarHBondContact O-CB 3.23Å; Q343-L346 PolarHBondContact O-N 3.35Å; Q343-Q347 WeakPolarHBondContact O-CG 3.02Å; Q343-Q347 PolarHBondContact O-N 3.33Å; Q343-Q347 VanDerWaalsContact O-N 3.08Å
344	E	98.1	Very high	96.6	Very high	55 Å²	55	53 Å²	53	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-40.4	173.7	-70.2	175.7	-160.2	0	0	112	S301 Q340 Y341 Q347 K348	S301-E344 WeakPolarHBondContact OG-CB 3.42Å; S301-E344 PolarHBondContact OG-OE2 3.4Å; Q340-E344 PolarHBondContact NE2-OE1 3.3Å; Q340-E344 PolarHBondContact O-N 3.3Å; Y341-E344 VanDerWaalsContact CD1-OE2 3.28Å; Y341-E344 WeakPolarHBondContact CD1-OE2 3.36Å; Y341-E344 PolarHBondContact O-N 2.91Å; E344-Q347 PolarHBondContact O-N 2.95Å; E344-K348 WeakPolarHBondContact O-CG 3.34Å; E344-K348 PolarHBondContact O-N 3.18Å
345	I	98.5	Very high	96.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.2	-46.7	172.8	-66.5	167.9	0	0	0	109.6	L267 I297 Y304 Y341 S342 Q347 K348 V349 T359 L363	L267-I345 HydrophobicContact CD1-CD1 4.19Å; L267-I345 HydrophobicContact CD1-CG2 4.49Å; L267-I345 HydrophobicContact CD2-CD1 4.09Å; I297-I345 HydrophobicContact CD1-CD1 4.45Å; Y304-I345 HydrophobicContact CD1-CG2 3.82Å; Y304-I345 HydrophobicContact CD2-CG2 3.93Å; Y304-I345 HydrophobicContact CE1-CG2 4.05Å; Y304-I345 HydrophobicContact CE2-CG2 4.16Å; Y304-I345 HydrophobicContact CG-CG2 3.75Å; Y341-I345 WeakPolarHBondContact O-CG1 3.21Å; Y341-I345 PolarHBondContact O-N 3.1Å; S342-I345 PolarHBondContact O-N 3.2Å; I345-Q347 PolarHBondContact O-N 2.95Å; I345-K348 WeakPolarHBondContact O-CA 3.4Å; I345-K348 WeakPolarHBondContact O-CB 3.14Å; I345-K348 PolarHBondContact O-N 3.39Å; I345-V349 WeakPolarHBondContact O-CG2 3.28Å; I345-V349 PolarHBondContact O-N 3.44Å; I345-T359 HydrophobicContact CG2-CG2 4.4Å; I345-L363 HydrophobicContact CB-CD1 4.47Å; I345-L363 HydrophobicContact CB-CD2 4.25Å; I345-L363 HydrophobicContact CG2-CD1 3.98Å; I345-L363 HydrophobicContact CG2-CD2 4.18Å
346	L	98.1	Very high	96.5	Very high	58 Å²	58	55.9 Å²	55.9	30%	0.304	30%	0.299	S	S	.	.	H	α-helix	trans	-53.9	-41.5	179.1	-177.9	58.6	0	0	0	112.2	S342 Q343 K348 V349 L360 L363	S342-L346 WeakPolarHBondContact O-CB 3.45Å; S342-L346 PolarHBondContact O-N 3.38Å; Q343-L346 WeakPolarHBondContact O-CB 3.23Å; Q343-L346 PolarHBondContact O-N 3.35Å; L346-K348 PolarHBondContact O-N 2.89Å; L346-V349 PolarHBondContact O-N 3.31Å; L346-L360 HydrophobicContact CD1-CD2 3.27Å; L346-L363 HydrophobicContact CB-CD1 3.98Å; L346-L363 HydrophobicContact CD1-CD1 4.12Å
347	Q	97.8	Very high	96.5	Very high	150 Å²	150	58.6 Å²	58.6	70%	0.701	31%	0.309	S	S	*	.	H	α-helix	trans	-67.3	-19.8	178.3	-71.7	172.1	-3.3	0	0	113.8	Q343 E344 I345	Q343-Q347 WeakPolarHBondContact O-CG 3.02Å; Q343-Q347 PolarHBondContact O-N 3.33Å; Q343-Q347 VanDerWaalsContact O-N 3.08Å; E344-Q347 PolarHBondContact O-N 2.95Å; I345-Q347 PolarHBondContact O-N 2.95Å
348	K	97.8	Very high	96.6	Very high	78 Å²	78	65.1 Å²	65.1	34%	0.339	34%	0.337	S	S	.	.	H	α-helix	trans	-96.4	-7.8	-179.5	-65.3	171.9	-167.6	175.8	0	113.4	S301 Y304 N305 E344 I345 L346 S350	S301-K348 PolarHBondContact O-NZ 3.2Å; Y304-K348 HydrophobicContact CD1-CB 3.75Å; Y304-K348 HydrophobicContact CE1-CB 4.05Å; N305-K348 PolarHBondContact ND2-O 2.75Å; E344-K348 WeakPolarHBondContact O-CG 3.34Å; E344-K348 PolarHBondContact O-N 3.18Å; I345-K348 WeakPolarHBondContact O-CA 3.4Å; I345-K348 WeakPolarHBondContact O-CB 3.14Å; I345-K348 PolarHBondContact O-N 3.39Å; L346-K348 PolarHBondContact O-N 2.89Å; K348-S350 PolarHBondContact O-N 2.73Å; K348-S350 VanDerWaalsContact O-N 3.15Å
349	V	97.4	Very high	96.6	Very high	23 Å²	23	65 Å²	65	14%	0.139	34%	0.336	C	S	.	.			trans	-65	113	-178.6	-177.6	0	0	0	0	109.6	Y304 I345 L346 R356 T359 L360 L363	Y304-V349 HydrophobicContact CE1-CG2 4.04Å; I345-V349 WeakPolarHBondContact O-CG2 3.28Å; I345-V349 PolarHBondContact O-N 3.44Å; L346-V349 PolarHBondContact O-N 3.31Å; V349-R356 HydrophobicContact CG1-CB 4.19Å; V349-R356 HydrophobicContact CG1-CG 3.78Å; V349-T359 HydrophobicContact CG2-CG2 4.14Å; V349-L360 HydrophobicContact CG1-CD2 4.35Å; V349-L360 HydrophobicContact CG1-CG 4.48Å; V349-L360 HydrophobicContact CG2-CD2 4.44Å; V349-L363 HydrophobicContact CG2-CD1 4.33Å
350	S	93.4	Very high	96.6	Very high	40 Å²	40	65.7 Å²	65.7	28%	0.28	33%	0.334	S	S	.	.			trans	-73.7	145.6	176.8	-177.2	0	0	0	0	111.4	K348 T352 D353	K348-S350 PolarHBondContact O-N 2.73Å; K348-S350 VanDerWaalsContact O-N 3.15Å; S350-T352 PolarHBondContact O-N 2.87Å; S350-T352 PolarHBondContact OG-N 2.75Å; S350-T352 PolarHBondContact OG-OG1 3.3Å; S350-D353 PolarHBondContact O-N 3.43Å
351	L	92.3	Very high	96.7	Very high	147 Å²	147	67 Å²	67	77%	0.77	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.1	171.6	-67.3	177.1	0	0	0	112.8
352	T	92	Very high	96.7	Very high	129 Å²	129	67.4 Å²	67.4	79%	0.791	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-4.1	-178.5	56.9	0	0	0	0	113.3	S350	S350-T352 PolarHBondContact O-N 2.87Å; S350-T352 PolarHBondContact OG-N 2.75Å; S350-T352 PolarHBondContact OG-OG1 3.3Å
353	D	93.3	Very high	96.8	Very high	13 Å²	13	67.4 Å²	67.4	7%	0.07	34%	0.343	C	S	.	.			trans	-71.7	127.4	-178.2	-175.6	-85.3	0	0	0	111	N260 S350 T355 R356	N260-D353 WeakPolarHBondContact CB-OD2 3.45Å; N260-D353 PolarHBondContact ND2-OD2 3.47Å; S350-D353 PolarHBondContact O-N 3.43Å; D353-T355 PolarHBondContact O-N 2.88Å; D353-T355 WeakPolarHBondContact OD1-CA 3.26Å; D353-T355 WeakPolarHBondContact OD1-CB 3.49Å; D353-T355 PolarHBondContact OD1-N 3.47Å; D353-T355 PolarHBondContact OD1-OG1 2.89Å; D353-R356 HydrophobicContact CB-CB 4.42Å; D353-R356 WeakPolarHBondContact O-CB 3.39Å; D353-R356 PolarHBondContact O-N 3.18Å; D353-R356 PolarHBondContact OD1-N 3.11Å; D353-R356 VanDerWaalsContact OD1-N 3.09Å
354	P	94.4	Very high	96.8	Very high	90 Å²	90	66.2 Å²	66.2	58%	0.584	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.6	-176.7	27.5	-34.3	0	0	0	113.5	F239	F239-P354 HydrophobicContact CE1-CG 4.06Å; F239-P354 HydrophobicContact CZ-CG 4.4Å
355	T	94.8	Very high	96.8	Very high	7 Å²	7	65.4 Å²	65.4	4%	0.043	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-2.9	179.7	71.3	0	0	0	0	113.6	L261 D353 D357 K358 T359	L261-T355 HydrophobicContact CB-CG2 3.73Å; L261-T355 HydrophobicContact CD1-CG2 3.72Å; L261-T355 HydrophobicContact CG-CG2 4.29Å; D353-T355 PolarHBondContact O-N 2.88Å; D353-T355 WeakPolarHBondContact OD1-CA 3.26Å; D353-T355 WeakPolarHBondContact OD1-CB 3.49Å; D353-T355 PolarHBondContact OD1-N 3.47Å; D353-T355 PolarHBondContact OD1-OG1 2.89Å; T355-D357 VanDerWaalsContact C-N 3.34Å; T355-D357 PolarHBondContact O-N 2.61Å; T355-D357 VanDerWaalsContact O-N 3.13Å; T355-K358 WeakPolarHBondContact O-CA 3.25Å; T355-K358 WeakPolarHBondContact O-CB 3.47Å; T355-K358 PolarHBondContact O-N 3.49Å; T355-T359 PolarHBondContact O-N 2.96Å; T355-T359 PolarHBondContact O-OG1 3.44Å
356	R	97.4	Very high	96.7	Very high	82 Å²	82	65.4 Å²	65.4	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-38.6	-56.7	-177.7	172.2	-179.2	178.3	-83.3	1.6	113.6	V349 D353 K358 T359 L360	V349-R356 HydrophobicContact CG1-CB 4.19Å; V349-R356 HydrophobicContact CG1-CG 3.78Å; D353-R356 HydrophobicContact CB-CB 4.42Å; D353-R356 WeakPolarHBondContact O-CB 3.39Å; D353-R356 PolarHBondContact O-N 3.18Å; D353-R356 PolarHBondContact OD1-N 3.11Å; D353-R356 VanDerWaalsContact OD1-N 3.09Å; R356-K358 VanDerWaalsContact C-N 3.29Å; R356-K358 PolarHBondContact O-N 3.39Å; R356-T359 WeakPolarHBondContact O-CB 3.49Å; R356-T359 PolarHBondContact O-N 2.55Å; R356-T359 VanDerWaalsContact O-N 3.13Å; R356-L360 HydrophobicContact CG-CD1 3.84Å; R356-L360 HydrophobicContact CG-CG 4.25Å; R356-L360 VanDerWaalsContact O-CG 3.31Å; R356-L360 WeakPolarHBondContact O-CG 3.39Å; R356-L360 PolarHBondContact O-N 3.37Å
357	D	98.1	Very high	96.6	Very high	114 Å²	114	67.9 Å²	67.9	61%	0.61	36%	0.355	S	S	*	.	H	α-helix	trans	-65.3	-35.7	-172.7	-67.5	-14.9	0	0	0	112	T355 H361	T355-D357 VanDerWaalsContact C-N 3.34Å; T355-D357 PolarHBondContact O-N 2.61Å; T355-D357 VanDerWaalsContact O-N 3.13Å; D357-H361 WeakPolarHBondContact O-CB 3.36Å; D357-H361 PolarHBondContact O-N 3Å
358	K	98.1	Very high	96.5	Very high	143 Å²	143	67.5 Å²	67.5	62%	0.622	35%	0.353	S	S	*	.	H	α-helix	trans	-67.7	-42.6	173.8	-63.6	179.9	-178.9	176.5	0	110.8	T264 T355 R356 H361 I362	T264-K358 HydrophobicContact CG2-CB 3.96Å; T355-K358 WeakPolarHBondContact O-CA 3.25Å; T355-K358 WeakPolarHBondContact O-CB 3.47Å; T355-K358 PolarHBondContact O-N 3.49Å; R356-K358 VanDerWaalsContact C-N 3.29Å; R356-K358 PolarHBondContact O-N 3.39Å; K358-H361 PolarHBondContact O-N 3.5Å; K358-I362 WeakPolarHBondContact O-CG2 3.46Å; K358-I362 PolarHBondContact O-N 2.87Å
359	T	98.6	Very high	96.2	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-48.1	176.7	-43	0	0	0	0	111.2	T264 Y304 I345 V349 T355 R356 H361 I362 L363	T264-T359 PolarHBondContact OG1-OG1 3.27Å; Y304-T359 HydrophobicContact CE2-CG2 3.93Å; I345-T359 HydrophobicContact CG2-CG2 4.4Å; V349-T359 HydrophobicContact CG2-CG2 4.14Å; T355-T359 PolarHBondContact O-N 2.96Å; T355-T359 PolarHBondContact O-OG1 3.44Å; R356-T359 WeakPolarHBondContact O-CB 3.49Å; R356-T359 PolarHBondContact O-N 2.55Å; R356-T359 VanDerWaalsContact O-N 3.13Å; T359-H361 VanDerWaalsContact C-N 3.29Å; T359-H361 PolarHBondContact O-N 3.33Å; T359-I362 VanDerWaalsContact O-CG2 3.29Å; T359-I362 WeakPolarHBondContact O-CG2 3.41Å; T359-I362 PolarHBondContact O-N 3.25Å; T359-L363 HydrophobicContact CG2-CD1 3.92Å; T359-L363 HydrophobicContact CG2-CG 4.35Å; T359-L363 WeakPolarHBondContact O-CB 3.45Å; T359-L363 WeakPolarHBondContact O-CG 3.3Å; T359-L363 PolarHBondContact O-N 3.44Å
360	L	98.6	Very high	95.9	Very high	51 Å²	51	68.5 Å²	68.5	27%	0.267	36%	0.356	S	S	.	.	H	α-helix	trans	-60	-41.4	177.9	-68.7	178.1	0	0	0	111.6	L346 V349 R356 A364	L346-L360 HydrophobicContact CD1-CD2 3.27Å; V349-L360 HydrophobicContact CG1-CD2 4.35Å; V349-L360 HydrophobicContact CG1-CG 4.48Å; V349-L360 HydrophobicContact CG2-CD2 4.44Å; R356-L360 HydrophobicContact CG-CD1 3.84Å; R356-L360 HydrophobicContact CG-CG 4.25Å; R356-L360 VanDerWaalsContact O-CG 3.31Å; R356-L360 WeakPolarHBondContact O-CG 3.39Å; R356-L360 PolarHBondContact O-N 3.37Å; L360-A364 WeakPolarHBondContact O-CB 3.46Å; L360-A364 PolarHBondContact O-N 2.87Å
361	H	98.6	Very high	95.2	Very high	130 Å²	130	69.7 Å²	69.7	60%	0.602	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-52.1	177.1	179.6	66.8	0	0	0	112	D357 K358 T359 L363 A364 V365	D357-H361 WeakPolarHBondContact O-CB 3.36Å; D357-H361 PolarHBondContact O-N 3Å; K358-H361 PolarHBondContact O-N 3.5Å; T359-H361 VanDerWaalsContact C-N 3.29Å; T359-H361 PolarHBondContact O-N 3.33Å; H361-L363 VanDerWaalsContact C-N 3.33Å; H361-L363 PolarHBondContact O-N 3.46Å; H361-A364 WeakPolarHBondContact O-CB 3.47Å; H361-A364 PolarHBondContact O-N 3.47Å; H361-V365 WeakPolarHBondContact O-CG2 3.48Å; H361-V365 PolarHBondContact O-N 2.96Å; H361-V365 VanDerWaalsContact O-N 3.11Å
362	I	98.7	Very high	93.8	Very high	22 Å²	22	65.9 Å²	65.9	11%	0.113	35%	0.349	C	S	.	.	H	α-helix	trans	-66.4	-35.6	-178.2	-171.5	57.3	0	0	0	112.1	T264 L267 R268 P271 K358 T359 A364 V365 I366	T264-I362 HydrophobicContact CG2-CG2 4.14Å; L267-I362 HydrophobicContact CB-CG1 4.04Å; L267-I362 HydrophobicContact CB-CG2 4.08Å; L267-I362 HydrophobicContact CD1-CG2 4.31Å; R268-I362 HydrophobicContact CB-CD1 4.45Å; P271-I362 HydrophobicContact CG-CD1 4.38Å; K358-I362 WeakPolarHBondContact O-CG2 3.46Å; K358-I362 PolarHBondContact O-N 2.87Å; T359-I362 VanDerWaalsContact O-CG2 3.29Å; T359-I362 WeakPolarHBondContact O-CG2 3.41Å; T359-I362 PolarHBondContact O-N 3.25Å; I362-A364 VanDerWaalsContact C-N 3.33Å; I362-A364 PolarHBondContact O-N 2.82Å; I362-V365 HydrophobicContact CD1-CB 4.35Å; I362-V365 PolarHBondContact O-N 2.82Å; I362-I366 HydrophobicContact CG1-CD1 4.12Å; I362-I366 HydrophobicContact CG1-CG1 4.46Å; I362-I366 VanDerWaalsContact O-CG1 3.28Å; I362-I366 WeakPolarHBondContact O-CG1 3.46Å; I362-I366 PolarHBondContact O-N 3.48Å
363	L	98.4	Very high	91.8	Very high	7 Å²	7	65.3 Å²	65.3	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-38.5	174.9	-69.6	172.6	0	0	0	112.1	L267 I345 L346 V349 T359 H361 I366 Q367	L267-L363 HydrophobicContact CD1-CD2 4.05Å; I345-L363 HydrophobicContact CB-CD1 4.47Å; I345-L363 HydrophobicContact CB-CD2 4.25Å; I345-L363 HydrophobicContact CG2-CD1 3.98Å; I345-L363 HydrophobicContact CG2-CD2 4.18Å; L346-L363 HydrophobicContact CB-CD1 3.98Å; L346-L363 HydrophobicContact CD1-CD1 4.12Å; V349-L363 HydrophobicContact CG2-CD1 4.33Å; T359-L363 HydrophobicContact CG2-CD1 3.92Å; T359-L363 HydrophobicContact CG2-CG 4.35Å; T359-L363 WeakPolarHBondContact O-CB 3.45Å; T359-L363 WeakPolarHBondContact O-CG 3.3Å; T359-L363 PolarHBondContact O-N 3.44Å; H361-L363 VanDerWaalsContact C-N 3.33Å; H361-L363 PolarHBondContact O-N 3.46Å; L363-I366 PolarHBondContact O-N 3.25Å; L363-Q367 WeakPolarHBondContact O-CB 3.46Å; L363-Q367 PolarHBondContact O-N 3.37Å
364	A	98	Very high	89.3	Confident	52 Å²	52	71.4 Å²	71.4	43%	0.43	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-42.7	174.4	0	0	0	0	0	111.8	L360 H361 I362 Q367 E368	L360-A364 WeakPolarHBondContact O-CB 3.46Å; L360-A364 PolarHBondContact O-N 2.87Å; H361-A364 WeakPolarHBondContact O-CB 3.47Å; H361-A364 PolarHBondContact O-N 3.47Å; I362-A364 VanDerWaalsContact C-N 3.33Å; I362-A364 PolarHBondContact O-N 2.82Å; A364-Q367 PolarHBondContact O-N 3.07Å; A364-E368 PolarHBondContact O-N 2.85Å
365	V	98.1	Very high	86.7	Confident	38 Å²	38	72.4 Å²	72.4	23%	0.23	38%	0.382	C	S	.	.	H	α-helix	trans	-61.9	-43.7	175.2	174.7	0	0	0	0	111.1	P271 H361 I362 Q367 E368 K369	P271-V365 HydrophobicContact CG-CG1 3.89Å; H361-V365 WeakPolarHBondContact O-CG2 3.48Å; H361-V365 PolarHBondContact O-N 2.96Å; H361-V365 VanDerWaalsContact O-N 3.11Å; I362-V365 HydrophobicContact CD1-CB 4.35Å; I362-V365 PolarHBondContact O-N 2.82Å; V365-Q367 VanDerWaalsContact C-N 3.32Å; V365-Q367 PolarHBondContact O-N 3.22Å; V365-E368 PolarHBondContact O-N 3.08Å; V365-K369 WeakPolarHBondContact O-CG 3.31Å; V365-K369 PolarHBondContact O-N 3.46Å
366	I	97.9	Very high	83.9	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-62.3	-41.9	176.7	-67.2	165.8	0	0	0	110.7	L267 V270 P271 I338 S342 I362 L363 K369 S370	L267-I366 HydrophobicContact CB-CD1 4.14Å; L267-I366 HydrophobicContact CD2-CD1 4.12Å; V270-I366 HydrophobicContact CB-CD1 3.76Å; V270-I366 HydrophobicContact CB-CG1 3.87Å; V270-I366 HydrophobicContact CG1-CB 4.45Å; V270-I366 HydrophobicContact CG1-CD1 3.98Å; V270-I366 HydrophobicContact CG1-CG1 3.85Å; V270-I366 HydrophobicContact CG1-CG2 3.76Å; V270-I366 HydrophobicContact CG2-CD1 4.09Å; P271-I366 HydrophobicContact CG-CG1 4.34Å; I338-I366 HydrophobicContact CG2-CG2 3.47Å; I338-I366 VanDerWaalsContact CG2-CG2 3.47Å; S342-I366 WeakPolarHBondContact OG-CG2 3.48Å; I362-I366 HydrophobicContact CG1-CD1 4.12Å; I362-I366 HydrophobicContact CG1-CG1 4.46Å; I362-I366 VanDerWaalsContact O-CG1 3.28Å; I362-I366 WeakPolarHBondContact O-CG1 3.46Å; I362-I366 PolarHBondContact O-N 3.48Å; L363-I366 PolarHBondContact O-N 3.25Å; I366-K369 PolarHBondContact O-N 3.13Å; I366-S370 VanDerWaalsContact O-CB 3.23Å; I366-S370 WeakPolarHBondContact O-CB 3.48Å; I366-S370 PolarHBondContact O-N 2.61Å; I366-S370 PolarHBondContact O-OG 3.13Å
367	Q	95.3	Very high	81.1	Confident	109 Å²	109	82.4 Å²	82.4	51%	0.509	44%	0.441	S	S	.	.	H	α-helix	trans	-62.9	-42.4	178.1	-172.5	174.7	11.1	0	0	111.7	L363 A364 V365 S370 A371	L363-Q367 WeakPolarHBondContact O-CB 3.46Å; L363-Q367 PolarHBondContact O-N 3.37Å; A364-Q367 PolarHBondContact O-N 3.07Å; V365-Q367 VanDerWaalsContact C-N 3.32Å; V365-Q367 PolarHBondContact O-N 3.22Å; Q367-S370 PolarHBondContact O-N 3.3Å; Q367-A371 PolarHBondContact O-N 3.08Å
368	E	94.8	Very high	78.1	Confident	143 Å²	143	82 Å²	82	67%	0.668	45%	0.447	S	S	*	.	H	α-helix	trans	-60.7	-46.3	174.9	-172.7	-172.6	165.6	0	0	111.5	A364 V365 S370 A371	A364-E368 PolarHBondContact O-N 2.85Å; V365-E368 PolarHBondContact O-N 3.08Å; E368-S370 VanDerWaalsContact C-N 3.29Å; E368-S370 PolarHBondContact O-N 2.94Å; E368-A371 WeakPolarHBondContact O-CB 3.43Å; E368-A371 PolarHBondContact O-N 3.27Å
369	K	93.1	Very high	75.1	Confident	113 Å²	113	79.2 Å²	79.2	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-71.4	-23.3	179.1	-66.1	-68.9	-177.9	-178.2	0	113.8	P271 I274 Q335 V365 I366	P271-K369 HydrophobicContact CB-CG 4.26Å; I274-K369 HydrophobicContact CD1-CB 3.99Å; Q335-K369 PolarHBondContact NE2-O 3.06Å; V365-K369 WeakPolarHBondContact O-CG 3.31Å; V365-K369 PolarHBondContact O-N 3.46Å; I366-K369 PolarHBondContact O-N 3.13Å
370	S	89.9	Confident	72.3	Confident	8 Å²	8	90.2 Å²	90.2	6%	0.056	49%	0.487	C	S	.	.	H	α-helix	trans	-90.6	-8.5	176.4	-53.9	0	0	0	0	112.6	I274 I366 Q367 E368 L372	I274-S370 WeakPolarHBondContact CD1-OG 3.47Å; I366-S370 VanDerWaalsContact O-CB 3.23Å; I366-S370 WeakPolarHBondContact O-CB 3.48Å; I366-S370 PolarHBondContact O-N 2.61Å; I366-S370 PolarHBondContact O-OG 3.13Å; Q367-S370 PolarHBondContact O-N 3.3Å; E368-S370 VanDerWaalsContact C-N 3.29Å; E368-S370 PolarHBondContact O-N 2.94Å; S370-L372 PolarHBondContact O-N 3.29Å
371	A	80	Confident	69.2	Low	66 Å²	66	92.9 Å²	92.9	55%	0.545	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-67.2	122.5	-179.7	0	0	0	0	0	110.4	Q367 E368	Q367-A371 PolarHBondContact O-N 3.08Å; E368-A371 WeakPolarHBondContact O-CB 3.43Å; E368-A371 PolarHBondContact O-N 3.27Å
372	L	62.1	Low	66.4	Low	67 Å²	67	96.1 Å²	96.1	35%	0.351	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-80.6	142	169.6	-64.4	157.3	0	0	0	108.5	R332 S370 Q374	R332-L372 HydrophobicContact CB-CD2 4.16Å; R332-L372 HydrophobicContact CG-CD1 3.68Å; R332-L372 HydrophobicContact CG-CD2 4.01Å; S370-L372 PolarHBondContact O-N 3.29Å; L372-Q374 PolarHBondContact O-N 3.28Å; L372-Q374 VanDerWaalsContact O-N 3.11Å
373	P	49.9	Very low	63.6	Low	117 Å²	117	102.7 Å²	102.7	76%	0.76	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-57.8	121	166.2	22.1	-29.3	0	0	0	108.3	P375	P373-P375 VanDerWaalsContact O-CD 3.23Å; P373-P375 WeakPolarHBondContact O-CD 3.41Å
374	Q	41.3	Very low	60.9	Low	140 Å²	140	107.5 Å²	107.5	65%	0.654	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-67	129.4	-176.7	-71.1	-115.3	-16.1	0	0	111.3	L372	L372-Q374 PolarHBondContact O-N 3.28Å; L372-Q374 VanDerWaalsContact O-N 3.11Å
375	P	39.6	Very low	58.5	Low	111 Å²	111	106.2 Å²	106.2	72%	0.721	56%	0.559	S	S	*	*	S	Bend	trans	-103.6	122.7	135.4	27.3	-13.1	0	0	0	108.1	P373	P373-P375 VanDerWaalsContact O-CD 3.23Å; P373-P375 WeakPolarHBondContact O-CD 3.41Å
376	D	36.4	Very low	56.4	Low	156 Å²	156	109.4 Å²	109.4	83%	0.834	58%	0.58	S	S	*	*			trans	21.8	117.8	175.2	-79.3	-29.1	0	0	0	119.2	S378	D376-S378 PolarHBondContact O-N 3.24Å
377	L	38.7	Very low	54.2	Low	144 Å²	144	112.2 Å²	112.2	75%	0.754	59%	0.594	S	S	*	*			trans	-46.2	92.9	162.4	-76	144.9	0	0	0	112.3	S379	L377-S379 PolarHBondContact O-N 3.12Å
378	S	33.4	Very low	52.1	Low	105 Å²	105	110.5 Å²	110.5	73%	0.734	58%	0.584	S	S	*	*			trans	-79	104.7	141.4	60.5	0	0	0	0	106.6	D376 R380	D376-S378 PolarHBondContact O-N 3.24Å; S378-R380 PolarHBondContact O-N 3.39Å; S378-R380 VanDerWaalsContact O-N 3.07Å
379	S	34.9	Very low	50.2	Low	84 Å²	84	108 Å²	108	59%	0.587	57%	0.574	S	S	*	*			trans	-48.4	118.8	166.9	53.4	0	0	0	0	108.5	L377 N381	L377-S379 PolarHBondContact O-N 3.12Å; S379-N381 PolarHBondContact O-N 2.75Å
380	R	41.2	Very low	48.2	Very low	232 Å²	232	105.4 Å²	105.4	88%	0.875	57%	0.571	S	S	*	*			trans	-68	83.2	156.9	-87.6	-177.7	171.2	179.3	-3.3	106	S378	S378-R380 PolarHBondContact O-N 3.39Å; S378-R380 VanDerWaalsContact O-N 3.07Å
381	N	33.8	Very low	46.3	Very low	107 Å²	107	106.6 Å²	106.6	57%	0.572	58%	0.581	S	S	*	*			trans	-50	141.8	151.1	-79.3	-16.9	0	0	0	106.6	S379 H383	S379-N381 PolarHBondContact O-N 2.75Å; N381-H383 PolarHBondContact O-N 2.85Å
382	H	38.7	Very low	45	Very low	198 Å²	198	106.2 Å²	106.2	92%	0.917	58%	0.578	S	S	*	*			trans	-59.2	73.6	168.2	-71.2	-65.1	0	0	0	109.8	L384	H382-L384 PolarHBondContact O-N 3.11Å; H382-L384 VanDerWaalsContact O-N 3.1Å
383	H	39.5	Very low	44.6	Very low	159 Å²	159	109 Å²	109	74%	0.736	59%	0.59	S	S	*	*			trans	-71.3	102.8	160.5	-77.6	-71	0	0	0	104.5	N381 S385	N381-H383 PolarHBondContact O-N 2.85Å; H383-S385 PolarHBondContact O-N 3.26Å
384	L	42	Very low	44.7	Very low	109 Å²	109	108.8 Å²	108.8	57%	0.571	58%	0.582	S	S	*	*			trans	-38.4	117.2	158.5	-80	153.3	0	0	0	106.5	H382 Y388 L389	H382-L384 PolarHBondContact O-N 3.11Å; H382-L384 VanDerWaalsContact O-N 3.1Å; L384-Y388 HydrophobicContact CD2-CG 4.32Å; L384-L389 HydrophobicContact CB-CD1 4.36Å; L384-L389 HydrophobicContact CB-CG 4.02Å
385	S	49.1	Very low	45.4	Very low	25 Å²	25	107.6 Å²	107.6	18%	0.175	58%	0.58	C	S	.	*			trans	-54.6	147.7	-176.3	120.7	0	0	0	0	108.6	E11 H383 M387 Y388 L389	E11-S385 WeakPolarHBondContact OE1-CB 3.5Å; E11-S385 PolarHBondContact OE1-OG 3.21Å; H383-S385 PolarHBondContact O-N 3.26Å; S385-M387 CarbonylContact O-C 3.41Å; S385-M387 PolarHBondContact O-N 3.05Å; S385-M387 PolarHBondContact OG-N 3.46Å; S385-Y388 WeakPolarHBondContact O-CA 3.48Å; S385-Y388 WeakPolarHBondContact O-CB 3.48Å; S385-Y388 PolarHBondContact O-N 2.82Å; S385-L389 PolarHBondContact O-N 3.04Å; S385-L389 VanDerWaalsContact O-N 3.11Å
386	P	53.7	Low	46	Very low	104 Å²	104	105.2 Å²	105.2	68%	0.675	57%	0.569	S	S	*	*	H	α-helix	trans	-50.1	-26.2	-178.6	-26.6	33.2	0	0	0	112.6	S390	P386-S390 VanDerWaalsContact O-CB 3.25Å; P386-S390 WeakPolarHBondContact O-CB 3.31Å; P386-S390 PolarHBondContact O-N 3.38Å; P386-S390 PolarHBondContact O-OG 3.15Å
387	M	51.2	Low	46.6	Very low	59 Å²	59	100.4 Å²	100.4	29%	0.291	55%	0.552	S	S	.	*	H	α-helix	trans	-73.5	-36.3	173.6	-64.7	-152.1	-59.5	0	0	114.2	E11 F14 S385 S390 A391	E11-M387 HydrophobicContact CB-CE 3.99Å; E11-M387 HydrophobicContact CG-CE 3.66Å; F14-M387 HydrophobicContact CB-CE 3.71Å; F14-M387 HydrophobicContact CB-SD 3.87Å; F14-M387 HydrophobicContact CD1-CE 4.05Å; F14-M387 HydrophobicContact CD1-SD 4.13Å; F14-M387 HydrophobicContact CD2-SD 3.97Å; F14-M387 HydrophobicContact CG-CE 3.93Å; F14-M387 HydrophobicContact CG-SD 3.71Å; S385-M387 CarbonylContact O-C 3.41Å; S385-M387 PolarHBondContact O-N 3.05Å; S385-M387 PolarHBondContact OG-N 3.46Å; M387-S390 PolarHBondContact O-N 3.01Å; M387-A391 WeakPolarHBondContact O-CB 3.44Å; M387-A391 PolarHBondContact O-N 3.41Å
388	Y	49.9	Very low	47	Very low	73 Å²	73	98.1 Å²	98.1	29%	0.286	54%	0.539	S	S	.	.	H	α-helix	trans	-66.4	-41.8	171.5	-78.2	-85.4	0	0	0	111.6	P10 E11 L384 S385 A391 A392	P10-Y388 VanDerWaalsContact CD-CE1 3.44Å; P10-Y388 HydrophobicContact CG-CD1 3.99Å; P10-Y388 HydrophobicContact CG-CE1 3.8Å; E11-Y388 HydrophobicContact CG-CD2 4.37Å; E11-Y388 HydrophobicContact CG-CE2 3.75Å; L384-Y388 HydrophobicContact CD2-CG 4.32Å; S385-Y388 WeakPolarHBondContact O-CA 3.48Å; S385-Y388 WeakPolarHBondContact O-CB 3.48Å; S385-Y388 PolarHBondContact O-N 2.82Å; Y388-A391 PolarHBondContact O-N 2.99Å; Y388-A392 WeakPolarHBondContact O-CB 3.48Å; Y388-A392 PolarHBondContact O-N 3.35Å
389	L	55.4	Low	47.9	Very low	91 Å²	91	96.2 Å²	96.2	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-62.5	-43.8	172.9	-80.5	161	0	0	0	111.2	L384 S385 A392 M393	L384-L389 HydrophobicContact CB-CD1 4.36Å; L384-L389 HydrophobicContact CB-CG 4.02Å; S385-L389 PolarHBondContact O-N 3.04Å; S385-L389 VanDerWaalsContact O-N 3.11Å; L389-A392 PolarHBondContact O-N 3.38Å; L389-M393 WeakPolarHBondContact O-CB 3.5Å; L389-M393 VanDerWaalsContact O-CG 3.3Å; L389-M393 WeakPolarHBondContact O-CG 3.24Å; L389-M393 PolarHBondContact O-N 2.73Å
390	S	51.9	Low	48.8	Very low	59 Å²	59	101.4 Å²	101.4	41%	0.413	53%	0.533	S	S	.	.	H	α-helix	trans	-65.4	-43.3	177.3	-59.6	0	0	0	0	112.1	P386 M387 M393 L394	P386-S390 VanDerWaalsContact O-CB 3.25Å; P386-S390 WeakPolarHBondContact O-CB 3.31Å; P386-S390 PolarHBondContact O-N 3.38Å; P386-S390 PolarHBondContact O-OG 3.15Å; M387-S390 PolarHBondContact O-N 3.01Å; S390-M393 PolarHBondContact O-N 3.36Å; S390-L394 WeakPolarHBondContact O-CB 3.29Å; S390-L394 PolarHBondContact O-N 3.36Å
391	A	49.5	Very low	49.1	Very low	33 Å²	33	96.1 Å²	96.1	27%	0.273	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-40.3	177	0	0	0	0	0	111.9	P10 M387 Y388 L394 L395	P10-A391 HydrophobicContact CG-CB 4.42Å; M387-A391 WeakPolarHBondContact O-CB 3.44Å; M387-A391 PolarHBondContact O-N 3.41Å; Y388-A391 PolarHBondContact O-N 2.99Å; A391-L394 PolarHBondContact O-N 2.99Å; A391-L395 WeakPolarHBondContact O-CB 3.32Å; A391-L395 WeakPolarHBondContact O-CG 3.49Å; A391-L395 PolarHBondContact O-N 2.7Å
392	A	52	Low	50	Low	58 Å²	58	98.8 Å²	98.8	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-64.1	-42	174	0	0	0	0	0	111.8	Y388 L389 A396	Y388-A392 WeakPolarHBondContact O-CB 3.48Å; Y388-A392 PolarHBondContact O-N 3.35Å; L389-A392 PolarHBondContact O-N 3.38Å; A392-A396 WeakPolarHBondContact O-CB 3.41Å; A392-A396 PolarHBondContact O-N 2.58Å
393	M	54.1	Low	50.8	Low	125 Å²	125	94.6 Å²	94.6	62%	0.616	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-38.4	174.1	-74.8	-167	-61.3	0	0	112.3	L389 S390 A396 A397	L389-M393 WeakPolarHBondContact O-CB 3.5Å; L389-M393 VanDerWaalsContact O-CG 3.3Å; L389-M393 WeakPolarHBondContact O-CG 3.24Å; L389-M393 PolarHBondContact O-N 2.73Å; S390-M393 PolarHBondContact O-N 3.36Å; M393-A396 PolarHBondContact O-N 3.35Å; M393-A397 WeakPolarHBondContact O-CB 3.48Å; M393-A397 PolarHBondContact O-N 3.13Å
394	L	52.7	Low	51.6	Low	113 Å²	113	89.5 Å²	89.5	59%	0.592	49%	0.487	S	S	*	.	H	α-helix	trans	-69.3	-41.5	179.1	-138.7	132.5	0	0	0	111.5	S390 A391 A397 L398	S390-L394 WeakPolarHBondContact O-CB 3.29Å; S390-L394 PolarHBondContact O-N 3.36Å; A391-L394 PolarHBondContact O-N 2.99Å; L394-A397 PolarHBondContact O-N 3.28Å; L394-L398 HydrophobicContact CD2-CD1 3.99Å; L394-L398 WeakPolarHBondContact O-CB 3.45Å; L394-L398 VanDerWaalsContact O-CG 3.29Å; L394-L398 WeakPolarHBondContact O-CG 3.22Å; L394-L398 PolarHBondContact O-N 2.95Å
395	L	55.8	Low	52.1	Low	115 Å²	115	87.7 Å²	87.7	60%	0.602	48%	0.481	S	S	*	.	H	α-helix	trans	-63.1	-44.2	172.3	-76	167.3	0	0	0	111.3	A391 A397 L398 S399	A391-L395 WeakPolarHBondContact O-CB 3.32Å; A391-L395 WeakPolarHBondContact O-CG 3.49Å; A391-L395 PolarHBondContact O-N 2.7Å; L395-A397 VanDerWaalsContact C-N 3.34Å; L395-A397 PolarHBondContact O-N 3.07Å; L395-L398 PolarHBondContact O-N 3.02Å; L395-S399 WeakPolarHBondContact O-CB 3.36Å; L395-S399 PolarHBondContact O-N 2.89Å; L395-S399 PolarHBondContact O-OG 3.24Å
396	A	52.6	Low	52.3	Low	60 Å²	60	88.8 Å²	88.8	50%	0.496	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-41.2	175.8	0	0	0	0	0	112.2	A392 M393 S399 W400	A392-A396 WeakPolarHBondContact O-CB 3.41Å; A392-A396 PolarHBondContact O-N 2.58Å; M393-A396 PolarHBondContact O-N 3.35Å; A396-S399 PolarHBondContact O-N 2.75Å; A396-W400 VanDerWaalsContact O-CB 3.32Å; A396-W400 WeakPolarHBondContact O-CB 3.3Å; A396-W400 PolarHBondContact O-N 2.99Å
397	A	47.9	Very low	52.1	Low	56 Å²	56	86.3 Å²	86.3	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-65.1	-43.8	176.3	0	0	0	0	0	112.1	M393 L394 L395 W400 Q401	M393-A397 WeakPolarHBondContact O-CB 3.48Å; M393-A397 PolarHBondContact O-N 3.13Å; L394-A397 PolarHBondContact O-N 3.28Å; L395-A397 VanDerWaalsContact C-N 3.34Å; L395-A397 PolarHBondContact O-N 3.07Å; A397-W400 PolarHBondContact O-N 3.28Å; A397-Q401 WeakPolarHBondContact O-CB 3.46Å; A397-Q401 PolarHBondContact O-N 2.94Å
398	L	47.8	Very low	52.2	Low	95 Å²	95	86.4 Å²	86.4	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-66.7	-40	176.8	-71.3	171.8	0	0	0	112	L394 L395 Q401 Y402	L394-L398 HydrophobicContact CD2-CD1 3.99Å; L394-L398 WeakPolarHBondContact O-CB 3.45Å; L394-L398 VanDerWaalsContact O-CG 3.29Å; L394-L398 WeakPolarHBondContact O-CG 3.22Å; L394-L398 PolarHBondContact O-N 2.95Å; L395-L398 PolarHBondContact O-N 3.02Å; L398-Q401 PolarHBondContact O-N 2.81Å; L398-Y402 WeakPolarHBondContact O-CB 3.22Å; L398-Y402 PolarHBondContact O-N 3.16Å
399	S	51.8	Low	52.3	Low	65 Å²	65	89.6 Å²	89.6	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-41.5	173.9	-62	0	0	0	0	112	L395 A396 Y402 L403	L395-S399 WeakPolarHBondContact O-CB 3.36Å; L395-S399 PolarHBondContact O-N 2.89Å; L395-S399 PolarHBondContact O-OG 3.24Å; A396-S399 PolarHBondContact O-N 2.75Å; S399-Y402 PolarHBondContact O-N 3.34Å; S399-L403 WeakPolarHBondContact O-CB 3.4Å; S399-L403 VanDerWaalsContact O-CG 3.31Å; S399-L403 WeakPolarHBondContact O-CG 3.4Å; S399-L403 PolarHBondContact O-N 3.07Å
400	W	53.8	Low	52.1	Low	194 Å²	194	88.7 Å²	88.7	74%	0.735	51%	0.508	S	S	*	.	H	α-helix	trans	-62.2	-42.2	173.6	-178.2	-94	0	0	0	111.8	A396 A397 L403 S404	A396-W400 VanDerWaalsContact O-CB 3.32Å; A396-W400 WeakPolarHBondContact O-CB 3.3Å; A396-W400 PolarHBondContact O-N 2.99Å; A397-W400 PolarHBondContact O-N 3.28Å; W400-L403 PolarHBondContact O-N 3.32Å; W400-S404 VanDerWaalsContact O-CB 3.31Å; W400-S404 WeakPolarHBondContact O-CB 3.45Å; W400-S404 PolarHBondContact O-N 3.21Å; W400-S404 PolarHBondContact O-OG 2.99Å
401	Q	48.9	Very low	52.2	Low	121 Å²	121	93.7 Å²	93.7	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-68.4	-36.2	178.7	-159.1	171.2	8.3	0	0	112.3	A397 L398 S404 T405	A397-Q401 WeakPolarHBondContact O-CB 3.46Å; A397-Q401 PolarHBondContact O-N 2.94Å; L398-Q401 PolarHBondContact O-N 2.81Å; Q401-S404 VanDerWaalsContact CA-OG 3.3Å; Q401-S404 WeakPolarHBondContact CA-OG 3.13Å; Q401-S404 PolarHBondContact O-OG 2.97Å; Q401-S404 VanDerWaalsContact O-OG 3.09Å; Q401-T405 WeakPolarHBondContact O-CB 3.46Å; Q401-T405 VanDerWaalsContact O-CG2 3.31Å; Q401-T405 WeakPolarHBondContact O-CG2 3.15Å; Q401-T405 PolarHBondContact O-N 3.18Å; Q401-T405 PolarHBondContact O-OG1 3.34Å
402	Y	52.1	Low	52.1	Low	162 Å²	162	94.8 Å²	94.8	64%	0.635	54%	0.539	S	S	*	.	H	α-helix	trans	-68.9	-43.9	173	-178.3	-97.5	0	0	0	112.1	L398 S399 T405 T406	L398-Y402 WeakPolarHBondContact O-CB 3.22Å; L398-Y402 PolarHBondContact O-N 3.16Å; S399-Y402 PolarHBondContact O-N 3.34Å; Y402-T405 WeakPolarHBondContact CA-OG1 3.44Å; Y402-T405 PolarHBondContact O-N 3.3Å; Y402-T405 PolarHBondContact O-OG1 2.96Å; Y402-T406 HydrophobicContact CD1-CG2 4.43Å; Y402-T406 HydrophobicContact CE1-CG2 4.05Å; Y402-T406 HydrophobicContact CE2-CG2 4.26Å; Y402-T406 WeakPolarHBondContact O-CB 3.35Å; Y402-T406 WeakPolarHBondContact O-CG2 3.26Å; Y402-T406 PolarHBondContact O-N 3.19Å; Y402-T406 PolarHBondContact O-OG1 3.24Å
403	L	54.9	Low	51.8	Low	110 Å²	110	97.9 Å²	97.9	58%	0.576	55%	0.552	S	S	*	*	H	α-helix	trans	-66.3	-37.9	177.1	-75.5	166.5	0	0	0	112.5	S399 W400 T406 A407	S399-L403 WeakPolarHBondContact O-CB 3.4Å; S399-L403 VanDerWaalsContact O-CG 3.31Å; S399-L403 WeakPolarHBondContact O-CG 3.4Å; S399-L403 PolarHBondContact O-N 3.07Å; W400-L403 PolarHBondContact O-N 3.32Å; L403-T406 WeakPolarHBondContact CA-OG1 3.34Å; L403-T406 PolarHBondContact O-OG1 3.34Å; L403-T406 VanDerWaalsContact O-OG1 3.09Å; L403-A407 WeakPolarHBondContact O-CB 3.21Å; L403-A407 PolarHBondContact O-N 2.79Å
404	S	55.4	Low	51.4	Low	52 Å²	52	94.8 Å²	94.8	36%	0.364	55%	0.553	S	S	.	*	H	α-helix	trans	-72.3	-35.8	177	50.7	0	0	0	0	113	W400 Q401 A408	W400-S404 VanDerWaalsContact O-CB 3.31Å; W400-S404 WeakPolarHBondContact O-CB 3.45Å; W400-S404 PolarHBondContact O-N 3.21Å; W400-S404 PolarHBondContact O-OG 2.99Å; Q401-S404 VanDerWaalsContact CA-OG 3.3Å; Q401-S404 WeakPolarHBondContact CA-OG 3.13Å; Q401-S404 PolarHBondContact O-OG 2.97Å; Q401-S404 VanDerWaalsContact O-OG 3.09Å; S404-A408 VanDerWaalsContact O-CB 3.3Å; S404-A408 WeakPolarHBondContact O-CB 3.42Å; S404-A408 PolarHBondContact O-N 3.07Å
405	T	52.5	Low	51	Low	72 Å²	72	96.9 Å²	96.9	44%	0.442	57%	0.565	S	S	.	*	H	α-helix	trans	-71.3	-38.9	174.4	46.1	0	0	0	0	112.5	Q401 Y402 A408 Q409	Q401-T405 WeakPolarHBondContact O-CB 3.46Å; Q401-T405 VanDerWaalsContact O-CG2 3.31Å; Q401-T405 WeakPolarHBondContact O-CG2 3.15Å; Q401-T405 PolarHBondContact O-N 3.18Å; Q401-T405 PolarHBondContact O-OG1 3.34Å; Y402-T405 WeakPolarHBondContact CA-OG1 3.44Å; Y402-T405 PolarHBondContact O-N 3.3Å; Y402-T405 PolarHBondContact O-OG1 2.96Å; T405-A408 PolarHBondContact O-N 2.84Å; T405-Q409 WeakPolarHBondContact O-CG 3.44Å; T405-Q409 PolarHBondContact O-N 3Å
406	T	53.4	Low	50.1	Low	47 Å²	47	100 Å²	100	29%	0.288	58%	0.578	S	S	.	*	H	α-helix	trans	-69.6	-37.1	173.9	48.2	0	0	0	0	112.7	Y402 L403 Q409 A410	Y402-T406 HydrophobicContact CD1-CG2 4.43Å; Y402-T406 HydrophobicContact CE1-CG2 4.05Å; Y402-T406 HydrophobicContact CE2-CG2 4.26Å; Y402-T406 WeakPolarHBondContact O-CB 3.35Å; Y402-T406 WeakPolarHBondContact O-CG2 3.26Å; Y402-T406 PolarHBondContact O-N 3.19Å; Y402-T406 PolarHBondContact O-OG1 3.24Å; L403-T406 WeakPolarHBondContact CA-OG1 3.34Å; L403-T406 PolarHBondContact O-OG1 3.34Å; L403-T406 VanDerWaalsContact O-OG1 3.09Å; T406-Q409 PolarHBondContact O-N 2.98Å; T406-A410 WeakPolarHBondContact O-CB 3.49Å; T406-A410 PolarHBondContact O-N 3.13Å
407	A	51.3	Low	49.3	Very low	52 Å²	52	110.2 Å²	110.2	43%	0.43	62%	0.616	S	S	.	*	H	α-helix	trans	-66.2	-39.3	172.5	0	0	0	0	0	112.5	L403 A410 Q411	L403-A407 WeakPolarHBondContact O-CB 3.21Å; L403-A407 PolarHBondContact O-N 2.79Å; A407-A410 PolarHBondContact O-N 2.63Å; A407-Q411 PolarHBondContact O-N 3.21Å; A407-Q411 VanDerWaalsContact O-N 3.09Å
408	A	52.8	Low	49.3	Very low	61 Å²	61	112.9 Å²	112.9	50%	0.504	62%	0.623	S	S	.	*	H	α-helix	trans	-66.7	-36	175	0	0	0	0	0	112.4	S404 T405 Q411 G412	S404-A408 VanDerWaalsContact O-CB 3.3Å; S404-A408 WeakPolarHBondContact O-CB 3.42Å; S404-A408 PolarHBondContact O-N 3.07Å; T405-A408 PolarHBondContact O-N 2.84Å; A408-Q411 PolarHBondContact O-N 3.09Å; A408-G412 PolarHBondContact O-N 3.18Å
409	Q	52.3	Low	49.4	Very low	141 Å²	141	113.8 Å²	113.8	66%	0.659	63%	0.63	S	S	*	*	H	α-helix	trans	-68.7	-32.4	172.7	-79.4	177.3	-27.1	0	0	113	T405 T406	T405-Q409 WeakPolarHBondContact O-CG 3.44Å; T405-Q409 PolarHBondContact O-N 3Å; T406-Q409 PolarHBondContact O-N 2.98Å
410	A	51	Low	49.3	Very low	71 Å²	71	116.6 Å²	116.6	59%	0.587	64%	0.64	S	S	*	*	H	α-helix	trans	-74.3	-23.7	175.1	0	0	0	0	0	113.6	T406 A407 T413	T406-A410 WeakPolarHBondContact O-CB 3.49Å; T406-A410 PolarHBondContact O-N 3.13Å; A407-A410 PolarHBondContact O-N 2.63Å; A410-T413 PolarHBondContact O-OG1 2.79Å
411	Q	52.8	Low	49	Very low	165 Å²	165	112 Å²	112	77%	0.771	63%	0.634	S	S	*	*	H	α-helix	trans	-87	-24.2	173.1	-74.5	-179.1	-24.3	0	0	113	A407 A408 T413	A407-Q411 PolarHBondContact O-N 3.21Å; A407-Q411 VanDerWaalsContact O-N 3.09Å; A408-Q411 PolarHBondContact O-N 3.09Å; Q411-T413 VanDerWaalsContact C-N 3.31Å; Q411-T413 PolarHBondContact O-N 2.96Å
412	G	48.3	Very low	49	Very low	55 Å²	55	111.4 Å²	111.4	57%	0.567	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-9.6	177.5	0	0	0	0	0	115.5	A408	A408-G412 PolarHBondContact O-N 3.18Å
413	T	46.2	Very low	48.8	Very low	123 Å²	123	108.1 Å²	108.1	76%	0.755	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	6.2	177	44	0	0	0	0	113.7	A410 Q411	A410-T413 PolarHBondContact O-OG1 2.79Å; Q411-T413 VanDerWaalsContact C-N 3.31Å; Q411-T413 PolarHBondContact O-N 2.96Å
414	G	45.9	Very low	48.4	Very low	61 Å²	61	107.9 Å²	107.9	63%	0.629	64%	0.643	S	S	*	*	S	Bend	trans	-93.6	-13.9	178.7	0	0	0	0	0	116
415	D	43.3	Very low	47.8	Very low	157 Å²	157	112.2 Å²	112.2	84%	0.84	66%	0.664	S	S	*	*	S	Bend	trans	-127.9	66.3	-176.6	-81.5	-30.3	0	0	0	111.4
416	M	37	Very low	47.4	Very low	180 Å²	180	115.6 Å²	115.6	89%	0.887	68%	0.683	S	S	*	*			trans	-146.1	121.3	149.7	-99.9	-170.3	-75.3	0	0	108.1
417	Q	35	Very low	46.9	Very low	274 Å²	274	121.8 Å²	121.8	100%	1.28	72%	0.719	S	S	*	*			trans	-51.2	0	174.4	-75.3	174.5	-35.2	0	0	113.7

Retrieved 417 of 417 residues in 137 ms (Link to these results)

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